A0A077ZEZ3_TRITR Loading...

Glycosyltransferase family 92 protein

AlphaFold DB , UniProt , Accession A0A077ZEZ3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 495 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	42.4	Very low	58.8	Low	245 Å²	245	102 Å²	102	100%	1.207	56%	0.562	S	S	*	*				0	-8.2	0	-123.2	-179.7	168.7	0	0	113.5
2	V	36.1	Very low	59.7	Low	122 Å²	122	98.8 Å²	98.8	74%	0.739	55%	0.551	S	S	*	*			trans	-71.1	143.4	155.8	-172.7	0	0	0	0	107.7	V6	V2-V6 HydrophobicContact CG1-CG2 4.36Å
3	D	53.8	Low	60.3	Low	101 Å²	101	102.8 Å²	102.8	54%	0.54	55%	0.554	S	S	.	*	S	Bend	trans	100.1	16.8	170.3	-60.8	-25.8	0	0	0	122.2	L7	D3-L7 WeakPolarHBondContact O-CB 3.38Å
4	F	59.9	Low	60.1	Low	131 Å²	131	97.6 Å²	97.6	58%	0.575	53%	0.53	S	S	*	.	S	Bend	trans	-96.4	-48.1	153.4	-164.7	-99.5	0	0	0	111.5	V6 L7 C8	F4-V6 PolarHBondContact O-N 3.33Å; F4-L7 PolarHBondContact O-N 3.08Å; F4-C8 VanDerWaalsContact CE1-SG 3.51Å; F4-C8 WeakPolarHBondContact O-CB 3.42Å; F4-C8 PolarHBondContact O-N 2.66Å
5	C	61.7	Low	60.1	Low	105 Å²	105	97.9 Å²	97.9	71%	0.709	53%	0.53	S	S	*	.	H	α-helix	trans	-64.3	-39.6	177.5	-63.2	0	0	0	0	112.7	L7 C8 A9	C5-L7 VanDerWaalsContact C-N 3.34Å; C5-C8 PolarHBondContact O-N 3.43Å; C5-A9 VanDerWaalsContact O-CB 3.26Å; C5-A9 WeakPolarHBondContact O-CB 3.22Å; C5-A9 PolarHBondContact O-N 2.94Å
6	V	63.1	Low	60.4	Low	80 Å²	80	102.9 Å²	102.9	49%	0.485	55%	0.545	S	S	.	.	H	α-helix	trans	-64.9	-41	175.7	-178.8	0	0	0	0	110.3	V2 F4 A9 F10	V2-V6 HydrophobicContact CG1-CG2 4.36Å; F4-V6 PolarHBondContact O-N 3.33Å; V6-A9 PolarHBondContact O-N 2.99Å; V6-F10 VanDerWaalsContact O-CB 3.32Å; V6-F10 WeakPolarHBondContact O-CB 3.38Å; V6-F10 PolarHBondContact O-N 3.44Å
7	L	61.7	Low	60.4	Low	55 Å²	55	100 Å²	100	29%	0.288	53%	0.53	S	S	.	.	H	α-helix	trans	-66.7	-44.4	178.3	-155.5	92.6	0	0	0	111.7	D3 F4 C5 F10 L11 V36	D3-L7 WeakPolarHBondContact O-CB 3.38Å; F4-L7 PolarHBondContact O-N 3.08Å; C5-L7 VanDerWaalsContact C-N 3.34Å; L7-F10 PolarHBondContact O-N 3.32Å; L7-L11 HydrophobicContact CD2-CD1 4.42Å; L7-L11 WeakPolarHBondContact O-CB 3.31Å; L7-L11 VanDerWaalsContact O-CG 3.27Å; L7-L11 WeakPolarHBondContact O-CG 3.4Å; L7-L11 PolarHBondContact O-N 2.89Å; L7-V36 HydrophobicContact CD2-CG1 4.22Å; L7-V36 HydrophobicContact CD2-CG2 4.21Å
8	C	68	Low	60.2	Low	49 Å²	49	103.6 Å²	103.6	33%	0.331	54%	0.544	S	S	.	.	H	α-helix	trans	-62.5	-45.2	173.9	-77.8	0	0	0	0	111.8	F4 C5 F10 L11 C12	F4-C8 VanDerWaalsContact CE1-SG 3.51Å; F4-C8 WeakPolarHBondContact O-CB 3.42Å; F4-C8 PolarHBondContact O-N 2.66Å; C5-C8 PolarHBondContact O-N 3.43Å; C8-F10 VanDerWaalsContact C-N 3.3Å; C8-F10 PolarHBondContact O-N 3.17Å; C8-L11 PolarHBondContact O-N 2.83Å; C8-C12 WeakPolarHBondContact O-CB 3.45Å; C8-C12 PolarHBondContact O-N 3.32Å; C8-C12 PolarHBondContact O-SG 3.2Å; C8-C12 VanDerWaalsContact O-SG 3.35Å
9	A	69.4	Low	59.9	Low	63 Å²	63	109.1 Å²	109.1	52%	0.521	56%	0.556	S	S	.	*	H	α-helix	trans	-61.4	-40.1	176.6	0	0	0	0	0	111.6	C5 V6 Y13	C5-A9 VanDerWaalsContact O-CB 3.26Å; C5-A9 WeakPolarHBondContact O-CB 3.22Å; C5-A9 PolarHBondContact O-N 2.94Å; V6-A9 PolarHBondContact O-N 2.99Å; A9-Y13 WeakPolarHBondContact O-CB 3.46Å; A9-Y13 PolarHBondContact O-N 2.97Å
10	F	65.5	Low	59.4	Low	122 Å²	122	105.2 Å²	105.2	54%	0.535	54%	0.541	S	S	.	.	H	α-helix	trans	-70	-41.6	177.5	-156	-91	0	0	0	112.2	V6 L7 C8 Y13 C14	V6-F10 VanDerWaalsContact O-CB 3.32Å; V6-F10 WeakPolarHBondContact O-CB 3.38Å; V6-F10 PolarHBondContact O-N 3.44Å; L7-F10 PolarHBondContact O-N 3.32Å; C8-F10 VanDerWaalsContact C-N 3.3Å; C8-F10 PolarHBondContact O-N 3.17Å; F10-Y13 PolarHBondContact O-N 3.46Å; F10-C14 WeakPolarHBondContact O-CB 3.5Å; F10-C14 PolarHBondContact O-N 2.84Å; F10-C14 PolarHBondContact O-SG 3.39Å; F10-C14 VanDerWaalsContact O-SG 3.35Å
11	L	65	Low	59.1	Low	49 Å²	49	110 Å²	110	26%	0.257	55%	0.552	S	S	.	*	H	α-helix	trans	-63.7	-42.1	174.3	-73.2	171.1	0	0	0	111.5	L7 C8 C14 L15	L7-L11 HydrophobicContact CD2-CD1 4.42Å; L7-L11 WeakPolarHBondContact O-CB 3.31Å; L7-L11 VanDerWaalsContact O-CG 3.27Å; L7-L11 WeakPolarHBondContact O-CG 3.4Å; L7-L11 PolarHBondContact O-N 2.89Å; C8-L11 PolarHBondContact O-N 2.83Å; L11-C14 PolarHBondContact O-N 3.19Å; L11-L15 WeakPolarHBondContact O-CB 3.42Å; L11-L15 VanDerWaalsContact O-CG 3.26Å; L11-L15 WeakPolarHBondContact O-CG 3.38Å; L11-L15 PolarHBondContact O-N 3.45Å
12	C	70.4	Confident	59.6	Low	63 Å²	63	104.1 Å²	104.1	43%	0.426	53%	0.526	S	S	.	.	H	α-helix	trans	-60.9	-48.9	172.2	-75.7	0	0	0	0	111	C8 C14 L15 F16	C8-C12 WeakPolarHBondContact O-CB 3.45Å; C8-C12 PolarHBondContact O-N 3.32Å; C8-C12 PolarHBondContact O-SG 3.2Å; C8-C12 VanDerWaalsContact O-SG 3.35Å; C12-C14 VanDerWaalsContact C-N 3.28Å; C12-C14 PolarHBondContact O-N 2.95Å; C12-L15 PolarHBondContact O-N 3.36Å; C12-L15 VanDerWaalsContact O-N 3.17Å; C12-F16 HydrophobicContact CB-CD2 4.45Å; C12-F16 WeakPolarHBondContact O-CD2 3.43Å; C12-F16 PolarHBondContact O-N 2.9Å
13	Y	67.1	Low	60.8	Low	151 Å²	151	101.2 Å²	101.2	59%	0.592	52%	0.521	S	S	*	.	H	α-helix	trans	-56.9	-42	177	-177.2	-96.5	0	0	0	111.9	A9 F10 N17	A9-Y13 WeakPolarHBondContact O-CB 3.46Å; A9-Y13 PolarHBondContact O-N 2.97Å; F10-Y13 PolarHBondContact O-N 3.46Å; Y13-N17 WeakPolarHBondContact O-CB 3.35Å; Y13-N17 PolarHBondContact O-N 2.65Å; Y13-N17 VanDerWaalsContact O-N 3.15Å; Y13-N17 PolarHBondContact OH-ND2 3.05Å
14	C	57.1	Low	60.8	Low	31 Å²	31	107.6 Å²	107.6	21%	0.209	54%	0.538	C	S	.	.	H	α-helix	trans	-71.4	-34.7	177.2	-71.3	0	0	0	0	113.8	F10 L11 C12	F10-C14 WeakPolarHBondContact O-CB 3.5Å; F10-C14 PolarHBondContact O-N 2.84Å; F10-C14 PolarHBondContact O-SG 3.39Å; F10-C14 VanDerWaalsContact O-SG 3.35Å; L11-C14 PolarHBondContact O-N 3.19Å; C12-C14 VanDerWaalsContact C-N 3.28Å; C12-C14 PolarHBondContact O-N 2.95Å
15	L	60	Low	60.5	Low	101 Å²	101	107 Å²	107	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-70.5	-36.3	177.8	-78.2	168.1	0	0	0	112.3	L11 C12	L11-L15 WeakPolarHBondContact O-CB 3.42Å; L11-L15 VanDerWaalsContact O-CG 3.26Å; L11-L15 WeakPolarHBondContact O-CG 3.38Å; L11-L15 PolarHBondContact O-N 3.45Å; C12-L15 PolarHBondContact O-N 3.36Å; C12-L15 VanDerWaalsContact O-N 3.17Å
16	F	65.6	Low	60.6	Low	178 Å²	178	106.8 Å²	106.8	78%	0.781	52%	0.521	S	S	*	.	H	α-helix	trans	-89.8	-13.1	-177.4	-74.6	-71.6	0	0	0	114.2	C12 E18	C12-F16 HydrophobicContact CB-CD2 4.45Å; C12-F16 WeakPolarHBondContact O-CD2 3.43Å; C12-F16 PolarHBondContact O-N 2.9Å; F16-E18 PolarHBondContact O-N 3.34Å
17	N	59.7	Low	60.6	Low	54 Å²	54	105.8 Å²	105.8	29%	0.289	52%	0.521	S	S	.	.			trans	-93.1	104.9	-178.2	-163.1	-22.6	0	0	0	111.3	Y13 R19 A20	Y13-N17 WeakPolarHBondContact O-CB 3.35Å; Y13-N17 PolarHBondContact O-N 2.65Å; Y13-N17 VanDerWaalsContact O-N 3.15Å; Y13-N17 PolarHBondContact OH-ND2 3.05Å; N17-R19 PolarHBondContact O-N 3.18Å; N17-R19 PolarHBondContact OD1-N 3.1Å; N17-A20 WeakPolarHBondContact O-CB 3.44Å; N17-A20 PolarHBondContact O-N 3.11Å
18	E	57.1	Low	60.5	Low	165 Å²	165	112 Å²	112	77%	0.771	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-53.3	-28.3	-178.9	-72	-165.8	146.9	0	0	113.9	F16 A20 R21	F16-E18 PolarHBondContact O-N 3.34Å; E18-A20 PolarHBondContact O-N 2.01Å; E18-R21 PolarHBondContact O-N 2.98Å; E18-R21 VanDerWaalsContact O-N 3.13Å
19	R	53.7	Low	60.2	Low	207 Å²	207	113.8 Å²	113.8	78%	0.781	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-62.5	-23.8	177.2	-74	-177.1	176.8	174.9	0.3	113.4	N17 R21	N17-R19 PolarHBondContact O-N 3.18Å; N17-R19 PolarHBondContact OD1-N 3.1Å; R19-R21 VanDerWaalsContact C-N 3.3Å; R19-R21 PolarHBondContact O-N 3.21Å
20	A	51	Low	59.9	Low	32 Å²	32	116.9 Å²	116.9	26%	0.264	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-77.8	-10.7	178.7	0	0	0	0	0	113.7	N17 E18 Y25	N17-A20 WeakPolarHBondContact O-CB 3.44Å; N17-A20 PolarHBondContact O-N 3.11Å; E18-A20 PolarHBondContact O-N 2.01Å; A20-Y25 WeakPolarHBondContact O-CB 3.42Å
21	R	52.8	Low	59.9	Low	205 Å²	205	120.3 Å²	120.3	77%	0.774	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-85.2	-2.9	178.9	-75.6	178.5	136.6	-178.7	-3.5	114.6	E18 R19	E18-R21 PolarHBondContact O-N 2.98Å; E18-R21 VanDerWaalsContact O-N 3.13Å; R19-R21 VanDerWaalsContact C-N 3.3Å; R19-R21 PolarHBondContact O-N 3.21Å
22	N	53.7	Low	59.8	Low	122 Å²	122	121.2 Å²	121.2	65%	0.652	56%	0.559	S	S	*	*	S	Bend	trans	-73.2	138.2	176.3	-101.9	-21.1	0	0	0	111.4	R24 Y25	N22-R24 PolarHBondContact O-N 3.5Å; N22-Y25 WeakPolarHBondContact O-CB 3.44Å; N22-Y25 PolarHBondContact O-N 3.22Å
23	G	60.3	Low	59.5	Low	62 Å²	62	121.7 Å²	121.7	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-54.3	-18.6	-166.3	0	0	0	0	0	117.9	Y25	G23-Y25 VanDerWaalsContact C-N 3.34Å
24	R	55	Low	59.4	Low	234 Å²	234	116.5 Å²	116.5	88%	0.883	55%	0.549	S	S	*	.	H	α-helix	trans	-71.1	-26.4	170.1	-74.1	-171.3	-162.8	-176.4	5.6	113.5	N22	N22-R24 PolarHBondContact O-N 3.5Å
25	Y	53.6	Low	59.8	Low	120 Å²	120	118.7 Å²	118.7	47%	0.471	56%	0.561	S	S	.	*	H	α-helix	trans	-83.1	-23.5	178.4	-77.3	-84.5	0	0	0	112.7	A20 N22 G23 A27 R28 Y29	A20-Y25 WeakPolarHBondContact O-CB 3.42Å; N22-Y25 WeakPolarHBondContact O-CB 3.44Å; N22-Y25 PolarHBondContact O-N 3.22Å; G23-Y25 VanDerWaalsContact C-N 3.34Å; Y25-A27 VanDerWaalsContact C-N 3.33Å; Y25-A27 PolarHBondContact O-N 3.12Å; Y25-R28 PolarHBondContact O-N 2.79Å; Y25-R28 VanDerWaalsContact O-N 3.12Å; Y25-Y29 VanDerWaalsContact O-CB 3.28Å; Y25-Y29 WeakPolarHBondContact O-CB 3.39Å; Y25-Y29 PolarHBondContact O-N 3.3Å
26	E	62.5	Low	59.8	Low	100 Å²	100	115.5 Å²	115.5	47%	0.467	55%	0.546	S	S	.	.	H	α-helix	trans	-52.5	-47.4	178.6	-166.4	83.8	-153.8	0	0	112.1	Y29 Q30	E26-Y29 WeakPolarHBondContact O-CB 3.45Å; E26-Y29 PolarHBondContact O-N 2.86Å; E26-Q30 WeakPolarHBondContact O-CG 2.8Å; E26-Q30 PolarHBondContact O-N 2.65Å
27	A	64.4	Low	59.3	Low	59 Å²	59	111.6 Å²	111.6	49%	0.488	53%	0.528	S	S	.	.	H	α-helix	trans	-68.5	-37.7	-179.8	0	0	0	0	0	112.8	Y25 R31	Y25-A27 VanDerWaalsContact C-N 3.33Å; Y25-A27 PolarHBondContact O-N 3.12Å; A27-R31 WeakPolarHBondContact O-CG 2.93Å; A27-R31 PolarHBondContact O-N 2.95Å; A27-R31 VanDerWaalsContact O-N 3.08Å
28	R	59.7	Low	59	Low	186 Å²	186	113.9 Å²	113.9	70%	0.702	54%	0.536	S	S	*	.	H	α-helix	trans	-67.6	-39.4	174.1	-76	-174.8	176	-176.3	-1.5	110.9	Y25 R31 L32	Y25-R28 PolarHBondContact O-N 2.79Å; Y25-R28 VanDerWaalsContact O-N 3.12Å; R28-R31 PolarHBondContact O-N 3.06Å; R28-L32 WeakPolarHBondContact O-CB 3.18Å; R28-L32 PolarHBondContact O-N 2.77Å
29	Y	60.6	Low	58.9	Low	86 Å²	86	109.3 Å²	109.3	34%	0.337	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-45.6	176	-177.9	-105.4	0	0	0	111.6	Y25 E26 R31 L32 I33	Y25-Y29 VanDerWaalsContact O-CB 3.28Å; Y25-Y29 WeakPolarHBondContact O-CB 3.39Å; Y25-Y29 PolarHBondContact O-N 3.3Å; E26-Y29 WeakPolarHBondContact O-CB 3.45Å; E26-Y29 PolarHBondContact O-N 2.86Å; Y29-R31 PolarHBondContact O-N 2.77Å; Y29-L32 PolarHBondContact O-N 2.77Å; Y29-I33 HydrophobicContact CD1-CD1 3.7Å; Y29-I33 HydrophobicContact CD1-CG1 4.44Å; Y29-I33 HydrophobicContact CE1-CD1 3.16Å; Y29-I33 HydrophobicContact CE1-CG1 4.16Å; Y29-I33 HydrophobicContact CE2-CD1 4.23Å; Y29-I33 HydrophobicContact CE2-CG1 4.47Å; Y29-I33 HydrophobicContact CG-CD1 4.42Å; Y29-I33 VanDerWaalsContact CZ-CD1 3.47Å; Y29-I33 WeakPolarHBondContact O-CG1 3.5Å; Y29-I33 PolarHBondContact O-N 3.13Å
30	Q	62.5	Low	58.7	Low	127 Å²	127	103 Å²	103	59%	0.593	49%	0.494	S	S	*	.	H	α-helix	trans	-62.6	-41.2	175	-74	-170.1	0.4	0	0	112.5	E26 G34	E26-Q30 WeakPolarHBondContact O-CG 2.8Å; E26-Q30 PolarHBondContact O-N 2.65Å; Q30-G34 PolarHBondContact O-N 3.36Å
31	R	65.6	Low	58.6	Low	194 Å²	194	104.2 Å²	104.2	73%	0.732	50%	0.495	S	S	*	.	H	α-helix	trans	-62.4	-43	172.5	-76.2	-173.6	-165.8	-175.2	4.9	111.8	A27 R28 Y29 G34 V35	A27-R31 WeakPolarHBondContact O-CG 2.93Å; A27-R31 PolarHBondContact O-N 2.95Å; A27-R31 VanDerWaalsContact O-N 3.08Å; R28-R31 PolarHBondContact O-N 3.06Å; Y29-R31 PolarHBondContact O-N 2.77Å; R31-G34 PolarHBondContact O-N 3.19Å; R31-V35 WeakPolarHBondContact O-CG2 3.13Å; R31-V35 PolarHBondContact O-N 3.08Å
32	L	62.9	Low	58.4	Low	68 Å²	68	100 Å²	100	36%	0.356	48%	0.484	S	S	.	.	H	α-helix	trans	-64	-46.7	179.2	-171.1	71.6	0	0	0	111.2	R28 Y29 G34 V35 V36	R28-L32 WeakPolarHBondContact O-CB 3.18Å; R28-L32 PolarHBondContact O-N 2.77Å; Y29-L32 PolarHBondContact O-N 2.77Å; L32-G34 VanDerWaalsContact C-N 3.27Å; L32-G34 PolarHBondContact O-N 2.65Å; L32-V35 PolarHBondContact O-N 3.42Å; L32-V35 VanDerWaalsContact O-N 3.1Å; L32-V36 WeakPolarHBondContact O-CG2 3.44Å; L32-V36 PolarHBondContact O-N 3.36Å
33	I	64.7	Low	58	Low	74 Å²	74	99.5 Å²	99.5	38%	0.379	48%	0.479	S	S	.	.	H	α-helix	trans	-55.2	-45.6	171.9	-72.5	177	0	0	0	110.2	Y29 V35 V36 F37	Y29-I33 HydrophobicContact CD1-CD1 3.7Å; Y29-I33 HydrophobicContact CD1-CG1 4.44Å; Y29-I33 HydrophobicContact CE1-CD1 3.16Å; Y29-I33 HydrophobicContact CE1-CG1 4.16Å; Y29-I33 HydrophobicContact CE2-CD1 4.23Å; Y29-I33 HydrophobicContact CE2-CG1 4.47Å; Y29-I33 HydrophobicContact CG-CD1 4.42Å; Y29-I33 VanDerWaalsContact CZ-CD1 3.47Å; Y29-I33 WeakPolarHBondContact O-CG1 3.5Å; Y29-I33 PolarHBondContact O-N 3.13Å; I33-V35 VanDerWaalsContact C-N 3.32Å; I33-V35 PolarHBondContact O-N 2.78Å; I33-V36 PolarHBondContact O-N 3.11Å; I33-F37 WeakPolarHBondContact O-CB 3.43Å; I33-F37 PolarHBondContact O-N 3.42Å
34	G	64.8	Low	57.3	Low	41 Å²	41	100.8 Å²	100.8	42%	0.423	47%	0.468	S	S	.	.	H	α-helix	trans	-58.7	-41.1	176.7	0	0	0	0	0	113	Q30 R31 L32 K38	Q30-G34 PolarHBondContact O-N 3.36Å; R31-G34 PolarHBondContact O-N 3.19Å; L32-G34 VanDerWaalsContact C-N 3.27Å; L32-G34 PolarHBondContact O-N 2.65Å; G34-K38 WeakPolarHBondContact O-CB 3.4Å; G34-K38 PolarHBondContact O-N 3.12Å
35	V	65.6	Low	56.5	Low	77 Å²	77	93.9 Å²	93.9	47%	0.467	45%	0.448	S	S	.	.	H	α-helix	trans	-66.9	-46.1	175.3	172.7	0	0	0	0	111.2	R31 L32 I33 F37 K38 I39	R31-V35 WeakPolarHBondContact O-CG2 3.13Å; R31-V35 PolarHBondContact O-N 3.08Å; L32-V35 PolarHBondContact O-N 3.42Å; L32-V35 VanDerWaalsContact O-N 3.1Å; I33-V35 VanDerWaalsContact C-N 3.32Å; I33-V35 PolarHBondContact O-N 2.78Å; V35-F37 VanDerWaalsContact C-N 3.32Å; V35-F37 PolarHBondContact O-N 3.34Å; V35-K38 WeakPolarHBondContact O-CB 3.38Å; V35-K38 PolarHBondContact O-N 3Å; V35-K38 VanDerWaalsContact O-N 3.16Å; V35-I39 HydrophobicContact CG1-CD1 3.81Å; V35-I39 HydrophobicContact CG1-CG1 4.35Å; V35-I39 WeakPolarHBondContact O-CG1 3.35Å; V35-I39 PolarHBondContact O-N 2.74Å
36	V	59.4	Low	55.6	Low	35 Å²	35	93 Å²	93	21%	0.212	46%	0.457	C	S	.	.	H	α-helix	trans	-59.8	-44	177	172	0	0	0	0	110.7	L7 L32 I33 K38 I39 F40	L7-V36 HydrophobicContact CD2-CG1 4.22Å; L7-V36 HydrophobicContact CD2-CG2 4.21Å; L32-V36 WeakPolarHBondContact O-CG2 3.44Å; L32-V36 PolarHBondContact O-N 3.36Å; I33-V36 PolarHBondContact O-N 3.11Å; V36-K38 VanDerWaalsContact C-N 3.3Å; V36-K38 PolarHBondContact O-N 3.07Å; V36-I39 PolarHBondContact O-N 3.14Å; V36-F40 WeakPolarHBondContact O-CB 3.49Å; V36-F40 PolarHBondContact O-N 3.44Å
37	F	56.3	Low	54.2	Low	95 Å²	95	97.6 Å²	97.6	42%	0.417	48%	0.476	S	S	.	.	H	α-helix	trans	-63	-38.8	177.4	-153.1	-89.8	0	0	0	111.5	I33 V35 F40 Q41	I33-F37 WeakPolarHBondContact O-CB 3.43Å; I33-F37 PolarHBondContact O-N 3.42Å; V35-F37 VanDerWaalsContact C-N 3.32Å; V35-F37 PolarHBondContact O-N 3.34Å; F37-F40 PolarHBondContact O-N 2.91Å; F37-Q41 HydrophobicContact CD1-CG 4.16Å; F37-Q41 HydrophobicContact CE1-CG 4.26Å; F37-Q41 WeakPolarHBondContact O-CB 3.27Å; F37-Q41 WeakPolarHBondContact O-CG 3.06Å; F37-Q41 PolarHBondContact O-N 3.04Å
38	K	53.5	Low	52.6	Low	102 Å²	102	102.4 Å²	102.4	44%	0.443	49%	0.493	S	S	.	.	H	α-helix	trans	-69	-41.7	176.8	-164.7	-179.2	-179.2	-172.3	0	112.4	G34 V35 V36 F40 Q41 Q42	G34-K38 WeakPolarHBondContact O-CB 3.4Å; G34-K38 PolarHBondContact O-N 3.12Å; V35-K38 WeakPolarHBondContact O-CB 3.38Å; V35-K38 PolarHBondContact O-N 3Å; V35-K38 VanDerWaalsContact O-N 3.16Å; V36-K38 VanDerWaalsContact C-N 3.3Å; V36-K38 PolarHBondContact O-N 3.07Å; K38-F40 VanDerWaalsContact C-N 3.32Å; K38-Q41 PolarHBondContact O-N 3.37Å; K38-Q42 WeakPolarHBondContact O-CG 3.42Å; K38-Q42 PolarHBondContact O-N 3.28Å
39	I	54.2	Low	51.2	Low	70 Å²	70	101.9 Å²	101.9	36%	0.359	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-42.8	173	-67.4	168.6	0	0	0	109.4	V35 V36 Q42 M43	V35-I39 HydrophobicContact CG1-CD1 3.81Å; V35-I39 HydrophobicContact CG1-CG1 4.35Å; V35-I39 WeakPolarHBondContact O-CG1 3.35Å; V35-I39 PolarHBondContact O-N 2.74Å; V36-I39 PolarHBondContact O-N 3.14Å; I39-Q42 CarbonylContact O-C 3.59Å; I39-Q42 WeakPolarHBondContact O-CB 3.33Å; I39-Q42 PolarHBondContact O-N 2.71Å; I39-Q42 VanDerWaalsContact O-N 3.12Å; I39-M43 HydrophobicContact CG2-CE 4.27Å; I39-M43 HydrophobicContact CG2-CG 4.38Å; I39-M43 HydrophobicContact CG2-SD 4.39Å; I39-M43 WeakPolarHBondContact O-CG 3.5Å; I39-M43 PolarHBondContact O-N 3.44Å
40	F	50.5	Low	49.6	Very low	74 Å²	74	103.2 Å²	103.2	33%	0.325	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-44.4	177.3	-168.8	-93.9	0	0	0	112.4	V36 F37 K38 Q42 M43 Q44	V36-F40 WeakPolarHBondContact O-CB 3.49Å; V36-F40 PolarHBondContact O-N 3.44Å; F37-F40 PolarHBondContact O-N 2.91Å; K38-F40 VanDerWaalsContact C-N 3.32Å; F40-Q42 PolarHBondContact O-N 3.34Å; F40-M43 HydrophobicContact CB-CE 4.3Å; F40-M43 HydrophobicContact CD2-CE 3.78Å; F40-M43 HydrophobicContact CG-CE 4.43Å; F40-M43 PolarHBondContact O-N 3.42Å; F40-Q44 HydrophobicContact CD1-CG 4.37Å; F40-Q44 HydrophobicContact CE1-CG 4.11Å; F40-Q44 WeakPolarHBondContact O-CG 3.37Å; F40-Q44 PolarHBondContact O-N 3.16Å
41	Q	49.3	Very low	48	Very low	58 Å²	58	102 Å²	102	27%	0.271	53%	0.531	S	S	.	.	H	α-helix	trans	-58.5	-36.8	171.8	-78	179.8	-29.3	0	0	112	F37 K38 Q44	F37-Q41 HydrophobicContact CD1-CG 4.16Å; F37-Q41 HydrophobicContact CE1-CG 4.26Å; F37-Q41 WeakPolarHBondContact O-CB 3.27Å; F37-Q41 WeakPolarHBondContact O-CG 3.06Å; F37-Q41 PolarHBondContact O-N 3.04Å; K38-Q41 PolarHBondContact O-N 3.37Å; Q41-Q44 PolarHBondContact O-N 3.02Å
42	Q	47.8	Very low	46	Very low	117 Å²	117	99.9 Å²	99.9	55%	0.547	54%	0.535	S	S	.	.	H	α-helix	trans	-71.7	-36	175.6	-74.1	176.5	-23.6	0	0	112.9	K38 I39 F40 Q44 I45	K38-Q42 WeakPolarHBondContact O-CG 3.42Å; K38-Q42 PolarHBondContact O-N 3.28Å; I39-Q42 CarbonylContact O-C 3.59Å; I39-Q42 WeakPolarHBondContact O-CB 3.33Å; I39-Q42 PolarHBondContact O-N 2.71Å; I39-Q42 VanDerWaalsContact O-N 3.12Å; F40-Q42 PolarHBondContact O-N 3.34Å; Q42-Q44 PolarHBondContact O-N 2.85Å; Q42-I45 WeakPolarHBondContact O-CB 3.3Å; Q42-I45 PolarHBondContact O-N 2.86Å; Q42-I45 VanDerWaalsContact O-N 3.15Å
43	M	45.8	Very low	44.3	Very low	111 Å²	111	105.1 Å²	105.1	55%	0.547	56%	0.562	S	S	.	*	H	α-helix	trans	-67.9	-23.7	174.3	-69.8	-170.7	-61.1	0	0	112.6	I39 F40 I45	I39-M43 HydrophobicContact CG2-CE 4.27Å; I39-M43 HydrophobicContact CG2-CG 4.38Å; I39-M43 HydrophobicContact CG2-SD 4.39Å; I39-M43 WeakPolarHBondContact O-CG 3.5Å; I39-M43 PolarHBondContact O-N 3.44Å; F40-M43 HydrophobicContact CB-CE 4.3Å; F40-M43 HydrophobicContact CD2-CE 3.78Å; F40-M43 HydrophobicContact CG-CE 4.43Å; F40-M43 PolarHBondContact O-N 3.42Å; M43-I45 VanDerWaalsContact C-N 3.25Å
44	Q	45.1	Very low	42.3	Very low	88 Å²	88	109.7 Å²	109.7	41%	0.411	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	-9.8	172.8	-71.4	-172.1	-36.1	0	0	113.6	F40 Q41 Q42 P46	F40-Q44 HydrophobicContact CD1-CG 4.37Å; F40-Q44 HydrophobicContact CE1-CG 4.11Å; F40-Q44 WeakPolarHBondContact O-CG 3.37Å; F40-Q44 PolarHBondContact O-N 3.16Å; Q41-Q44 PolarHBondContact O-N 3.02Å; Q42-Q44 PolarHBondContact O-N 2.85Å; Q44-P46 VanDerWaalsContact O-CD 3.31Å; Q44-P46 WeakPolarHBondContact O-CD 3.21Å
45	I	36.9	Very low	40.6	Very low	89 Å²	89	113.7 Å²	113.7	46%	0.456	60%	0.6	S	S	.	*	S	Bend	trans	-83.5	109.6	170.7	-55.3	171.6	0	0	0	106.1	Q42 M43 K47	Q42-I45 WeakPolarHBondContact O-CB 3.3Å; Q42-I45 PolarHBondContact O-N 2.86Å; Q42-I45 VanDerWaalsContact O-N 3.15Å; M43-I45 VanDerWaalsContact C-N 3.25Å; I45-K47 PolarHBondContact O-N 3.09Å; I45-K47 VanDerWaalsContact O-N 3.12Å
46	P	36.3	Very low	39.1	Very low	103 Å²	103	114.2 Å²	114.2	67%	0.669	61%	0.608	S	S	*	*			trans	-60.2	122.4	-179.6	-16.5	29.9	0	0	0	108.8	Q44	Q44-P46 VanDerWaalsContact O-CD 3.31Å; Q44-P46 WeakPolarHBondContact O-CD 3.21Å
47	K	31.7	Very low	37.7	Very low	196 Å²	196	116.2 Å²	116.2	85%	0.852	63%	0.627	S	S	*	*			trans	-99.2	111.5	164	-79.5	-171.7	175.1	-175.2	0	107.5	I45	I45-K47 PolarHBondContact O-N 3.09Å; I45-K47 VanDerWaalsContact O-N 3.12Å
48	D	31.9	Very low	36.9	Very low	160 Å²	160	115.4 Å²	115.4	86%	0.856	63%	0.633	S	S	*	*			trans	54.9	132.9	168.2	-77	-32.3	0	0	0	119.8	S50	D48-S50 PolarHBondContact O-N 3Å
49	D	29.4	Very low	35.7	Very low	175 Å²	175	114.5 Å²	114.5	94%	0.936	64%	0.644	S	S	*	*			trans	-69.8	102.8	171.2	-72	-40.3	0	0	0	110.1
50	S	28.4	Very low	34.7	Very low	113 Å²	113	118.7 Å²	118.7	79%	0.79	67%	0.667	S	S	*	*			trans	-116.7	94.9	158.8	69.2	0	0	0	0	109.7	D48 N52	D48-S50 PolarHBondContact O-N 3Å; S50-N52 PolarHBondContact O-N 3.2Å
51	S	27	Very low	34.1	Very low	102 Å²	102	120 Å²	120	71%	0.713	67%	0.674	S	S	*	*			trans	-62	122.4	162	54.3	0	0	0	0	109.5
52	N	23.7	Very low	33.6	Very low	149 Å²	149	118.5 Å²	118.5	80%	0.797	67%	0.673	S	S	*	*			trans	148.9	101.1	148.7	-76	-20.3	0	0	0	110.7	S50	S50-N52 PolarHBondContact O-N 3.2Å
53	L	27.6	Very low	33.6	Very low	178 Å²	178	113.7 Å²	113.7	93%	0.932	65%	0.651	S	S	*	*				-179.2	153.3	119.2	-133.8	72.8	0	0	0	110.9
54	M	23.7	Very low	34	Very low	170 Å²	170	110.5 Å²	110.5	84%	0.837	64%	0.639	S	S	*	*			trans	-72	167.9	-166.1	-67.5	-174.6	158.4	0	0	116.9
55	T	28	Very low	34.5	Very low	125 Å²	125	107.1 Å²	107.1	77%	0.767	63%	0.625	S	S	*	*	S	Bend	trans	99.1	116.2	152	64.5	0	0	0	0	118.8
56	S	34	Very low	35.7	Very low	89 Å²	89	106.2 Å²	106.2	62%	0.622	63%	0.626	S	S	*	*			trans	61.5	78.2	-177.5	75.6	0	0	0	0	115.9	C58 A59	S56-C58 PolarHBondContact O-N 2.92Å; S56-A59 PolarHBondContact O-N 3.15Å
57	A	29.8	Very low	37	Very low	76 Å²	76	103.7 Å²	103.7	63%	0.628	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.8	-20.4	177	0	0	0	0	0	115	Q61	A57-Q61 WeakPolarHBondContact O-CB 3.29Å
58	C	40.1	Very low	38.7	Very low	78 Å²	78	99 Å²	99	53%	0.527	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	-27.6	-179.7	-84.9	0	0	0	0	115.6	S56 C64	S56-C58 PolarHBondContact O-N 2.92Å; C58-C64 WeakPolarHBondContact CA-SG 3.24Å; C58-C64 HydrophobicContact CB-CB 4.05Å; C58-C64 WeakPolarHBondContact CB-SG 3.45Å; C58-C64 WeakPolarHBondContact SG-CB 3.45Å; C58-C64 CovalentContact SG-SG 2.06Å; C58-C64 PolarHBondContact SG-SG 3.26Å
59	A	28.9	Very low	40.9	Very low	83 Å²	83	100.3 Å²	100.3	69%	0.686	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-23.2	-171.8	0	0	0	0	0	113.7	S56	S56-A59 PolarHBondContact O-N 3.15Å
60	L	32.2	Very low	43.3	Very low	159 Å²	159	92.8 Å²	92.8	83%	0.832	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	-6.8	-170.3	-78.7	163.1	0	0	0	114.7
61	Q	38.2	Very low	46	Very low	102 Å²	102	90.9 Å²	90.9	48%	0.477	53%	0.532	S	S	.	.	S	Bend	trans	-127.7	13.8	-158.7	-76	-168.1	-22.1	0	0	117.3	A57 S432	A57-Q61 WeakPolarHBondContact O-CB 3.29Å; Q61-S432 WeakPolarHBondContact O-CA 3.45Å; Q61-S432 WeakPolarHBondContact O-CB 3.3Å
62	G	38.1	Very low	48.5	Very low	25 Å²	25	93.1 Å²	93.1	26%	0.258	53%	0.526	S	S	.	.	S	Bend	trans	104.3	169.4	-179.3	0	0	0	0	0	111.7	C64	G62-C64 PolarHBondContact O-N 3.46Å
63	Q	49.6	Very low	51.2	Low	16 Å²	16	86.7 Å²	86.7	8%	0.075	49%	0.493	C	S	.	.			trans	-61.8	103.5	-165	-68.3	-169.8	13.1	0	0	112.2	V65	Q63-V65 PolarHBondContact O-N 3.24Å
64	C	53.1	Low	53.2	Low	45 Å²	45	82.9 Å²	82.9	30%	0.304	48%	0.479	S	S	.	.			trans	-61	112.8	158.2	-72.5	0	0	0	0	107.3	C58 G62 S66 K155	C58-C64 WeakPolarHBondContact CA-SG 3.24Å; C58-C64 HydrophobicContact CB-CB 4.05Å; C58-C64 WeakPolarHBondContact CB-SG 3.45Å; C58-C64 WeakPolarHBondContact SG-CB 3.45Å; C58-C64 CovalentContact SG-SG 2.06Å; C58-C64 PolarHBondContact SG-SG 3.26Å; G62-C64 PolarHBondContact O-N 3.46Å; C64-S66 PolarHBondContact O-N 3.43Å; C64-S66 VanDerWaalsContact O-N 3.08Å; C64-K155 PolarHBondContact O-NZ 2.81Å
65	V	55.8	Low	55.4	Low	17 Å²	17	82.3 Å²	82.3	10%	0.103	47%	0.468	C	S	.	.			trans	-66.2	104	165.6	176.8	0	0	0	0	105.4	Q63 V67 Y112 V119 A179	Q63-V65 PolarHBondContact O-N 3.24Å; V65-V67 PolarHBondContact O-N 2.85Å; V65-Y112 HydrophobicContact CG2-CD1 3.29Å; V65-Y112 HydrophobicContact CG2-CE1 3.52Å; V65-Y112 HydrophobicContact CG2-CG 3.97Å; V65-V119 HydrophobicContact CB-CG2 4.16Å; V65-V119 HydrophobicContact CG1-CG1 4.29Å; V65-V119 HydrophobicContact CG1-CG2 4.19Å; V65-A179 HydrophobicContact CG1-CB 3.08Å
66	S	61.8	Low	57.3	Low	69 Å²	69	83.1 Å²	83.1	48%	0.483	46%	0.457	S	S	.	.			trans	-71.1	110.9	173.8	50.6	0	0	0	0	107.3	C64 E68	C64-S66 PolarHBondContact O-N 3.43Å; C64-S66 VanDerWaalsContact O-N 3.08Å; S66-E68 PolarHBondContact O-N 3.4Å
67	V	63.5	Low	58.7	Low	50 Å²	50	79.3 Å²	79.3	30%	0.303	43%	0.431	S	S	.	.			trans	-84.2	110	172.8	176.8	0	0	0	0	106.9	V65 V119 S181	V65-V67 PolarHBondContact O-N 2.85Å; V67-V119 HydrophobicContact CG2-CB 4.45Å; V67-V119 HydrophobicContact CG2-CG2 3.68Å; V67-S181 VanDerWaalsContact CG1-CB 3.46Å; V67-S181 VanDerWaalsContact CG1-N 3.29Å
68	E	68.8	Low	60.4	Low	98 Å²	98	79 Å²	79	46%	0.458	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-95.6	150.2	170.6	-67.8	-176.7	-171.1	0	0	109.6	S66 V152 A153	S66-E68 PolarHBondContact O-N 3.4Å; E68-V152 HydrophobicContact CB-CG2 4.2Å; E68-A153 WeakPolarHBondContact OE2-CB 3.28Å
69	E	77	Confident	61.5	Low	188 Å²	188	82.7 Å²	82.7	88%	0.879	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-67	129.6	171.5	-72.5	-170.1	167.2	0	0	109.4
70	P	80.9	Confident	62.9	Low	17 Å²	17	81.4 Å²	81.4	11%	0.11	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-69.2	141.5	180	27.8	-32.9	0	0	0	110.9	L150 V151 L180 Y184	P70-L150 HydrophobicContact CB-CB 4.35Å; P70-V151 CarbonylContact C-O 3.6Å; P70-V151 VanDerWaalsContact CA-O 3.25Å; P70-V151 WeakPolarHBondContact CA-O 3.35Å; P70-L180 HydrophobicContact CB-CD2 3.96Å; P70-L180 HydrophobicContact CG-CD2 4.12Å; P70-Y184 HydrophobicContact CG-CE1 4.39Å; P70-Y184 HydrophobicContact CG-CE2 3.74Å; P70-Y184 WeakPolarHBondContact CG-OH 3.38Å
71	L	83.3	Confident	63.8	Low	73 Å²	73	80.3 Å²	80.3	38%	0.382	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	136.5	171.7	-176.5	71.7	0	0	0	110.3	V151 Q197 C198	L71-V151 HydrophobicContact CB-CB 4.48Å; L71-V151 PolarHBondContact N-O 2.77Å; L71-V151 PolarHBondContact O-N 3.1Å; L71-Q197 HydrophobicContact CD2-CB 4.23Å; L71-Q197 VanDerWaalsContact CD2-OE1 3.24Å; L71-C198 WeakPolarHBondContact CD2-SG 3.31Å
72	Y	81.2	Confident	64.4	Low	148 Å²	148	81.8 Å²	81.8	58%	0.58	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.2	168.2	-68.5	-89.3	0	0	0	109.8	L150 Y184	Y72-L150 HydrophobicContact CD1-CD2 4.07Å; Y72-L150 HydrophobicContact CE1-CD2 3.45Å; Y72-L150 VanDerWaalsContact CE1-CD2 3.45Å; Y72-Y184 PolarHBondContact OH-OH 3.49Å
73	C	79.4	Confident	64.6	Low	15 Å²	15	85.6 Å²	85.6	10%	0.101	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-80.2	138.1	179	-64.7	0	0	0	0	111.6	Y75 V151 C198	C73-Y75 PolarHBondContact O-N 2.92Å; C73-V151 VanDerWaalsContact SG-CG2 3.53Å; C73-C198 WeakPolarHBondContact CA-SG 3.01Å; C73-C198 HydrophobicContact CB-CB 3.69Å; C73-C198 WeakPolarHBondContact CB-SG 3.25Å; C73-C198 WeakPolarHBondContact SG-CA 3.2Å; C73-C198 WeakPolarHBondContact SG-CB 3.48Å; C73-C198 CovalentContact SG-SG 2.05Å; C73-C198 PolarHBondContact SG-SG 3.07Å
74	P	69.8	Low	64.3	Low	98 Å²	98	88.1 Å²	88.1	64%	0.636	46%	0.464	S	S	*	.	S	Bend	trans	-70.3	-14	-176	26.7	-34.3	0	0	0	113.8
75	Y	69.9	Low	64.1	Low	157 Å²	157	88 Å²	88	62%	0.616	47%	0.466	S	S	*	.	S	Bend	trans	-126.9	150.1	179.8	-24.8	-72	0	0	0	109.9	C73 A77	C73-Y75 PolarHBondContact O-N 2.92Å; Y75-A77 PolarHBondContact O-N 3.21Å
76	R	68	Low	63.8	Low	143 Å²	143	91.8 Å²	91.8	54%	0.54	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-73.1	117.2	169.5	-175.3	172.9	173.8	-159.3	-9.7	108.6	S78 L145 S146	R76-S78 PolarHBondContact O-N 3.11Å; R76-L145 PolarHBondContact NH2-O 3.19Å; R76-S146 PolarHBondContact NE-O 3Å; R76-S146 PolarHBondContact NH1-O 2.71Å; R76-S146 PolarHBondContact NH2-O 2.84Å
77	A	63.1	Low	63	Low	8 Å²	8	93.1 Å²	93.1	7%	0.066	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-58.7	123.6	170.8	0	0	0	0	0	109	Y75 W142 V199 V202	Y75-A77 PolarHBondContact O-N 3.21Å; A77-W142 HydrophobicContact CB-CH2 3.96Å; A77-V199 WeakPolarHBondContact CB-O 3.33Å; A77-V202 HydrophobicContact CB-CG1 4.37Å
78	S	65	Low	62.6	Low	70 Å²	70	93.5 Å²	93.5	49%	0.49	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	163.8	172.8	65.3	0	0	0	0	110.3	R76 S200 A201 V202	R76-S78 PolarHBondContact O-N 3.11Å; S78-S200 PolarHBondContact N-O 3.11Å; S78-S200 PolarHBondContact OG-O 3.18Å; S78-A201 WeakPolarHBondContact O-CA 3.34Å; S78-V202 PolarHBondContact O-N 2.88Å
79	R	64.6	Low	62.6	Low	156 Å²	156	91.6 Å²	91.6	59%	0.589	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	124.1	174.2	-70	-175.5	-64.7	-177.9	-0.3	108.9
80	S	57.4	Low	63	Low	56 Å²	56	88.1 Å²	88.1	39%	0.392	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-84.7	116.3	157.4	174	0	0	0	0	106.3	V202	S80-V202 PolarHBondContact N-O 2.76Å
81	L	52.3	Low	63.6	Low	136 Å²	136	89.2 Å²	89.2	71%	0.712	48%	0.48	S	S	*	.	S	Bend	trans	99.3	156.8	161.8	-62.4	140.4	0	0	0	121.5
82	D	50.1	Low	64.1	Low	133 Å²	133	87 Å²	87	71%	0.711	47%	0.467	S	S	*	.			trans	-50.7	142.4	-165.8	-71.9	-48.9	0	0	0	116.6	A84	D82-A84 PolarHBondContact O-N 3.08Å
83	S	42.6	Very low	64.6	Low	104 Å²	104	85.5 Å²	85.5	73%	0.727	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-58.9	1	179.2	50.1	0	0	0	0	116.2	A85	S83-A85 VanDerWaalsContact C-N 3.33Å; S83-A85 PolarHBondContact O-N 2.89Å
84	A	42.9	Very low	65.3	Low	69 Å²	69	84.8 Å²	84.8	57%	0.57	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-77.9	-10.5	-174.7	0	0	0	0	0	114.6	D82 F86	D82-A84 PolarHBondContact O-N 3.08Å; A84-F86 VanDerWaalsContact C-N 3.25Å; A84-F86 PolarHBondContact O-N 3.42Å
85	A	47.9	Very low	66.2	Low	42 Å²	42	84 Å²	84	35%	0.347	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-75.1	-2	-173.5	0	0	0	0	0	115.7	S83	S83-A85 VanDerWaalsContact C-N 3.33Å; S83-A85 PolarHBondContact O-N 2.89Å
86	F	49.3	Very low	66.9	Low	98 Å²	98	79.2 Å²	79.2	43%	0.43	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-92.3	-10.4	-172.8	-68.2	-75.3	0	0	0	115.2	A84 L145 Y190 L205	A84-F86 VanDerWaalsContact C-N 3.25Å; A84-F86 PolarHBondContact O-N 3.42Å; F86-L145 HydrophobicContact CZ-CD1 4.38Å; F86-Y190 HydrophobicContact CD1-CE1 4.37Å; F86-Y190 HydrophobicContact CE1-CD1 4.05Å; F86-Y190 AromaticContact CE1-CE1 3.7Å; F86-Y190 HydrophobicContact CE1-CE1 3.7Å; F86-L205 HydrophobicContact CE1-CD2 3.94Å; F86-L205 HydrophobicContact CE1-CG 4.44Å; F86-L205 HydrophobicContact CZ-CD2 3.51Å; F86-L205 HydrophobicContact CZ-CG 4.42Å
87	S	46.4	Very low	67.9	Low	97 Å²	97	73 Å²	73	68%	0.678	42%	0.42	S	S	*	.	S	Bend	trans	-119.9	97.4	-178.4	63.4	0	0	0	0	111.8
88	G	54	Low	69.2	Low	57 Å²	57	77.9 Å²	77.9	59%	0.588	45%	0.454	S	S	*	.	S	Bend	trans	126.6	160.3	167.4	0	0	0	0	0	114.3	Q90	G88-Q90 PolarHBondContact O-N 3.36Å
89	Y	70.3	Confident	70.5	Confident	58 Å²	58	76.2 Å²	76.2	23%	0.227	44%	0.439	C	S	.	.	S	Bend	trans	-75.5	61.3	176.2	-66.1	-91.7	0	0	0	110.7	F104 T105 I281 R321	Y89-F104 HydrophobicContact CD1-CE1 4.36Å; Y89-F104 HydrophobicContact CD1-CE2 4.28Å; Y89-F104 AromaticContact CD1-CZ 3.76Å; Y89-F104 HydrophobicContact CD1-CZ 3.76Å; Y89-F104 HydrophobicContact CG-CZ 4.4Å; Y89-T105 HydrophobicContact CD1-CG2 4.16Å; Y89-T105 HydrophobicContact CE1-CG2 4.3Å; Y89-I281 HydrophobicContact CD1-CG2 3.71Å; Y89-I281 HydrophobicContact CD2-CB 4.46Å; Y89-I281 HydrophobicContact CD2-CG2 3.22Å; Y89-I281 HydrophobicContact CE1-CD1 3.81Å; Y89-I281 HydrophobicContact CE1-CG1 4.36Å; Y89-I281 HydrophobicContact CE1-CG2 3.71Å; Y89-I281 HydrophobicContact CE2-CB 4.1Å; Y89-I281 HydrophobicContact CE2-CD1 4.15Å; Y89-I281 HydrophobicContact CE2-CG1 3.82Å; Y89-I281 HydrophobicContact CE2-CG2 3.24Å; Y89-I281 HydrophobicContact CG-CG2 3.46Å; Y89-I281 VanDerWaalsContact CG-CG2 3.46Å; Y89-I281 VanDerWaalsContact CZ-CD1 3.43Å; Y89-I281 VanDerWaalsContact CZ-CG2 3.48Å; Y89-I281 WeakPolarHBondContact OH-CD1 3.19Å; Y89-I281 WeakPolarHBondContact OH-CG1 3.44Å; Y89-R321 VanDerWaalsContact CE1-NH2 3.33Å; Y89-R321 VanDerWaalsContact OH-CZ 3.23Å; Y89-R321 PolarHBondContact OH-NH1 3.47Å; Y89-R321 PolarHBondContact OH-NH2 2.78Å
90	Q	84.1	Confident	71.9	Confident	116 Å²	116	71.2 Å²	71.2	54%	0.542	42%	0.422	S	S	.	.			trans	-100.5	135.6	-177.7	-66	-169.5	-17.7	0	0	110.7	G88	G88-Q90 PolarHBondContact O-N 3.36Å
91	W	93.7	Very high	73.8	Confident	40 Å²	40	68.5 Å²	68.5	15%	0.152	40%	0.403	C	S	.	.			trans	-71.1	128.6	176.3	-66.5	97.5	0	0	0	110.9	Y102 L103 F104 M128 S284 P286 I313	W91-Y102 HydrophobicContact CB-CD1 4.42Å; W91-L103 WeakPolarHBondContact CA-O 3.36Å; W91-F104 HydrophobicContact CD2-CD2 4.04Å; W91-F104 AromaticContact CE2-CD2 3.8Å; W91-F104 HydrophobicContact CE3-CB 3.91Å; W91-F104 HydrophobicContact CE3-CD2 4.28Å; W91-F104 HydrophobicContact CH2-CB 3.82Å; W91-F104 HydrophobicContact CH2-CD2 4.11Å; W91-F104 HydrophobicContact CH2-CG 4.04Å; W91-F104 HydrophobicContact CZ2-CB 4.42Å; W91-F104 AromaticContact CZ2-CD2 3.83Å; W91-F104 HydrophobicContact CZ2-CD2 3.83Å; W91-F104 HydrophobicContact CZ2-CE2 4.38Å; W91-F104 HydrophobicContact CZ2-CG 4.2Å; W91-F104 HydrophobicContact CZ3-CB 3.56Å; W91-F104 HydrophobicContact CZ3-CD2 4.34Å; W91-F104 HydrophobicContact CZ3-CG 4.22Å; W91-M128 HydrophobicContact CE3-CB 4.44Å; W91-M128 HydrophobicContact CH2-CB 3.84Å; W91-M128 HydrophobicContact CH2-CE 4.27Å; W91-M128 HydrophobicContact CZ3-CB 3.6Å; W91-S284 VanDerWaalsContact CD1-OG 3.25Å; W91-S284 PolarHBondContact NE1-O 2.88Å; W91-P286 HydrophobicContact CD2-CB 3.57Å; W91-P286 HydrophobicContact CD2-CG 4.42Å; W91-P286 HydrophobicContact CE3-CB 3.81Å; W91-P286 HydrophobicContact CG-CB 4.06Å; W91-P286 HydrophobicContact CH2-CB 4.01Å; W91-P286 HydrophobicContact CH2-CG 3.99Å; W91-P286 HydrophobicContact CZ2-CB 3.81Å; W91-P286 HydrophobicContact CZ2-CG 3.73Å; W91-P286 HydrophobicContact CZ3-CB 3.99Å; W91-P286 HydrophobicContact CZ3-CG 4.43Å; W91-I313 HydrophobicContact CH2-CD1 4.11Å; W91-I313 HydrophobicContact CH2-CG1 3.95Å; W91-I313 HydrophobicContact CH2-CG2 4Å; W91-I313 HydrophobicContact CZ2-CG2 4.26Å
92	Q	93.2	Very high	75.9	Confident	25 Å²	25	62.8 Å²	62.8	12%	0.117	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.5	176.5	-58.5	-174.3	12	0	0	110.3	Y102 L103 N204 L205 L206	Q92-Y102 CarbonylContact O-C 3.57Å; Q92-Y102 WeakPolarHBondContact O-CA 3.48Å; Q92-L103 HydrophobicContact CB-CB 4.47Å; Q92-L103 PolarHBondContact N-O 3.08Å; Q92-L103 PolarHBondContact O-N 2.94Å; Q92-N204 HydrophobicContact CB-CB 4.12Å; Q92-L205 PolarHBondContact NE2-O 3.38Å; Q92-L205 PolarHBondContact OE1-O 3.01Å; Q92-L206 HydrophobicContact CG-CD2 4.32Å
93	R	93.5	Very high	78.1	Confident	117 Å²	117	56.5 Å²	56.5	44%	0.442	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	138.2	179	-173.8	175.2	177.4	167.4	2.4	110.9	S95 V101 Y102 S203	R93-S95 PolarHBondContact O-N 3.43Å; R93-V101 WeakPolarHBondContact CA-O 3.19Å; R93-Y102 HydrophobicContact CB-CD1 3.96Å; R93-Y102 HydrophobicContact CB-CE1 3.79Å; R93-Y102 HydrophobicContact CG-CD1 4.36Å; R93-Y102 HydrophobicContact CG-CE1 3.95Å; R93-S203 PolarHBondContact O-OG 2.99Å
94	I	93.7	Very high	80.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	31%	0.305	C	S	.	.			trans	-81.3	106.2	164.5	-45.9	179.1	0	0	0	107.9	S96 C97 V101 L103 L137 I193 S203	I94-S96 WeakPolarHBondContact CG2-OG 3.45Å; I94-C97 HydrophobicContact CG2-CB 4.42Å; I94-C97 WeakPolarHBondContact CG2-SG 3.36Å; I94-V101 HydrophobicContact CB-CB 4.39Å; I94-V101 HydrophobicContact CD1-CB 3.92Å; I94-V101 HydrophobicContact CD1-CG1 3.49Å; I94-V101 VanDerWaalsContact CD1-CG1 3.49Å; I94-V101 HydrophobicContact CG1-CB 4.15Å; I94-V101 HydrophobicContact CG1-CG1 4.04Å; I94-V101 PolarHBondContact N-O 3.18Å; I94-L103 HydrophobicContact CD1-CD2 4.09Å; I94-L103 HydrophobicContact CD1-CG 4.4Å; I94-L103 HydrophobicContact CG1-CD1 4.25Å; I94-L103 HydrophobicContact CG1-CD2 4.37Å; I94-L103 HydrophobicContact CG1-CG 4.15Å; I94-L137 HydrophobicContact CD1-CD2 4.29Å; I94-I193 HydrophobicContact CD1-CB 4.03Å; I94-I193 HydrophobicContact CD1-CG2 3.77Å; I94-I193 VanDerWaalsContact CG2-O 3.3Å; I94-I193 WeakPolarHBondContact CG2-O 3.47Å; I94-S203 WeakPolarHBondContact CA-OG 2.75Å
95	S	88.2	Confident	83.2	Confident	82 Å²	82	49.4 Å²	49.4	57%	0.573	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-20.7	-173.5	64.7	0	0	0	0	113.4	R93 C97 S203	R93-S95 PolarHBondContact O-N 3.43Å; S95-C97 PolarHBondContact O-N 2.83Å; S95-S203 PolarHBondContact N-OG 2.92Å; S95-S203 WeakPolarHBondContact OG-CB 3.27Å
96	S	85.1	Confident	85.6	Confident	57 Å²	57	47.5 Å²	47.5	40%	0.399	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-16.2	178.2	63	0	0	0	0	113.5	I94 E194 C195	I94-S96 WeakPolarHBondContact CG2-OG 3.45Å; S96-E194 WeakPolarHBondContact CB-OE2 3.49Å; S96-E194 PolarHBondContact OG-OE2 3.49Å; S96-C195 PolarHBondContact OG-N 2.86Å
97	C	88.8	Confident	87.8	Confident	11 Å²	11	43.1 Å²	43.1	7%	0.074	25%	0.248	C	C	.	.			trans	-86.7	142	-177	-58.7	0	0	0	0	111.9	I94 S95 E99 I135 C195	I94-C97 HydrophobicContact CG2-CB 4.42Å; I94-C97 WeakPolarHBondContact CG2-SG 3.36Å; S95-C97 PolarHBondContact O-N 2.83Å; C97-E99 VanDerWaalsContact C-N 3.29Å; C97-E99 WeakPolarHBondContact CB-O 3.35Å; C97-I135 HydrophobicContact CB-CD1 3.98Å; C97-C195 VanDerWaalsContact CA-SG 3.57Å; C97-C195 HydrophobicContact CB-CB 4.05Å; C97-C195 WeakPolarHBondContact CB-SG 3.46Å; C97-C195 WeakPolarHBondContact SG-CB 3.25Å; C97-C195 CovalentContact SG-SG 2.01Å; C97-C195 PolarHBondContact SG-SG 3.3Å
98	S	90.3	Very high	90.2	Very high	111 Å²	111	39.6 Å²	39.6	78%	0.776	23%	0.225	S	C	*	.	S	Bend	trans	-67.1	-34.3	166.6	51.8	0	0	0	0	111.8
99	E	91.4	Very high	92.2	Very high	36 Å²	36	37 Å²	37	17%	0.168	20%	0.198	C	C	.	.	S	Bend	trans	-81.9	149.5	177.7	-62.5	-176.3	-136.4	0	0	112.3	C97 V101 L133 Q134 I135	C97-E99 VanDerWaalsContact C-N 3.29Å; C97-E99 WeakPolarHBondContact CB-O 3.35Å; E99-V101 HydrophobicContact CB-CG2 4.36Å; E99-V101 PolarHBondContact O-N 3.37Å; E99-V101 VanDerWaalsContact O-N 3.14Å; E99-L133 VanDerWaalsContact OE2-CA 3.27Å; E99-L133 WeakPolarHBondContact OE2-CA 3.37Å; E99-Q134 WeakPolarHBondContact OE1-CA 3.31Å; E99-Q134 WeakPolarHBondContact OE1-CB 3.32Å; E99-Q134 PolarHBondContact OE1-N 2.99Å; E99-Q134 PolarHBondContact OE2-N 3.34Å; E99-I135 HydrophobicContact CB-CD1 4Å; E99-I135 HydrophobicContact CG-CD1 3.92Å; E99-I135 PolarHBondContact OE1-N 3.12Å
100	E	94.7	Very high	93.2	Very high	50 Å²	50	36.6 Å²	36.6	23%	0.234	20%	0.203	C	C	.	.			trans	-78.8	96.3	176.1	-71.4	-177.2	-117.7	0	0	111.2	Y102 V129 K130 Y171	E100-Y102 HydrophobicContact CB-CE2 3.94Å; E100-Y102 PolarHBondContact OE2-OH 2.89Å; E100-V129 WeakPolarHBondContact O-CA 3.49Å; E100-K130 HydrophobicContact CB-CB 3.66Å; E100-K130 HydrophobicContact CG-CB 4.42Å; E100-K130 PolarHBondContact O-N 3.33Å; E100-Y171 PolarHBondContact OE2-OH 3.42Å
101	V	96.9	Very high	93.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.4	178.3	-174.8	0	0	0	0	110.7	R93 I94 E99 L103 V129 L133 F176	R93-V101 WeakPolarHBondContact CA-O 3.19Å; I94-V101 HydrophobicContact CB-CB 4.39Å; I94-V101 HydrophobicContact CD1-CB 3.92Å; I94-V101 HydrophobicContact CD1-CG1 3.49Å; I94-V101 VanDerWaalsContact CD1-CG1 3.49Å; I94-V101 HydrophobicContact CG1-CB 4.15Å; I94-V101 HydrophobicContact CG1-CG1 4.04Å; I94-V101 PolarHBondContact N-O 3.18Å; E99-V101 HydrophobicContact CB-CG2 4.36Å; E99-V101 PolarHBondContact O-N 3.37Å; E99-V101 VanDerWaalsContact O-N 3.14Å; V101-L103 HydrophobicContact CG1-CD2 4.44Å; V101-V129 HydrophobicContact CG1-CG2 4.14Å; V101-V129 HydrophobicContact CG2-CG1 4.26Å; V101-V129 HydrophobicContact CG2-CG2 4.27Å; V101-L133 HydrophobicContact CG2-CD1 3.88Å; V101-F176 HydrophobicContact CG1-CE2 3.96Å; V101-F176 HydrophobicContact CG1-CZ 4.07Å
102	Y	96.6	Very high	93.5	Very high	16 Å²	16	29.5 Å²	29.5	6%	0.063	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	122.4	-179.7	-62.3	-87.3	0	0	0	111	W91 Q92 R93 E100 A127 M128 Y171 G287	W91-Y102 HydrophobicContact CB-CD1 4.42Å; Q92-Y102 CarbonylContact O-C 3.57Å; Q92-Y102 WeakPolarHBondContact O-CA 3.48Å; R93-Y102 HydrophobicContact CB-CD1 3.96Å; R93-Y102 HydrophobicContact CB-CE1 3.79Å; R93-Y102 HydrophobicContact CG-CD1 4.36Å; R93-Y102 HydrophobicContact CG-CE1 3.95Å; E100-Y102 HydrophobicContact CB-CE2 3.94Å; E100-Y102 PolarHBondContact OE2-OH 2.89Å; Y102-A127 CarbonylContact O-C 3.53Å; Y102-A127 WeakPolarHBondContact O-CA 3.17Å; Y102-A127 WeakPolarHBondContact O-CB 3.34Å; Y102-M128 PolarHBondContact N-O 3.2Å; Y102-M128 PolarHBondContact O-N 2.96Å; Y102-Y171 HydrophobicContact CD2-CE1 4.06Å; Y102-Y171 AromaticContact CE2-CE1 3.8Å; Y102-Y171 HydrophobicContact CE2-CE1 3.8Å; Y102-G287 VanDerWaalsContact CE1-CA 3.5Å; Y102-G287 WeakPolarHBondContact OH-CA 3.37Å
103	L	96.8	Very high	93.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	145.2	178.1	-50.1	179.2	0	0	0	110.7	W91 Q92 I94 V101 V125 A127 F176 I193 N204 L206	W91-L103 WeakPolarHBondContact CA-O 3.36Å; Q92-L103 HydrophobicContact CB-CB 4.47Å; Q92-L103 PolarHBondContact N-O 3.08Å; Q92-L103 PolarHBondContact O-N 2.94Å; I94-L103 HydrophobicContact CD1-CD2 4.09Å; I94-L103 HydrophobicContact CD1-CG 4.4Å; I94-L103 HydrophobicContact CG1-CD1 4.25Å; I94-L103 HydrophobicContact CG1-CD2 4.37Å; I94-L103 HydrophobicContact CG1-CG 4.15Å; V101-L103 HydrophobicContact CG1-CD2 4.44Å; L103-V125 HydrophobicContact CD2-CG1 4.23Å; L103-A127 HydrophobicContact CD2-CB 3.98Å; L103-F176 HydrophobicContact CD2-CD2 4.06Å; L103-F176 HydrophobicContact CD2-CE2 3.85Å; L103-I193 HydrophobicContact CD1-CB 4.05Å; L103-I193 HydrophobicContact CD1-CD1 4.41Å; L103-I193 HydrophobicContact CD1-CG1 4.27Å; L103-I193 HydrophobicContact CD2-CB 4.44Å; L103-I193 HydrophobicContact CD2-CD1 3.98Å; L103-N204 HydrophobicContact CD1-CB 4.12Å; L103-N204 WeakPolarHBondContact CD1-OD1 3.33Å; L103-L206 HydrophobicContact CB-CD1 3.79Å; L103-L206 HydrophobicContact CB-CG 4.44Å; L103-L206 HydrophobicContact CD1-CD1 4.32Å
104	F	95.9	Very high	92.8	Very high	6 Å²	6	30.8 Å²	30.8	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-68.8	-178.3	-171.4	-123.7	0	0	0	112.6	Y89 W91 L126 I283 I313 D317	Y89-F104 HydrophobicContact CD1-CE1 4.36Å; Y89-F104 HydrophobicContact CD1-CE2 4.28Å; Y89-F104 AromaticContact CD1-CZ 3.76Å; Y89-F104 HydrophobicContact CD1-CZ 3.76Å; Y89-F104 HydrophobicContact CG-CZ 4.4Å; W91-F104 HydrophobicContact CD2-CD2 4.04Å; W91-F104 AromaticContact CE2-CD2 3.8Å; W91-F104 HydrophobicContact CE3-CB 3.91Å; W91-F104 HydrophobicContact CE3-CD2 4.28Å; W91-F104 HydrophobicContact CH2-CB 3.82Å; W91-F104 HydrophobicContact CH2-CD2 4.11Å; W91-F104 HydrophobicContact CH2-CG 4.04Å; W91-F104 HydrophobicContact CZ2-CB 4.42Å; W91-F104 AromaticContact CZ2-CD2 3.83Å; W91-F104 HydrophobicContact CZ2-CD2 3.83Å; W91-F104 HydrophobicContact CZ2-CE2 4.38Å; W91-F104 HydrophobicContact CZ2-CG 4.2Å; W91-F104 HydrophobicContact CZ3-CB 3.56Å; W91-F104 HydrophobicContact CZ3-CD2 4.34Å; W91-F104 HydrophobicContact CZ3-CG 4.22Å; F104-L126 HydrophobicContact CB-CB 4.31Å; F104-L126 WeakPolarHBondContact CB-O 3.21Å; F104-L126 PolarHBondContact N-O 3.25Å; F104-I283 HydrophobicContact CE2-CG2 4.44Å; F104-I283 HydrophobicContact CZ-CG2 3.92Å; F104-I313 HydrophobicContact CD1-CG2 3.37Å; F104-I313 HydrophobicContact CE1-CG2 3.61Å; F104-I313 HydrophobicContact CG-CG2 3.93Å; F104-I313 HydrophobicContact CZ-CG2 4.35Å; F104-D317 HydrophobicContact CE1-CB 4.13Å
105	T	96.5	Very high	92.4	Very high	17 Å²	17	34.6 Å²	34.6	10%	0.104	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152.8	-173.6	48.9	0	0	0	0	110.8	Y89 Y107 V125 L126 D317	Y89-T105 HydrophobicContact CD1-CG2 4.16Å; Y89-T105 HydrophobicContact CE1-CG2 4.3Å; T105-Y107 WeakPolarHBondContact OG1-CE2 3.46Å; T105-V125 CarbonylContact O-C 3.59Å; T105-V125 WeakPolarHBondContact O-CA 3.31Å; T105-L126 PolarHBondContact O-N 2.71Å; T105-D317 WeakPolarHBondContact CB-OD1 3.35Å; T105-D317 WeakPolarHBondContact CG2-OD1 3.44Å; T105-D317 PolarHBondContact OG1-OD1 3.47Å
106	A	97.5	Very high	92.4	Very high	3 Å²	3	33.1 Å²	33.1	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.1	-179.4	0	0	0	0	0	111.3	V123 S124 V125 V191 L206 I208 S209	A106-V123 HydrophobicContact CB-CG1 4.47Å; A106-S124 CarbonylContact C-O 3.56Å; A106-S124 WeakPolarHBondContact CA-O 3.43Å; A106-V125 HydrophobicContact CB-CG2 3.91Å; A106-V191 HydrophobicContact CB-CG1 3.56Å; A106-L206 HydrophobicContact CB-CB 3.89Å; A106-L206 HydrophobicContact CB-CD1 4.07Å; A106-I208 HydrophobicContact CB-CG1 4.28Å; A106-S209 PolarHBondContact O-N 3.04Å
107	Y	97	Very high	92.5	Very high	6 Å²	6	35.5 Å²	35.5	2%	0.024	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	138.2	-174.9	-62.8	-84.5	0	0	0	111.2	T105 D109 V123 S124 S209 D317 L320 R321	T105-Y107 WeakPolarHBondContact OG1-CE2 3.46Å; Y107-D109 PolarHBondContact O-N 3.18Å; Y107-V123 CarbonylContact O-C 3.6Å; Y107-V123 WeakPolarHBondContact O-CA 3.27Å; Y107-S124 PolarHBondContact N-O 3.41Å; Y107-S124 PolarHBondContact O-N 3.33Å; Y107-S209 WeakPolarHBondContact CA-O 3.04Å; Y107-D317 PolarHBondContact OH-OD1 3.06Å; Y107-D317 PolarHBondContact OH-OD2 2.79Å; Y107-L320 HydrophobicContact CD1-CB 4.26Å; Y107-L320 HydrophobicContact CD2-CB 3.5Å; Y107-L320 HydrophobicContact CD2-CD1 3.79Å; Y107-L320 HydrophobicContact CD2-CG 4.29Å; Y107-L320 HydrophobicContact CE2-CB 3.83Å; Y107-L320 HydrophobicContact CE2-CD1 4.27Å; Y107-L320 HydrophobicContact CG-CB 3.74Å; Y107-R321 VanDerWaalsContact CE1-CA 3.49Å; Y107-R321 HydrophobicContact CE1-CB 3.86Å; Y107-R321 PolarHBondContact OH-NH2 2.89Å
108	A	96	Very high	92.5	Very high	23 Å²	23	40.9 Å²	40.9	19%	0.19	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	119.9	164	0	0	0	0	0	108.4	I208 S209 H210	A108-I208 HydrophobicContact CB-CG2 3.9Å; A108-S209 PolarHBondContact N-O 3.2Å; A108-H210 WeakPolarHBondContact CB-ND1 3.14Å
109	D	95.2	Very high	92.4	Very high	3 Å²	3	36 Å²	36	2%	0.016	20%	0.197	C	C	.	.			trans	-104	87.9	-173.5	-161.7	-30.1	0	0	0	110.7	Y107 R111 Y112 V122 S124 I323	Y107-D109 PolarHBondContact O-N 3.18Å; D109-R111 PolarHBondContact O-N 2.88Å; D109-R111 VanDerWaalsContact O-N 3.15Å; D109-R111 WeakPolarHBondContact OD1-CB 3.28Å; D109-R111 IonicContact OD1-CZ 2.66Å; D109-R111 PolarHBondContact OD1-N 3.31Å; D109-R111 IonicContact OD1-NE 2.93Å; D109-R111 PolarHBondContact OD1-NE 3.37Å; D109-R111 IonicContact OD1-NH2 3.76Å; D109-R111 PolarHBondContact OD1-NH2 3.32Å; D109-R111 IonicContact OD2-CZ 3.67Å; D109-R111 IonicContact OD2-NE 3.13Å; D109-R111 IonicContact OD2-NH2 3.39Å; D109-R111 PolarHBondContact OD2-NH2 3.35Å; D109-Y112 HydrophobicContact CB-CD2 4.25Å; D109-Y112 HydrophobicContact CB-CE2 4.27Å; D109-Y112 WeakPolarHBondContact OD2-CE2 3.45Å; D109-V122 HydrophobicContact CB-CB 4.2Å; D109-V122 HydrophobicContact CB-CG1 4.02Å; D109-V122 PolarHBondContact N-O 3.37Å; D109-S124 PolarHBondContact OD2-OG 3.23Å; D109-I323 HydrophobicContact CB-CD1 4.35Å
110	S	92.7	Very high	92.4	Very high	48 Å²	48	35.1 Å²	35.1	34%	0.336	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	3	-175.7	59.5	0	0	0	0	114.7	N114	S110-N114 PolarHBondContact O-ND2 3.31Å
111	R	93.1	Very high	92.3	Very high	7 Å²	7	33.7 Å²	33.7	3%	0.026	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-36.1	-176.1	-62.3	172	-67.1	178.1	5.4	112.5	D109 F115 I323 I415 V418 V430	D109-R111 PolarHBondContact O-N 2.88Å; D109-R111 VanDerWaalsContact O-N 3.15Å; D109-R111 WeakPolarHBondContact OD1-CB 3.28Å; D109-R111 IonicContact OD1-CZ 2.66Å; D109-R111 PolarHBondContact OD1-N 3.31Å; D109-R111 IonicContact OD1-NE 2.93Å; D109-R111 PolarHBondContact OD1-NE 3.37Å; D109-R111 IonicContact OD1-NH2 3.76Å; D109-R111 PolarHBondContact OD1-NH2 3.32Å; D109-R111 IonicContact OD2-CZ 3.67Å; D109-R111 IonicContact OD2-NE 3.13Å; D109-R111 IonicContact OD2-NH2 3.39Å; D109-R111 PolarHBondContact OD2-NH2 3.35Å; R111-F115 WeakPolarHBondContact O-CD2 3.32Å; R111-F115 WeakPolarHBondContact O-CE2 3.33Å; R111-I323 HydrophobicContact CG-CG2 3.7Å; R111-I415 WeakPolarHBondContact CD-O 3.46Å; R111-I415 PolarHBondContact NH1-O 3.21Å; R111-V418 PolarHBondContact NH1-O 3.26Å; R111-V430 HydrophobicContact CB-CG1 4.03Å; R111-V430 HydrophobicContact CB-CG2 4.38Å
112	Y	91.1	Very high	92.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-68.6	-44.5	-174.4	-64.2	-89.2	0	0	0	114.3	V65 D109 N114 F115 Y116 V122 V430	V65-Y112 HydrophobicContact CG2-CD1 3.29Å; V65-Y112 HydrophobicContact CG2-CE1 3.52Å; V65-Y112 HydrophobicContact CG2-CG 3.97Å; D109-Y112 HydrophobicContact CB-CD2 4.25Å; D109-Y112 HydrophobicContact CB-CE2 4.27Å; D109-Y112 WeakPolarHBondContact OD2-CE2 3.45Å; Y112-N114 PolarHBondContact O-N 2.78Å; Y112-N114 VanDerWaalsContact O-N 3.08Å; Y112-F115 PolarHBondContact O-N 2.84Å; Y112-Y116 HydrophobicContact CD1-CD2 4.07Å; Y112-Y116 AromaticContact CD1-CE2 3.83Å; Y112-Y116 HydrophobicContact CD1-CE2 3.83Å; Y112-Y116 WeakPolarHBondContact O-CD2 3.28Å; Y112-Y116 PolarHBondContact O-N 3.41Å; Y112-V122 HydrophobicContact CD2-CB 4.11Å; Y112-V122 HydrophobicContact CD2-CG1 3.82Å; Y112-V122 HydrophobicContact CD2-CG2 4.05Å; Y112-V122 HydrophobicContact CE2-CG1 4.07Å; Y112-V122 HydrophobicContact CG-CG2 4.15Å; Y112-V430 HydrophobicContact CD1-CG1 3.77Å; Y112-V430 HydrophobicContact CE1-CB 4.48Å; Y112-V430 HydrophobicContact CE1-CG1 3.77Å; Y112-V430 HydrophobicContact CG-CG1 4.16Å
113	P	86	Confident	92.2	Very high	44 Å²	44	33.2 Å²	33.2	29%	0.286	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.7	179.4	-27.3	37.8	0	0	0	113.9	F115 V119 G120	P113-F115 VanDerWaalsContact C-N 3.26Å; P113-F115 PolarHBondContact O-N 3.25Å; P113-V119 WeakPolarHBondContact CB-O 3.38Å; P113-G120 WeakPolarHBondContact CG-O 3.37Å
114	N	84.7	Confident	92.2	Very high	126 Å²	126	33.1 Å²	33.1	67%	0.674	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-23.4	177.2	-59.9	-26.9	0	0	0	113.3	S110 Y112	S110-N114 PolarHBondContact O-ND2 3.31Å; Y112-N114 PolarHBondContact O-N 2.78Å; Y112-N114 VanDerWaalsContact O-N 3.08Å
115	F	86.5	Confident	92.4	Very high	79 Å²	79	32.9 Å²	32.9	35%	0.346	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-21.6	-176	-57	-67.2	0	0	0	113.2	R111 Y112 P113 V430 H431	R111-F115 WeakPolarHBondContact O-CD2 3.32Å; R111-F115 WeakPolarHBondContact O-CE2 3.33Å; Y112-F115 PolarHBondContact O-N 2.84Å; P113-F115 VanDerWaalsContact C-N 3.26Å; P113-F115 PolarHBondContact O-N 3.25Å; F115-V430 HydrophobicContact CD2-CG1 4.1Å; F115-V430 HydrophobicContact CE2-CG1 4.42Å; F115-H431 HydrophobicContact CB-CB 3.87Å; F115-H431 HydrophobicContact CD1-CB 4.44Å; F115-H431 AromaticContact CD1-CD2 3.66Å; F115-H431 AromaticContact CD1-CE1 3.75Å; F115-H431 AromaticContact CD1-CG 3.72Å; F115-H431 AromaticContact CD1-ND1 3.79Å; F115-H431 AromaticContact CD1-NE2 3.72Å; F115-H431 HydrophobicContact CD2-CB 4.12Å; F115-H431 AromaticContact CD2-CD2 3.34Å; F115-H431 WeakPolarHBondContact CD2-CD2 3.48Å; F115-H431 AromaticContact CD2-CG 3.8Å; F115-H431 AromaticContact CE1-CD2 3.58Å; F115-H431 AromaticContact CE1-CE1 3.52Å; F115-H431 AromaticContact CE1-NE2 3.24Å; F115-H431 WeakPolarHBondContact CE1-NE2 3.37Å; F115-H431 AromaticContact CE2-CD2 3.27Å; F115-H431 WeakPolarHBondContact CE2-CD2 3.36Å; F115-H431 AromaticContact CE2-NE2 3.62Å; F115-H431 HydrophobicContact CG-CB 3.89Å; F115-H431 AromaticContact CG-CD2 3.55Å; F115-H431 AromaticContact CG-CG 3.58Å; F115-H431 AromaticContact CZ-CD2 3.39Å; F115-H431 WeakPolarHBondContact CZ-CD2 3.21Å; F115-H431 AromaticContact CZ-CE1 3.96Å; F115-H431 AromaticContact CZ-NE2 3.19Å; F115-H431 WeakPolarHBondContact CZ-NE2 3.23Å
116	Y	88.4	Confident	92.4	Very high	51 Å²	51	32 Å²	32	20%	0.2	18%	0.184	C	C	.	.			trans	-124.5	96.8	-176.8	-55.9	-74.5	0	0	0	110.2	Y112 N118 V119 V430 H431	Y112-Y116 HydrophobicContact CD1-CD2 4.07Å; Y112-Y116 AromaticContact CD1-CE2 3.83Å; Y112-Y116 HydrophobicContact CD1-CE2 3.83Å; Y112-Y116 WeakPolarHBondContact O-CD2 3.28Å; Y112-Y116 PolarHBondContact O-N 3.41Å; Y116-N118 PolarHBondContact O-N 3.19Å; Y116-V119 HydrophobicContact CG-CG2 4.41Å; Y116-V119 WeakPolarHBondContact O-CB 3.45Å; Y116-V119 PolarHBondContact O-N 2.96Å; Y116-V430 WeakPolarHBondContact CE2-O 3.47Å; Y116-V430 PolarHBondContact OH-O 3.49Å; Y116-H431 HydrophobicContact CE2-CB 4.17Å; Y116-H431 WeakPolarHBondContact OH-CA 3.48Å
117	P	86.1	Confident	92.5	Very high	108 Å²	108	31.9 Å²	31.9	70%	0.701	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.1	-175.1	-26.9	34.9	0	0	0	115.6	S182	P117-S182 VanDerWaalsContact O-CB 3.23Å; P117-S182 WeakPolarHBondContact O-CB 3.4Å; P117-S182 PolarHBondContact O-OG 3.03Å
118	N	88.4	Confident	92.5	Very high	124 Å²	124	31.7 Å²	31.7	66%	0.663	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-5	178.7	-64.3	-20.3	0	0	0	113.2	Y116 S181 S182	Y116-N118 PolarHBondContact O-N 3.19Å; N118-S181 CarbonylContact O-C 3.57Å; N118-S181 VanDerWaalsContact O-CA 3.3Å; N118-S181 WeakPolarHBondContact O-CA 3.12Å; N118-S182 PolarHBondContact O-N 3.13Å
119	V	90.1	Very high	92.5	Very high	8 Å²	8	30.6 Å²	30.6	5%	0.048	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.6	-178.3	-179.9	0	0	0	0	109.1	V65 V67 P113 Y116 V122	V65-V119 HydrophobicContact CB-CG2 4.16Å; V65-V119 HydrophobicContact CG1-CG1 4.29Å; V65-V119 HydrophobicContact CG1-CG2 4.19Å; V67-V119 HydrophobicContact CG2-CB 4.45Å; V67-V119 HydrophobicContact CG2-CG2 3.68Å; P113-V119 WeakPolarHBondContact CB-O 3.38Å; Y116-V119 HydrophobicContact CG-CG2 4.41Å; Y116-V119 WeakPolarHBondContact O-CB 3.45Å; Y116-V119 PolarHBondContact O-N 2.96Å; V119-V122 HydrophobicContact CG1-CG2 3.38Å
120	G	90.1	Very high	92.6	Very high	18 Å²	18	33.2 Å²	33.2	19%	0.186	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-70.5	-179.3	0	0	0	0	0	112.5	P113 L180 S181 Y184	P113-G120 WeakPolarHBondContact CG-O 3.37Å; G120-L180 PolarHBondContact N-O 3.31Å; G120-S181 WeakPolarHBondContact CA-O 3.48Å; G120-S181 PolarHBondContact N-O 3.46Å; G120-Y184 CarbonylContact C-O 3.56Å; G120-Y184 WeakPolarHBondContact CA-O 3.46Å
121	V	93.2	Very high	92.6	Very high	19 Å²	19	33.4 Å²	33.4	12%	0.115	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.5	179.4	173.8	0	0	0	0	109.9	V123 A179 L180 E186 F188	V121-V123 HydrophobicContact CG1-CG2 4.19Å; V121-A179 CarbonylContact O-C 3.59Å; V121-A179 WeakPolarHBondContact O-CA 3.29Å; V121-L180 HydrophobicContact CB-CB 4.26Å; V121-L180 HydrophobicContact CB-CD1 4.3Å; V121-L180 PolarHBondContact O-N 3.4Å; V121-E186 WeakPolarHBondContact CG2-O 3.49Å; V121-F188 HydrophobicContact CG1-CD2 3.97Å; V121-F188 HydrophobicContact CG1-CE2 4.38Å; V121-F188 HydrophobicContact CG2-CD2 4.36Å; V121-F188 HydrophobicContact CG2-CE2 4.24Å
122	V	94.9	Very high	92.6	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.6	168.6	-176.1	0	0	0	0	109.7	D109 Y112 V119 T177 C178 A179	D109-V122 HydrophobicContact CB-CB 4.2Å; D109-V122 HydrophobicContact CB-CG1 4.02Å; D109-V122 PolarHBondContact N-O 3.37Å; Y112-V122 HydrophobicContact CD2-CB 4.11Å; Y112-V122 HydrophobicContact CD2-CG1 3.82Å; Y112-V122 HydrophobicContact CD2-CG2 4.05Å; Y112-V122 HydrophobicContact CE2-CG1 4.07Å; Y112-V122 HydrophobicContact CG-CG2 4.15Å; V119-V122 HydrophobicContact CG1-CG2 3.38Å; V122-T177 HydrophobicContact CG1-CG2 3.46Å; V122-T177 VanDerWaalsContact CG1-CG2 3.46Å; V122-C178 CarbonylContact C-O 3.55Å; V122-C178 WeakPolarHBondContact CA-O 3.39Å; V122-A179 HydrophobicContact CG2-CB 4.23Å
123	V	96.7	Very high	92.7	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.6	172.6	-178.6	0	0	0	0	108.9	A106 Y107 V121 V125 L141 T177 C178 V191 I208	A106-V123 HydrophobicContact CB-CG1 4.47Å; Y107-V123 CarbonylContact O-C 3.6Å; Y107-V123 WeakPolarHBondContact O-CA 3.27Å; V121-V123 HydrophobicContact CG1-CG2 4.19Å; V123-V125 HydrophobicContact CG1-CG2 4.05Å; V123-L141 HydrophobicContact CB-CD2 4.2Å; V123-L141 HydrophobicContact CG2-CD2 3.81Å; V123-T177 WeakPolarHBondContact O-CA 3.48Å; V123-C178 HydrophobicContact CB-CB 4.21Å; V123-C178 PolarHBondContact N-O 2.86Å; V123-C178 PolarHBondContact O-N 2.85Å; V123-V191 HydrophobicContact CG1-CB 4.38Å; V123-V191 HydrophobicContact CG1-CG1 4.13Å; V123-I208 HydrophobicContact CG1-CD1 4.02Å; V123-I208 HydrophobicContact CG1-CG1 4Å; V123-I208 HydrophobicContact CG1-CG2 4.48Å; V123-I208 HydrophobicContact CG2-CD1 3.86Å
124	S	97.3	Very high	93	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	121.6	178.2	-77.4	0	0	0	0	109.3	A106 Y107 D109 F176	A106-S124 CarbonylContact C-O 3.56Å; A106-S124 WeakPolarHBondContact CA-O 3.43Å; Y107-S124 PolarHBondContact N-O 3.41Å; Y107-S124 PolarHBondContact O-N 3.33Å; D109-S124 PolarHBondContact OD2-OG 3.23Å; S124-F176 CarbonylContact C-O 3.5Å; S124-F176 WeakPolarHBondContact CA-O 3.22Å
125	V	98.2	Very high	93.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.1	-178.9	-176	0	0	0	0	109.9	L103 T105 A106 V123 F176 V191 I193 L206	L103-V125 HydrophobicContact CD2-CG1 4.23Å; T105-V125 CarbonylContact O-C 3.59Å; T105-V125 WeakPolarHBondContact O-CA 3.31Å; A106-V125 HydrophobicContact CB-CG2 3.91Å; V123-V125 HydrophobicContact CG1-CG2 4.05Å; V125-F176 HydrophobicContact CB-CB 4.27Å; V125-F176 PolarHBondContact N-O 2.78Å; V125-F176 PolarHBondContact O-N 2.84Å; V125-V191 HydrophobicContact CG2-CG1 3.92Å; V125-I193 HydrophobicContact CB-CD1 3.93Å; V125-I193 HydrophobicContact CG1-CD1 3.83Å; V125-I193 HydrophobicContact CG2-CD1 4.02Å; V125-L206 HydrophobicContact CG1-CD1 3.68Å
126	L	98.2	Very high	93.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	135.8	173.2	-69.6	174.3	0	0	0	110.2	F104 T105 I159 L175 N316 D317 L320	F104-L126 HydrophobicContact CB-CB 4.31Å; F104-L126 WeakPolarHBondContact CB-O 3.21Å; F104-L126 PolarHBondContact N-O 3.25Å; T105-L126 PolarHBondContact O-N 2.71Å; L126-I159 HydrophobicContact CD2-CD1 3.91Å; L126-L175 HydrophobicContact CD2-CD1 3.98Å; L126-N316 HydrophobicContact CD1-CB 4.1Å; L126-N316 HydrophobicContact CD2-CB 3.75Å; L126-D317 VanDerWaalsContact CD1-CA 3.49Å; L126-D317 HydrophobicContact CD1-CB 3.78Å; L126-D317 VanDerWaalsContact CD1-N 3.3Å; L126-L320 HydrophobicContact CD1-CD1 3.99Å; L126-L320 HydrophobicContact CD2-CD1 4.05Å; L126-L320 HydrophobicContact CG-CD1 3.82Å
127	A	98	Very high	94.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	165.3	-178.1	0	0	0	0	0	111.6	Y102 L103 P173 Y174 F176 I313	Y102-A127 CarbonylContact O-C 3.53Å; Y102-A127 WeakPolarHBondContact O-CA 3.17Å; Y102-A127 WeakPolarHBondContact O-CB 3.34Å; L103-A127 HydrophobicContact CD2-CB 3.98Å; A127-P173 CarbonylContact O-C 3.57Å; A127-P173 WeakPolarHBondContact O-CA 3.34Å; A127-Y174 PolarHBondContact N-O 2.86Å; A127-Y174 PolarHBondContact O-N 3.34Å; A127-F176 HydrophobicContact CB-CD2 3.74Å; A127-F176 HydrophobicContact CB-CE1 4.43Å; A127-F176 HydrophobicContact CB-CE2 3.24Å; A127-F176 HydrophobicContact CB-CZ 3.64Å; A127-I313 WeakPolarHBondContact O-CD1 3.36Å
128	M	97.6	Very high	94.5	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.9	170	-164.5	79.5	71.5	0	0	108.8	W91 Y102 Y171 P173 P286 I313	W91-M128 HydrophobicContact CE3-CB 4.44Å; W91-M128 HydrophobicContact CH2-CB 3.84Å; W91-M128 HydrophobicContact CH2-CE 4.27Å; W91-M128 HydrophobicContact CZ3-CB 3.6Å; Y102-M128 PolarHBondContact N-O 3.2Å; Y102-M128 PolarHBondContact O-N 2.96Å; M128-Y171 HydrophobicContact CG-CD1 4.08Å; M128-Y171 HydrophobicContact CG-CG 4.19Å; M128-P173 HydrophobicContact CE-CB 4.33Å; M128-P173 VanDerWaalsContact SD-CA 3.53Å; M128-P173 HydrophobicContact SD-CB 3.95Å; M128-P286 HydrophobicContact CB-CB 3.77Å; M128-P286 HydrophobicContact CB-CG 3.71Å; M128-P286 HydrophobicContact CE-CG 3.66Å; M128-P286 HydrophobicContact CG-CB 3.98Å; M128-P286 HydrophobicContact CG-CG 3.48Å; M128-P286 VanDerWaalsContact CG-CG 3.48Å; M128-P286 HydrophobicContact SD-CG 4.36Å; M128-I313 HydrophobicContact CE-CD1 4.09Å; M128-I313 HydrophobicContact CE-CG1 3.43Å; M128-I313 VanDerWaalsContact CE-CG1 3.43Å
129	V	97	Very high	94.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137	-178.1	-177.7	0	0	0	0	108.5	E100 V101 D131 L133 Y171 V172 Y174 F176	E100-V129 WeakPolarHBondContact O-CA 3.49Å; V101-V129 HydrophobicContact CG1-CG2 4.14Å; V101-V129 HydrophobicContact CG2-CG1 4.26Å; V101-V129 HydrophobicContact CG2-CG2 4.27Å; V129-D131 PolarHBondContact O-N 2.94Å; V129-L133 HydrophobicContact CG1-CB 4.33Å; V129-L133 HydrophobicContact CG1-CD1 4.2Å; V129-Y171 CarbonylContact O-C 3.56Å; V129-Y171 VanDerWaalsContact O-CA 3.31Å; V129-Y171 WeakPolarHBondContact O-CA 3.37Å; V129-V172 PolarHBondContact N-O 3.48Å; V129-V172 PolarHBondContact O-N 2.87Å; V129-Y174 HydrophobicContact CB-CD2 3.83Å; V129-Y174 HydrophobicContact CB-CE2 3.77Å; V129-Y174 HydrophobicContact CG2-CD2 3.52Å; V129-Y174 HydrophobicContact CG2-CE2 3.87Å; V129-Y174 HydrophobicContact CG2-CG 4.06Å; V129-F176 HydrophobicContact CG2-CZ 3.97Å
130	K	95.5	Very high	95.1	Very high	58 Å²	58	26.1 Å²	26.1	25%	0.252	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	122.1	167.5	-174.9	65.1	171.4	-167.7	0	108.3	E100 G169 Y171	E100-K130 HydrophobicContact CB-CB 3.66Å; E100-K130 HydrophobicContact CG-CB 4.42Å; E100-K130 PolarHBondContact O-N 3.33Å; K130-G169 PolarHBondContact NZ-O 3.28Å; K130-Y171 HydrophobicContact CB-CD1 4.04Å; K130-Y171 HydrophobicContact CB-CE1 3.79Å; K130-Y171 HydrophobicContact CD-CD1 4.2Å; K130-Y171 HydrophobicContact CD-CD2 4.31Å; K130-Y171 HydrophobicContact CD-CE1 4.05Å; K130-Y171 HydrophobicContact CD-CE2 4.19Å; K130-Y171 HydrophobicContact CD-CG 4.32Å; K130-Y171 HydrophobicContact CG-CE1 4.46Å
131	D	93	Very high	95.3	Very high	52 Å²	52	25.3 Å²	25.3	28%	0.278	13%	0.126	S	C	.	.	S	Bend	trans	61	-147.3	-172.9	-61.5	-51.3	0	0	0	112.7	V129 P168 G169 F170 V172	V129-D131 PolarHBondContact O-N 2.94Å; D131-P168 VanDerWaalsContact OD1-CA 3.23Å; D131-P168 WeakPolarHBondContact OD1-CA 3.36Å; D131-G169 PolarHBondContact OD1-N 2.83Å; D131-F170 PolarHBondContact N-O 2.86Å; D131-F170 PolarHBondContact OD1-N 3.04Å; D131-V172 WeakPolarHBondContact O-CB 3.12Å; D131-V172 WeakPolarHBondContact O-CG2 3.32Å
132	Y	93	Very high	95.4	Very high	55 Å²	55	24.8 Å²	24.8	22%	0.216	12%	0.121	C	C	.	.			trans	-110.6	129.3	-177.5	-69.1	-92.8	0	0	0	110.8	Q134 A158 S162 V172 Y174	Y132-Q134 PolarHBondContact O-N 3.22Å; Y132-Q134 PolarHBondContact O-NE2 3.16Å; Y132-A158 HydrophobicContact CD1-CB 4.49Å; Y132-A158 HydrophobicContact CE1-CB 4.34Å; Y132-S162 PolarHBondContact OH-OG 3.13Å; Y132-V172 HydrophobicContact CE1-CG1 4.23Å; Y132-V172 HydrophobicContact CE2-CG2 4.38Å; Y132-Y174 WeakPolarHBondContact CA-OH 3.42Å; Y132-Y174 WeakPolarHBondContact CD1-OH 3.34Å
133	L	93.1	Very high	95.2	Very high	19 Å²	19	27.2 Å²	27.2	10%	0.099	13%	0.132	C	C	.	.			trans	-58.7	127.4	-177	-166.6	75.4	0	0	0	111.7	E99 V101 V129 I135 L137 T156 Y174 F176	E99-L133 VanDerWaalsContact OE2-CA 3.27Å; E99-L133 WeakPolarHBondContact OE2-CA 3.37Å; V101-L133 HydrophobicContact CG2-CD1 3.88Å; V129-L133 HydrophobicContact CG1-CB 4.33Å; V129-L133 HydrophobicContact CG1-CD1 4.2Å; L133-I135 HydrophobicContact CD1-CG1 3.86Å; L133-I135 HydrophobicContact CG-CG1 4.41Å; L133-L137 HydrophobicContact CD1-CD1 4.39Å; L133-L137 HydrophobicContact CD2-CD1 3.63Å; L133-L137 HydrophobicContact CD2-CG 3.95Å; L133-T156 HydrophobicContact CD2-CG2 3.67Å; L133-Y174 HydrophobicContact CB-CE1 4.21Å; L133-Y174 PolarHBondContact N-OH 3.11Å; L133-F176 HydrophobicContact CD2-CE1 4.33Å
134	Q	92.7	Very high	94.8	Very high	157 Å²	157	30.6 Å²	30.6	73%	0.734	15%	0.15	S	C	*	.			trans	-112.6	-15.7	176.1	-57.4	-54.4	-57.8	0	0	113.3	E99 Y132	E99-Q134 WeakPolarHBondContact OE1-CA 3.31Å; E99-Q134 WeakPolarHBondContact OE1-CB 3.32Å; E99-Q134 PolarHBondContact OE1-N 2.99Å; E99-Q134 PolarHBondContact OE2-N 3.34Å; Y132-Q134 PolarHBondContact O-N 3.22Å; Y132-Q134 PolarHBondContact O-NE2 3.16Å
135	I	92.7	Very high	94.3	Very high	42 Å²	42	32.3 Å²	32.3	22%	0.215	16%	0.159	C	C	.	.	S	Bend	trans	-98	147.4	-178.4	61.6	-166	0	0	0	112.6	C97 E99 L133 C195	C97-I135 HydrophobicContact CB-CD1 3.98Å; E99-I135 HydrophobicContact CB-CD1 4Å; E99-I135 HydrophobicContact CG-CD1 3.92Å; E99-I135 PolarHBondContact OE1-N 3.12Å; L133-I135 HydrophobicContact CD1-CG1 3.86Å; L133-I135 HydrophobicContact CG-CG1 4.41Å; I135-C195 HydrophobicContact CD1-CB 4.39Å; I135-C195 WeakPolarHBondContact CD1-SG 3.44Å
136	P	93.8	Very high	93.7	Very high	78 Å²	78	35.3 Å²	35.3	51%	0.506	18%	0.179	S	C	.	.			trans	-69.2	149.9	172	30.8	-34.9	0	0	0	110.7	Y138	P136-Y138 HydrophobicContact CB-CE2 4.31Å; P136-Y138 HydrophobicContact CG-CE2 4.34Å
137	L	96	Very high	93	Very high	2 Å²	2	40 Å²	40	1%	0.01	20%	0.201	C	C	.	.			trans	-121.4	151.1	175.5	-65.6	179.3	0	0	0	109.9	I94 L133 A154 T156 F176 I193 E194 C195	I94-L137 HydrophobicContact CD1-CD2 4.29Å; L133-L137 HydrophobicContact CD1-CD1 4.39Å; L133-L137 HydrophobicContact CD2-CD1 3.63Å; L133-L137 HydrophobicContact CD2-CG 3.95Å; L137-A154 HydrophobicContact CB-CB 3.9Å; L137-A154 WeakPolarHBondContact O-CB 3.48Å; L137-A154 PolarHBondContact O-N 2.92Å; L137-T156 HydrophobicContact CD1-CG2 4.13Å; L137-F176 HydrophobicContact CD1-CD1 4.43Å; L137-F176 HydrophobicContact CD1-CD2 4.15Å; L137-F176 HydrophobicContact CD1-CE1 3.95Å; L137-F176 HydrophobicContact CD1-CE2 3.63Å; L137-F176 HydrophobicContact CD1-CZ 3.52Å; L137-I193 HydrophobicContact CB-CG2 3.9Å; L137-I193 HydrophobicContact CD1-CG2 4.11Å; L137-I193 HydrophobicContact CD2-CG2 4.31Å; L137-I193 HydrophobicContact CG-CG2 4.34Å; L137-E194 WeakPolarHBondContact CA-O 3.35Å; L137-C195 WeakPolarHBondContact CD2-SG 3.07Å
138	Y	95.5	Very high	92.6	Very high	41 Å²	41	43.4 Å²	43.4	16%	0.161	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.9	-179.6	-59	-81.8	0	0	0	110.2	P136 V152 A153 I193 E194 Q197	P136-Y138 HydrophobicContact CB-CE2 4.31Å; P136-Y138 HydrophobicContact CG-CE2 4.34Å; Y138-V152 CarbonylContact C-O 3.39Å; Y138-V152 WeakPolarHBondContact CA-O 3.44Å; Y138-A153 HydrophobicContact CD1-CB 4.3Å; Y138-A153 HydrophobicContact CE1-CB 4.29Å; Y138-I193 VanDerWaalsContact O-CA 3.32Å; Y138-I193 WeakPolarHBondContact O-CA 3.47Å; Y138-E194 PolarHBondContact N-O 3.15Å; Y138-E194 PolarHBondContact O-N 3.23Å; Y138-Q197 HydrophobicContact CD1-CG 3.38Å; Y138-Q197 HydrophobicContact CD2-CG 3.83Å; Y138-Q197 VanDerWaalsContact CE1-CD 3.47Å; Y138-Q197 HydrophobicContact CE1-CG 3.27Å; Y138-Q197 HydrophobicContact CE2-CG 3.72Å; Y138-Q197 HydrophobicContact CG-CG 3.65Å; Y138-Q197 VanDerWaalsContact CZ-CG 3.43Å; Y138-Q197 PolarHBondContact OH-NE2 2.86Å
139	C	96	Very high	92.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	132.1	174.8	-55.8	0	0	0	0	110.5	L141 V151 V152 A154 C178 V191 S192	C139-L141 HydrophobicContact CB-CG 4.5Å; C139-V151 VanDerWaalsContact O-CA 3.28Å; C139-V151 WeakPolarHBondContact O-CA 3.12Å; C139-V152 HydrophobicContact CB-CG1 4.02Å; C139-V152 PolarHBondContact N-O 3.18Å; C139-V152 PolarHBondContact O-N 3.09Å; C139-A154 WeakPolarHBondContact SG-CB 3.4Å; C139-C178 HydrophobicContact CB-CB 3.45Å; C139-C178 VanDerWaalsContact CB-CB 3.45Å; C139-C178 WeakPolarHBondContact CB-SG 3.35Å; C139-C178 WeakPolarHBondContact SG-CB 3.44Å; C139-C178 CovalentContact SG-SG 2.01Å; C139-C178 PolarHBondContact SG-SG 2.98Å; C139-V191 HydrophobicContact CB-CG2 4.27Å; C139-S192 CarbonylContact C-O 3.52Å; C139-S192 WeakPolarHBondContact CA-O 3.39Å
140	Y	94.7	Very high	92.1	Very high	1 Å²	1	44.1 Å²	44.1	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	105.4	171.6	-67.3	-115.9	0	0	0	106.4	W142 P149 L150 V151 V191 S192 E194 S196 Q197 C198 V199 V202	Y140-W142 PolarHBondContact O-NE1 2.93Å; Y140-P149 HydrophobicContact CD1-CB 4.4Å; Y140-P149 HydrophobicContact CD1-CG 3.76Å; Y140-P149 HydrophobicContact CG-CG 4.49Å; Y140-L150 CarbonylContact C-O 3.46Å; Y140-L150 WeakPolarHBondContact CA-O 3.18Å; Y140-V151 HydrophobicContact CD1-CG2 3.54Å; Y140-V151 HydrophobicContact CD2-CG2 4.49Å; Y140-V151 HydrophobicContact CE1-CG2 3.58Å; Y140-V151 HydrophobicContact CE2-CG1 4.22Å; Y140-V151 HydrophobicContact CE2-CG2 4.49Å; Y140-V151 HydrophobicContact CG-CG2 4.02Å; Y140-V191 CarbonylContact O-C 3.49Å; Y140-V191 VanDerWaalsContact O-CA 3.31Å; Y140-V191 WeakPolarHBondContact O-CA 3.26Å; Y140-S192 PolarHBondContact N-O 2.83Å; Y140-S192 PolarHBondContact O-N 3.45Å; Y140-E194 HydrophobicContact CD2-CB 4.42Å; Y140-E194 HydrophobicContact CD2-CG 4.17Å; Y140-E194 HydrophobicContact CE2-CB 3.74Å; Y140-E194 HydrophobicContact CE2-CG 3.81Å; Y140-S196 PolarHBondContact OH-O 2.87Å; Y140-Q197 VanDerWaalsContact OH-C 3.23Å; Y140-C198 PolarHBondContact OH-N 3.39Å; Y140-V199 HydrophobicContact CE1-CG2 4.26Å; Y140-V199 PolarHBondContact OH-N 2.63Å; Y140-V202 HydrophobicContact CD1-CG1 4.08Å; Y140-V202 HydrophobicContact CE1-CG1 4.38Å; Y140-V202 HydrophobicContact CG-CG1 4.2Å
141	L	95	Very high	92	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.5	-176	-63.4	175	0	0	0	109.7	V123 C139 P149 L150 V152 C178 L180 F188 V191	V123-L141 HydrophobicContact CB-CD2 4.2Å; V123-L141 HydrophobicContact CG2-CD2 3.81Å; C139-L141 HydrophobicContact CB-CG 4.5Å; L141-P149 VanDerWaalsContact O-CA 3.28Å; L141-P149 WeakPolarHBondContact O-CA 3.29Å; L141-P149 WeakPolarHBondContact O-CB 3.18Å; L141-L150 PolarHBondContact N-O 3.07Å; L141-L150 PolarHBondContact O-N 2.88Å; L141-V152 HydrophobicContact CD1-CG1 4.18Å; L141-C178 HydrophobicContact CD1-CB 4.43Å; L141-C178 HydrophobicContact CD2-CB 4.23Å; L141-L180 HydrophobicContact CD1-CD1 3.72Å; L141-L180 HydrophobicContact CD1-CD2 4.33Å; L141-L180 HydrophobicContact CD1-CG 3.92Å; L141-F188 VanDerWaalsContact C-CD1 3.47Å; L141-F188 HydrophobicContact CB-CB 4.43Å; L141-F188 HydrophobicContact CB-CD1 3.47Å; L141-F188 VanDerWaalsContact CB-CD1 3.47Å; L141-F188 HydrophobicContact CB-CE1 3.76Å; L141-F188 HydrophobicContact CB-CG 3.91Å; L141-F188 HydrophobicContact CB-CZ 4.47Å; L141-V191 HydrophobicContact CD2-CB 4.12Å; L141-V191 HydrophobicContact CD2-CG2 3.85Å
142	W	93.7	Very high	92	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.8	-174.3	-49.6	84.4	0	0	0	111	A77 Y140 L145 P149 Y189 Y190 S192 V202	A77-W142 HydrophobicContact CB-CH2 3.96Å; Y140-W142 PolarHBondContact O-NE1 2.93Å; W142-L145 HydrophobicContact CB-CD2 4.24Å; W142-L145 HydrophobicContact CD2-CD2 4.31Å; W142-L145 HydrophobicContact CE3-CD2 4.49Å; W142-L145 HydrophobicContact CG-CD2 4.22Å; W142-P149 HydrophobicContact CD2-CB 3.68Å; W142-P149 HydrophobicContact CD2-CG 4.23Å; W142-P149 HydrophobicContact CE3-CB 3.79Å; W142-P149 HydrophobicContact CE3-CG 4.04Å; W142-P149 HydrophobicContact CG-CB 4.24Å; W142-P149 HydrophobicContact CH2-CB 4.18Å; W142-P149 HydrophobicContact CH2-CG 3.62Å; W142-P149 HydrophobicContact CZ2-CB 4.05Å; W142-P149 HydrophobicContact CZ2-CG 3.78Å; W142-P149 HydrophobicContact CZ3-CB 4.05Å; W142-P149 VanDerWaalsContact CZ3-CD 3.47Å; W142-P149 HydrophobicContact CZ3-CG 3.76Å; W142-Y189 PolarHBondContact O-N 3.01Å; W142-Y190 PolarHBondContact N-O 2.82Å; W142-Y190 PolarHBondContact O-N 2.79Å; W142-S192 PolarHBondContact NE1-OG 2.73Å; W142-S192 VanDerWaalsContact NE1-OG 3.09Å; W142-V202 HydrophobicContact CZ2-CG1 4.09Å; W142-V202 HydrophobicContact CZ2-CG2 4Å
143	K	92	Very high	92.1	Very high	56 Å²	56	37.8 Å²	37.8	24%	0.243	20%	0.202	C	C	.	.	S	Bend	trans	-73.4	-46.1	166.3	-63.9	-179.7	-177.1	177.5	0	110.1	E186 F188 Y189	K143-E186 VanDerWaalsContact CD-OE2 3.29Å; K143-E186 WeakPolarHBondContact CD-OE2 3.44Å; K143-E186 WeakPolarHBondContact CE-OE2 3.35Å; K143-E186 IonicContact NZ-OE1 2.81Å; K143-E186 PolarHBondContact NZ-OE1 3.01Å; K143-E186 IonicContact NZ-OE2 2.64Å; K143-E186 PolarHBondContact NZ-OE2 3.15Å; K143-F188 HydrophobicContact CD-CE1 4.39Å; K143-F188 HydrophobicContact CG-CD1 3.7Å; K143-F188 HydrophobicContact CG-CE1 3.6Å; K143-F188 HydrophobicContact CG-CG 4.43Å; K143-F188 HydrophobicContact CG-CZ 4.21Å; K143-Y189 WeakPolarHBondContact O-CD2 3.47Å
144	D	88.5	Confident	92.2	Very high	72 Å²	72	37.4 Å²	37.4	39%	0.385	20%	0.202	S	C	.	.			trans	-140.4	141.5	172.7	-178.1	-9	0	0	0	106.9	S146 Q147	D144-S146 PolarHBondContact O-N 3.44Å; D144-S146 PolarHBondContact OD1-N 3.17Å; D144-S146 PolarHBondContact OD1-OG 2.84Å; D144-S146 WeakPolarHBondContact OD2-CB 3.39Å; D144-S146 PolarHBondContact OD2-OG 3.22Å; D144-Q147 HydrophobicContact CB-CG 4.15Å; D144-Q147 PolarHBondContact O-N 3.06Å
145	L	87.1	Confident	92.3	Very high	37 Å²	37	32.9 Å²	32.9	19%	0.194	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-16.7	173.3	-57.2	179.4	0	0	0	111.7	R76 F86 W142 Q147 Y190 L205	R76-L145 PolarHBondContact NH2-O 3.19Å; F86-L145 HydrophobicContact CZ-CD1 4.38Å; W142-L145 HydrophobicContact CB-CD2 4.24Å; W142-L145 HydrophobicContact CD2-CD2 4.31Å; W142-L145 HydrophobicContact CE3-CD2 4.49Å; W142-L145 HydrophobicContact CG-CD2 4.22Å; L145-Q147 VanDerWaalsContact C-N 3.32Å; L145-Y190 HydrophobicContact CD1-CD2 4.48Å; L145-Y190 HydrophobicContact CD1-CE2 4.32Å; L145-Y190 HydrophobicContact CD2-CD2 3.79Å; L145-Y190 HydrophobicContact CD2-CE2 4.39Å; L145-Y190 HydrophobicContact CD2-CG 3.97Å; L145-Y190 HydrophobicContact CG-CD2 3.94Å; L145-Y190 HydrophobicContact CG-CE2 4.06Å; L145-Y190 HydrophobicContact CG-CG 4.49Å; L145-L205 HydrophobicContact CD1-CD2 3.94Å; L145-L205 HydrophobicContact CD2-CD1 3.9Å; L145-L205 HydrophobicContact CD2-CD2 3.7Å; L145-L205 HydrophobicContact CD2-CG 4.41Å
146	S	84.5	Confident	92.4	Very high	62 Å²	62	33.5 Å²	33.5	43%	0.434	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-21	171.4	81.4	0	0	0	0	114	R76 D144	R76-S146 PolarHBondContact NE-O 3Å; R76-S146 PolarHBondContact NH1-O 2.71Å; R76-S146 PolarHBondContact NH2-O 2.84Å; D144-S146 PolarHBondContact O-N 3.44Å; D144-S146 PolarHBondContact OD1-N 3.17Å; D144-S146 PolarHBondContact OD1-OG 2.84Å; D144-S146 WeakPolarHBondContact OD2-CB 3.39Å; D144-S146 PolarHBondContact OD2-OG 3.22Å
147	Q	84.5	Confident	92.5	Very high	99 Å²	99	33 Å²	33	46%	0.463	18%	0.176	S	C	.	.	S	Bend	trans	-105.1	165.8	-173.1	-63	179.9	23.7	0	0	112.4	D144 L145	D144-Q147 HydrophobicContact CB-CG 4.15Å; D144-Q147 PolarHBondContact O-N 3.06Å; L145-Q147 VanDerWaalsContact C-N 3.32Å
148	T	88.2	Confident	92.5	Very high	71 Å²	71	34 Å²	34	44%	0.436	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-71.2	133.9	170.9	-54.3	0	0	0	0	109.6
149	P	91.9	Very high	92.5	Very high	2 Å²	2	32 Å²	32	1%	0.013	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-74	156.7	178.5	30.4	-32.9	0	0	0	111.5	Y140 L141 W142	Y140-P149 HydrophobicContact CD1-CB 4.4Å; Y140-P149 HydrophobicContact CD1-CG 3.76Å; Y140-P149 HydrophobicContact CG-CG 4.49Å; L141-P149 VanDerWaalsContact O-CA 3.28Å; L141-P149 WeakPolarHBondContact O-CA 3.29Å; L141-P149 WeakPolarHBondContact O-CB 3.18Å; W142-P149 HydrophobicContact CD2-CB 3.68Å; W142-P149 HydrophobicContact CD2-CG 4.23Å; W142-P149 HydrophobicContact CE3-CB 3.79Å; W142-P149 HydrophobicContact CE3-CG 4.04Å; W142-P149 HydrophobicContact CG-CB 4.24Å; W142-P149 HydrophobicContact CH2-CB 4.18Å; W142-P149 HydrophobicContact CH2-CG 3.62Å; W142-P149 HydrophobicContact CZ2-CB 4.05Å; W142-P149 HydrophobicContact CZ2-CG 3.78Å; W142-P149 HydrophobicContact CZ3-CB 4.05Å; W142-P149 VanDerWaalsContact CZ3-CD 3.47Å; W142-P149 HydrophobicContact CZ3-CG 3.76Å
150	L	92.5	Very high	92.4	Very high	14 Å²	14	32.7 Å²	32.7	7%	0.073	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	132.6	162.7	-64.6	-174.5	0	0	0	109.4	P70 Y72 Y140 L141 L180 Y184 F188	P70-L150 HydrophobicContact CB-CB 4.35Å; Y72-L150 HydrophobicContact CD1-CD2 4.07Å; Y72-L150 HydrophobicContact CE1-CD2 3.45Å; Y72-L150 VanDerWaalsContact CE1-CD2 3.45Å; Y140-L150 CarbonylContact C-O 3.46Å; Y140-L150 WeakPolarHBondContact CA-O 3.18Å; L141-L150 PolarHBondContact N-O 3.07Å; L141-L150 PolarHBondContact O-N 2.88Å; L150-L180 HydrophobicContact CD1-CD1 4.1Å; L150-Y184 HydrophobicContact CD1-CD1 3.73Å; L150-Y184 HydrophobicContact CD1-CE1 3.45Å; L150-Y184 VanDerWaalsContact CD1-CE1 3.45Å; L150-F188 HydrophobicContact CB-CE1 4.45Å; L150-F188 HydrophobicContact CD1-CE1 3.98Å; L150-F188 HydrophobicContact CD1-CZ 3.59Å; L150-F188 HydrophobicContact CG-CE1 4.19Å; L150-F188 HydrophobicContact CG-CZ 4.3Å
151	V	93.8	Very high	92.2	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.1	-179.7	-176.2	0	0	0	0	110.2	P70 L71 C73 C139 Y140	P70-V151 CarbonylContact C-O 3.6Å; P70-V151 VanDerWaalsContact CA-O 3.25Å; P70-V151 WeakPolarHBondContact CA-O 3.35Å; L71-V151 HydrophobicContact CB-CB 4.48Å; L71-V151 PolarHBondContact N-O 2.77Å; L71-V151 PolarHBondContact O-N 3.1Å; C73-V151 VanDerWaalsContact SG-CG2 3.53Å; C139-V151 VanDerWaalsContact O-CA 3.28Å; C139-V151 WeakPolarHBondContact O-CA 3.12Å; Y140-V151 HydrophobicContact CD1-CG2 3.54Å; Y140-V151 HydrophobicContact CD2-CG2 4.49Å; Y140-V151 HydrophobicContact CE1-CG2 3.58Å; Y140-V151 HydrophobicContact CE2-CG1 4.22Å; Y140-V151 HydrophobicContact CE2-CG2 4.49Å; Y140-V151 HydrophobicContact CG-CG2 4.02Å
152	V	93.9	Very high	91.9	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	150.3	178.2	64.9	0	0	0	0	110.2	E68 Y138 C139 L141 C178 L180	E68-V152 HydrophobicContact CB-CG2 4.2Å; Y138-V152 CarbonylContact C-O 3.39Å; Y138-V152 WeakPolarHBondContact CA-O 3.44Å; C139-V152 HydrophobicContact CB-CG1 4.02Å; C139-V152 PolarHBondContact N-O 3.18Å; C139-V152 PolarHBondContact O-N 3.09Å; L141-V152 HydrophobicContact CD1-CG1 4.18Å; V152-C178 HydrophobicContact CG1-CB 4.16Å; V152-L180 HydrophobicContact CB-CD2 4.32Å; V152-L180 HydrophobicContact CG1-CD2 4.39Å
153	A	93.7	Very high	91.6	Very high	25 Å²	25	43.1 Å²	43.1	21%	0.207	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	140.7	173.9	0	0	0	0	0	111.2	E68 Y138	E68-A153 WeakPolarHBondContact OE2-CB 3.28Å; Y138-A153 HydrophobicContact CD1-CB 4.3Å; Y138-A153 HydrophobicContact CE1-CB 4.29Å
154	A	95.6	Very high	91.5	Very high	12 Å²	12	42.9 Å²	42.9	10%	0.099	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.4	174.9	0	0	0	0	0	109.5	L137 C139	L137-A154 HydrophobicContact CB-CB 3.9Å; L137-A154 WeakPolarHBondContact O-CB 3.48Å; L137-A154 PolarHBondContact O-N 2.92Å; C139-A154 WeakPolarHBondContact SG-CB 3.4Å
155	K	94.5	Very high	91.5	Very high	61 Å²	61	39.8 Å²	39.8	27%	0.265	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.8	165.6	-176.8	176.9	-175.6	178.8	0	109	C64 F176 T177	C64-K155 PolarHBondContact O-NZ 2.81Å; K155-F176 CarbonylContact O-C 3.4Å; K155-F176 VanDerWaalsContact O-CA 3.3Å; K155-F176 WeakPolarHBondContact O-CA 3.4Å; K155-T177 PolarHBondContact N-O 3.24Å; K155-T177 PolarHBondContact O-N 2.86Å
156	T	95	Very high	91.6	Very high	55 Å²	55	41.8 Å²	41.8	34%	0.337	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133.4	-176.8	67.1	0	0	0	0	111.1	L133 L137 F176	L133-T156 HydrophobicContact CD2-CG2 3.67Å; L137-T156 HydrophobicContact CD1-CG2 4.13Å; T156-F176 HydrophobicContact CG2-CD1 3.53Å; T156-F176 HydrophobicContact CG2-CE1 3.74Å; T156-F176 HydrophobicContact CG2-CG 4.37Å
157	K	95	Very high	92	Very high	69 Å²	69	45 Å²	45	30%	0.3	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	118.1	178	-178.9	73.2	176.9	-162.9	0	110	I159 Y174 L175 I420 E428	K157-I159 PolarHBondContact O-N 3.03Å; K157-Y174 VanDerWaalsContact C-CD1 3.44Å; K157-Y174 CarbonylContact O-C 3.52Å; K157-Y174 WeakPolarHBondContact O-CA 3.26Å; K157-L175 PolarHBondContact N-O 3.35Å; K157-L175 PolarHBondContact O-N 3.4Å; K157-I420 HydrophobicContact CB-CD1 4.46Å; K157-I420 HydrophobicContact CG-CD1 3.72Å; K157-E428 WeakPolarHBondContact CE-OE1 3.1Å; K157-E428 IonicContact NZ-OE1 3.95Å; K157-E428 PolarHBondContact NZ-OE1 2.84Å
158	A	96.3	Very high	92.3	Very high	21 Å²	21	45.2 Å²	45.2	17%	0.174	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	129	170.5	0	0	0	0	0	110	Y132 W160 V172 Y174	Y132-A158 HydrophobicContact CD1-CB 4.49Å; Y132-A158 HydrophobicContact CE1-CB 4.34Å; A158-W160 PolarHBondContact O-N 2.87Å; A158-W160 VanDerWaalsContact O-N 3.1Å; A158-V172 HydrophobicContact CB-CG1 4.17Å; A158-Y174 HydrophobicContact CB-CD1 4.29Å; A158-Y174 HydrophobicContact CB-CE1 3.79Å; A158-Y174 HydrophobicContact CB-CE2 4.15Å
159	I	96.6	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-85.3	42.9	170.3	-50.7	164.3	0	0	0	108.3	L126 K157 P173 L175 L312 N316 I420 L427	L126-I159 HydrophobicContact CD2-CD1 3.91Å; K157-I159 PolarHBondContact O-N 3.03Å; I159-P173 HydrophobicContact CB-CB 4.13Å; I159-P173 HydrophobicContact CB-CG 3.98Å; I159-P173 HydrophobicContact CD1-CB 4.39Å; I159-P173 PolarHBondContact N-O 2.77Å; I159-L175 HydrophobicContact CD1-CB 4.18Å; I159-L175 HydrophobicContact CG1-CB 4.3Å; I159-L312 HydrophobicContact CG2-CB 4.05Å; I159-L312 HydrophobicContact CG2-CD1 4.19Å; I159-L312 WeakPolarHBondContact O-CD1 3.29Å; I159-N316 HydrophobicContact CD1-CB 4.47Å; I159-I420 HydrophobicContact CB-CG2 4.17Å; I159-I420 HydrophobicContact CG1-CD1 4.15Å; I159-I420 HydrophobicContact CG1-CG2 3.94Å; I159-I420 HydrophobicContact CG2-CG2 3.39Å; I159-L427 HydrophobicContact CG2-CD2 4.22Å
160	W	94.4	Very high	92.7	Very high	14 Å²	14	44.9 Å²	44.9	5%	0.053	26%	0.256	C	S	.	.	S	Bend	trans	-156.8	138.5	179.8	-168.9	-99.3	0	0	0	108.8	A158 W164 D165 V172 R308 R309 L312	A158-W160 PolarHBondContact O-N 2.87Å; A158-W160 VanDerWaalsContact O-N 3.1Å; W160-W164 AromaticContact CD2-CE3 3.8Å; W160-W164 HydrophobicContact CD2-CE3 3.8Å; W160-W164 HydrophobicContact CD2-CZ3 4.38Å; W160-W164 AromaticContact CE3-CE3 3.76Å; W160-W164 HydrophobicContact CE3-CE3 3.76Å; W160-W164 HydrophobicContact CE3-CZ3 4.07Å; W160-W164 HydrophobicContact CG-CE3 4.28Å; W160-W164 HydrophobicContact CH2-CE3 4.45Å; W160-W164 HydrophobicContact CZ2-CB 3.93Å; W160-W164 HydrophobicContact CZ2-CE3 4.46Å; W160-W164 HydrophobicContact CZ3-CE3 4.11Å; W160-D165 HydrophobicContact CZ2-CB 3.83Å; W160-D165 PolarHBondContact NE1-O 2.71Å; W160-V172 HydrophobicContact CB-CG1 3.83Å; W160-R308 HydrophobicContact CH2-CB 4.01Å; W160-R308 HydrophobicContact CZ3-CB 4.13Å; W160-R309 HydrophobicContact CD2-CG 3.82Å; W160-R309 HydrophobicContact CE3-CG 3.58Å; W160-R309 HydrophobicContact CH2-CG 4.01Å; W160-R309 HydrophobicContact CZ2-CG 4.24Å; W160-R309 HydrophobicContact CZ3-CG 3.68Å; W160-L312 HydrophobicContact CE3-CD1 3.63Å; W160-L312 HydrophobicContact CZ3-CD1 4Å
161	R	90.4	Very high	92.9	Very high	66 Å²	66	44.7 Å²	44.7	25%	0.249	25%	0.254	C	S	.	.			trans	-97.9	129.5	173.6	-58.4	-174.7	179.2	-175.5	-0.7	109.1	S163 W164	R161-S163 PolarHBondContact O-N 2.91Å; R161-S163 VanDerWaalsContact O-N 3.09Å; R161-W164 HydrophobicContact CB-CD2 3.73Å; R161-W164 HydrophobicContact CB-CE3 4.05Å; R161-W164 HydrophobicContact CB-CG 4.11Å; R161-W164 HydrophobicContact CB-CH2 4.49Å; R161-W164 HydrophobicContact CB-CZ2 4.2Å; R161-W164 HydrophobicContact CB-CZ3 4.42Å; R161-W164 HydrophobicContact CG-CD2 4.2Å; R161-W164 HydrophobicContact CG-CE3 4.36Å; R161-W164 HydrophobicContact CG-CH2 3.94Å; R161-W164 HydrophobicContact CG-CZ2 3.74Å; R161-W164 HydrophobicContact CG-CZ3 4.24Å; R161-W164 VanDerWaalsContact N-CE3 3.35Å; R161-W164 WeakPolarHBondContact O-CB 3.44Å; R161-W164 PolarHBondContact O-N 3.27Å
162	S	87.6	Confident	93	Very high	64 Å²	64	44.7 Å²	44.7	45%	0.448	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.6	176.9	-44.7	0	0	0	0	112.3	Y132 W164 D165 P166	Y132-S162 PolarHBondContact OH-OG 3.13Å; S162-W164 PolarHBondContact O-N 3.18Å; S162-D165 CarbonylContact O-C 3.6Å; S162-D165 VanDerWaalsContact O-C 3.29Å; S162-D165 PolarHBondContact O-N 3.18Å; S162-P166 WeakPolarHBondContact O-CA 3.36Å; S162-P166 WeakPolarHBondContact O-CB 3.27Å; S162-P166 WeakPolarHBondContact O-CD 3.39Å; S162-P166 VanDerWaalsContact O-N 3.11Å
163	S	88.2	Confident	93.2	Very high	98 Å²	98	44.5 Å²	44.5	69%	0.685	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.9	173.7	61.9	0	0	0	0	114.5	R161	R161-S163 PolarHBondContact O-N 2.91Å; R161-S163 VanDerWaalsContact O-N 3.09Å
164	W	88.6	Confident	93.4	Very high	51 Å²	51	43.8 Å²	43.8	19%	0.193	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-39.5	176.2	-59.6	-25.9	0	0	0	111.7	W160 R161 S162 F422 L427	W160-W164 AromaticContact CD2-CE3 3.8Å; W160-W164 HydrophobicContact CD2-CE3 3.8Å; W160-W164 HydrophobicContact CD2-CZ3 4.38Å; W160-W164 AromaticContact CE3-CE3 3.76Å; W160-W164 HydrophobicContact CE3-CE3 3.76Å; W160-W164 HydrophobicContact CE3-CZ3 4.07Å; W160-W164 HydrophobicContact CG-CE3 4.28Å; W160-W164 HydrophobicContact CH2-CE3 4.45Å; W160-W164 HydrophobicContact CZ2-CB 3.93Å; W160-W164 HydrophobicContact CZ2-CE3 4.46Å; W160-W164 HydrophobicContact CZ3-CE3 4.11Å; R161-W164 HydrophobicContact CB-CD2 3.73Å; R161-W164 HydrophobicContact CB-CE3 4.05Å; R161-W164 HydrophobicContact CB-CG 4.11Å; R161-W164 HydrophobicContact CB-CH2 4.49Å; R161-W164 HydrophobicContact CB-CZ2 4.2Å; R161-W164 HydrophobicContact CB-CZ3 4.42Å; R161-W164 HydrophobicContact CG-CD2 4.2Å; R161-W164 HydrophobicContact CG-CE3 4.36Å; R161-W164 HydrophobicContact CG-CH2 3.94Å; R161-W164 HydrophobicContact CG-CZ2 3.74Å; R161-W164 HydrophobicContact CG-CZ3 4.24Å; R161-W164 VanDerWaalsContact N-CE3 3.35Å; R161-W164 WeakPolarHBondContact O-CB 3.44Å; R161-W164 PolarHBondContact O-N 3.27Å; S162-W164 PolarHBondContact O-N 3.18Å; W164-F422 HydrophobicContact CE3-CE2 4.19Å; W164-F422 AromaticContact CH2-CD2 3.62Å; W164-F422 HydrophobicContact CH2-CD2 3.62Å; W164-F422 AromaticContact CH2-CE2 3.65Å; W164-F422 HydrophobicContact CH2-CE2 3.65Å; W164-F422 HydrophobicContact CH2-CG 4.14Å; W164-F422 HydrophobicContact CH2-CZ 4.18Å; W164-F422 HydrophobicContact CZ2-CE2 4.41Å; W164-F422 AromaticContact CZ3-CD2 3.81Å; W164-F422 HydrophobicContact CZ3-CD2 3.81Å; W164-F422 AromaticContact CZ3-CE2 3.53Å; W164-F422 HydrophobicContact CZ3-CE2 3.53Å; W164-F422 HydrophobicContact CZ3-CZ 4.26Å; W164-L427 HydrophobicContact CH2-CD1 3.56Å; W164-L427 HydrophobicContact CH2-CD2 4Å; W164-L427 HydrophobicContact CH2-CG 4.46Å; W164-L427 HydrophobicContact CZ2-CD1 3.89Å
165	D	90.1	Very high	93.6	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.043	24%	0.24	C	C	.	.			trans	-167	107.3	174.3	-177	17.4	0	0	0	109.5	W160 S162 R167 R309	W160-D165 HydrophobicContact CZ2-CB 3.83Å; W160-D165 PolarHBondContact NE1-O 2.71Å; S162-D165 CarbonylContact O-C 3.6Å; S162-D165 VanDerWaalsContact O-C 3.29Å; S162-D165 PolarHBondContact O-N 3.18Å; D165-R167 VanDerWaalsContact CG-NH2 3.29Å; D165-R167 IonicContact OD1-CZ 3.33Å; D165-R167 PolarHBondContact OD1-N 3.11Å; D165-R167 IonicContact OD1-NE 3.73Å; D165-R167 PolarHBondContact OD1-NE 2.87Å; D165-R167 IonicContact OD1-NH2 3.72Å; D165-R167 PolarHBondContact OD1-NH2 3.49Å; D165-R167 VanDerWaalsContact OD1-NH2 3.13Å; D165-R167 IonicContact OD2-CZ 2.65Å; D165-R167 IonicContact OD2-NE 3.11Å; D165-R167 IonicContact OD2-NH2 3.36Å; D165-R167 PolarHBondContact OD2-NH2 3.13Å; D165-R309 VanDerWaalsContact CG-NH2 3.26Å; D165-R309 PolarHBondContact O-NH2 2.99Å; D165-R309 IonicContact OD2-CZ 3.95Å; D165-R309 IonicContact OD2-NH1 3.27Å; D165-R309 PolarHBondContact OD2-NH1 2.93Å; D165-R309 VanDerWaalsContact OD2-NH1 3.17Å; D165-R309 IonicContact OD2-NH2 3.87Å; D165-R309 PolarHBondContact OD2-NH2 3.12Å
166	P	89.3	Confident	93.7	Very high	79 Å²	79	40.4 Å²	40.4	51%	0.513	23%	0.228	S	C	.	.			trans	-89.3	-2.3	-174.9	34.9	-35.8	0	0	0	113.4	S162	S162-P166 WeakPolarHBondContact O-CA 3.36Å; S162-P166 WeakPolarHBondContact O-CB 3.27Å; S162-P166 WeakPolarHBondContact O-CD 3.39Å; S162-P166 VanDerWaalsContact O-N 3.11Å
167	R	91.3	Very high	93.8	Very high	130 Å²	130	38 Å²	38	49%	0.491	21%	0.213	S	C	.	.			trans	-63.9	140.6	-173.2	-72.6	173.6	-65.8	172.3	5.7	111.6	D165 F170	D165-R167 VanDerWaalsContact CG-NH2 3.29Å; D165-R167 IonicContact OD1-CZ 3.33Å; D165-R167 PolarHBondContact OD1-N 3.11Å; D165-R167 IonicContact OD1-NE 3.73Å; D165-R167 PolarHBondContact OD1-NE 2.87Å; D165-R167 IonicContact OD1-NH2 3.72Å; D165-R167 PolarHBondContact OD1-NH2 3.49Å; D165-R167 VanDerWaalsContact OD1-NH2 3.13Å; D165-R167 IonicContact OD2-CZ 2.65Å; D165-R167 IonicContact OD2-NE 3.11Å; D165-R167 IonicContact OD2-NH2 3.36Å; D165-R167 PolarHBondContact OD2-NH2 3.13Å; R167-F170 HydrophobicContact CB-CD2 4.29Å; R167-F170 HydrophobicContact CB-CE2 3.89Å; R167-F170 WeakPolarHBondContact O-CD2 3.2Å
168	P	91.6	Very high	93.8	Very high	102 Å²	102	34.7 Å²	34.7	66%	0.662	20%	0.199	S	C	*	.	S	Bend	trans	-76.4	177.6	171	35.3	-36.6	0	0	0	111	D131 F170	D131-P168 VanDerWaalsContact OD1-CA 3.23Å; D131-P168 WeakPolarHBondContact OD1-CA 3.36Å; P168-F170 WeakPolarHBondContact O-CD2 3.26Å
169	G	92.3	Very high	93.7	Very high	41 Å²	41	34 Å²	34	42%	0.423	19%	0.193	S	C	.	.	S	Bend	trans	83	7.7	-177.8	0	0	0	0	0	114.2	K130 D131	K130-G169 PolarHBondContact NZ-O 3.28Å; D131-G169 PolarHBondContact OD1-N 2.83Å
170	F	95.3	Very high	93.6	Very high	25 Å²	25	34 Å²	34	11%	0.11	19%	0.193	C	C	.	.	S	Bend	trans	-107.1	148.9	-179.2	-70.8	-89.7	0	0	0	111.5	D131 R167 P168 Q305 Q306	D131-F170 PolarHBondContact N-O 2.86Å; D131-F170 PolarHBondContact OD1-N 3.04Å; R167-F170 HydrophobicContact CB-CD2 4.29Å; R167-F170 HydrophobicContact CB-CE2 3.89Å; R167-F170 WeakPolarHBondContact O-CD2 3.2Å; P168-F170 WeakPolarHBondContact O-CD2 3.26Å; F170-Q305 HydrophobicContact CE1-CB 3.78Å; F170-Q305 HydrophobicContact CZ-CB 4.17Å; F170-Q306 HydrophobicContact CD1-CB 4.07Å; F170-Q306 HydrophobicContact CE1-CB 4.32Å
171	Y	96.9	Very high	93.5	Very high	11 Å²	11	34.6 Å²	34.6	4%	0.043	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	122.8	165.5	-77.1	-76.7	0	0	0	109.1	E100 Y102 M128 V129 K130 N288 Q289 Q306 R309	E100-Y171 PolarHBondContact OE2-OH 3.42Å; Y102-Y171 HydrophobicContact CD2-CE1 4.06Å; Y102-Y171 AromaticContact CE2-CE1 3.8Å; Y102-Y171 HydrophobicContact CE2-CE1 3.8Å; M128-Y171 HydrophobicContact CG-CD1 4.08Å; M128-Y171 HydrophobicContact CG-CG 4.19Å; V129-Y171 CarbonylContact O-C 3.56Å; V129-Y171 VanDerWaalsContact O-CA 3.31Å; V129-Y171 WeakPolarHBondContact O-CA 3.37Å; K130-Y171 HydrophobicContact CB-CD1 4.04Å; K130-Y171 HydrophobicContact CB-CE1 3.79Å; K130-Y171 HydrophobicContact CD-CD1 4.2Å; K130-Y171 HydrophobicContact CD-CD2 4.31Å; K130-Y171 HydrophobicContact CD-CE1 4.05Å; K130-Y171 HydrophobicContact CD-CE2 4.19Å; K130-Y171 HydrophobicContact CD-CG 4.32Å; K130-Y171 HydrophobicContact CG-CE1 4.46Å; Y171-N288 PolarHBondContact OH-N 2.88Å; Y171-Q289 HydrophobicContact CD2-CG 3.9Å; Y171-Q289 HydrophobicContact CE2-CG 3.87Å; Y171-Q306 PolarHBondContact O-NE2 3.1Å; Y171-R309 WeakPolarHBondContact O-CB 3.33Å; Y171-R309 WeakPolarHBondContact O-CD 3.39Å
172	V	97.3	Very high	93.5	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.5	-176.7	-178.9	0	0	0	0	109.5	V129 D131 Y132 A158 W160 Y174	V129-V172 PolarHBondContact N-O 3.48Å; V129-V172 PolarHBondContact O-N 2.87Å; D131-V172 WeakPolarHBondContact O-CB 3.12Å; D131-V172 WeakPolarHBondContact O-CG2 3.32Å; Y132-V172 HydrophobicContact CE1-CG1 4.23Å; Y132-V172 HydrophobicContact CE2-CG2 4.38Å; A158-V172 HydrophobicContact CB-CG1 4.17Å; W160-V172 HydrophobicContact CB-CG1 3.83Å; V172-Y174 HydrophobicContact CB-CD2 4.46Å; V172-Y174 HydrophobicContact CB-CE2 3.92Å; V172-Y174 HydrophobicContact CG1-CD2 4.22Å; V172-Y174 HydrophobicContact CG1-CE2 3.69Å; V172-Y174 WeakPolarHBondContact O-CD2 3.28Å
173	P	97.9	Very high	93.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	143.1	178.3	29.2	-34.7	0	0	0	110.5	A127 M128 I159 L312 I313	A127-P173 CarbonylContact O-C 3.57Å; A127-P173 WeakPolarHBondContact O-CA 3.34Å; M128-P173 HydrophobicContact CE-CB 4.33Å; M128-P173 VanDerWaalsContact SD-CA 3.53Å; M128-P173 HydrophobicContact SD-CB 3.95Å; I159-P173 HydrophobicContact CB-CB 4.13Å; I159-P173 HydrophobicContact CB-CG 3.98Å; I159-P173 HydrophobicContact CD1-CB 4.39Å; I159-P173 PolarHBondContact N-O 2.77Å; P173-L312 HydrophobicContact CB-CB 4.39Å; P173-L312 HydrophobicContact CG-CB 3.98Å; P173-L312 HydrophobicContact CG-CD1 4Å; P173-I313 HydrophobicContact CB-CD1 3.72Å; P173-I313 HydrophobicContact CB-CG1 4.13Å
174	Y	98.2	Very high	93.8	Very high	10 Å²	10	33.8 Å²	33.8	4%	0.039	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	149.1	179.3	-83.3	-103.5	0	0	0	111.5	A127 V129 Y132 L133 K157 A158 V172 F176	A127-Y174 PolarHBondContact N-O 2.86Å; A127-Y174 PolarHBondContact O-N 3.34Å; V129-Y174 HydrophobicContact CB-CD2 3.83Å; V129-Y174 HydrophobicContact CB-CE2 3.77Å; V129-Y174 HydrophobicContact CG2-CD2 3.52Å; V129-Y174 HydrophobicContact CG2-CE2 3.87Å; V129-Y174 HydrophobicContact CG2-CG 4.06Å; Y132-Y174 WeakPolarHBondContact CA-OH 3.42Å; Y132-Y174 WeakPolarHBondContact CD1-OH 3.34Å; L133-Y174 HydrophobicContact CB-CE1 4.21Å; L133-Y174 PolarHBondContact N-OH 3.11Å; K157-Y174 VanDerWaalsContact C-CD1 3.44Å; K157-Y174 CarbonylContact O-C 3.52Å; K157-Y174 WeakPolarHBondContact O-CA 3.26Å; A158-Y174 HydrophobicContact CB-CD1 4.29Å; A158-Y174 HydrophobicContact CB-CE1 3.79Å; A158-Y174 HydrophobicContact CB-CE2 4.15Å; V172-Y174 HydrophobicContact CB-CD2 4.46Å; V172-Y174 HydrophobicContact CB-CE2 3.92Å; V172-Y174 HydrophobicContact CG1-CD2 4.22Å; V172-Y174 HydrophobicContact CG1-CE2 3.69Å; V172-Y174 WeakPolarHBondContact O-CD2 3.28Å; Y174-F176 VanDerWaalsContact CB-CE1 3.43Å; Y174-F176 HydrophobicContact CD1-CD1 4.42Å; Y174-F176 AromaticContact CD1-CE1 3.75Å; Y174-F176 HydrophobicContact CD1-CE1 3.75Å; Y174-F176 AromaticContact CG-CE1 3.78Å; Y174-F176 HydrophobicContact CG-CE1 3.78Å; Y174-F176 HydrophobicContact CG-CZ 4.43Å
175	L	98.2	Very high	93.6	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.4	159.7	-177.3	65.3	0	0	0	107.7	L126 K157 I159 L320 I420	L126-L175 HydrophobicContact CD2-CD1 3.98Å; K157-L175 PolarHBondContact N-O 3.35Å; K157-L175 PolarHBondContact O-N 3.4Å; I159-L175 HydrophobicContact CD1-CB 4.18Å; I159-L175 HydrophobicContact CG1-CB 4.3Å; L175-L320 HydrophobicContact CD1-CD1 4.04Å; L175-I420 HydrophobicContact CB-CD1 4.28Å; L175-I420 HydrophobicContact CD2-CD1 4.11Å; L175-I420 HydrophobicContact CD2-CG1 3.83Å
176	F	97.7	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.8	169	-54.2	-29.9	0	0	0	109.1	V101 L103 S124 V125 A127 V129 L133 L137 K155 T156 Y174 I193	V101-F176 HydrophobicContact CG1-CE2 3.96Å; V101-F176 HydrophobicContact CG1-CZ 4.07Å; L103-F176 HydrophobicContact CD2-CD2 4.06Å; L103-F176 HydrophobicContact CD2-CE2 3.85Å; S124-F176 CarbonylContact C-O 3.5Å; S124-F176 WeakPolarHBondContact CA-O 3.22Å; V125-F176 HydrophobicContact CB-CB 4.27Å; V125-F176 PolarHBondContact N-O 2.78Å; V125-F176 PolarHBondContact O-N 2.84Å; A127-F176 HydrophobicContact CB-CD2 3.74Å; A127-F176 HydrophobicContact CB-CE1 4.43Å; A127-F176 HydrophobicContact CB-CE2 3.24Å; A127-F176 HydrophobicContact CB-CZ 3.64Å; V129-F176 HydrophobicContact CG2-CZ 3.97Å; L133-F176 HydrophobicContact CD2-CE1 4.33Å; L137-F176 HydrophobicContact CD1-CD1 4.43Å; L137-F176 HydrophobicContact CD1-CD2 4.15Å; L137-F176 HydrophobicContact CD1-CE1 3.95Å; L137-F176 HydrophobicContact CD1-CE2 3.63Å; L137-F176 HydrophobicContact CD1-CZ 3.52Å; K155-F176 CarbonylContact O-C 3.4Å; K155-F176 VanDerWaalsContact O-CA 3.3Å; K155-F176 WeakPolarHBondContact O-CA 3.4Å; T156-F176 HydrophobicContact CG2-CD1 3.53Å; T156-F176 HydrophobicContact CG2-CE1 3.74Å; T156-F176 HydrophobicContact CG2-CG 4.37Å; Y174-F176 VanDerWaalsContact CB-CE1 3.43Å; Y174-F176 HydrophobicContact CD1-CD1 4.42Å; Y174-F176 AromaticContact CD1-CE1 3.75Å; Y174-F176 HydrophobicContact CD1-CE1 3.75Å; Y174-F176 AromaticContact CG-CE1 3.78Å; Y174-F176 HydrophobicContact CG-CE1 3.78Å; Y174-F176 HydrophobicContact CG-CZ 4.43Å; F176-I193 HydrophobicContact CB-CD1 4.22Å; F176-I193 HydrophobicContact CD2-CD1 3.68Å; F176-I193 HydrophobicContact CG-CD1 4.42Å
177	T	96.5	Very high	93.5	Very high	5 Å²	5	42 Å²	42	3%	0.031	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120	-177.8	-56.2	0	0	0	0	109.4	V122 V123 K155	V122-T177 HydrophobicContact CG1-CG2 3.46Å; V122-T177 VanDerWaalsContact CG1-CG2 3.46Å; V123-T177 WeakPolarHBondContact O-CA 3.48Å; K155-T177 PolarHBondContact N-O 3.24Å; K155-T177 PolarHBondContact O-N 2.86Å
178	C	96.1	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.9	174.1	-37.8	0	0	0	0	107.5	V122 V123 C139 L141 V152	V122-C178 CarbonylContact C-O 3.55Å; V122-C178 WeakPolarHBondContact CA-O 3.39Å; V123-C178 HydrophobicContact CB-CB 4.21Å; V123-C178 PolarHBondContact N-O 2.86Å; V123-C178 PolarHBondContact O-N 2.85Å; C139-C178 HydrophobicContact CB-CB 3.45Å; C139-C178 VanDerWaalsContact CB-CB 3.45Å; C139-C178 WeakPolarHBondContact CB-SG 3.35Å; C139-C178 WeakPolarHBondContact SG-CB 3.44Å; C139-C178 CovalentContact SG-SG 2.01Å; C139-C178 PolarHBondContact SG-SG 2.98Å; L141-C178 HydrophobicContact CD1-CB 4.43Å; L141-C178 HydrophobicContact CD2-CB 4.23Å; V152-C178 HydrophobicContact CG1-CB 4.16Å
179	A	94.2	Very high	93.8	Very high	5 Å²	5	36.7 Å²	36.7	4%	0.041	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.5	-175.7	0	0	0	0	0	112.2	V65 V121 V122	V65-A179 HydrophobicContact CG1-CB 3.08Å; V121-A179 CarbonylContact O-C 3.59Å; V121-A179 WeakPolarHBondContact O-CA 3.29Å; V122-A179 HydrophobicContact CG2-CB 4.23Å
180	L	93.6	Very high	94	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	157	174.8	-62.3	173.9	0	0	0	110.1	P70 G120 V121 L141 L150 V152 Y184 F188	P70-L180 HydrophobicContact CB-CD2 3.96Å; P70-L180 HydrophobicContact CG-CD2 4.12Å; G120-L180 PolarHBondContact N-O 3.31Å; V121-L180 HydrophobicContact CB-CB 4.26Å; V121-L180 HydrophobicContact CB-CD1 4.3Å; V121-L180 PolarHBondContact O-N 3.4Å; L141-L180 HydrophobicContact CD1-CD1 3.72Å; L141-L180 HydrophobicContact CD1-CD2 4.33Å; L141-L180 HydrophobicContact CD1-CG 3.92Å; L150-L180 HydrophobicContact CD1-CD1 4.1Å; V152-L180 HydrophobicContact CB-CD2 4.32Å; V152-L180 HydrophobicContact CG1-CD2 4.39Å; L180-Y184 HydrophobicContact CB-CD2 3.87Å; L180-Y184 HydrophobicContact CB-CG 4.02Å; L180-Y184 HydrophobicContact CD1-CD1 4.28Å; L180-Y184 HydrophobicContact CD1-CD2 4.49Å; L180-Y184 HydrophobicContact CD1-CG 4Å; L180-F188 HydrophobicContact CD1-CD2 4.42Å; L180-F188 HydrophobicContact CD1-CE2 3.52Å; L180-F188 HydrophobicContact CD1-CZ 3.69Å
181	S	92.5	Very high	94	Very high	28 Å²	28	36.3 Å²	36.3	20%	0.196	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	165.3	178.2	68.1	0	0	0	0	112	V67 N118 G120 S183 Y184	V67-S181 VanDerWaalsContact CG1-CB 3.46Å; V67-S181 VanDerWaalsContact CG1-N 3.29Å; N118-S181 CarbonylContact O-C 3.57Å; N118-S181 VanDerWaalsContact O-CA 3.3Å; N118-S181 WeakPolarHBondContact O-CA 3.12Å; G120-S181 WeakPolarHBondContact CA-O 3.48Å; G120-S181 PolarHBondContact N-O 3.46Å; S181-S183 PolarHBondContact O-N 3.17Å; S181-S183 VanDerWaalsContact O-N 3.08Å; S181-S183 WeakPolarHBondContact OG-CB 3.42Å; S181-Y184 PolarHBondContact O-N 2.88Å
182	S	90.1	Very high	93.9	Very high	56 Å²	56	35.8 Å²	35.8	39%	0.392	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-12.7	175.2	50.9	0	0	0	0	114.2	P117 N118 Y184	P117-S182 VanDerWaalsContact O-CB 3.23Å; P117-S182 WeakPolarHBondContact O-CB 3.4Å; P117-S182 PolarHBondContact O-OG 3.03Å; N118-S182 PolarHBondContact O-N 3.13Å; S182-Y184 PolarHBondContact O-N 3.15Å
183	S	91.3	Very high	93.8	Very high	106 Å²	106	35.7 Å²	35.7	74%	0.741	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.6	167.6	-51.3	0	0	0	0	113.1	S181	S181-S183 PolarHBondContact O-N 3.17Å; S181-S183 VanDerWaalsContact O-N 3.08Å; S181-S183 WeakPolarHBondContact OG-CB 3.42Å
184	Y	91.1	Very high	93.7	Very high	49 Å²	49	35.7 Å²	35.7	19%	0.192	19%	0.192	C	C	.	.			trans	-107.1	114.3	175.6	-61	-88.5	0	0	0	109.5	P70 Y72 G120 L150 L180 S181 S182	P70-Y184 HydrophobicContact CG-CE1 4.39Å; P70-Y184 HydrophobicContact CG-CE2 3.74Å; P70-Y184 WeakPolarHBondContact CG-OH 3.38Å; Y72-Y184 PolarHBondContact OH-OH 3.49Å; G120-Y184 CarbonylContact C-O 3.56Å; G120-Y184 WeakPolarHBondContact CA-O 3.46Å; L150-Y184 HydrophobicContact CD1-CD1 3.73Å; L150-Y184 HydrophobicContact CD1-CE1 3.45Å; L150-Y184 VanDerWaalsContact CD1-CE1 3.45Å; L180-Y184 HydrophobicContact CB-CD2 3.87Å; L180-Y184 HydrophobicContact CB-CG 4.02Å; L180-Y184 HydrophobicContact CD1-CD1 4.28Å; L180-Y184 HydrophobicContact CD1-CD2 4.49Å; L180-Y184 HydrophobicContact CD1-CG 4Å; S181-Y184 PolarHBondContact O-N 2.88Å; S182-Y184 PolarHBondContact O-N 3.15Å
185	T	83.2	Confident	93.5	Very high	116 Å²	116	36.1 Å²	36.1	71%	0.712	20%	0.196	S	C	*	.			trans	-121.7	-0.1	178.1	60.1	0	0	0	0	112.7
186	E	87.3	Confident	93.3	Very high	108 Å²	108	39.1 Å²	39.1	51%	0.505	22%	0.217	S	C	.	.	S	Bend	trans	-79.6	149.8	-177	-67.6	-178	-124	0	0	112.3	V121 K143 F188	V121-E186 WeakPolarHBondContact CG2-O 3.49Å; K143-E186 VanDerWaalsContact CD-OE2 3.29Å; K143-E186 WeakPolarHBondContact CD-OE2 3.44Å; K143-E186 WeakPolarHBondContact CE-OE2 3.35Å; K143-E186 IonicContact NZ-OE1 2.81Å; K143-E186 PolarHBondContact NZ-OE1 3.01Å; K143-E186 IonicContact NZ-OE2 2.64Å; K143-E186 PolarHBondContact NZ-OE2 3.15Å; E186-F188 WeakPolarHBondContact O-CD2 3.45Å
187	N	91.1	Very high	93	Very high	87 Å²	87	43.4 Å²	43.4	47%	0.465	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-76.1	129.7	176.3	-72.4	-22.8	0	0	0	111.3	Y189	N187-Y189 HydrophobicContact CB-CE1 4.07Å
188	F	94.8	Very high	92.6	Very high	3 Å²	3	44.6 Å²	44.6	1%	0.013	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-97.3	133.9	164.9	-63.8	-93.3	0	0	0	108.6	V121 L141 K143 L150 L180 E186 I208 H210	V121-F188 HydrophobicContact CG1-CD2 3.97Å; V121-F188 HydrophobicContact CG1-CE2 4.38Å; V121-F188 HydrophobicContact CG2-CD2 4.36Å; V121-F188 HydrophobicContact CG2-CE2 4.24Å; L141-F188 VanDerWaalsContact C-CD1 3.47Å; L141-F188 HydrophobicContact CB-CB 4.43Å; L141-F188 HydrophobicContact CB-CD1 3.47Å; L141-F188 VanDerWaalsContact CB-CD1 3.47Å; L141-F188 HydrophobicContact CB-CE1 3.76Å; L141-F188 HydrophobicContact CB-CG 3.91Å; L141-F188 HydrophobicContact CB-CZ 4.47Å; K143-F188 HydrophobicContact CD-CE1 4.39Å; K143-F188 HydrophobicContact CG-CD1 3.7Å; K143-F188 HydrophobicContact CG-CE1 3.6Å; K143-F188 HydrophobicContact CG-CG 4.43Å; K143-F188 HydrophobicContact CG-CZ 4.21Å; L150-F188 HydrophobicContact CB-CE1 4.45Å; L150-F188 HydrophobicContact CD1-CE1 3.98Å; L150-F188 HydrophobicContact CD1-CZ 3.59Å; L150-F188 HydrophobicContact CG-CE1 4.19Å; L150-F188 HydrophobicContact CG-CZ 4.3Å; L180-F188 HydrophobicContact CD1-CD2 4.42Å; L180-F188 HydrophobicContact CD1-CE2 3.52Å; L180-F188 HydrophobicContact CD1-CZ 3.69Å; E186-F188 WeakPolarHBondContact O-CD2 3.45Å; F188-I208 HydrophobicContact CB-CD1 3.84Å; F188-I208 WeakPolarHBondContact O-CD1 3.46Å; F188-H210 PolarHBondContact O-CE1 2.8Å; F188-H210 PolarHBondContact O-NE2 2.84Å
189	Y	95	Very high	92.3	Very high	117 Å²	117	46.1 Å²	46.1	46%	0.459	25%	0.254	S	S	.	.			trans	-101.2	-18.4	-176.4	-62.1	-62.1	0	0	0	113.1	W142 K143 N187 I208 H210	W142-Y189 PolarHBondContact O-N 3.01Å; K143-Y189 WeakPolarHBondContact O-CD2 3.47Å; N187-Y189 HydrophobicContact CB-CE1 4.07Å; Y189-I208 PolarHBondContact O-N 3.33Å; Y189-H210 AromaticContact CD1-NE2 3.92Å
190	Y	95.2	Very high	91.9	Very high	56 Å²	56	50 Å²	50	22%	0.22	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.3	176.2	-47.6	-91.5	0	0	0	111.9	F86 W142 L145 L205 L206 K207 I208	F86-Y190 HydrophobicContact CD1-CE1 4.37Å; F86-Y190 HydrophobicContact CE1-CD1 4.05Å; F86-Y190 AromaticContact CE1-CE1 3.7Å; F86-Y190 HydrophobicContact CE1-CE1 3.7Å; W142-Y190 PolarHBondContact N-O 2.82Å; W142-Y190 PolarHBondContact O-N 2.79Å; L145-Y190 HydrophobicContact CD1-CD2 4.48Å; L145-Y190 HydrophobicContact CD1-CE2 4.32Å; L145-Y190 HydrophobicContact CD2-CD2 3.79Å; L145-Y190 HydrophobicContact CD2-CE2 4.39Å; L145-Y190 HydrophobicContact CD2-CG 3.97Å; L145-Y190 HydrophobicContact CG-CD2 3.94Å; L145-Y190 HydrophobicContact CG-CE2 4.06Å; L145-Y190 HydrophobicContact CG-CG 4.49Å; Y190-L205 HydrophobicContact CD1-CG 4.37Å; Y190-L205 HydrophobicContact CG-CD1 4.34Å; Y190-L206 CarbonylContact C-O 3.58Å; Y190-L206 WeakPolarHBondContact CA-O 3.13Å; Y190-L206 WeakPolarHBondContact CB-O 3.5Å; Y190-K207 HydrophobicContact CD1-CB 4.12Å; Y190-K207 HydrophobicContact CD1-CG 4.43Å; Y190-K207 HydrophobicContact CE1-CB 4.12Å; Y190-K207 HydrophobicContact CE1-CG 4.15Å; Y190-I208 WeakPolarHBondContact O-CD1 3.43Å
191	V	95.5	Very high	91.6	Very high	1 Å²	1	52 Å²	52	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	137.9	173.1	59.9	0	0	0	0	110	A106 V123 V125 C139 Y140 L141 I193 L206 I208	A106-V191 HydrophobicContact CB-CG1 3.56Å; V123-V191 HydrophobicContact CG1-CB 4.38Å; V123-V191 HydrophobicContact CG1-CG1 4.13Å; V125-V191 HydrophobicContact CG2-CG1 3.92Å; C139-V191 HydrophobicContact CB-CG2 4.27Å; Y140-V191 CarbonylContact O-C 3.49Å; Y140-V191 VanDerWaalsContact O-CA 3.31Å; Y140-V191 WeakPolarHBondContact O-CA 3.26Å; L141-V191 HydrophobicContact CD2-CB 4.12Å; L141-V191 HydrophobicContact CD2-CG2 3.85Å; V191-I193 HydrophobicContact CG2-CG1 4.31Å; V191-L206 HydrophobicContact CG1-CB 4.04Å; V191-L206 PolarHBondContact N-O 3.14Å; V191-L206 PolarHBondContact O-N 3.04Å; V191-I208 HydrophobicContact CB-CD1 4.1Å; V191-I208 HydrophobicContact CB-CG1 4.19Å; V191-I208 HydrophobicContact CG1-CD1 4.39Å; V191-I208 HydrophobicContact CG1-CG1 3.94Å
192	S	95.1	Very high	91.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	153.8	162.7	-50.2	0	0	0	0	109	C139 Y140 W142 N204 L205	C139-S192 CarbonylContact C-O 3.52Å; C139-S192 WeakPolarHBondContact CA-O 3.39Å; Y140-S192 PolarHBondContact N-O 2.83Å; Y140-S192 PolarHBondContact O-N 3.45Å; W142-S192 PolarHBondContact NE1-OG 2.73Å; W142-S192 VanDerWaalsContact NE1-OG 3.09Å; S192-N204 VanDerWaalsContact CA-OD1 3.32Å; S192-N204 WeakPolarHBondContact CA-OD1 3.48Å; S192-N204 WeakPolarHBondContact CB-O 3.17Å; S192-N204 PolarHBondContact OG-O 3.3Å; S192-L205 WeakPolarHBondContact OG-CD1 3.29Å
193	I	95.8	Very high	91.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.6	175.6	-58	-176.6	0	0	0	109.3	I94 L103 V125 L137 Y138 F176 V191 N204	I94-I193 HydrophobicContact CD1-CB 4.03Å; I94-I193 HydrophobicContact CD1-CG2 3.77Å; I94-I193 VanDerWaalsContact CG2-O 3.3Å; I94-I193 WeakPolarHBondContact CG2-O 3.47Å; L103-I193 HydrophobicContact CD1-CB 4.05Å; L103-I193 HydrophobicContact CD1-CD1 4.41Å; L103-I193 HydrophobicContact CD1-CG1 4.27Å; L103-I193 HydrophobicContact CD2-CB 4.44Å; L103-I193 HydrophobicContact CD2-CD1 3.98Å; V125-I193 HydrophobicContact CB-CD1 3.93Å; V125-I193 HydrophobicContact CG1-CD1 3.83Å; V125-I193 HydrophobicContact CG2-CD1 4.02Å; L137-I193 HydrophobicContact CB-CG2 3.9Å; L137-I193 HydrophobicContact CD1-CG2 4.11Å; L137-I193 HydrophobicContact CD2-CG2 4.31Å; L137-I193 HydrophobicContact CG-CG2 4.34Å; Y138-I193 VanDerWaalsContact O-CA 3.32Å; Y138-I193 WeakPolarHBondContact O-CA 3.47Å; F176-I193 HydrophobicContact CB-CD1 4.22Å; F176-I193 HydrophobicContact CD2-CD1 3.68Å; F176-I193 HydrophobicContact CG-CD1 4.42Å; V191-I193 HydrophobicContact CG2-CG1 4.31Å; I193-N204 PolarHBondContact N-OD1 2.82Å; I193-N204 PolarHBondContact O-ND2 2.83Å
194	E	95.2	Very high	91.6	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	160.1	-179.3	-59.6	-64.3	159	0	0	111.8	S96 L137 Y138 Y140 S196 V199 V202 S203 N204	S96-E194 WeakPolarHBondContact CB-OE2 3.49Å; S96-E194 PolarHBondContact OG-OE2 3.49Å; L137-E194 WeakPolarHBondContact CA-O 3.35Å; Y138-E194 PolarHBondContact N-O 3.15Å; Y138-E194 PolarHBondContact O-N 3.23Å; Y140-E194 HydrophobicContact CD2-CB 4.42Å; Y140-E194 HydrophobicContact CD2-CG 4.17Å; Y140-E194 HydrophobicContact CE2-CB 3.74Å; Y140-E194 HydrophobicContact CE2-CG 3.81Å; E194-S196 VanDerWaalsContact C-N 3.28Å; E194-S196 PolarHBondContact O-N 2.91Å; E194-V199 HydrophobicContact CB-CG2 4.38Å; E194-V199 HydrophobicContact CG-CG2 3.85Å; E194-V202 HydrophobicContact CG-CB 4.47Å; E194-V202 HydrophobicContact CG-CG1 4.09Å; E194-V202 WeakPolarHBondContact OE1-CA 3.39Å; E194-S203 PolarHBondContact OE1-N 3.46Å; E194-N204 PolarHBondContact OE1-ND2 2.87Å
195	C	94.3	Very high	91.7	Very high	18 Å²	18	43.1 Å²	43.1	12%	0.122	24%	0.24	C	C	.	.	S	Bend	trans	-83.1	-0.1	177.4	-82.1	0	0	0	0	114.5	S96 C97 I135 L137	S96-C195 PolarHBondContact OG-N 2.86Å; C97-C195 VanDerWaalsContact CA-SG 3.57Å; C97-C195 HydrophobicContact CB-CB 4.05Å; C97-C195 WeakPolarHBondContact CB-SG 3.46Å; C97-C195 WeakPolarHBondContact SG-CB 3.25Å; C97-C195 CovalentContact SG-SG 2.01Å; C97-C195 PolarHBondContact SG-SG 3.3Å; I135-C195 HydrophobicContact CD1-CB 4.39Å; I135-C195 WeakPolarHBondContact CD1-SG 3.44Å; L137-C195 WeakPolarHBondContact CD2-SG 3.07Å
196	S	92.9	Very high	92.2	Very high	65 Å²	65	38.1 Å²	38.1	46%	0.455	21%	0.209	S	C	.	.	S	Bend	trans	-143.2	152.5	178.4	-65.9	0	0	0	0	110.8	Y140 E194	Y140-S196 PolarHBondContact OH-O 2.87Å; E194-S196 VanDerWaalsContact C-N 3.28Å; E194-S196 PolarHBondContact O-N 2.91Å
197	Q	91.3	Very high	92.5	Very high	91 Å²	91	39.8 Å²	39.8	43%	0.425	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	148.8	174.6	-59.7	177.9	34.9	0	0	110.1	L71 Y138 Y140 V199	L71-Q197 HydrophobicContact CD2-CB 4.23Å; L71-Q197 VanDerWaalsContact CD2-OE1 3.24Å; Y138-Q197 HydrophobicContact CD1-CG 3.38Å; Y138-Q197 HydrophobicContact CD2-CG 3.83Å; Y138-Q197 VanDerWaalsContact CE1-CD 3.47Å; Y138-Q197 HydrophobicContact CE1-CG 3.27Å; Y138-Q197 HydrophobicContact CE2-CG 3.72Å; Y138-Q197 HydrophobicContact CG-CG 3.65Å; Y138-Q197 VanDerWaalsContact CZ-CG 3.43Å; Y138-Q197 PolarHBondContact OH-NE2 2.86Å; Y140-Q197 VanDerWaalsContact OH-C 3.23Å; Q197-V199 VanDerWaalsContact C-N 3.32Å; Q197-V199 PolarHBondContact O-N 3.32Å
198	C	88.1	Confident	92.8	Very high	30 Å²	30	35.9 Å²	35.9	20%	0.203	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	44.4	175.7	-57.2	0	0	0	0	116.2	L71 C73 Y140	L71-C198 WeakPolarHBondContact CD2-SG 3.31Å; C73-C198 WeakPolarHBondContact CA-SG 3.01Å; C73-C198 HydrophobicContact CB-CB 3.69Å; C73-C198 WeakPolarHBondContact CB-SG 3.25Å; C73-C198 WeakPolarHBondContact SG-CA 3.2Å; C73-C198 WeakPolarHBondContact SG-CB 3.48Å; C73-C198 CovalentContact SG-SG 2.05Å; C73-C198 PolarHBondContact SG-SG 3.07Å; Y140-C198 PolarHBondContact OH-N 3.39Å
199	V	90	Very high	92.8	Very high	31 Å²	31	37.9 Å²	37.9	19%	0.188	21%	0.208	C	C	.	.			trans	-65.2	142.8	172.4	-58.7	0	0	0	0	111.1	A77 Y140 E194 Q197 A201 V202	A77-V199 WeakPolarHBondContact CB-O 3.33Å; Y140-V199 HydrophobicContact CE1-CG2 4.26Å; Y140-V199 PolarHBondContact OH-N 2.63Å; E194-V199 HydrophobicContact CB-CG2 4.38Å; E194-V199 HydrophobicContact CG-CG2 3.85Å; Q197-V199 VanDerWaalsContact C-N 3.32Å; Q197-V199 PolarHBondContact O-N 3.32Å; V199-A201 VanDerWaalsContact C-N 3.25Å; V199-A201 WeakPolarHBondContact CG2-O 3.46Å; V199-A201 PolarHBondContact O-N 3.28Å; V199-V202 HydrophobicContact CG2-CG1 4.08Å
200	S	85.9	Confident	92.7	Very high	87 Å²	87	34.2 Å²	34.2	61%	0.608	20%	0.195	S	C	*	.	S	Bend	trans	-68.9	-24	179.8	-45.3	0	0	0	0	113.3	S78	S78-S200 PolarHBondContact N-O 3.11Å; S78-S200 PolarHBondContact OG-O 3.18Å
201	A	87.8	Confident	92.2	Very high	41 Å²	41	33.4 Å²	33.4	34%	0.339	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	129.5	173.4	0	0	0	0	0	112	S78 V199	S78-A201 WeakPolarHBondContact O-CA 3.34Å; V199-A201 VanDerWaalsContact C-N 3.25Å; V199-A201 WeakPolarHBondContact CG2-O 3.46Å; V199-A201 PolarHBondContact O-N 3.28Å
202	V	91.2	Very high	91.2	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.03	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	146.5	173.5	-64.2	0	0	0	0	110.6	A77 S78 S80 Y140 W142 E194 V199	A77-V202 HydrophobicContact CB-CG1 4.37Å; S78-V202 PolarHBondContact O-N 2.88Å; S80-V202 PolarHBondContact N-O 2.76Å; Y140-V202 HydrophobicContact CD1-CG1 4.08Å; Y140-V202 HydrophobicContact CE1-CG1 4.38Å; Y140-V202 HydrophobicContact CG-CG1 4.2Å; W142-V202 HydrophobicContact CZ2-CG1 4.09Å; W142-V202 HydrophobicContact CZ2-CG2 4Å; E194-V202 HydrophobicContact CG-CB 4.47Å; E194-V202 HydrophobicContact CG-CG1 4.09Å; E194-V202 WeakPolarHBondContact OE1-CA 3.39Å; V199-V202 HydrophobicContact CG2-CG1 4.08Å
203	S	91.1	Very high	89.8	Confident	22 Å²	22	47.7 Å²	47.7	15%	0.154	26%	0.263	C	S	.	.	S	Bend	trans	-96.1	-9.2	-177.1	85.4	0	0	0	0	114.4	R93 I94 S95 E194	R93-S203 PolarHBondContact O-OG 2.99Å; I94-S203 WeakPolarHBondContact CA-OG 2.75Å; S95-S203 PolarHBondContact N-OG 2.92Å; S95-S203 WeakPolarHBondContact OG-CB 3.27Å; E194-S203 PolarHBondContact OE1-N 3.46Å
204	N	92.4	Very high	88.4	Confident	10 Å²	10	54 Å²	54	5%	0.053	30%	0.302	C	S	.	.			trans	-148.3	159.7	-171.9	61.6	89	0	0	0	110.4	Q92 L103 S192 I193 E194	Q92-N204 HydrophobicContact CB-CB 4.12Å; L103-N204 HydrophobicContact CD1-CB 4.12Å; L103-N204 WeakPolarHBondContact CD1-OD1 3.33Å; S192-N204 VanDerWaalsContact CA-OD1 3.32Å; S192-N204 WeakPolarHBondContact CA-OD1 3.48Å; S192-N204 WeakPolarHBondContact CB-O 3.17Å; S192-N204 PolarHBondContact OG-O 3.3Å; I193-N204 PolarHBondContact N-OD1 2.82Å; I193-N204 PolarHBondContact O-ND2 2.83Å; E194-N204 PolarHBondContact OE1-ND2 2.87Å
205	L	92.6	Very high	87.6	Confident	17 Å²	17	57.3 Å²	57.3	9%	0.089	34%	0.336	C	S	.	.			trans	-160.1	112.3	179	-172.3	66.2	0	0	0	109.9	F86 Q92 L145 Y190 S192	F86-L205 HydrophobicContact CE1-CD2 3.94Å; F86-L205 HydrophobicContact CE1-CG 4.44Å; F86-L205 HydrophobicContact CZ-CD2 3.51Å; F86-L205 HydrophobicContact CZ-CG 4.42Å; Q92-L205 PolarHBondContact NE2-O 3.38Å; Q92-L205 PolarHBondContact OE1-O 3.01Å; L145-L205 HydrophobicContact CD1-CD2 3.94Å; L145-L205 HydrophobicContact CD2-CD1 3.9Å; L145-L205 HydrophobicContact CD2-CD2 3.7Å; L145-L205 HydrophobicContact CD2-CG 4.41Å; Y190-L205 HydrophobicContact CD1-CG 4.37Å; Y190-L205 HydrophobicContact CG-CD1 4.34Å; S192-L205 WeakPolarHBondContact OG-CD1 3.29Å
206	L	94.2	Very high	87.2	Confident	10 Å²	10	65 Å²	65	5%	0.052	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.2	173.9	-66.2	179.2	0	0	0	110.4	Q92 L103 A106 V125 Y190 V191	Q92-L206 HydrophobicContact CG-CD2 4.32Å; L103-L206 HydrophobicContact CB-CD1 3.79Å; L103-L206 HydrophobicContact CB-CG 4.44Å; L103-L206 HydrophobicContact CD1-CD1 4.32Å; A106-L206 HydrophobicContact CB-CB 3.89Å; A106-L206 HydrophobicContact CB-CD1 4.07Å; V125-L206 HydrophobicContact CG1-CD1 3.68Å; Y190-L206 CarbonylContact C-O 3.58Å; Y190-L206 WeakPolarHBondContact CA-O 3.13Å; Y190-L206 WeakPolarHBondContact CB-O 3.5Å; V191-L206 HydrophobicContact CG1-CB 4.04Å; V191-L206 PolarHBondContact N-O 3.14Å; V191-L206 PolarHBondContact O-N 3.04Å
207	K	94.1	Very high	87.1	Confident	144 Å²	144	64.5 Å²	64.5	63%	0.626	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.5	165.4	-175.2	176	-179.2	176.6	0	109.1	Y190	Y190-K207 HydrophobicContact CD1-CB 4.12Å; Y190-K207 HydrophobicContact CD1-CG 4.43Å; Y190-K207 HydrophobicContact CE1-CB 4.12Å; Y190-K207 HydrophobicContact CE1-CG 4.15Å
208	I	95.8	Very high	87.3	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.021	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.2	174.7	-61.3	166.9	0	0	0	108.2	A106 A108 V123 F188 Y189 Y190 V191 H210	A106-I208 HydrophobicContact CB-CG1 4.28Å; A108-I208 HydrophobicContact CB-CG2 3.9Å; V123-I208 HydrophobicContact CG1-CD1 4.02Å; V123-I208 HydrophobicContact CG1-CG1 4Å; V123-I208 HydrophobicContact CG1-CG2 4.48Å; V123-I208 HydrophobicContact CG2-CD1 3.86Å; F188-I208 HydrophobicContact CB-CD1 3.84Å; F188-I208 WeakPolarHBondContact O-CD1 3.46Å; Y189-I208 PolarHBondContact O-N 3.33Å; Y190-I208 WeakPolarHBondContact O-CD1 3.43Å; V191-I208 HydrophobicContact CB-CD1 4.1Å; V191-I208 HydrophobicContact CB-CG1 4.19Å; V191-I208 HydrophobicContact CG1-CD1 4.39Å; V191-I208 HydrophobicContact CG1-CG1 3.94Å; I208-H210 PolarHBondContact O-CD2 2.73Å
209	S	94.7	Very high	87.8	Confident	46 Å²	46	62.8 Å²	62.8	32%	0.322	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.8	171.6	-176.1	0	0	0	0	110.2	A106 Y107 A108	A106-S209 PolarHBondContact O-N 3.04Å; Y107-S209 WeakPolarHBondContact CA-O 3.04Å; A108-S209 PolarHBondContact N-O 3.2Å
210	H	93.1	Very high	88.2	Confident	39 Å²	39	61.3 Å²	61.3	18%	0.181	34%	0.342	C	S	.	.			trans	-95.3	-1	178.2	-72	-94.4	0	0	0	113.3	A108 F188 Y189 I208 H213	A108-H210 WeakPolarHBondContact CB-ND1 3.14Å; F188-H210 PolarHBondContact O-CE1 2.8Å; F188-H210 PolarHBondContact O-NE2 2.84Å; Y189-H210 AromaticContact CD1-NE2 3.92Å; I208-H210 PolarHBondContact O-CD2 2.73Å; H210-H213 PolarHBondContact O-NE2 2.81Å
211	G	84.6	Confident	88.8	Confident	39 Å²	39	57.1 Å²	57.1	40%	0.402	31%	0.313	S	S	.	.			trans	65.7	-160.6	-174.1	0	0	0	0	0	113
212	R	75.6	Confident	89.3	Confident	170 Å²	170	55.2 Å²	55.2	64%	0.642	30%	0.297	S	S	*	.			trans	-115.3	129.2	173.5	-69.9	-177.1	178.8	-177	-1.4	108.6	T324	R212-T324 PolarHBondContact N-OG1 3.02Å; R212-T324 WeakPolarHBondContact O-CB 3.46Å; R212-T324 PolarHBondContact O-OG1 3.3Å
213	H	66.2	Low	89.6	Confident	132 Å²	132	55 Å²	55	61%	0.611	30%	0.296	S	S	*	.			trans	-99	2.2	-178.9	-69.9	-75.9	0	0	0	114.2	H210	H210-H213 PolarHBondContact O-NE2 2.81Å
214	T	65.3	Low	89.9	Confident	133 Å²	133	54 Å²	54	82%	0.816	29%	0.289	S	S	*	.	S	Bend	trans	-95.7	114	-171.1	56.9	0	0	0	0	112
215	G	79.4	Confident	90	Very high	69 Å²	69	55.3 Å²	55.3	71%	0.711	29%	0.294	S	S	*	.	S	Bend	trans	97.1	-178	170.6	0	0	0	0	0	114.6
216	Q	84.8	Confident	90.1	Very high	179 Å²	179	55.1 Å²	55.1	84%	0.836	30%	0.296	S	S	*	.	S	Bend	trans	-69.7	140.4	175.8	-68	-62.3	-31.8	0	0	110.3	R218	Q216-R218 PolarHBondContact O-N 2.9Å
217	P	91.5	Very high	90.3	Very high	56 Å²	56	54.7 Å²	54.7	36%	0.364	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-61.7	140.9	176	27	-33.4	0	0	0	109.9	S325	P217-S325 WeakPolarHBondContact CA-O 3.38Å
218	R	95.6	Very high	90.4	Very high	77 Å²	77	49 Å²	49	29%	0.291	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	166.3	171	-60.6	-175.2	73.9	-173.9	-1.6	109.8	Q216 D250 H276 S325 H326 T327	Q216-R218 PolarHBondContact O-N 2.9Å; R218-D250 HydrophobicContact CB-CB 3.94Å; R218-D250 IonicContact CZ-OD1 3.92Å; R218-D250 IonicContact NE-OD1 3.3Å; R218-D250 PolarHBondContact NE-OD1 3.33Å; R218-D250 PolarHBondContact NH1-O 2.86Å; R218-D250 VanDerWaalsContact NH2-C 3.25Å; R218-D250 VanDerWaalsContact NH2-CA 3.31Å; R218-D250 PolarHBondContact NH2-O 2.88Å; R218-D250 IonicContact NH2-OD1 3.99Å; R218-D250 PolarHBondContact NH2-OD1 3.41Å; R218-H276 PolarHBondContact NH1-O 2.92Å; R218-S325 PolarHBondContact N-O 3.35Å; R218-H326 CarbonylContact O-C 3.57Å; R218-H326 VanDerWaalsContact O-CA 3.26Å; R218-H326 WeakPolarHBondContact O-CA 3.47Å; R218-T327 PolarHBondContact O-N 3.45Å; R218-T327 PolarHBondContact O-OG1 2.74Å; R218-T327 VanDerWaalsContact O-OG1 3.11Å
219	H	97.3	Very high	90.4	Very high	7 Å²	7	51.9 Å²	51.9	3%	0.032	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-66.9	-172.9	-166.4	-110.8	0	0	0	112.2	D250 T327 Y328 R347	H219-D250 VanDerWaalsContact CA-OD2 3.31Å; H219-D250 WeakPolarHBondContact CA-OD2 3.23Å; H219-D250 WeakPolarHBondContact CB-OD2 3.39Å; H219-D250 PolarHBondContact N-OD2 2.94Å; H219-T327 WeakPolarHBondContact O-CB 3.45Å; H219-T327 PolarHBondContact O-N 3.32Å; H219-Y328 AromaticContact CE1-CD2 3.96Å; H219-Y328 AromaticContact NE2-CD2 3.69Å; H219-Y328 AromaticContact NE2-CE2 3.71Å; H219-Y328 PolarHBondContact O-N 2.99Å; H219-R347 WeakPolarHBondContact CE1-CA 3.39Å
220	T	98.5	Very high	90.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	119.7	-168.2	-56.6	0	0	0	0	111.8	D250 Y328 L330 W346 F412	T220-D250 PolarHBondContact N-OD2 3.38Å; T220-D250 WeakPolarHBondContact O-CB 3.27Å; T220-D250 PolarHBondContact O-N 2.83Å; T220-Y328 WeakPolarHBondContact CA-O 3.32Å; T220-L330 HydrophobicContact CG2-CB 3.98Å; T220-W346 HydrophobicContact CG2-CE3 3.81Å; T220-W346 HydrophobicContact CG2-CZ3 3.84Å; T220-F412 HydrophobicContact CG2-CD1 4.1Å; T220-F412 HydrophobicContact CG2-CE1 4.04Å
221	V	98.4	Very high	90.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	135	160.9	62.3	0	0	0	0	109.3	K251 H322 H326 Y328 A329 L330 I415	V221-K251 CarbonylContact C-O 3.52Å; V221-K251 WeakPolarHBondContact CA-O 3.45Å; V221-K251 HydrophobicContact CG2-CB 4.28Å; V221-K251 HydrophobicContact CG2-CG 4.39Å; V221-H322 HydrophobicContact CG1-CB 3.96Å; V221-H326 HydrophobicContact CB-CB 4.25Å; V221-H326 HydrophobicContact CG1-CB 4.09Å; V221-H326 PolarHBondContact N-CD2 3.5Å; V221-Y328 PolarHBondContact N-O 2.71Å; V221-A329 HydrophobicContact CG1-CB 3.96Å; V221-A329 CarbonylContact O-C 3.45Å; V221-A329 WeakPolarHBondContact O-CA 3.36Å; V221-L330 PolarHBondContact O-N 2.88Å; V221-I415 HydrophobicContact CG1-CD1 4.1Å
222	V	98.7	Very high	91.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.5	171.8	178	0	0	0	0	109	W240 A249 K251 I252 L253 L330 V332 W346	V222-W240 HydrophobicContact CG1-CH2 3.63Å; V222-W240 HydrophobicContact CG1-CZ2 3.9Å; V222-A249 HydrophobicContact CG2-CB 3.59Å; V222-K251 PolarHBondContact N-O 3.07Å; V222-I252 HydrophobicContact CB-CG1 4.09Å; V222-I252 WeakPolarHBondContact O-CA 3.49Å; V222-L253 PolarHBondContact O-N 2.66Å; V222-L330 CarbonylContact C-O 3.56Å; V222-L330 WeakPolarHBondContact CA-O 3.28Å; V222-V332 HydrophobicContact CG1-CG2 3.33Å; V222-W346 HydrophobicContact CG2-CH2 3.66Å; V222-W346 HydrophobicContact CG2-CZ3 3.61Å
223	C	98.4	Very high	92.1	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.007	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	100.1	179.6	-55.6	0	0	0	0	109	C318 L330 L331 V332	C223-C318 VanDerWaalsContact CA-SG 3.57Å; C223-C318 HydrophobicContact CB-CB 3.63Å; C223-C318 WeakPolarHBondContact CB-SG 3.13Å; C223-C318 WeakPolarHBondContact SG-CB 3.48Å; C223-C318 CovalentContact SG-SG 2.03Å; C223-C318 PolarHBondContact SG-SG 3.13Å; C223-L330 PolarHBondContact N-O 3.45Å; C223-L331 HydrophobicContact CB-CD1 4.13Å; C223-L331 HydrophobicContact CB-CG 4.04Å; C223-V332 PolarHBondContact O-N 3.11Å
224	L	97.7	Very high	93.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	131.3	177.9	-179.4	57.5	0	0	0	109.9	L227 L237 W240 M241 L253 A254 L334	L224-L227 HydrophobicContact CD1-CD2 4.45Å; L224-L227 HydrophobicContact CD2-CD1 4.1Å; L224-L227 HydrophobicContact CD2-CD2 3.92Å; L224-L227 HydrophobicContact CD2-CG 4.22Å; L224-L227 HydrophobicContact CG-CD2 4.15Å; L224-L237 HydrophobicContact CD2-CD1 4.21Å; L224-W240 HydrophobicContact CB-CH2 3.84Å; L224-W240 HydrophobicContact CB-CZ2 4.49Å; L224-W240 HydrophobicContact CB-CZ3 4.38Å; L224-W240 HydrophobicContact CD1-CH2 3.88Å; L224-W240 HydrophobicContact CD1-CZ2 3.82Å; L224-W240 HydrophobicContact CD1-CZ3 4.37Å; L224-W240 HydrophobicContact CD2-CE3 4.36Å; L224-W240 HydrophobicContact CD2-CH2 4.03Å; L224-W240 HydrophobicContact CD2-CZ3 3.82Å; L224-W240 HydrophobicContact CG-CH2 4.13Å; L224-W240 HydrophobicContact CG-CZ3 4.43Å; L224-M241 HydrophobicContact CD2-CE 4.45Å; L224-L253 PolarHBondContact N-O 3.09Å; L224-A254 HydrophobicContact CB-CB 4.3Å; L224-A254 HydrophobicContact CD2-CB 3.98Å; L224-L334 HydrophobicContact CD1-CB 4.36Å
225	K	93.6	Very high	95.1	Very high	38 Å²	38	38.4 Å²	38.4	17%	0.165	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	148.2	172.7	175.2	175.6	174	147.4	0	112.4	L227 E311 Y315 D333	K225-L227 PolarHBondContact O-N 2.77Å; K225-E311 WeakPolarHBondContact CE-OE1 3.4Å; K225-E311 WeakPolarHBondContact CE-OE2 3.48Å; K225-E311 HydrophobicContact CG-CG 4.48Å; K225-E311 IonicContact NZ-OE1 3.72Å; K225-E311 PolarHBondContact NZ-OE1 2.88Å; K225-E311 IonicContact NZ-OE2 3.63Å; K225-E311 PolarHBondContact NZ-OE2 2.91Å; K225-Y315 HydrophobicContact CB-CE1 4.07Å; K225-Y315 WeakPolarHBondContact CD-OH 3.38Å; K225-Y315 HydrophobicContact CG-CE1 4.44Å; K225-Y315 WeakPolarHBondContact CG-OH 3.32Å; K225-D333 IonicContact NZ-OD2 3.92Å
226	G	95	Very high	95.9	Very high	12 Å²	12	40 Å²	40	12%	0.124	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	112.7	176.7	0	0	0	0	0	112.7	Y255	G226-Y255 CarbonylContact C-O 3.54Å; G226-Y255 WeakPolarHBondContact CA-O 3.35Å
227	L	97.4	Very high	96.5	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	123.7	-177.7	-61.5	177.3	0	0	0	110.8	L224 K225 Y229 L237 Y255 Y257 I259 L267 L334	L224-L227 HydrophobicContact CD1-CD2 4.45Å; L224-L227 HydrophobicContact CD2-CD1 4.1Å; L224-L227 HydrophobicContact CD2-CD2 3.92Å; L224-L227 HydrophobicContact CD2-CG 4.22Å; L224-L227 HydrophobicContact CG-CD2 4.15Å; K225-L227 PolarHBondContact O-N 2.77Å; L227-Y229 HydrophobicContact CB-CD2 4.05Å; L227-Y229 HydrophobicContact CB-CE2 4.41Å; L227-Y229 HydrophobicContact CD2-CD2 3.9Å; L227-Y229 HydrophobicContact CD2-CE2 3.59Å; L227-L237 HydrophobicContact CD1-CD1 4.44Å; L227-Y255 WeakPolarHBondContact CB-O 3.27Å; L227-Y255 WeakPolarHBondContact CG-O 3.45Å; L227-Y255 PolarHBondContact N-O 3.47Å; L227-Y257 PolarHBondContact O-N 3.1Å; L227-I259 HydrophobicContact CB-CG2 3.62Å; L227-L267 HydrophobicContact CD1-CD1 4.26Å; L227-L267 HydrophobicContact CD1-CD2 4.38Å; L227-L334 HydrophobicContact CD2-CD2 4.39Å
228	D	96.6	Very high	96.8	Very high	25 Å²	25	28.9 Å²	28.9	13%	0.134	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	77.7	175.9	-166.9	54.3	0	0	0	108.4	Y257 N258 T297 I300	D228-Y257 HydrophobicContact CB-CD2 4.37Å; D228-N258 CarbonylContact C-O 3.57Å; D228-N258 VanDerWaalsContact CA-O 3.29Å; D228-N258 WeakPolarHBondContact CA-O 3.1Å; D228-N258 WeakPolarHBondContact OD1-CB 3.4Å; D228-N258 PolarHBondContact OD1-N 3.23Å; D228-T297 WeakPolarHBondContact OD2-CA 3.49Å; D228-I300 HydrophobicContact CB-CD1 4.47Å
229	Y	95.9	Very high	96.9	Very high	63 Å²	63	25.2 Å²	25.2	25%	0.247	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	82.5	-170.2	-68	-77.3	0	0	0	109.9	L227 E231 N233 N258 I259 H260 M263 L334	L227-Y229 HydrophobicContact CB-CD2 4.05Å; L227-Y229 HydrophobicContact CB-CE2 4.41Å; L227-Y229 HydrophobicContact CD2-CD2 3.9Å; L227-Y229 HydrophobicContact CD2-CE2 3.59Å; Y229-E231 WeakPolarHBondContact CD1-OE1 3.25Å; Y229-E231 PolarHBondContact O-N 3.14Å; Y229-N233 WeakPolarHBondContact CD1-ND2 3.47Å; Y229-N258 CarbonylContact C-O 3.56Å; Y229-N258 PolarHBondContact N-O 3.45Å; Y229-I259 CarbonylContact O-C 3.48Å; Y229-I259 VanDerWaalsContact O-CA 3.28Å; Y229-I259 WeakPolarHBondContact O-CA 3.24Å; Y229-H260 PolarHBondContact O-N 2.96Å; Y229-M263 HydrophobicContact CD2-CE 4.04Å; Y229-M263 HydrophobicContact CG-CE 4.26Å; Y229-M263 HydrophobicContact CG-SD 4.34Å; Y229-L334 HydrophobicContact CD2-CD2 4.35Å; Y229-L334 HydrophobicContact CE1-CD2 4.46Å; Y229-L334 HydrophobicContact CE2-CD2 3.78Å
230	P	95.4	Very high	97	Very high	56 Å²	56	24.9 Å²	24.9	36%	0.364	12%	0.122	S	C	.	.	S	Bend	trans	-63.1	-26.7	175.6	26.7	-35.2	0	0	0	112.8	T297	P230-T297 HydrophobicContact CG-CG2 4.15Å
231	E	95.5	Very high	97	Very high	98 Å²	98	24.9 Å²	24.9	46%	0.458	12%	0.122	S	C	.	.	S	Bend	trans	-80.8	158.9	171.5	72.6	-76.8	-179	0	0	113.2	Y229 N233 H260	Y229-E231 WeakPolarHBondContact CD1-OE1 3.25Å; Y229-E231 PolarHBondContact O-N 3.14Å; E231-N233 PolarHBondContact O-N 3.34Å; E231-N233 VanDerWaalsContact O-N 3.15Å; E231-N233 PolarHBondContact OE1-ND2 2.93Å; E231-H260 WeakPolarHBondContact O-CB 3.44Å
232	D	96.2	Very high	97	Very high	68 Å²	68	25.3 Å²	25.3	36%	0.364	12%	0.124	S	C	.	.			trans	-75.7	104.9	-178.5	-162.7	-5.4	0	0	0	112.5	S234 H260 N262	D232-S234 WeakPolarHBondContact OD1-CB 3.41Å; D232-S234 PolarHBondContact OD1-N 3.13Å; D232-S234 PolarHBondContact OD1-OG 2.76Å; D232-H260 WeakPolarHBondContact CB-ND1 3.46Å; D232-H260 VanDerWaalsContact CG-ND1 3.29Å; D232-H260 IonicContact OD1-ND1 2.74Å; D232-H260 IonicContact OD2-CE1 2.78Å; D232-H260 PolarHBondContact OD2-CE1 2.97Å; D232-H260 IonicContact OD2-ND1 3.84Å; D232-H260 PolarHBondContact OD2-ND1 3.36Å; D232-N262 WeakPolarHBondContact OD2-CB 3.44Å; D232-N262 PolarHBondContact OD2-ND2 3.24Å
233	N	95.8	Very high	97	Very high	22 Å²	22	25.5 Å²	25.5	12%	0.118	13%	0.126	C	C	.	.			trans	-113.4	26.2	168.7	-72.4	-55.1	0	0	0	112.1	Y229 E231 L235 R236 L237 M263	Y229-N233 WeakPolarHBondContact CD1-ND2 3.47Å; E231-N233 PolarHBondContact O-N 3.34Å; E231-N233 VanDerWaalsContact O-N 3.15Å; E231-N233 PolarHBondContact OE1-ND2 2.93Å; N233-L235 PolarHBondContact O-N 3.3Å; N233-R236 HydrophobicContact CB-CB 4.44Å; N233-R236 PolarHBondContact O-N 2.88Å; N233-L237 WeakPolarHBondContact O-CB 3.2Å; N233-L237 PolarHBondContact O-N 2.78Å; N233-M263 HydrophobicContact CB-CE 4.01Å; N233-M263 HydrophobicContact CB-SD 3.82Å
234	S	97.4	Very high	97	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.028	13%	0.125	C	C	.	.	H	α-helix	trans	-60.2	-41.9	-176.6	56.5	0	0	0	0	113.2	D232 L237 I238	D232-S234 WeakPolarHBondContact OD1-CB 3.41Å; D232-S234 PolarHBondContact OD1-N 3.13Å; D232-S234 PolarHBondContact OD1-OG 2.76Å; S234-L237 WeakPolarHBondContact O-CB 3.36Å; S234-L237 PolarHBondContact O-N 3.39Å; S234-I238 VanDerWaalsContact O-CG1 3.29Å; S234-I238 WeakPolarHBondContact O-CG1 2.96Å; S234-I238 PolarHBondContact O-N 2.92Å
235	L	97.2	Very high	97	Very high	28 Å²	28	27 Å²	27	15%	0.147	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-42.3	177	-58.7	-173.3	0	0	0	111.9	N233 L237 I238 E239 R389 F486 V490 L495	N233-L235 PolarHBondContact O-N 3.3Å; L235-L237 VanDerWaalsContact C-N 3.3Å; L235-L237 PolarHBondContact O-N 3.22Å; L235-I238 PolarHBondContact O-N 3.04Å; L235-E239 PolarHBondContact O-N 3.22Å; L235-R389 HydrophobicContact CD1-CG 4.46Å; L235-F486 HydrophobicContact CB-CE2 4.29Å; L235-F486 HydrophobicContact CB-CZ 4.25Å; L235-F486 HydrophobicContact CD2-CE2 4.44Å; L235-F486 HydrophobicContact CD2-CZ 4.06Å; L235-V490 HydrophobicContact CD2-CG1 4.36Å; L235-V490 HydrophobicContact CD2-CG2 3.77Å; L235-L495 HydrophobicContact CD2-CB 4.22Å
236	R	96	Very high	97.2	Very high	104 Å²	104	26.6 Å²	26.6	39%	0.392	13%	0.131	S	C	.	.	H	α-helix	trans	-60.5	-41.6	174.7	-65.9	-173.1	174.4	-164	-7.5	111.5	N233 W240	N233-R236 HydrophobicContact CB-CB 4.44Å; N233-R236 PolarHBondContact O-N 2.88Å; R236-W240 VanDerWaalsContact O-CB 3.23Å; R236-W240 WeakPolarHBondContact O-CB 3.24Å; R236-W240 PolarHBondContact O-N 3.37Å
237	L	98.1	Very high	97.4	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.2	-45.1	175.6	-178.2	67.2	0	0	0	112.5	L224 L227 N233 S234 L235 W240 M241 M263 A266 L267 L334	L224-L237 HydrophobicContact CD2-CD1 4.21Å; L227-L237 HydrophobicContact CD1-CD1 4.44Å; N233-L237 WeakPolarHBondContact O-CB 3.2Å; N233-L237 PolarHBondContact O-N 2.78Å; S234-L237 WeakPolarHBondContact O-CB 3.36Å; S234-L237 PolarHBondContact O-N 3.39Å; L235-L237 VanDerWaalsContact C-N 3.3Å; L235-L237 PolarHBondContact O-N 3.22Å; L237-W240 PolarHBondContact O-N 2.96Å; L237-M241 HydrophobicContact CD1-CE 3.79Å; L237-M241 HydrophobicContact CD1-CG 4.32Å; L237-M241 HydrophobicContact CG-CE 4.4Å; L237-M241 HydrophobicContact CG-CG 4.42Å; L237-M241 WeakPolarHBondContact O-CB 3.42Å; L237-M241 WeakPolarHBondContact O-CG 3.31Å; L237-M241 PolarHBondContact O-N 2.86Å; L237-M263 HydrophobicContact CB-CE 4.32Å; L237-M263 HydrophobicContact CD2-CB 4.27Å; L237-M263 HydrophobicContact CD2-CE 4.11Å; L237-A266 HydrophobicContact CD2-CB 4.15Å; L237-L267 HydrophobicContact CD1-CD2 4.48Å; L237-L267 HydrophobicContact CD2-CD2 3.77Å; L237-L267 HydrophobicContact CD2-CG 3.98Å; L237-L334 HydrophobicContact CB-CD1 4.26Å; L237-L334 HydrophobicContact CD1-CD1 3.66Å
238	I	98.5	Very high	97.4	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.2	-46	179.3	-66.8	163.3	0	0	0	110.5	S234 L235 W240 M241 E242 A266 F486 V489 V490 L493 L495	S234-I238 VanDerWaalsContact O-CG1 3.29Å; S234-I238 WeakPolarHBondContact O-CG1 2.96Å; S234-I238 PolarHBondContact O-N 2.92Å; L235-I238 PolarHBondContact O-N 3.04Å; I238-W240 VanDerWaalsContact C-N 3.35Å; I238-W240 PolarHBondContact O-N 2.71Å; I238-M241 PolarHBondContact O-N 2.88Å; I238-E242 HydrophobicContact CG2-CG 4.45Å; I238-E242 WeakPolarHBondContact O-CG 3.44Å; I238-E242 PolarHBondContact O-N 3.21Å; I238-A266 HydrophobicContact CD1-CB 4.25Å; I238-A266 HydrophobicContact CG1-CB 3.99Å; I238-F486 HydrophobicContact CB-CD2 4.16Å; I238-F486 HydrophobicContact CB-CE2 4.24Å; I238-F486 HydrophobicContact CG2-CD2 3.64Å; I238-F486 HydrophobicContact CG2-CE2 4.14Å; I238-F486 HydrophobicContact CG2-CG 4.42Å; I238-V489 HydrophobicContact CD1-CG1 4Å; I238-V489 HydrophobicContact CG1-CG1 4.06Å; I238-V489 HydrophobicContact CG2-CB 3.82Å; I238-V489 HydrophobicContact CG2-CG1 3.85Å; I238-V489 HydrophobicContact CG2-CG2 4.47Å; I238-V490 HydrophobicContact CD1-CG2 4.08Å; I238-V490 HydrophobicContact CG2-CG2 4.41Å; I238-L493 HydrophobicContact CD1-CD1 4.21Å; I238-L495 HydrophobicContact CD1-CD1 3.66Å
239	E	98	Very high	97.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-58.4	-48	176.3	-177.1	-179.9	-151.1	0	0	111.1	L235 M241 E242 A243 L390 H391 M392 S393 L482 F486	L235-E239 PolarHBondContact O-N 3.22Å; E239-M241 PolarHBondContact O-N 2.92Å; E239-E242 PolarHBondContact O-N 2.96Å; E239-A243 WeakPolarHBondContact O-CB 3.14Å; E239-A243 PolarHBondContact O-N 3.29Å; E239-L390 HydrophobicContact CB-CD2 4.31Å; E239-L390 HydrophobicContact CG-CD2 3.87Å; E239-L390 WeakPolarHBondContact OE1-CA 3.47Å; E239-H391 PolarHBondContact OE1-N 3.14Å; E239-H391 WeakPolarHBondContact OE2-CA 3.2Å; E239-H391 PolarHBondContact OE2-N 2.89Å; E239-M392 VanDerWaalsContact CD-N 3.26Å; E239-M392 HydrophobicContact CG-CB 4.37Å; E239-M392 PolarHBondContact OE1-N 3.48Å; E239-M392 VanDerWaalsContact OE1-N 3.07Å; E239-M392 PolarHBondContact OE2-N 3.16Å; E239-S393 WeakPolarHBondContact OE1-CB 3.21Å; E239-S393 PolarHBondContact OE1-N 3.37Å; E239-L482 HydrophobicContact CG-CD1 4.4Å; E239-L482 HydrophobicContact CG-CD2 4.21Å; E239-F486 HydrophobicContact CB-CD2 4.08Å; E239-F486 HydrophobicContact CB-CE2 4.26Å
240	W	98.1	Very high	97.6	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.5	-44.2	178.9	-179.4	92.9	0	0	0	112.5	V222 L224 R236 L237 I238 A243 N244 I252 V332 D333 L334 E336 M392	V222-W240 HydrophobicContact CG1-CH2 3.63Å; V222-W240 HydrophobicContact CG1-CZ2 3.9Å; L224-W240 HydrophobicContact CB-CH2 3.84Å; L224-W240 HydrophobicContact CB-CZ2 4.49Å; L224-W240 HydrophobicContact CB-CZ3 4.38Å; L224-W240 HydrophobicContact CD1-CH2 3.88Å; L224-W240 HydrophobicContact CD1-CZ2 3.82Å; L224-W240 HydrophobicContact CD1-CZ3 4.37Å; L224-W240 HydrophobicContact CD2-CE3 4.36Å; L224-W240 HydrophobicContact CD2-CH2 4.03Å; L224-W240 HydrophobicContact CD2-CZ3 3.82Å; L224-W240 HydrophobicContact CG-CH2 4.13Å; L224-W240 HydrophobicContact CG-CZ3 4.43Å; R236-W240 VanDerWaalsContact O-CB 3.23Å; R236-W240 WeakPolarHBondContact O-CB 3.24Å; R236-W240 PolarHBondContact O-N 3.37Å; L237-W240 PolarHBondContact O-N 2.96Å; I238-W240 VanDerWaalsContact C-N 3.35Å; I238-W240 PolarHBondContact O-N 2.71Å; W240-A243 PolarHBondContact O-N 2.68Å; W240-N244 VanDerWaalsContact CD2-ND2 3.33Å; W240-N244 PolarHBondContact NE1-ND2 3.29Å; W240-N244 PolarHBondContact O-N 3.07Å; W240-N244 PolarHBondContact O-ND2 3.25Å; W240-I252 HydrophobicContact CH2-CG2 3.93Å; W240-I252 HydrophobicContact CZ3-CD1 4.05Å; W240-I252 HydrophobicContact CZ3-CG2 3.76Å; W240-V332 HydrophobicContact CZ2-CB 4.48Å; W240-V332 HydrophobicContact CZ2-CG2 3.71Å; W240-D333 PolarHBondContact NE1-O 2.88Å; W240-L334 HydrophobicContact CB-CD1 4.01Å; W240-L334 HydrophobicContact CD2-CD1 4.24Å; W240-L334 HydrophobicContact CG-CD1 4.01Å; W240-E336 PolarHBondContact NE1-O 3.18Å; W240-M392 HydrophobicContact CB-CE 4.24Å; W240-M392 HydrophobicContact CG-CE 4.32Å
241	M	98.5	Very high	97.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.7	-53.5	178.4	-74.1	-72.5	-173.3	0	0	110.9	L224 L237 I238 E239 A243 N244 Y245 I252 L267 Y270 F278	L224-M241 HydrophobicContact CD2-CE 4.45Å; L237-M241 HydrophobicContact CD1-CE 3.79Å; L237-M241 HydrophobicContact CD1-CG 4.32Å; L237-M241 HydrophobicContact CG-CE 4.4Å; L237-M241 HydrophobicContact CG-CG 4.42Å; L237-M241 WeakPolarHBondContact O-CB 3.42Å; L237-M241 WeakPolarHBondContact O-CG 3.31Å; L237-M241 PolarHBondContact O-N 2.86Å; I238-M241 PolarHBondContact O-N 2.88Å; E239-M241 PolarHBondContact O-N 2.92Å; M241-A243 VanDerWaalsContact C-N 3.32Å; M241-A243 PolarHBondContact O-N 2.78Å; M241-N244 PolarHBondContact O-N 2.83Å; M241-Y245 HydrophobicContact CB-CE2 4.4Å; M241-Y245 WeakPolarHBondContact O-CD2 3.28Å; M241-Y245 PolarHBondContact O-N 2.99Å; M241-I252 HydrophobicContact CE-CG2 4.23Å; M241-I252 HydrophobicContact SD-CB 4.29Å; M241-I252 HydrophobicContact SD-CD1 3.56Å; M241-I252 VanDerWaalsContact SD-CD1 3.56Å; M241-I252 HydrophobicContact SD-CG2 3.83Å; M241-L267 HydrophobicContact CE-CD2 3.92Å; M241-Y270 HydrophobicContact CB-CD2 4.5Å; M241-Y270 HydrophobicContact CB-CE1 4.09Å; M241-Y270 HydrophobicContact CB-CE2 3.76Å; M241-Y270 WeakPolarHBondContact CB-OH 3.18Å; M241-Y270 HydrophobicContact CG-CD2 4.11Å; M241-Y270 HydrophobicContact CG-CE2 3.69Å; M241-F278 HydrophobicContact CE-CD2 4.09Å; M241-F278 HydrophobicContact CE-CE2 3.31Å; M241-F278 HydrophobicContact CE-CZ 3.82Å; M241-F278 HydrophobicContact SD-CD2 4.27Å; M241-F278 HydrophobicContact SD-CE2 4.06Å
242	E	98.4	Very high	97.9	Very high	9 Å²	9	18.4 Å²	18.4	4%	0.042	9%	0.094	C	C	.	.	H	α-helix	trans	-64	-38.6	-178.3	-65.3	-57.9	159.3	0	0	111.6	I238 E239 Y245 I246 Y270 L482 R485 V489	I238-E242 HydrophobicContact CG2-CG 4.45Å; I238-E242 WeakPolarHBondContact O-CG 3.44Å; I238-E242 PolarHBondContact O-N 3.21Å; E239-E242 PolarHBondContact O-N 2.96Å; E242-Y245 PolarHBondContact O-N 3.43Å; E242-I246 VanDerWaalsContact O-CG1 3.24Å; E242-I246 WeakPolarHBondContact O-CG1 3.42Å; E242-I246 PolarHBondContact O-N 3.33Å; E242-Y270 WeakPolarHBondContact CG-OH 3.19Å; E242-Y270 VanDerWaalsContact OE1-CE1 3.27Å; E242-Y270 WeakPolarHBondContact OE1-CE1 3.18Å; E242-Y270 PolarHBondContact OE1-OH 2.98Å; E242-L482 HydrophobicContact CB-CD1 3.81Å; E242-R485 HydrophobicContact CB-CB 4.17Å; E242-R485 HydrophobicContact CG-CB 3.98Å; E242-R485 WeakPolarHBondContact OE2-CB 3.42Å; E242-R485 IonicContact OE2-CZ 3.97Å; E242-R485 IonicContact OE2-NE 2.88Å; E242-R485 PolarHBondContact OE2-NE 3.29Å; E242-R485 IonicContact OE2-NH2 3.71Å; E242-R485 PolarHBondContact OE2-NH2 2.86Å; E242-V489 WeakPolarHBondContact OE1-CG2 3.2Å
243	A	98.3	Very high	98	Very high	4 Å²	4	15.1 Å²	15.1	3%	0.033	8%	0.076	C	C	.	.	H	α-helix	trans	-62	-47.2	175.5	0	0	0	0	0	111.9	E239 W240 M241 Y245 I246 L247 L337 L482	E239-A243 WeakPolarHBondContact O-CB 3.14Å; E239-A243 PolarHBondContact O-N 3.29Å; W240-A243 PolarHBondContact O-N 2.68Å; M241-A243 VanDerWaalsContact C-N 3.32Å; M241-A243 PolarHBondContact O-N 2.78Å; A243-Y245 VanDerWaalsContact C-N 3.33Å; A243-Y245 PolarHBondContact O-N 3.04Å; A243-I246 PolarHBondContact O-N 3.5Å; A243-L247 WeakPolarHBondContact O-CB 3.31Å; A243-L247 WeakPolarHBondContact O-CD1 3.45Å; A243-L247 WeakPolarHBondContact O-CG 3.5Å; A243-L247 PolarHBondContact O-N 3.21Å; A243-L337 HydrophobicContact CB-CD1 3.86Å; A243-L337 HydrophobicContact CB-CD2 3.85Å; A243-L482 HydrophobicContact CB-CD1 4.02Å; A243-L482 HydrophobicContact CB-CD2 4.37Å
244	N	98.7	Very high	98.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.2	-41.4	177	-82.7	-88.7	0	0	0	111.7	W240 M241 L247 G248 A249 I252 W346	W240-N244 VanDerWaalsContact CD2-ND2 3.33Å; W240-N244 PolarHBondContact NE1-ND2 3.29Å; W240-N244 PolarHBondContact O-N 3.07Å; W240-N244 PolarHBondContact O-ND2 3.25Å; M241-N244 PolarHBondContact O-N 2.83Å; N244-L247 PolarHBondContact O-N 3.41Å; N244-G248 PolarHBondContact O-N 3.41Å; N244-A249 HydrophobicContact CB-CB 4.1Å; N244-A249 WeakPolarHBondContact O-CB 3.34Å; N244-A249 PolarHBondContact O-N 3.36Å; N244-I252 HydrophobicContact CB-CD1 3.88Å; N244-W346 HydrophobicContact CB-CH2 4.27Å; N244-W346 VanDerWaalsContact OD1-CH2 3.31Å; N244-W346 WeakPolarHBondContact OD1-CH2 3.24Å
245	Y	98.5	Very high	98.1	Very high	34 Å²	34	13.9 Å²	13.9	13%	0.133	7%	0.07	C	C	.	.	H	α-helix	trans	-64.4	-39.3	175.3	-71.7	-54.7	0	0	0	113	M241 E242 A243 L247 G248 A249 I252 Y270 T277 R485	M241-Y245 HydrophobicContact CB-CE2 4.4Å; M241-Y245 WeakPolarHBondContact O-CD2 3.28Å; M241-Y245 PolarHBondContact O-N 2.99Å; E242-Y245 PolarHBondContact O-N 3.43Å; A243-Y245 VanDerWaalsContact C-N 3.33Å; A243-Y245 PolarHBondContact O-N 3.04Å; Y245-L247 VanDerWaalsContact C-N 3.3Å; Y245-G248 PolarHBondContact O-N 3.49Å; Y245-A249 HydrophobicContact CD1-CB 4.3Å; Y245-A249 WeakPolarHBondContact CD1-O 3.18Å; Y245-I252 HydrophobicContact CD1-CD1 4.33Å; Y245-I252 HydrophobicContact CD2-CD1 4.25Å; Y245-I252 HydrophobicContact CE1-CD1 3.91Å; Y245-I252 HydrophobicContact CE1-CG1 3.88Å; Y245-I252 HydrophobicContact CE2-CD1 3.82Å; Y245-I252 HydrophobicContact CG-CD1 4.47Å; Y245-Y270 HydrophobicContact CE2-CD1 4.04Å; Y245-Y270 AromaticContact CE2-CE1 3.97Å; Y245-Y270 HydrophobicContact CE2-CE1 3.97Å; Y245-T277 PolarHBondContact OH-O 3.17Å; Y245-R485 VanDerWaalsContact CB-NH2 3.32Å
246	I	98.2	Very high	98	Very high	28 Å²	28	12.7 Å²	12.7	14%	0.144	6%	0.064	C	C	.	.	H	α-helix	trans	-62.7	-40.6	175.4	-69.5	164.4	0	0	0	110.6	E242 A243 G248 F478 D481 L482	E242-I246 VanDerWaalsContact O-CG1 3.24Å; E242-I246 WeakPolarHBondContact O-CG1 3.42Å; E242-I246 PolarHBondContact O-N 3.33Å; A243-I246 PolarHBondContact O-N 3.5Å; I246-G248 PolarHBondContact O-N 2.91Å; I246-F478 HydrophobicContact CG2-CB 3.97Å; I246-F478 HydrophobicContact CG2-CD1 3.74Å; I246-F478 HydrophobicContact CG2-CG 4.16Å; I246-D481 HydrophobicContact CD1-CB 4.13Å; I246-L482 VanDerWaalsContact CD1-CA 3.46Å; I246-L482 HydrophobicContact CD1-CB 3.79Å; I246-L482 HydrophobicContact CD1-CD1 4.19Å
247	L	98.4	Very high	98	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-78.6	-5	-176	-63.2	167.2	0	0	0	113.9	A243 N244 Y245 L337 V338 N345 W346 F478	A243-L247 WeakPolarHBondContact O-CB 3.31Å; A243-L247 WeakPolarHBondContact O-CD1 3.45Å; A243-L247 WeakPolarHBondContact O-CG 3.5Å; A243-L247 PolarHBondContact O-N 3.21Å; N244-L247 PolarHBondContact O-N 3.41Å; Y245-L247 VanDerWaalsContact C-N 3.3Å; L247-L337 HydrophobicContact CD1-CD1 3.54Å; L247-L337 HydrophobicContact CD1-CD2 3.9Å; L247-L337 HydrophobicContact CD1-CG 3.61Å; L247-V338 WeakPolarHBondContact CD1-O 3.35Å; L247-N345 CarbonylContact O-C 3.5Å; L247-N345 VanDerWaalsContact O-CA 3.24Å; L247-N345 WeakPolarHBondContact O-CA 3.44Å; L247-N345 WeakPolarHBondContact O-CB 3.48Å; L247-W346 HydrophobicContact CB-CD2 4.48Å; L247-W346 HydrophobicContact CB-CZ2 3.84Å; L247-W346 VanDerWaalsContact O-CG 3.31Å; L247-W346 PolarHBondContact O-N 3Å; L247-F478 HydrophobicContact CD2-CD1 4.32Å; L247-F478 HydrophobicContact CD2-CD2 3.91Å; L247-F478 HydrophobicContact CD2-CE1 4.21Å; L247-F478 HydrophobicContact CD2-CE2 3.78Å; L247-F478 HydrophobicContact CD2-CG 4.18Å; L247-F478 HydrophobicContact CD2-CZ 3.94Å
248	G	98.1	Very high	97.9	Very high	21 Å²	21	10.7 Å²	10.7	22%	0.216	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	113.9	19.7	171.3	0	0	0	0	0	115.7	N244 Y245 I246 D250	N244-G248 PolarHBondContact O-N 3.41Å; Y245-G248 PolarHBondContact O-N 3.49Å; I246-G248 PolarHBondContact O-N 2.91Å; G248-D250 PolarHBondContact O-N 2.93Å
249	A	98.6	Very high	97.8	Very high	9 Å²	9	11.7 Å²	11.7	7%	0.074	6%	0.064	C	C	.	.			trans	-65.1	122	167.8	0	0	0	0	0	110.5	V222 N244 Y245 I252 W346	V222-A249 HydrophobicContact CG2-CB 3.59Å; N244-A249 HydrophobicContact CB-CB 4.1Å; N244-A249 WeakPolarHBondContact O-CB 3.34Å; N244-A249 PolarHBondContact O-N 3.36Å; Y245-A249 HydrophobicContact CD1-CB 4.3Å; Y245-A249 WeakPolarHBondContact CD1-O 3.18Å; A249-I252 HydrophobicContact CB-CG1 4.14Å; A249-W346 HydrophobicContact CB-CH2 4.08Å; A249-W346 HydrophobicContact CB-CZ3 3.72Å
250	D	97.8	Very high	97.9	Very high	38 Å²	38	14.1 Å²	14.1	20%	0.203	8%	0.075	C	C	.	.	S	Bend	trans	-78.3	-44.6	173.8	-89.7	-68.7	0	0	0	111.4	R218 H219 T220 G248	R218-D250 HydrophobicContact CB-CB 3.94Å; R218-D250 IonicContact CZ-OD1 3.92Å; R218-D250 IonicContact NE-OD1 3.3Å; R218-D250 PolarHBondContact NE-OD1 3.33Å; R218-D250 PolarHBondContact NH1-O 2.86Å; R218-D250 VanDerWaalsContact NH2-C 3.25Å; R218-D250 VanDerWaalsContact NH2-CA 3.31Å; R218-D250 PolarHBondContact NH2-O 2.88Å; R218-D250 IonicContact NH2-OD1 3.99Å; R218-D250 PolarHBondContact NH2-OD1 3.41Å; H219-D250 VanDerWaalsContact CA-OD2 3.31Å; H219-D250 WeakPolarHBondContact CA-OD2 3.23Å; H219-D250 WeakPolarHBondContact CB-OD2 3.39Å; H219-D250 PolarHBondContact N-OD2 2.94Å; T220-D250 PolarHBondContact N-OD2 3.38Å; T220-D250 WeakPolarHBondContact O-CB 3.27Å; T220-D250 PolarHBondContact O-N 2.83Å; G248-D250 PolarHBondContact O-N 2.93Å
251	K	98.1	Very high	97.9	Very high	15 Å²	15	18.1 Å²	18.1	7%	0.065	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142.2	177.6	178.9	163.7	173	164.8	0	109.8	V221 V222 N275 T277 E279	V221-K251 CarbonylContact C-O 3.52Å; V221-K251 WeakPolarHBondContact CA-O 3.45Å; V221-K251 HydrophobicContact CG2-CB 4.28Å; V221-K251 HydrophobicContact CG2-CG 4.39Å; V222-K251 PolarHBondContact N-O 3.07Å; K251-N275 WeakPolarHBondContact CE-O 3.42Å; K251-N275 PolarHBondContact NZ-O 3.2Å; K251-N275 PolarHBondContact NZ-OD1 3.38Å; K251-T277 CarbonylContact C-O 3.57Å; K251-T277 WeakPolarHBondContact CA-O 3.24Å; K251-E279 IonicContact NZ-OE2 3.98Å; K251-E279 PolarHBondContact NZ-OE2 2.85Å
252	I	98.7	Very high	97.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130	167.9	-56.9	179	0	0	0	108.2	V222 W240 M241 N244 Y245 A249 T277 F278 E279	V222-I252 HydrophobicContact CB-CG1 4.09Å; V222-I252 WeakPolarHBondContact O-CA 3.49Å; W240-I252 HydrophobicContact CH2-CG2 3.93Å; W240-I252 HydrophobicContact CZ3-CD1 4.05Å; W240-I252 HydrophobicContact CZ3-CG2 3.76Å; M241-I252 HydrophobicContact CE-CG2 4.23Å; M241-I252 HydrophobicContact SD-CB 4.29Å; M241-I252 HydrophobicContact SD-CD1 3.56Å; M241-I252 VanDerWaalsContact SD-CD1 3.56Å; M241-I252 HydrophobicContact SD-CG2 3.83Å; N244-I252 HydrophobicContact CB-CD1 3.88Å; Y245-I252 HydrophobicContact CD1-CD1 4.33Å; Y245-I252 HydrophobicContact CD2-CD1 4.25Å; Y245-I252 HydrophobicContact CE1-CD1 3.91Å; Y245-I252 HydrophobicContact CE1-CG1 3.88Å; Y245-I252 HydrophobicContact CE2-CD1 3.82Å; Y245-I252 HydrophobicContact CG-CD1 4.47Å; A249-I252 HydrophobicContact CB-CG1 4.14Å; I252-T277 PolarHBondContact N-O 3.06Å; I252-F278 HydrophobicContact CB-CD2 3.97Å; I252-F278 HydrophobicContact CB-CE2 4.43Å; I252-F278 HydrophobicContact CG2-CD2 4.16Å; I252-F278 HydrophobicContact CG2-CE2 4.11Å; I252-F278 WeakPolarHBondContact O-CA 3.47Å; I252-F278 VanDerWaalsContact O-CD2 3.28Å; I252-F278 WeakPolarHBondContact O-CD2 3.15Å; I252-E279 PolarHBondContact O-N 3.48Å; I252-E279 VanDerWaalsContact O-N 3.08Å
253	L	98.1	Very high	97.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.9	170.8	-172	68.8	0	0	0	108.9	V222 L224 Y255 E279 I281 C318	V222-L253 PolarHBondContact O-N 2.66Å; L224-L253 PolarHBondContact N-O 3.09Å; L253-Y255 HydrophobicContact CD2-CE2 3.64Å; L253-Y255 WeakPolarHBondContact CD2-OH 2.96Å; L253-Y255 HydrophobicContact CG-CE2 3.85Å; L253-E279 WeakPolarHBondContact CA-O 3.48Å; L253-E279 HydrophobicContact CD1-CB 3.48Å; L253-E279 VanDerWaalsContact CD1-CB 3.48Å; L253-E279 HydrophobicContact CD1-CG 3.59Å; L253-I281 HydrophobicContact CD1-CD1 3.68Å; L253-I281 HydrophobicContact CD1-CG1 4.24Å; L253-I281 HydrophobicContact CD2-CD1 4.31Å; L253-I281 HydrophobicContact CG-CD1 4.3Å; L253-C318 HydrophobicContact CD2-CB 3.7Å
254	A	98.1	Very high	97.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.7	178.7	0	0	0	0	0	111.3	L224 L267 F278 E279 H280 I281	L224-A254 HydrophobicContact CB-CB 4.3Å; L224-A254 HydrophobicContact CD2-CB 3.98Å; A254-L267 HydrophobicContact CB-CD2 4.24Å; A254-F278 HydrophobicContact CB-CE2 3.8Å; A254-F278 HydrophobicContact CB-CZ 3.81Å; A254-E279 PolarHBondContact N-O 3.45Å; A254-H280 CarbonylContact O-C 3.29Å; A254-H280 WeakPolarHBondContact O-CA 3.32Å; A254-I281 PolarHBondContact O-N 2.9Å
255	Y	97.2	Very high	97.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	145.7	172	-61	-93.6	0	0	0	109.7	G226 L227 L253 I281 I283 P314 D317 C318	G226-Y255 CarbonylContact C-O 3.54Å; G226-Y255 WeakPolarHBondContact CA-O 3.35Å; L227-Y255 WeakPolarHBondContact CB-O 3.27Å; L227-Y255 WeakPolarHBondContact CG-O 3.45Å; L227-Y255 PolarHBondContact N-O 3.47Å; L253-Y255 HydrophobicContact CD2-CE2 3.64Å; L253-Y255 WeakPolarHBondContact CD2-OH 2.96Å; L253-Y255 HydrophobicContact CG-CE2 3.85Å; Y255-I281 CarbonylContact C-O 3.58Å; Y255-I281 WeakPolarHBondContact CA-O 2.94Å; Y255-I281 HydrophobicContact CD1-CB 3.8Å; Y255-I281 HydrophobicContact CD1-CD1 4.27Å; Y255-I281 HydrophobicContact CD1-CG2 3.97Å; Y255-I281 HydrophobicContact CE1-CB 4.05Å; Y255-I281 HydrophobicContact CE1-CD1 3.64Å; Y255-I281 HydrophobicContact CE1-CG1 4.44Å; Y255-I281 HydrophobicContact CE1-CG2 4.17Å; Y255-I283 HydrophobicContact CD1-CD1 4.3Å; Y255-I283 HydrophobicContact CD1-CG2 3.78Å; Y255-I283 HydrophobicContact CE1-CG2 4.49Å; Y255-I283 HydrophobicContact CG-CD1 4.46Å; Y255-P314 HydrophobicContact CD1-CB 3.77Å; Y255-P314 HydrophobicContact CD2-CB 3.42Å; Y255-P314 VanDerWaalsContact CD2-CB 3.42Å; Y255-P314 HydrophobicContact CE1-CB 3.95Å; Y255-P314 HydrophobicContact CE2-CB 3.62Å; Y255-P314 WeakPolarHBondContact CE2-O 3.04Å; Y255-P314 HydrophobicContact CG-CB 3.48Å; Y255-P314 VanDerWaalsContact CG-CB 3.48Å; Y255-P314 PolarHBondContact OH-O 3.39Å; Y255-D317 WeakPolarHBondContact OH-CB 3.28Å; Y255-D317 PolarHBondContact OH-OD2 3.01Å; Y255-C318 HydrophobicContact CE2-CB 4.19Å; Y255-C318 PolarHBondContact OH-N 2.65Å; Y255-C318 VanDerWaalsContact OH-N 3.09Å
256	S	96.5	Very high	97.8	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	147.8	175.2	71.1	0	0	0	0	113.1	H280 I281 I283	S256-H280 WeakPolarHBondContact CB-NE2 3.41Å; S256-H280 PolarHBondContact OG-NE2 2.97Å; S256-I281 PolarHBondContact N-O 2.78Å; S256-I283 WeakPolarHBondContact O-CG1 3.41Å; S256-I283 PolarHBondContact O-N 3.36Å
257	Y	95.4	Very high	97.8	Very high	28 Å²	28	23.8 Å²	23.8	11%	0.11	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-88.2	165.5	-63.3	-69.8	0	0	0	108.7	L227 D228 I283 L285 R296 I300	L227-Y257 PolarHBondContact O-N 3.1Å; D228-Y257 HydrophobicContact CB-CD2 4.37Å; Y257-I283 HydrophobicContact CD1-CD1 4.39Å; Y257-I283 HydrophobicContact CD1-CG1 3.91Å; Y257-I283 HydrophobicContact CE1-CB 4.49Å; Y257-I283 HydrophobicContact CE1-CD1 3.6Å; Y257-I283 HydrophobicContact CE1-CG1 3.54Å; Y257-I283 HydrophobicContact CE2-CD1 4.12Å; Y257-I283 VanDerWaalsContact CZ-CD1 3.45Å; Y257-I283 WeakPolarHBondContact OH-CD1 3.41Å; Y257-L285 HydrophobicContact CD1-CD2 4.32Å; Y257-L285 HydrophobicContact CE1-CD2 3.6Å; Y257-L285 HydrophobicContact CE1-CG 4.34Å; Y257-R296 PolarHBondContact O-NH2 3.23Å; Y257-I300 HydrophobicContact CD2-CD1 3.95Å; Y257-I300 HydrophobicContact CE2-CD1 4.3Å; Y257-I300 HydrophobicContact CG-CD1 4.06Å
258	N	95.6	Very high	97.8	Very high	34 Å²	34	27.7 Å²	27.7	18%	0.182	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	120.9	178.8	-178	30.2	0	0	0	109.4	D228 Y229 P293 T297	D228-N258 CarbonylContact C-O 3.57Å; D228-N258 VanDerWaalsContact CA-O 3.29Å; D228-N258 WeakPolarHBondContact CA-O 3.1Å; D228-N258 WeakPolarHBondContact OD1-CB 3.4Å; D228-N258 PolarHBondContact OD1-N 3.23Å; Y229-N258 CarbonylContact C-O 3.56Å; Y229-N258 PolarHBondContact N-O 3.45Å; N258-P293 HydrophobicContact CB-CB 4.28Å; N258-T297 PolarHBondContact ND2-OG1 2.84Å
259	I	97.4	Very high	97.8	Very high	21 Å²	21	27.9 Å²	27.9	11%	0.108	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	149.4	-178	56.7	172.5	0	0	0	111.5	L227 Y229 M263 Q264 L267	L227-I259 HydrophobicContact CB-CG2 3.62Å; Y229-I259 CarbonylContact O-C 3.48Å; Y229-I259 VanDerWaalsContact O-CA 3.28Å; Y229-I259 WeakPolarHBondContact O-CA 3.24Å; I259-M263 HydrophobicContact CB-CB 4.28Å; I259-M263 HydrophobicContact CD1-CB 4.43Å; I259-Q264 HydrophobicContact CD1-CB 4.19Å; I259-L267 HydrophobicContact CD1-CD1 3.3Å
260	H	98.2	Very high	97.8	Very high	51 Å²	51	27.5 Å²	27.5	24%	0.236	14%	0.139	C	C	.	.			trans	-59.7	145.1	175.4	-172.8	-100.3	0	0	0	112	Y229 E231 D232 N262 M263 Q264	Y229-H260 PolarHBondContact O-N 2.96Å; E231-H260 WeakPolarHBondContact O-CB 3.44Å; D232-H260 WeakPolarHBondContact CB-ND1 3.46Å; D232-H260 VanDerWaalsContact CG-ND1 3.29Å; D232-H260 IonicContact OD1-ND1 2.74Å; D232-H260 IonicContact OD2-CE1 2.78Å; D232-H260 PolarHBondContact OD2-CE1 2.97Å; D232-H260 IonicContact OD2-ND1 3.84Å; D232-H260 PolarHBondContact OD2-ND1 3.36Å; H260-N262 VanDerWaalsContact C-N 3.26Å; H260-N262 PolarHBondContact ND1-N 2.81Å; H260-N262 PolarHBondContact O-N 3.43Å; H260-N262 VanDerWaalsContact O-N 3.16Å; H260-M263 HydrophobicContact CB-CG 4.28Å; H260-M263 HydrophobicContact CB-SD 4.48Å; H260-M263 WeakPolarHBondContact O-CA 3.38Å; H260-M263 WeakPolarHBondContact O-CB 3.32Å; H260-M263 PolarHBondContact O-N 2.95Å; H260-Q264 PolarHBondContact O-N 3.48Å; H260-Q264 VanDerWaalsContact O-N 3.07Å
261	P	98.1	Very high	97.8	Very high	85 Å²	85	27.9 Å²	27.9	55%	0.552	14%	0.144	S	C	*	.	H	α-helix	trans	-54.7	-35.3	-179	-30.3	37.1	0	0	0	115	M263 Q264 K265	P261-M263 VanDerWaalsContact C-N 3.32Å; P261-M263 PolarHBondContact O-N 3.47Å; P261-Q264 WeakPolarHBondContact O-CB 3.31Å; P261-Q264 PolarHBondContact O-N 2.94Å; P261-K265 WeakPolarHBondContact O-CG 3.34Å; P261-K265 PolarHBondContact O-N 2.81Å
262	N	98.5	Very high	97.8	Very high	35 Å²	35	31.5 Å²	31.5	19%	0.187	17%	0.172	C	C	.	.	H	α-helix	trans	-69.3	-30.6	176.2	-70.5	-19.2	0	0	0	112.7	D232 H260 K265 A266 L495	D232-N262 WeakPolarHBondContact OD2-CB 3.44Å; D232-N262 PolarHBondContact OD2-ND2 3.24Å; H260-N262 VanDerWaalsContact C-N 3.26Å; H260-N262 PolarHBondContact ND1-N 2.81Å; H260-N262 PolarHBondContact O-N 3.43Å; H260-N262 VanDerWaalsContact O-N 3.16Å; N262-K265 PolarHBondContact OD1-NZ 2.74Å; N262-A266 PolarHBondContact O-N 3.28Å; N262-A266 VanDerWaalsContact O-N 3.15Å; N262-L495 HydrophobicContact CB-CD2 3.65Å; N262-L495 VanDerWaalsContact CG-CD2 3.41Å
263	M	98.5	Very high	97.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.8	-41.3	170.8	-63.4	-176.8	75.3	0	0	110.7	Y229 N233 L237 I259 H260 P261 K265 A266 L267 L334	Y229-M263 HydrophobicContact CD2-CE 4.04Å; Y229-M263 HydrophobicContact CG-CE 4.26Å; Y229-M263 HydrophobicContact CG-SD 4.34Å; N233-M263 HydrophobicContact CB-CE 4.01Å; N233-M263 HydrophobicContact CB-SD 3.82Å; L237-M263 HydrophobicContact CB-CE 4.32Å; L237-M263 HydrophobicContact CD2-CB 4.27Å; L237-M263 HydrophobicContact CD2-CE 4.11Å; I259-M263 HydrophobicContact CB-CB 4.28Å; I259-M263 HydrophobicContact CD1-CB 4.43Å; H260-M263 HydrophobicContact CB-CG 4.28Å; H260-M263 HydrophobicContact CB-SD 4.48Å; H260-M263 WeakPolarHBondContact O-CA 3.38Å; H260-M263 WeakPolarHBondContact O-CB 3.32Å; H260-M263 PolarHBondContact O-N 2.95Å; P261-M263 VanDerWaalsContact C-N 3.32Å; P261-M263 PolarHBondContact O-N 3.47Å; M263-K265 PolarHBondContact O-N 3.49Å; M263-A266 WeakPolarHBondContact O-CB 3.22Å; M263-A266 PolarHBondContact O-N 3.14Å; M263-A266 VanDerWaalsContact O-N 3.15Å; M263-L267 WeakPolarHBondContact O-CG 3.33Å; M263-L267 PolarHBondContact O-N 2.95Å; M263-L334 HydrophobicContact CE-CD2 4.32Å
264	Q	98.2	Very high	97.5	Very high	58 Å²	58	36.3 Å²	36.3	27%	0.271	20%	0.201	S	C	.	.	H	α-helix	trans	-59.1	-45.9	174.4	-173.6	63.1	63.5	0	0	111.2	I259 H260 P261 A266 L267 D268	I259-Q264 HydrophobicContact CD1-CB 4.19Å; H260-Q264 PolarHBondContact O-N 3.48Å; H260-Q264 VanDerWaalsContact O-N 3.07Å; P261-Q264 WeakPolarHBondContact O-CB 3.31Å; P261-Q264 PolarHBondContact O-N 2.94Å; Q264-A266 VanDerWaalsContact C-N 3.27Å; Q264-A266 PolarHBondContact O-N 2.79Å; Q264-L267 PolarHBondContact O-N 3.27Å; Q264-L267 VanDerWaalsContact O-N 3.12Å; Q264-D268 PolarHBondContact NE2-OD1 3.27Å; Q264-D268 WeakPolarHBondContact O-CB 3.5Å; Q264-D268 PolarHBondContact O-N 3.41Å
265	K	98.3	Very high	97.2	Very high	100 Å²	100	40.2 Å²	40.2	44%	0.435	22%	0.222	S	C	.	.	H	α-helix	trans	-54.5	-42.3	173.8	-71.7	176.3	-174.3	167.8	0	112.6	P261 N262 M263 Y269	P261-K265 WeakPolarHBondContact O-CG 3.34Å; P261-K265 PolarHBondContact O-N 2.81Å; N262-K265 PolarHBondContact OD1-NZ 2.74Å; M263-K265 PolarHBondContact O-N 3.49Å; K265-Y269 WeakPolarHBondContact O-CB 3.36Å; K265-Y269 PolarHBondContact O-N 2.9Å
266	A	98.5	Very high	97	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-44.9	177.1	0	0	0	0	0	111.9	L237 I238 N262 M263 Q264 Y269 Y270 L493	L237-A266 HydrophobicContact CD2-CB 4.15Å; I238-A266 HydrophobicContact CD1-CB 4.25Å; I238-A266 HydrophobicContact CG1-CB 3.99Å; N262-A266 PolarHBondContact O-N 3.28Å; N262-A266 VanDerWaalsContact O-N 3.15Å; M263-A266 WeakPolarHBondContact O-CB 3.22Å; M263-A266 PolarHBondContact O-N 3.14Å; M263-A266 VanDerWaalsContact O-N 3.15Å; Q264-A266 VanDerWaalsContact C-N 3.27Å; Q264-A266 PolarHBondContact O-N 2.79Å; A266-Y269 WeakPolarHBondContact O-CB 3.3Å; A266-Y269 PolarHBondContact O-N 3.18Å; A266-Y270 WeakPolarHBondContact O-CD2 3.13Å; A266-Y270 PolarHBondContact O-N 3.26Å; A266-Y270 VanDerWaalsContact O-N 3.07Å; A266-L493 HydrophobicContact CB-CD1 4.11Å
267	L	98.4	Very high	96.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-39.2	176.6	-61	171	0	0	0	112	L227 L237 M241 A254 I259 M263 Q264 Y269 Y270 S271 F278 H280	L227-L267 HydrophobicContact CD1-CD1 4.26Å; L227-L267 HydrophobicContact CD1-CD2 4.38Å; L237-L267 HydrophobicContact CD1-CD2 4.48Å; L237-L267 HydrophobicContact CD2-CD2 3.77Å; L237-L267 HydrophobicContact CD2-CG 3.98Å; M241-L267 HydrophobicContact CE-CD2 3.92Å; A254-L267 HydrophobicContact CB-CD2 4.24Å; I259-L267 HydrophobicContact CD1-CD1 3.3Å; M263-L267 WeakPolarHBondContact O-CG 3.33Å; M263-L267 PolarHBondContact O-N 2.95Å; Q264-L267 PolarHBondContact O-N 3.27Å; Q264-L267 VanDerWaalsContact O-N 3.12Å; L267-Y269 VanDerWaalsContact C-N 3.34Å; L267-Y270 PolarHBondContact O-N 2.89Å; L267-S271 WeakPolarHBondContact O-CB 3.23Å; L267-S271 PolarHBondContact O-N 3.36Å; L267-S271 PolarHBondContact O-OG 3.42Å; L267-F278 HydrophobicContact CB-CE1 4.27Å; L267-F278 HydrophobicContact CB-CZ 4.41Å; L267-F278 HydrophobicContact CD2-CE1 4.25Å; L267-F278 HydrophobicContact CD2-CE2 4.42Å; L267-F278 HydrophobicContact CD2-CZ 3.55Å; L267-F278 VanDerWaalsContact O-CE1 3.29Å; L267-F278 WeakPolarHBondContact O-CE1 3.47Å; L267-H280 HydrophobicContact CB-CB 4.39Å
268	D	98.3	Very high	97.1	Very high	84 Å²	84	45.3 Å²	45.3	45%	0.449	25%	0.248	S	C	.	.	H	α-helix	trans	-63.8	-41.7	176.3	-66.7	-18.9	0	0	0	110.9	Q264 S271 S272	Q264-D268 PolarHBondContact NE2-OD1 3.27Å; Q264-D268 WeakPolarHBondContact O-CB 3.5Å; Q264-D268 PolarHBondContact O-N 3.41Å; D268-S271 PolarHBondContact O-N 2.91Å; D268-S272 PolarHBondContact O-N 3.15Å
269	Y	98.4	Very high	97.1	Very high	25 Å²	25	45 Å²	45	10%	0.098	25%	0.246	C	C	.	.	H	α-helix	trans	-58.3	-53	173.6	168.1	-98.8	0	0	0	112	K265 A266 L267 S271 S272 L273 V489 H492 L493	K265-Y269 WeakPolarHBondContact O-CB 3.36Å; K265-Y269 PolarHBondContact O-N 2.9Å; A266-Y269 WeakPolarHBondContact O-CB 3.3Å; A266-Y269 PolarHBondContact O-N 3.18Å; L267-Y269 VanDerWaalsContact C-N 3.34Å; Y269-S271 PolarHBondContact O-N 2.79Å; Y269-S272 WeakPolarHBondContact O-CB 3.1Å; Y269-S272 PolarHBondContact O-N 3.33Å; Y269-S272 VanDerWaalsContact O-N 3.1Å; Y269-S272 PolarHBondContact O-OG 3.19Å; Y269-L273 HydrophobicContact CE1-CD1 4Å; Y269-L273 HydrophobicContact CE2-CD2 4.35Å; Y269-L273 PolarHBondContact O-N 3.04Å; Y269-V489 HydrophobicContact CD1-CG1 3.73Å; Y269-V489 HydrophobicContact CD1-CG2 4.45Å; Y269-V489 HydrophobicContact CE1-CB 4.19Å; Y269-V489 HydrophobicContact CE1-CG1 3.66Å; Y269-V489 HydrophobicContact CE1-CG2 3.56Å; Y269-H492 AromaticContact CD2-CD2 3.33Å; Y269-H492 WeakPolarHBondContact CD2-CD2 3.48Å; Y269-H492 AromaticContact CD2-NE2 3.61Å; Y269-H492 AromaticContact CE2-CD2 3.36Å; Y269-H492 WeakPolarHBondContact CE2-CD2 3.24Å; Y269-H492 AromaticContact CE2-NE2 3.7Å; Y269-L493 HydrophobicContact CG-CD1 4.47Å; Y269-L493 HydrophobicContact CG-CD2 4.38Å
270	Y	98.5	Very high	97.1	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-34.3	178.3	-73.3	-70.7	0	0	0	111.9	M241 E242 Y245 A266 L267 S272 L273 F278	M241-Y270 HydrophobicContact CB-CD2 4.5Å; M241-Y270 HydrophobicContact CB-CE1 4.09Å; M241-Y270 HydrophobicContact CB-CE2 3.76Å; M241-Y270 WeakPolarHBondContact CB-OH 3.18Å; M241-Y270 HydrophobicContact CG-CD2 4.11Å; M241-Y270 HydrophobicContact CG-CE2 3.69Å; E242-Y270 WeakPolarHBondContact CG-OH 3.19Å; E242-Y270 VanDerWaalsContact OE1-CE1 3.27Å; E242-Y270 WeakPolarHBondContact OE1-CE1 3.18Å; E242-Y270 PolarHBondContact OE1-OH 2.98Å; Y245-Y270 HydrophobicContact CE2-CD1 4.04Å; Y245-Y270 AromaticContact CE2-CE1 3.97Å; Y245-Y270 HydrophobicContact CE2-CE1 3.97Å; A266-Y270 WeakPolarHBondContact O-CD2 3.13Å; A266-Y270 PolarHBondContact O-N 3.26Å; A266-Y270 VanDerWaalsContact O-N 3.07Å; L267-Y270 PolarHBondContact O-N 2.89Å; Y270-S272 VanDerWaalsContact C-N 3.29Å; Y270-S272 PolarHBondContact O-N 3.22Å; Y270-L273 HydrophobicContact CD1-CD1 4.04Å; Y270-L273 WeakPolarHBondContact O-CB 3.5Å; Y270-L273 PolarHBondContact O-N 3.09Å; Y270-F278 VanDerWaalsContact C-CD1 3.5Å
271	S	97.5	Very high	96.9	Very high	45 Å²	45	43.6 Å²	43.6	32%	0.315	24%	0.239	S	C	.	.	H	α-helix	trans	-64.8	-36.5	176.6	-60.2	0	0	0	0	111.4	L267 D268 Y269 L273 G274 F278	L267-S271 WeakPolarHBondContact O-CB 3.23Å; L267-S271 PolarHBondContact O-N 3.36Å; L267-S271 PolarHBondContact O-OG 3.42Å; D268-S271 PolarHBondContact O-N 2.91Å; Y269-S271 PolarHBondContact O-N 2.79Å; S271-L273 VanDerWaalsContact C-N 3.26Å; S271-L273 PolarHBondContact O-N 3.39Å; S271-G274 PolarHBondContact O-N 3.39Å; S271-G274 VanDerWaalsContact O-N 3.09Å; S271-F278 VanDerWaalsContact N-CD1 3.35Å; S271-F278 WeakPolarHBondContact OG-CD1 3.35Å; S271-F278 WeakPolarHBondContact OG-CE1 3.48Å
272	S	97.6	Very high	96.8	Very high	91 Å²	91	42.7 Å²	42.7	64%	0.636	24%	0.239	S	C	*	.	H	α-helix	trans	-66.7	-24.4	177.1	81.3	0	0	0	0	113.7	D268 Y269 Y270 G274	D268-S272 PolarHBondContact O-N 3.15Å; Y269-S272 WeakPolarHBondContact O-CB 3.1Å; Y269-S272 PolarHBondContact O-N 3.33Å; Y269-S272 VanDerWaalsContact O-N 3.1Å; Y269-S272 PolarHBondContact O-OG 3.19Å; Y270-S272 VanDerWaalsContact C-N 3.29Å; Y270-S272 PolarHBondContact O-N 3.22Å; S272-G274 PolarHBondContact O-N 2.95Å
273	L	96.8	Very high	96.6	Very high	84 Å²	84	41.6 Å²	41.6	44%	0.44	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-19.4	174.1	-56.4	-178.1	0	0	0	112.1	Y269 Y270 S271	Y269-L273 HydrophobicContact CE1-CD1 4Å; Y269-L273 HydrophobicContact CE2-CD2 4.35Å; Y269-L273 PolarHBondContact O-N 3.04Å; Y270-L273 HydrophobicContact CD1-CD1 4.04Å; Y270-L273 WeakPolarHBondContact O-CB 3.5Å; Y270-L273 PolarHBondContact O-N 3.09Å; S271-L273 VanDerWaalsContact C-N 3.26Å; S271-L273 PolarHBondContact O-N 3.39Å
274	G	93.9	Very high	96.4	Very high	17 Å²	17	43.1 Å²	43.1	18%	0.175	24%	0.243	C	C	.	.			trans	125	146.2	169.1	0	0	0	0	0	113.8	S271 S272 H276 T277 F278	S271-G274 PolarHBondContact O-N 3.39Å; S271-G274 VanDerWaalsContact O-N 3.09Å; S272-G274 PolarHBondContact O-N 2.95Å; G274-H276 PolarHBondContact O-N 3.47Å; G274-T277 PolarHBondContact O-N 2.91Å; G274-T277 PolarHBondContact O-OG1 3.17Å; G274-T277 VanDerWaalsContact O-OG1 3.07Å; G274-F278 PolarHBondContact O-N 3.11Å
275	N	91.1	Very high	96.3	Very high	82 Å²	82	40.4 Å²	40.4	44%	0.439	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-10.8	-178.1	-169.4	23.4	0	0	0	114.9	K251 F278 E279	K251-N275 WeakPolarHBondContact CE-O 3.42Å; K251-N275 PolarHBondContact NZ-O 3.2Å; K251-N275 PolarHBondContact NZ-OD1 3.38Å; N275-F278 WeakPolarHBondContact CA-O 3.42Å; N275-E279 WeakPolarHBondContact OD1-CB 3.4Å; N275-E279 PolarHBondContact OD1-OE2 3.01Å
276	H	92.6	Very high	96.1	Very high	104 Å²	104	35.8 Å²	35.8	48%	0.481	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-33.5	176	62.3	-80.9	0	0	0	111.7	R218 G274	R218-H276 PolarHBondContact NH1-O 2.92Å; G274-H276 PolarHBondContact O-N 3.47Å
277	T	96.1	Very high	95.8	Very high	33 Å²	33	36.7 Å²	36.7	20%	0.202	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-36.7	177.3	50.9	0	0	0	0	112.4	Y245 K251 I252 G274	Y245-T277 PolarHBondContact OH-O 3.17Å; K251-T277 CarbonylContact C-O 3.57Å; K251-T277 WeakPolarHBondContact CA-O 3.24Å; I252-T277 PolarHBondContact N-O 3.06Å; G274-T277 PolarHBondContact O-N 2.91Å; G274-T277 PolarHBondContact O-OG1 3.17Å; G274-T277 VanDerWaalsContact O-OG1 3.07Å
278	F	98.2	Very high	95.4	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.7	-174.3	-176.6	-107.1	0	0	0	112.3	M241 I252 A254 L267 Y270 S271 G274 N275 H280	M241-F278 HydrophobicContact CE-CD2 4.09Å; M241-F278 HydrophobicContact CE-CE2 3.31Å; M241-F278 HydrophobicContact CE-CZ 3.82Å; M241-F278 HydrophobicContact SD-CD2 4.27Å; M241-F278 HydrophobicContact SD-CE2 4.06Å; I252-F278 HydrophobicContact CB-CD2 3.97Å; I252-F278 HydrophobicContact CB-CE2 4.43Å; I252-F278 HydrophobicContact CG2-CD2 4.16Å; I252-F278 HydrophobicContact CG2-CE2 4.11Å; I252-F278 WeakPolarHBondContact O-CA 3.47Å; I252-F278 VanDerWaalsContact O-CD2 3.28Å; I252-F278 WeakPolarHBondContact O-CD2 3.15Å; A254-F278 HydrophobicContact CB-CE2 3.8Å; A254-F278 HydrophobicContact CB-CZ 3.81Å; L267-F278 HydrophobicContact CB-CE1 4.27Å; L267-F278 HydrophobicContact CB-CZ 4.41Å; L267-F278 HydrophobicContact CD2-CE1 4.25Å; L267-F278 HydrophobicContact CD2-CE2 4.42Å; L267-F278 HydrophobicContact CD2-CZ 3.55Å; L267-F278 VanDerWaalsContact O-CE1 3.29Å; L267-F278 WeakPolarHBondContact O-CE1 3.47Å; Y270-F278 VanDerWaalsContact C-CD1 3.5Å; S271-F278 VanDerWaalsContact N-CD1 3.35Å; S271-F278 WeakPolarHBondContact OG-CD1 3.35Å; S271-F278 WeakPolarHBondContact OG-CE1 3.48Å; G274-F278 PolarHBondContact O-N 3.11Å; N275-F278 WeakPolarHBondContact CA-O 3.42Å; F278-H280 HydrophobicContact CE1-CB 3.62Å; F278-H280 HydrophobicContact CZ-CB 3.87Å
279	E	96.4	Very high	95.2	Very high	29 Å²	29	39.3 Å²	39.3	14%	0.136	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	130.2	170.5	-178.4	178.4	175.2	0	0	109	K251 I252 L253 A254 N275 I281 R321	K251-E279 IonicContact NZ-OE2 3.98Å; K251-E279 PolarHBondContact NZ-OE2 2.85Å; I252-E279 PolarHBondContact O-N 3.48Å; I252-E279 VanDerWaalsContact O-N 3.08Å; L253-E279 WeakPolarHBondContact CA-O 3.48Å; L253-E279 HydrophobicContact CD1-CB 3.48Å; L253-E279 VanDerWaalsContact CD1-CB 3.48Å; L253-E279 HydrophobicContact CD1-CG 3.59Å; A254-E279 PolarHBondContact N-O 3.45Å; N275-E279 WeakPolarHBondContact OD1-CB 3.4Å; N275-E279 PolarHBondContact OD1-OE2 3.01Å; E279-I281 HydrophobicContact CG-CG1 4.24Å; E279-R321 IonicContact OE1-CZ 3.75Å; E279-R321 IonicContact OE1-NH1 2.78Å; E279-R321 PolarHBondContact OE1-NH1 2.79Å; E279-R321 IonicContact OE2-NH1 2.9Å
280	H	96.9	Very high	95	Very high	38 Å²	38	39.8 Å²	39.8	18%	0.176	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.1	174	170.5	-133.9	0	0	0	110.1	A254 S256 L267 F278	A254-H280 CarbonylContact O-C 3.29Å; A254-H280 WeakPolarHBondContact O-CA 3.32Å; S256-H280 WeakPolarHBondContact CB-NE2 3.41Å; S256-H280 PolarHBondContact OG-NE2 2.97Å; L267-H280 HydrophobicContact CB-CB 4.39Å; F278-H280 HydrophobicContact CE1-CB 3.62Å; F278-H280 HydrophobicContact CZ-CB 3.87Å
281	I	95.3	Very high	94.8	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.015	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	110.4	179.4	-60	169.9	0	0	0	110	Y89 L253 A254 Y255 S256 E279 I283	Y89-I281 HydrophobicContact CD1-CG2 3.71Å; Y89-I281 HydrophobicContact CD2-CB 4.46Å; Y89-I281 HydrophobicContact CD2-CG2 3.22Å; Y89-I281 HydrophobicContact CE1-CD1 3.81Å; Y89-I281 HydrophobicContact CE1-CG1 4.36Å; Y89-I281 HydrophobicContact CE1-CG2 3.71Å; Y89-I281 HydrophobicContact CE2-CB 4.1Å; Y89-I281 HydrophobicContact CE2-CD1 4.15Å; Y89-I281 HydrophobicContact CE2-CG1 3.82Å; Y89-I281 HydrophobicContact CE2-CG2 3.24Å; Y89-I281 HydrophobicContact CG-CG2 3.46Å; Y89-I281 VanDerWaalsContact CG-CG2 3.46Å; Y89-I281 VanDerWaalsContact CZ-CD1 3.43Å; Y89-I281 VanDerWaalsContact CZ-CG2 3.48Å; Y89-I281 WeakPolarHBondContact OH-CD1 3.19Å; Y89-I281 WeakPolarHBondContact OH-CG1 3.44Å; L253-I281 HydrophobicContact CD1-CD1 3.68Å; L253-I281 HydrophobicContact CD1-CG1 4.24Å; L253-I281 HydrophobicContact CD2-CD1 4.31Å; L253-I281 HydrophobicContact CG-CD1 4.3Å; A254-I281 PolarHBondContact O-N 2.9Å; Y255-I281 CarbonylContact C-O 3.58Å; Y255-I281 WeakPolarHBondContact CA-O 2.94Å; Y255-I281 HydrophobicContact CD1-CB 3.8Å; Y255-I281 HydrophobicContact CD1-CD1 4.27Å; Y255-I281 HydrophobicContact CD1-CG2 3.97Å; Y255-I281 HydrophobicContact CE1-CB 4.05Å; Y255-I281 HydrophobicContact CE1-CD1 3.64Å; Y255-I281 HydrophobicContact CE1-CG1 4.44Å; Y255-I281 HydrophobicContact CE1-CG2 4.17Å; S256-I281 PolarHBondContact N-O 2.78Å; E279-I281 HydrophobicContact CG-CG1 4.24Å; I281-I283 HydrophobicContact CG2-CG2 3.67Å
282	A	95	Very high	94.7	Very high	67 Å²	67	45.5 Å²	45.5	55%	0.554	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	128.8	166.1	0	0	0	0	0	110.2
283	I	94.5	Very high	94.5	Very high	12 Å²	12	44.2 Å²	44.2	6%	0.062	26%	0.256	C	S	.	.			trans	-123.6	159.9	-177.7	55.9	170.3	0	0	0	112.4	F104 Y255 S256 Y257 I281 R296 P314	F104-I283 HydrophobicContact CE2-CG2 4.44Å; F104-I283 HydrophobicContact CZ-CG2 3.92Å; Y255-I283 HydrophobicContact CD1-CD1 4.3Å; Y255-I283 HydrophobicContact CD1-CG2 3.78Å; Y255-I283 HydrophobicContact CE1-CG2 4.49Å; Y255-I283 HydrophobicContact CG-CD1 4.46Å; S256-I283 WeakPolarHBondContact O-CG1 3.41Å; S256-I283 PolarHBondContact O-N 3.36Å; Y257-I283 HydrophobicContact CD1-CD1 4.39Å; Y257-I283 HydrophobicContact CD1-CG1 3.91Å; Y257-I283 HydrophobicContact CE1-CB 4.49Å; Y257-I283 HydrophobicContact CE1-CD1 3.6Å; Y257-I283 HydrophobicContact CE1-CG1 3.54Å; Y257-I283 HydrophobicContact CE2-CD1 4.12Å; Y257-I283 VanDerWaalsContact CZ-CD1 3.45Å; Y257-I283 WeakPolarHBondContact OH-CD1 3.41Å; I281-I283 HydrophobicContact CG2-CG2 3.67Å; I283-R296 PolarHBondContact O-NH1 3.41Å; I283-P314 HydrophobicContact CD1-CB 4.42Å; I283-P314 HydrophobicContact CD1-CG 4.34Å
284	S	94.4	Very high	94.4	Very high	31 Å²	31	43.8 Å²	43.8	22%	0.217	27%	0.265	C	S	.	.			trans	-113.6	159.3	175	56.9	0	0	0	0	111.1	W91 N291	W91-S284 VanDerWaalsContact CD1-OG 3.25Å; W91-S284 PolarHBondContact NE1-O 2.88Å; S284-N291 VanDerWaalsContact CA-OD1 3.23Å; S284-N291 WeakPolarHBondContact CA-OD1 3.2Å; S284-N291 WeakPolarHBondContact CB-OD1 3.07Å
285	L	95.5	Very high	94.5	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	28%	0.281	C	S	.	.			trans	-77.7	142.6	169.3	-63.1	-174.3	0	0	0	110.2	Y257 Q289 N291 R296 F299 I300 N310	Y257-L285 HydrophobicContact CD1-CD2 4.32Å; Y257-L285 HydrophobicContact CE1-CD2 3.6Å; Y257-L285 HydrophobicContact CE1-CG 4.34Å; L285-Q289 HydrophobicContact CB-CB 3.55Å; L285-Q289 HydrophobicContact CB-CG 4.46Å; L285-Q289 HydrophobicContact CD1-CB 3.98Å; L285-Q289 HydrophobicContact CG-CB 4.43Å; L285-N291 PolarHBondContact N-OD1 3.36Å; L285-N291 PolarHBondContact O-ND2 2.84Å; L285-R296 HydrophobicContact CD1-CG 3.83Å; L285-R296 HydrophobicContact CG-CG 4.09Å; L285-F299 HydrophobicContact CD1-CD1 3.75Å; L285-F299 HydrophobicContact CD1-CE1 4.09Å; L285-I300 HydrophobicContact CD1-CG1 4.29Å; L285-N310 HydrophobicContact CD2-CB 4.26Å; L285-N310 WeakPolarHBondContact CD2-ND2 3.18Å
286	P	94.5	Very high	94.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.013	26%	0.264	C	S	.	.			trans	-71.6	154.1	-178.8	19.3	-24.9	0	0	0	113.5	W91 M128 Q289	W91-P286 HydrophobicContact CD2-CB 3.57Å; W91-P286 HydrophobicContact CD2-CG 4.42Å; W91-P286 HydrophobicContact CE3-CB 3.81Å; W91-P286 HydrophobicContact CG-CB 4.06Å; W91-P286 HydrophobicContact CH2-CB 4.01Å; W91-P286 HydrophobicContact CH2-CG 3.99Å; W91-P286 HydrophobicContact CZ2-CB 3.81Å; W91-P286 HydrophobicContact CZ2-CG 3.73Å; W91-P286 HydrophobicContact CZ3-CB 3.99Å; W91-P286 HydrophobicContact CZ3-CG 4.43Å; M128-P286 HydrophobicContact CB-CB 3.77Å; M128-P286 HydrophobicContact CB-CG 3.71Å; M128-P286 HydrophobicContact CE-CG 3.66Å; M128-P286 HydrophobicContact CG-CB 3.98Å; M128-P286 HydrophobicContact CG-CG 3.48Å; M128-P286 VanDerWaalsContact CG-CG 3.48Å; M128-P286 HydrophobicContact SD-CG 4.36Å; P286-Q289 VanDerWaalsContact CG-NE2 3.3Å; P286-Q289 WeakPolarHBondContact O-CB 3.46Å; P286-Q289 WeakPolarHBondContact O-CG 3.27Å; P286-Q289 PolarHBondContact O-N 3.05Å; P286-Q289 PolarHBondContact O-NE2 2.8Å
287	G	91.5	Very high	94.9	Very high	20 Å²	20	41 Å²	41	21%	0.206	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	-138.5	172.6	0	0	0	0	0	114.1	Y102 Q289	Y102-G287 VanDerWaalsContact CE1-CA 3.5Å; Y102-G287 WeakPolarHBondContact OH-CA 3.37Å; G287-Q289 PolarHBondContact O-N 3.24Å
288	N	90	Very high	94.9	Very high	126 Å²	126	40.8 Å²	40.8	67%	0.674	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	13.8	-175.5	-61.4	-39	0	0	0	113.1	Y171	Y171-N288 PolarHBondContact OH-N 2.88Å
289	Q	95	Very high	94.8	Very high	13 Å²	13	43.2 Å²	43.2	6%	0.061	26%	0.257	C	S	.	.	S	Bend	trans	-70.3	145.9	174.5	-70.2	176.5	95.4	0	0	110.8	Y171 L285 P286 G287 N291 F299 N310	Y171-Q289 HydrophobicContact CD2-CG 3.9Å; Y171-Q289 HydrophobicContact CE2-CG 3.87Å; L285-Q289 HydrophobicContact CB-CB 3.55Å; L285-Q289 HydrophobicContact CB-CG 4.46Å; L285-Q289 HydrophobicContact CD1-CB 3.98Å; L285-Q289 HydrophobicContact CG-CB 4.43Å; P286-Q289 VanDerWaalsContact CG-NE2 3.3Å; P286-Q289 WeakPolarHBondContact O-CB 3.46Å; P286-Q289 WeakPolarHBondContact O-CG 3.27Å; P286-Q289 PolarHBondContact O-N 3.05Å; P286-Q289 PolarHBondContact O-NE2 2.8Å; G287-Q289 PolarHBondContact O-N 3.24Å; Q289-N291 PolarHBondContact O-N 2.79Å; Q289-N291 PolarHBondContact O-ND2 2.95Å; Q289-F299 HydrophobicContact CG-CE1 4.15Å; Q289-F299 HydrophobicContact CG-CZ 3.98Å; Q289-N310 PolarHBondContact OE1-ND2 3.41Å
290	P	94.8	Very high	94.7	Very high	34 Å²	34	42.2 Å²	42.2	22%	0.221	25%	0.252	C	S	.	.			trans	-69.4	134.1	-175	27.5	-33.9	0	0	0	111.5	Q295 R296 F299	P290-Q295 HydrophobicContact CB-CB 3.91Å; P290-R296 VanDerWaalsContact O-CB 3.3Å; P290-R296 WeakPolarHBondContact O-CB 3.4Å; P290-F299 HydrophobicContact CG-CB 3.53Å; P290-F299 HydrophobicContact CG-CD1 4.43Å; P290-F299 HydrophobicContact CG-CD2 3.95Å; P290-F299 HydrophobicContact CG-CG 3.72Å
291	N	93.8	Very high	94.5	Very high	58 Å²	58	46.1 Å²	46.1	31%	0.31	27%	0.271	S	S	.	.			trans	-115.9	-4.8	177.6	-84.1	-64.3	0	0	0	114.7	S284 L285 Q289 R296	S284-N291 VanDerWaalsContact CA-OD1 3.23Å; S284-N291 WeakPolarHBondContact CA-OD1 3.2Å; S284-N291 WeakPolarHBondContact CB-OD1 3.07Å; L285-N291 PolarHBondContact N-OD1 3.36Å; L285-N291 PolarHBondContact O-ND2 2.84Å; Q289-N291 PolarHBondContact O-N 2.79Å; Q289-N291 PolarHBondContact O-ND2 2.95Å; N291-R296 PolarHBondContact OD1-NH1 3.19Å
292	L	94.2	Very high	94.5	Very high	108 Å²	108	56.2 Å²	56.2	57%	0.565	31%	0.309	S	S	*	.	S	Bend	trans	-63.3	131.6	167.7	-69.9	178.3	0	0	0	109.3	A294 Q295 R296	L292-A294 PolarHBondContact O-N 3.12Å; L292-Q295 HydrophobicContact CB-CB 4.22Å; L292-Q295 HydrophobicContact CB-CG 4.2Å; L292-Q295 PolarHBondContact O-N 2.85Å; L292-R296 VanDerWaalsContact O-CB 3.31Å; L292-R296 WeakPolarHBondContact O-CB 3.41Å; L292-R296 PolarHBondContact O-N 3.25Å
293	P	93.7	Very high	94.5	Very high	64 Å²	64	55.3 Å²	55.3	42%	0.416	30%	0.295	S	S	.	.	H	α-helix	trans	-49.6	-51.9	-167	-31.2	34.9	0	0	0	115.1	N258 R296 T297	N258-P293 HydrophobicContact CB-CB 4.28Å; P293-R296 PolarHBondContact O-N 3.23Å; P293-T297 WeakPolarHBondContact O-CB 3.4Å; P293-T297 PolarHBondContact O-N 2.88Å; P293-T297 PolarHBondContact O-OG1 3.15Å
294	A	94.7	Very high	94.3	Very high	75 Å²	75	62.4 Å²	62.4	62%	0.62	32%	0.321	S	S	*	.	H	α-helix	trans	-68.1	-40.8	-179.6	0	0	0	0	0	113	L292 T297 A298	L292-A294 PolarHBondContact O-N 3.12Å; A294-T297 PolarHBondContact O-N 2.93Å; A294-A298 WeakPolarHBondContact O-CB 3.42Å; A294-A298 PolarHBondContact O-N 2.94Å
295	Q	96.2	Very high	94.3	Very high	110 Å²	110	63.2 Å²	63.2	51%	0.514	32%	0.321	S	S	.	.	H	α-helix	trans	-67.7	-40.2	178.2	-63.9	-179.9	-4.3	0	0	111.4	P290 L292 A298 F299	P290-Q295 HydrophobicContact CB-CB 3.91Å; L292-Q295 HydrophobicContact CB-CB 4.22Å; L292-Q295 HydrophobicContact CB-CG 4.2Å; L292-Q295 PolarHBondContact O-N 2.85Å; Q295-A298 PolarHBondContact O-N 2.86Å; Q295-F299 VanDerWaalsContact O-CB 3.3Å; Q295-F299 WeakPolarHBondContact O-CB 3.3Å; Q295-F299 PolarHBondContact O-N 2.92Å
296	R	95.5	Very high	94.3	Very high	24 Å²	24	63.3 Å²	63.3	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-48.7	175.2	-178.5	166.9	58.9	-168	4.2	111.3	Y257 I283 L285 P290 N291 L292 P293 A298 F299 I300	Y257-R296 PolarHBondContact O-NH2 3.23Å; I283-R296 PolarHBondContact O-NH1 3.41Å; L285-R296 HydrophobicContact CD1-CG 3.83Å; L285-R296 HydrophobicContact CG-CG 4.09Å; P290-R296 VanDerWaalsContact O-CB 3.3Å; P290-R296 WeakPolarHBondContact O-CB 3.4Å; N291-R296 PolarHBondContact OD1-NH1 3.19Å; L292-R296 VanDerWaalsContact O-CB 3.31Å; L292-R296 WeakPolarHBondContact O-CB 3.41Å; L292-R296 PolarHBondContact O-N 3.25Å; P293-R296 PolarHBondContact O-N 3.23Å; R296-A298 PolarHBondContact O-N 2.92Å; R296-F299 WeakPolarHBondContact O-CB 3.46Å; R296-F299 PolarHBondContact O-N 3.33Å; R296-I300 HydrophobicContact CG-CD1 3.85Å; R296-I300 HydrophobicContact CG-CG1 4.46Å; R296-I300 WeakPolarHBondContact O-CG1 3Å; R296-I300 PolarHBondContact O-N 2.81Å
297	T	96	Very high	94.3	Very high	10 Å²	10	66.7 Å²	66.7	6%	0.061	34%	0.336	C	S	.	.	H	α-helix	trans	-56.1	-50.9	176.1	-54.5	0	0	0	0	110.3	D228 P230 N258 P293 A294 F299 I300 Q301	D228-T297 WeakPolarHBondContact OD2-CA 3.49Å; P230-T297 HydrophobicContact CG-CG2 4.15Å; N258-T297 PolarHBondContact ND2-OG1 2.84Å; P293-T297 WeakPolarHBondContact O-CB 3.4Å; P293-T297 PolarHBondContact O-N 2.88Å; P293-T297 PolarHBondContact O-OG1 3.15Å; A294-T297 PolarHBondContact O-N 2.93Å; T297-F299 VanDerWaalsContact C-N 3.31Å; T297-F299 PolarHBondContact O-N 2.85Å; T297-I300 PolarHBondContact O-N 3.03Å; T297-Q301 VanDerWaalsContact O-CG 3.31Å; T297-Q301 WeakPolarHBondContact O-CG 3.02Å; T297-Q301 PolarHBondContact O-N 2.74Å
298	A	96.6	Very high	94.5	Very high	30 Å²	30	70.6 Å²	70.6	25%	0.248	34%	0.344	C	S	.	.	H	α-helix	trans	-61.1	-38.6	178.5	0	0	0	0	0	112.6	A294 Q295 R296 R302	A294-A298 WeakPolarHBondContact O-CB 3.42Å; A294-A298 PolarHBondContact O-N 2.94Å; Q295-A298 PolarHBondContact O-N 2.86Å; R296-A298 PolarHBondContact O-N 2.92Å; A298-R302 WeakPolarHBondContact O-CB 3.35Å; A298-R302 WeakPolarHBondContact O-CG 3.45Å; A298-R302 PolarHBondContact O-N 2.9Å
299	F	96.4	Very high	94.8	Very high	51 Å²	51	64.7 Å²	64.7	22%	0.224	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-48.3	176.4	178.1	-90.2	0	0	0	112.1	L285 Q289 P290 Q295 R296 T297 Q301 R302 N303 Q306	L285-F299 HydrophobicContact CD1-CD1 3.75Å; L285-F299 HydrophobicContact CD1-CE1 4.09Å; Q289-F299 HydrophobicContact CG-CE1 4.15Å; Q289-F299 HydrophobicContact CG-CZ 3.98Å; P290-F299 HydrophobicContact CG-CB 3.53Å; P290-F299 HydrophobicContact CG-CD1 4.43Å; P290-F299 HydrophobicContact CG-CD2 3.95Å; P290-F299 HydrophobicContact CG-CG 3.72Å; Q295-F299 VanDerWaalsContact O-CB 3.3Å; Q295-F299 WeakPolarHBondContact O-CB 3.3Å; Q295-F299 PolarHBondContact O-N 2.92Å; R296-F299 WeakPolarHBondContact O-CB 3.46Å; R296-F299 PolarHBondContact O-N 3.33Å; T297-F299 VanDerWaalsContact C-N 3.31Å; T297-F299 PolarHBondContact O-N 2.85Å; F299-Q301 VanDerWaalsContact C-N 3.31Å; F299-Q301 PolarHBondContact O-N 2.65Å; F299-R302 PolarHBondContact O-N 3.21Å; F299-N303 HydrophobicContact CZ-CB 4.39Å; F299-N303 WeakPolarHBondContact O-CB 3.13Å; F299-N303 PolarHBondContact O-N 3.26Å; F299-Q306 HydrophobicContact CE1-CB 4.29Å; F299-Q306 HydrophobicContact CE1-CG 3.83Å; F299-Q306 HydrophobicContact CZ-CB 4.3Å; F299-Q306 HydrophobicContact CZ-CG 3.88Å
300	I	94.8	Very high	94.9	Very high	8 Å²	8	64.3 Å²	64.3	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-59.4	-42.7	178.3	-71.7	171.8	0	0	0	110.8	D228 Y257 L285 R296 T297 K307	D228-I300 HydrophobicContact CB-CD1 4.47Å; Y257-I300 HydrophobicContact CD2-CD1 3.95Å; Y257-I300 HydrophobicContact CE2-CD1 4.3Å; Y257-I300 HydrophobicContact CG-CD1 4.06Å; L285-I300 HydrophobicContact CD1-CG1 4.29Å; R296-I300 HydrophobicContact CG-CD1 3.85Å; R296-I300 HydrophobicContact CG-CG1 4.46Å; R296-I300 WeakPolarHBondContact O-CG1 3Å; R296-I300 PolarHBondContact O-N 2.81Å; T297-I300 PolarHBondContact O-N 3.03Å; I300-K307 HydrophobicContact CG2-CB 4.31Å; I300-K307 HydrophobicContact CG2-CD 3.66Å; I300-K307 HydrophobicContact CG2-CG 3.91Å
301	Q	93	Very high	95	Very high	120 Å²	120	63.6 Å²	63.6	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-67.7	-43.2	179.4	-71.1	176.3	-3.6	0	0	112.9	T297 F299	T297-Q301 VanDerWaalsContact O-CG 3.31Å; T297-Q301 WeakPolarHBondContact O-CG 3.02Å; T297-Q301 PolarHBondContact O-N 2.74Å; F299-Q301 VanDerWaalsContact C-N 3.31Å; F299-Q301 PolarHBondContact O-N 2.65Å
302	R	94.3	Very high	95.2	Very high	216 Å²	216	60.9 Å²	60.9	82%	0.815	29%	0.29	S	S	*	.	H	α-helix	trans	-77.1	-34.8	-177.2	-69.4	173.6	-176	179.6	1.5	112.6	A298 F299	A298-R302 WeakPolarHBondContact O-CB 3.35Å; A298-R302 WeakPolarHBondContact O-CG 3.45Å; A298-R302 PolarHBondContact O-N 2.9Å; F299-R302 PolarHBondContact O-N 3.21Å
303	N	94.5	Very high	95.4	Very high	48 Å²	48	56 Å²	56	26%	0.257	26%	0.264	S	S	.	.			trans	-105.5	70.4	-174.7	-161.9	-22.4	0	0	0	112	F299 Q305 Q306 K307	F299-N303 HydrophobicContact CZ-CB 4.39Å; F299-N303 WeakPolarHBondContact O-CB 3.13Å; F299-N303 PolarHBondContact O-N 3.26Å; N303-Q305 PolarHBondContact O-N 3.21Å; N303-Q305 VanDerWaalsContact O-N 3.11Å; N303-Q306 HydrophobicContact CB-CB 4.12Å; N303-Q306 PolarHBondContact O-N 2.8Å; N303-Q306 VanDerWaalsContact OD1-CB 3.32Å; N303-Q306 WeakPolarHBondContact OD1-CB 3.38Å; N303-Q306 PolarHBondContact OD1-N 2.03Å; N303-K307 WeakPolarHBondContact O-CB 3.43Å; N303-K307 PolarHBondContact O-N 3.49Å
304	R	91.8	Very high	95.5	Very high	161 Å²	161	53 Å²	53	61%	0.608	25%	0.245	S	C	*	.	H	α-helix	trans	-53.6	-34.7	-178	-67.2	-174.8	179.5	-172.1	-0	113.7	R308	R304-R308 VanDerWaalsContact O-CG 3.32Å; R304-R308 WeakPolarHBondContact O-CG 3.41Å; R304-R308 PolarHBondContact O-N 2.85Å
305	Q	93.1	Very high	95.7	Very high	48 Å²	48	49.5 Å²	49.5	22%	0.224	22%	0.216	C	C	.	.	H	α-helix	trans	-79.4	-35.7	-176.3	-66.1	-69.3	-6	0	0	112	F170 N303 R309	F170-Q305 HydrophobicContact CE1-CB 3.78Å; F170-Q305 HydrophobicContact CZ-CB 4.17Å; N303-Q305 PolarHBondContact O-N 3.21Å; N303-Q305 VanDerWaalsContact O-N 3.11Å; Q305-R309 PolarHBondContact O-N 3.3Å; Q305-R309 PolarHBondContact O-NH1 3.33Å
306	Q	96.1	Very high	95.8	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.019	19%	0.192	C	C	.	.	H	α-helix	trans	-70.2	-39.5	169	-171.4	57	57	0	0	111.3	F170 Y171 F299 N303 R308 R309 N310	F170-Q306 HydrophobicContact CD1-CB 4.07Å; F170-Q306 HydrophobicContact CE1-CB 4.32Å; Y171-Q306 PolarHBondContact O-NE2 3.1Å; F299-Q306 HydrophobicContact CE1-CB 4.29Å; F299-Q306 HydrophobicContact CE1-CG 3.83Å; F299-Q306 HydrophobicContact CZ-CB 4.3Å; F299-Q306 HydrophobicContact CZ-CG 3.88Å; N303-Q306 HydrophobicContact CB-CB 4.12Å; N303-Q306 PolarHBondContact O-N 2.8Å; N303-Q306 VanDerWaalsContact OD1-CB 3.32Å; N303-Q306 WeakPolarHBondContact OD1-CB 3.38Å; N303-Q306 PolarHBondContact OD1-N 2.03Å; Q306-R308 VanDerWaalsContact C-N 3.35Å; Q306-R308 PolarHBondContact O-N 3.02Å; Q306-R309 WeakPolarHBondContact O-CB 3.42Å; Q306-R309 PolarHBondContact O-N 2.89Å; Q306-R309 VanDerWaalsContact O-N 3.08Å; Q306-N310 PolarHBondContact NE2-OD1 2.75Å; Q306-N310 VanDerWaalsContact O-CG 3.29Å; Q306-N310 PolarHBondContact O-N 3.28Å; Q306-N310 PolarHBondContact O-ND2 2.82Å
307	K	95.4	Very high	95.9	Very high	73 Å²	73	43.2 Å²	43.2	32%	0.317	19%	0.188	S	C	.	.	H	α-helix	trans	-52.2	-51.4	173	171.4	-178.7	178.8	172.8	0	111.3	I300 N303 R309 N310 E311	I300-K307 HydrophobicContact CG2-CB 4.31Å; I300-K307 HydrophobicContact CG2-CD 3.66Å; I300-K307 HydrophobicContact CG2-CG 3.91Å; N303-K307 WeakPolarHBondContact O-CB 3.43Å; N303-K307 PolarHBondContact O-N 3.49Å; K307-R309 VanDerWaalsContact C-N 3.26Å; K307-R309 PolarHBondContact O-N 3.36Å; K307-N310 PolarHBondContact O-N 2.97Å; K307-N310 VanDerWaalsContact O-N 3.17Å; K307-E311 WeakPolarHBondContact CE-OE1 3.16Å; K307-E311 VanDerWaalsContact CG-OE1 3.28Å; K307-E311 WeakPolarHBondContact CG-OE1 3.42Å; K307-E311 WeakPolarHBondContact O-CG 3.45Å; K307-E311 PolarHBondContact O-N 2.99Å
308	R	94.8	Very high	96	Very high	102 Å²	102	42.8 Å²	42.8	39%	0.385	19%	0.185	S	C	.	.	H	α-helix	trans	-57.2	-35.8	177.6	-75.2	172.9	-179.5	-170	-2.7	113.2	W160 R304 Q306 L312 E457	W160-R308 HydrophobicContact CH2-CB 4.01Å; W160-R308 HydrophobicContact CZ3-CB 4.13Å; R304-R308 VanDerWaalsContact O-CG 3.32Å; R304-R308 WeakPolarHBondContact O-CG 3.41Å; R304-R308 PolarHBondContact O-N 2.85Å; Q306-R308 VanDerWaalsContact C-N 3.35Å; Q306-R308 PolarHBondContact O-N 3.02Å; R308-L312 WeakPolarHBondContact O-CG 3.45Å; R308-E457 IonicContact CZ-OE1 3.61Å; R308-E457 IonicContact NH2-OE1 3.42Å; R308-E457 PolarHBondContact NH2-OE1 3.2Å
309	R	96.8	Very high	96	Very high	1 Å²	1	41.3 Å²	41.3	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-73.2	-43.5	176.4	-72.6	178.5	-177.4	88.3	-15.7	111.8	W160 D165 Y171 Q305 Q306 K307 E311 L312	W160-R309 HydrophobicContact CD2-CG 3.82Å; W160-R309 HydrophobicContact CE3-CG 3.58Å; W160-R309 HydrophobicContact CH2-CG 4.01Å; W160-R309 HydrophobicContact CZ2-CG 4.24Å; W160-R309 HydrophobicContact CZ3-CG 3.68Å; D165-R309 VanDerWaalsContact CG-NH2 3.26Å; D165-R309 PolarHBondContact O-NH2 2.99Å; D165-R309 IonicContact OD2-CZ 3.95Å; D165-R309 IonicContact OD2-NH1 3.27Å; D165-R309 PolarHBondContact OD2-NH1 2.93Å; D165-R309 VanDerWaalsContact OD2-NH1 3.17Å; D165-R309 IonicContact OD2-NH2 3.87Å; D165-R309 PolarHBondContact OD2-NH2 3.12Å; Y171-R309 WeakPolarHBondContact O-CB 3.33Å; Y171-R309 WeakPolarHBondContact O-CD 3.39Å; Q305-R309 PolarHBondContact O-N 3.3Å; Q305-R309 PolarHBondContact O-NH1 3.33Å; Q306-R309 WeakPolarHBondContact O-CB 3.42Å; Q306-R309 PolarHBondContact O-N 2.89Å; Q306-R309 VanDerWaalsContact O-N 3.08Å; K307-R309 VanDerWaalsContact C-N 3.26Å; K307-R309 PolarHBondContact O-N 3.36Å; R309-E311 VanDerWaalsContact C-N 3.28Å; R309-E311 PolarHBondContact O-N 2.79Å; R309-L312 PolarHBondContact O-N 3.05Å
310	N	96.8	Very high	96.1	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.027	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-36.9	177.5	-68.2	-19.1	0	0	0	111.9	L285 Q289 Q306 K307 L312 I313 P314	L285-N310 HydrophobicContact CD2-CB 4.26Å; L285-N310 WeakPolarHBondContact CD2-ND2 3.18Å; Q289-N310 PolarHBondContact OE1-ND2 3.41Å; Q306-N310 PolarHBondContact NE2-OD1 2.75Å; Q306-N310 VanDerWaalsContact O-CG 3.29Å; Q306-N310 PolarHBondContact O-N 3.28Å; Q306-N310 PolarHBondContact O-ND2 2.82Å; K307-N310 PolarHBondContact O-N 2.97Å; K307-N310 VanDerWaalsContact O-N 3.17Å; N310-L312 PolarHBondContact O-N 3.17Å; N310-I313 PolarHBondContact O-N 3.32Å; N310-P314 WeakPolarHBondContact O-CD 3.46Å
311	E	96.8	Very high	96.1	Very high	19 Å²	19	40.7 Å²	40.7	9%	0.089	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.2	177.2	-75.6	173	-161.4	0	0	113.8	K225 K307 R309 I313 P314 Y315	K225-E311 WeakPolarHBondContact CE-OE1 3.4Å; K225-E311 WeakPolarHBondContact CE-OE2 3.48Å; K225-E311 HydrophobicContact CG-CG 4.48Å; K225-E311 IonicContact NZ-OE1 3.72Å; K225-E311 PolarHBondContact NZ-OE1 2.88Å; K225-E311 IonicContact NZ-OE2 3.63Å; K225-E311 PolarHBondContact NZ-OE2 2.91Å; K307-E311 WeakPolarHBondContact CE-OE1 3.16Å; K307-E311 VanDerWaalsContact CG-OE1 3.28Å; K307-E311 WeakPolarHBondContact CG-OE1 3.42Å; K307-E311 WeakPolarHBondContact O-CG 3.45Å; K307-E311 PolarHBondContact O-N 2.99Å; R309-E311 VanDerWaalsContact C-N 3.28Å; R309-E311 PolarHBondContact O-N 2.79Å; E311-I313 VanDerWaalsContact C-N 3.31Å; E311-I313 PolarHBondContact O-N 2.88Å; E311-P314 VanDerWaalsContact O-CD 3.29Å; E311-P314 WeakPolarHBondContact O-CD 3.17Å; E311-P314 WeakPolarHBondContact O-CG 3.31Å; E311-Y315 HydrophobicContact CB-CE2 3.91Å; E311-Y315 WeakPolarHBondContact O-CD2 3.35Å; E311-Y315 WeakPolarHBondContact O-CE2 3.29Å; E311-Y315 PolarHBondContact OE2-OH 2.76Å
312	L	97.7	Very high	96.3	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-75.2	-20.8	-176.1	-60.5	174.2	0	0	0	113.1	I159 W160 P173 R308 R309 N310 Y315 N316 F422	I159-L312 HydrophobicContact CG2-CB 4.05Å; I159-L312 HydrophobicContact CG2-CD1 4.19Å; I159-L312 WeakPolarHBondContact O-CD1 3.29Å; W160-L312 HydrophobicContact CE3-CD1 3.63Å; W160-L312 HydrophobicContact CZ3-CD1 4Å; P173-L312 HydrophobicContact CB-CB 4.39Å; P173-L312 HydrophobicContact CG-CB 3.98Å; P173-L312 HydrophobicContact CG-CD1 4Å; R308-L312 WeakPolarHBondContact O-CG 3.45Å; R309-L312 PolarHBondContact O-N 3.05Å; N310-L312 PolarHBondContact O-N 3.17Å; L312-Y315 HydrophobicContact CD2-CD2 3.98Å; L312-Y315 HydrophobicContact CD2-CE2 4.39Å; L312-N316 PolarHBondContact O-N 3.19Å; L312-N316 PolarHBondContact O-ND2 2.98Å; L312-F422 HydrophobicContact CD1-CD2 4.28Å; L312-F422 HydrophobicContact CD1-CE2 4.28Å; L312-F422 HydrophobicContact CD2-CD2 3.48Å; L312-F422 VanDerWaalsContact CD2-CD2 3.48Å; L312-F422 HydrophobicContact CD2-CE2 3.87Å; L312-F422 HydrophobicContact CD2-CG 4.44Å
313	I	97.5	Very high	96.3	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-67.4	-58.6	175.7	-63.4	-68.6	0	0	0	111.8	W91 F104 A127 M128 P173 N310 E311 Y315 N316 D317	W91-I313 HydrophobicContact CH2-CD1 4.11Å; W91-I313 HydrophobicContact CH2-CG1 3.95Å; W91-I313 HydrophobicContact CH2-CG2 4Å; W91-I313 HydrophobicContact CZ2-CG2 4.26Å; F104-I313 HydrophobicContact CD1-CG2 3.37Å; F104-I313 HydrophobicContact CE1-CG2 3.61Å; F104-I313 HydrophobicContact CG-CG2 3.93Å; F104-I313 HydrophobicContact CZ-CG2 4.35Å; A127-I313 WeakPolarHBondContact O-CD1 3.36Å; M128-I313 HydrophobicContact CE-CD1 4.09Å; M128-I313 HydrophobicContact CE-CG1 3.43Å; M128-I313 VanDerWaalsContact CE-CG1 3.43Å; P173-I313 HydrophobicContact CB-CD1 3.72Å; P173-I313 HydrophobicContact CB-CG1 4.13Å; N310-I313 PolarHBondContact O-N 3.32Å; E311-I313 VanDerWaalsContact C-N 3.31Å; E311-I313 PolarHBondContact O-N 2.88Å; I313-Y315 PolarHBondContact O-N 3.1Å; I313-N316 PolarHBondContact O-N 3.23Å; I313-N316 VanDerWaalsContact O-N 3.16Å; I313-D317 WeakPolarHBondContact O-CB 3.15Å; I313-D317 PolarHBondContact O-N 3.38Å
314	P	97.1	Very high	96.3	Very high	2 Å²	2	25 Å²	25	1%	0.013	11%	0.106	C	C	.	.	H	α-helix	trans	-61.3	-30.9	179.5	22.4	-32.6	0	0	0	112.9	Y255 I283 N310 E311 C318	Y255-P314 HydrophobicContact CD1-CB 3.77Å; Y255-P314 HydrophobicContact CD2-CB 3.42Å; Y255-P314 VanDerWaalsContact CD2-CB 3.42Å; Y255-P314 HydrophobicContact CE1-CB 3.95Å; Y255-P314 HydrophobicContact CE2-CB 3.62Å; Y255-P314 WeakPolarHBondContact CE2-O 3.04Å; Y255-P314 HydrophobicContact CG-CB 3.48Å; Y255-P314 VanDerWaalsContact CG-CB 3.48Å; Y255-P314 PolarHBondContact OH-O 3.39Å; I283-P314 HydrophobicContact CD1-CB 4.42Å; I283-P314 HydrophobicContact CD1-CG 4.34Å; N310-P314 WeakPolarHBondContact O-CD 3.46Å; E311-P314 VanDerWaalsContact O-CD 3.29Å; E311-P314 WeakPolarHBondContact O-CD 3.17Å; E311-P314 WeakPolarHBondContact O-CG 3.31Å; P314-C318 VanDerWaalsContact O-CB 3.3Å; P314-C318 WeakPolarHBondContact O-CB 3.12Å; P314-C318 PolarHBondContact O-N 2.9Å
315	Y	97.9	Very high	96.5	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-61.9	-48.3	174.2	-66.2	-15.3	0	0	0	112.6	K225 E311 L312 I313 L319 L331 N423	K225-Y315 HydrophobicContact CB-CE1 4.07Å; K225-Y315 WeakPolarHBondContact CD-OH 3.38Å; K225-Y315 HydrophobicContact CG-CE1 4.44Å; K225-Y315 WeakPolarHBondContact CG-OH 3.32Å; E311-Y315 HydrophobicContact CB-CE2 3.91Å; E311-Y315 WeakPolarHBondContact O-CD2 3.35Å; E311-Y315 WeakPolarHBondContact O-CE2 3.29Å; E311-Y315 PolarHBondContact OE2-OH 2.76Å; L312-Y315 HydrophobicContact CD2-CD2 3.98Å; L312-Y315 HydrophobicContact CD2-CE2 4.39Å; I313-Y315 PolarHBondContact O-N 3.1Å; Y315-L319 PolarHBondContact O-N 2.96Å; Y315-L319 VanDerWaalsContact O-N 3.15Å; Y315-L331 HydrophobicContact CD1-CD2 3.86Å; Y315-L331 HydrophobicContact CD1-CG 4.22Å; Y315-L331 HydrophobicContact CD2-CD2 3.84Å; Y315-L331 HydrophobicContact CG-CD2 3.5Å; Y315-L331 HydrophobicContact CG-CG 4.33Å; Y315-N423 HydrophobicContact CE2-CB 3.81Å; Y315-N423 PolarHBondContact OH-OD1 2.63Å
316	N	98.2	Very high	96.7	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.011	8%	0.078	C	C	.	.	H	α-helix	trans	-76.3	-31.2	179.4	-73.8	-82.8	0	0	0	111.7	L126 I159 L312 I313 C318 L319 L320 I420 A421	L126-N316 HydrophobicContact CD1-CB 4.1Å; L126-N316 HydrophobicContact CD2-CB 3.75Å; I159-N316 HydrophobicContact CD1-CB 4.47Å; L312-N316 PolarHBondContact O-N 3.19Å; L312-N316 PolarHBondContact O-ND2 2.98Å; I313-N316 PolarHBondContact O-N 3.23Å; I313-N316 VanDerWaalsContact O-N 3.16Å; N316-C318 VanDerWaalsContact C-N 3.34Å; N316-L319 PolarHBondContact O-N 3.42Å; N316-L320 WeakPolarHBondContact O-CB 3.45Å; N316-L320 VanDerWaalsContact O-CG 3.24Å; N316-L320 WeakPolarHBondContact O-CG 3.5Å; N316-L320 PolarHBondContact O-N 3.17Å; N316-I420 VanDerWaalsContact OD1-CA 3.3Å; N316-I420 WeakPolarHBondContact OD1-CA 3.32Å; N316-I420 WeakPolarHBondContact OD1-CG2 3.42Å; N316-A421 PolarHBondContact ND2-O 3.34Å; N316-A421 PolarHBondContact OD1-N 3.21Å
317	D	97.8	Very high	96.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.3	-45.6	172.8	-173.6	78.4	0	0	0	110.5	F104 T105 Y107 L126 Y255 I313 L319 L320 R321	F104-D317 HydrophobicContact CE1-CB 4.13Å; T105-D317 WeakPolarHBondContact CB-OD1 3.35Å; T105-D317 WeakPolarHBondContact CG2-OD1 3.44Å; T105-D317 PolarHBondContact OG1-OD1 3.47Å; Y107-D317 PolarHBondContact OH-OD1 3.06Å; Y107-D317 PolarHBondContact OH-OD2 2.79Å; L126-D317 VanDerWaalsContact CD1-CA 3.49Å; L126-D317 HydrophobicContact CD1-CB 3.78Å; L126-D317 VanDerWaalsContact CD1-N 3.3Å; Y255-D317 WeakPolarHBondContact OH-CB 3.28Å; Y255-D317 PolarHBondContact OH-OD2 3.01Å; I313-D317 WeakPolarHBondContact O-CB 3.15Å; I313-D317 PolarHBondContact O-N 3.38Å; D317-L319 PolarHBondContact O-N 2.87Å; D317-L320 PolarHBondContact O-N 3.08Å; D317-R321 WeakPolarHBondContact O-CB 3.37Å; D317-R321 PolarHBondContact O-N 3.26Å; D317-R321 IonicContact OD1-NH2 2.68Å; D317-R321 IonicContact OD2-CZ 2.76Å; D317-R321 IonicContact OD2-NE 3.73Å; D317-R321 IonicContact OD2-NH2 3.1Å; D317-R321 PolarHBondContact OD2-NH2 3.36Å
318	C	97.7	Very high	96.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.9	-45.1	175.6	-174.2	0	0	0	0	112.2	C223 L253 Y255 P314 N316 H322	C223-C318 VanDerWaalsContact CA-SG 3.57Å; C223-C318 HydrophobicContact CB-CB 3.63Å; C223-C318 WeakPolarHBondContact CB-SG 3.13Å; C223-C318 WeakPolarHBondContact SG-CB 3.48Å; C223-C318 CovalentContact SG-SG 2.03Å; C223-C318 PolarHBondContact SG-SG 3.13Å; L253-C318 HydrophobicContact CD2-CB 3.7Å; Y255-C318 HydrophobicContact CE2-CB 4.19Å; Y255-C318 PolarHBondContact OH-N 2.65Å; Y255-C318 VanDerWaalsContact OH-N 3.09Å; P314-C318 VanDerWaalsContact O-CB 3.3Å; P314-C318 WeakPolarHBondContact O-CB 3.12Å; P314-C318 PolarHBondContact O-N 2.9Å; N316-C318 VanDerWaalsContact C-N 3.34Å; C318-H322 PolarHBondContact O-N 3.44Å; C318-H322 PolarHBondContact O-ND1 3.5Å
319	L	97.8	Very high	97.1	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-60	-52.9	177.4	-177.6	77.7	0	0	0	111.4	Y315 N316 D317 H322 I323 A329 I415 V418 A421	Y315-L319 PolarHBondContact O-N 2.96Å; Y315-L319 VanDerWaalsContact O-N 3.15Å; N316-L319 PolarHBondContact O-N 3.42Å; D317-L319 PolarHBondContact O-N 2.87Å; L319-H322 PolarHBondContact O-N 3.48Å; L319-I323 PolarHBondContact O-N 2.64Å; L319-A329 HydrophobicContact CD1-CB 3.9Å; L319-I415 HydrophobicContact CD1-CB 4.48Å; L319-I415 HydrophobicContact CD1-CG1 4.04Å; L319-I415 HydrophobicContact CD1-CG2 4.32Å; L319-V418 HydrophobicContact CD2-CG1 4.06Å; L319-V418 WeakPolarHBondContact CD2-O 3.14Å; L319-A421 HydrophobicContact CD2-CB 4.12Å
320	L	97.5	Very high	97.2	Very high	4 Å²	4	9.9 Å²	9.9	2%	0.021	5%	0.053	C	C	.	.	H	α-helix	trans	-66.7	-39.3	-176.1	-66.8	175.4	0	0	0	112	Y107 L126 L175 N316 D317 H322 I323	Y107-L320 HydrophobicContact CD1-CB 4.26Å; Y107-L320 HydrophobicContact CD2-CB 3.5Å; Y107-L320 HydrophobicContact CD2-CD1 3.79Å; Y107-L320 HydrophobicContact CD2-CG 4.29Å; Y107-L320 HydrophobicContact CE2-CB 3.83Å; Y107-L320 HydrophobicContact CE2-CD1 4.27Å; Y107-L320 HydrophobicContact CG-CB 3.74Å; L126-L320 HydrophobicContact CD1-CD1 3.99Å; L126-L320 HydrophobicContact CD2-CD1 4.05Å; L126-L320 HydrophobicContact CG-CD1 3.82Å; L175-L320 HydrophobicContact CD1-CD1 4.04Å; N316-L320 WeakPolarHBondContact O-CB 3.45Å; N316-L320 VanDerWaalsContact O-CG 3.24Å; N316-L320 WeakPolarHBondContact O-CG 3.5Å; N316-L320 PolarHBondContact O-N 3.17Å; D317-L320 PolarHBondContact O-N 3.08Å; L320-H322 PolarHBondContact O-N 3.26Å; L320-H322 VanDerWaalsContact O-N 3.14Å; L320-I323 HydrophobicContact CB-CD1 4.31Å; L320-I323 HydrophobicContact CD2-CD1 3.77Å; L320-I323 WeakPolarHBondContact O-CD1 3.09Å; L320-I323 VanDerWaalsContact O-CG1 3.27Å; L320-I323 WeakPolarHBondContact O-CG1 3.36Å; L320-I323 PolarHBondContact O-N 3.49Å
321	R	95.6	Very high	97.2	Very high	41 Å²	41	9.7 Å²	9.7	16%	0.155	5%	0.052	C	C	.	.	H	α-helix	trans	-56.9	-29.6	175.7	179.5	178.1	-58.8	-92	-16.7	113.3	Y89 Y107 E279 D317	Y89-R321 VanDerWaalsContact CE1-NH2 3.33Å; Y89-R321 VanDerWaalsContact OH-CZ 3.23Å; Y89-R321 PolarHBondContact OH-NH1 3.47Å; Y89-R321 PolarHBondContact OH-NH2 2.78Å; Y107-R321 VanDerWaalsContact CE1-CA 3.49Å; Y107-R321 HydrophobicContact CE1-CB 3.86Å; Y107-R321 PolarHBondContact OH-NH2 2.89Å; E279-R321 IonicContact OE1-CZ 3.75Å; E279-R321 IonicContact OE1-NH1 2.78Å; E279-R321 PolarHBondContact OE1-NH1 2.79Å; E279-R321 IonicContact OE2-NH1 2.9Å; D317-R321 WeakPolarHBondContact O-CB 3.37Å; D317-R321 PolarHBondContact O-N 3.26Å; D317-R321 IonicContact OD1-NH2 2.68Å; D317-R321 IonicContact OD2-CZ 2.76Å; D317-R321 IonicContact OD2-NE 3.73Å; D317-R321 IonicContact OD2-NH2 3.1Å; D317-R321 PolarHBondContact OD2-NH2 3.36Å
322	H	96.4	Very high	97.2	Very high	5 Å²	5	8.9 Å²	8.9	2%	0.023	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	12.2	-172.8	-63.1	95.9	0	0	0	114.3	V221 C318 L319 L320 T324 S325 H326 I415	V221-H322 HydrophobicContact CG1-CB 3.96Å; C318-H322 PolarHBondContact O-N 3.44Å; C318-H322 PolarHBondContact O-ND1 3.5Å; L319-H322 PolarHBondContact O-N 3.48Å; L320-H322 PolarHBondContact O-N 3.26Å; L320-H322 VanDerWaalsContact O-N 3.14Å; H322-T324 PolarHBondContact O-N 2.8Å; H322-T324 VanDerWaalsContact O-N 3.14Å; H322-S325 WeakPolarHBondContact CA-OG 3.49Å; H322-S325 PolarHBondContact CD2-OG 3.34Å; H322-S325 PolarHBondContact O-N 2.89Å; H322-S325 VanDerWaalsContact O-N 3.08Å; H322-H326 HydrophobicContact CB-CB 4.25Å; H322-H326 AromaticContact CD2-CE1 3.44Å; H322-H326 PolarHBondContact CD2-CE1 2.76Å; H322-H326 VanDerWaalsContact CD2-CE1 3.44Å; H322-H326 AromaticContact CD2-ND1 3.24Å; H322-H326 PolarHBondContact CD2-ND1 3.18Å; H322-H326 AromaticContact CG-ND1 3.81Å; H322-H326 PolarHBondContact O-N 2.95Å; H322-H326 VanDerWaalsContact O-N 3.11Å; H322-I415 HydrophobicContact CB-CD1 4.08Å
323	I	95.9	Very high	97.2	Very high	19 Å²	19	9.8 Å²	9.8	10%	0.097	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.8	-46.4	176.9	-75	167.8	0	0	0	112.9	D109 R111 L319 L320 I415	D109-I323 HydrophobicContact CB-CD1 4.35Å; R111-I323 HydrophobicContact CG-CG2 3.7Å; L319-I323 PolarHBondContact O-N 2.64Å; L320-I323 HydrophobicContact CB-CD1 4.31Å; L320-I323 HydrophobicContact CD2-CD1 3.77Å; L320-I323 WeakPolarHBondContact O-CD1 3.09Å; L320-I323 VanDerWaalsContact O-CG1 3.27Å; L320-I323 WeakPolarHBondContact O-CG1 3.36Å; L320-I323 PolarHBondContact O-N 3.49Å; I323-I415 HydrophobicContact CG1-CG2 4.2Å
324	T	94.4	Very high	97.2	Very high	31 Å²	31	10.1 Å²	10.1	19%	0.19	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-5.4	-174.3	69.9	0	0	0	0	114	R212 H322	R212-T324 PolarHBondContact N-OG1 3.02Å; R212-T324 WeakPolarHBondContact O-CB 3.46Å; R212-T324 PolarHBondContact O-OG1 3.3Å; H322-T324 PolarHBondContact O-N 2.8Å; H322-T324 VanDerWaalsContact O-N 3.14Å
325	S	95.5	Very high	97.1	Very high	28 Å²	28	12.4 Å²	12.4	20%	0.196	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-19.4	-166.8	60.1	0	0	0	0	114.7	P217 R218 H322	P217-S325 WeakPolarHBondContact CA-O 3.38Å; R218-S325 PolarHBondContact N-O 3.35Å; H322-S325 WeakPolarHBondContact CA-OG 3.49Å; H322-S325 PolarHBondContact CD2-OG 3.34Å; H322-S325 PolarHBondContact O-N 2.89Å; H322-S325 VanDerWaalsContact O-N 3.08Å
326	H	97.1	Very high	97.1	Very high	10 Å²	10	12.5 Å²	12.5	5%	0.046	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.2	-178.5	-63.9	72.3	0	0	0	111.9	R218 V221 H322 I415	R218-H326 CarbonylContact O-C 3.57Å; R218-H326 VanDerWaalsContact O-CA 3.26Å; R218-H326 WeakPolarHBondContact O-CA 3.47Å; V221-H326 HydrophobicContact CB-CB 4.25Å; V221-H326 HydrophobicContact CG1-CB 4.09Å; V221-H326 PolarHBondContact N-CD2 3.5Å; H322-H326 HydrophobicContact CB-CB 4.25Å; H322-H326 AromaticContact CD2-CE1 3.44Å; H322-H326 PolarHBondContact CD2-CE1 2.76Å; H322-H326 VanDerWaalsContact CD2-CE1 3.44Å; H322-H326 AromaticContact CD2-ND1 3.24Å; H322-H326 PolarHBondContact CD2-ND1 3.18Å; H322-H326 AromaticContact CG-ND1 3.81Å; H322-H326 PolarHBondContact O-N 2.95Å; H322-H326 VanDerWaalsContact O-N 3.11Å; H326-I415 HydrophobicContact CB-CD1 3.92Å
327	T	97	Very high	97.1	Very high	30 Å²	30	12.4 Å²	12.4	18%	0.184	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-43	179.9	-53.7	0	0	0	0	111.5	R218 H219 K414 I415	R218-T327 PolarHBondContact O-N 3.45Å; R218-T327 PolarHBondContact O-OG1 2.74Å; R218-T327 VanDerWaalsContact O-OG1 3.11Å; H219-T327 WeakPolarHBondContact O-CB 3.45Å; H219-T327 PolarHBondContact O-N 3.32Å; T327-K414 HydrophobicContact CG2-CD 4.02Å; T327-I415 PolarHBondContact O-N 2.74Å
328	Y	98.4	Very high	97.2	Very high	4 Å²	4	12.4 Å²	12.4	2%	0.016	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141	-178.6	-64.3	-74.9	0	0	0	111.7	H219 T220 V221 I350 L367 F412 M413 K414	H219-Y328 AromaticContact CE1-CD2 3.96Å; H219-Y328 AromaticContact NE2-CD2 3.69Å; H219-Y328 AromaticContact NE2-CE2 3.71Å; H219-Y328 PolarHBondContact O-N 2.99Å; T220-Y328 WeakPolarHBondContact CA-O 3.32Å; V221-Y328 PolarHBondContact N-O 2.71Å; Y328-I350 HydrophobicContact CD2-CD1 4.07Å; Y328-I350 HydrophobicContact CE2-CD1 3.97Å; Y328-I350 HydrophobicContact CE2-CG2 4.15Å; Y328-I350 HydrophobicContact CG-CD1 4.5Å; Y328-L367 HydrophobicContact CD1-CD1 4.45Å; Y328-L367 HydrophobicContact CE1-CD1 3.69Å; Y328-F412 HydrophobicContact CD1-CB 3.96Å; Y328-F412 HydrophobicContact CG-CB 4.25Å; Y328-M413 CarbonylContact C-O 3.47Å; Y328-M413 VanDerWaalsContact CA-O 3.24Å; Y328-M413 WeakPolarHBondContact CA-O 3.29Å; Y328-K414 HydrophobicContact CD1-CB 4.31Å; Y328-K414 HydrophobicContact CD1-CD 4.44Å; Y328-K414 HydrophobicContact CE1-CB 4.01Å; Y328-K414 HydrophobicContact CE1-CD 3.85Å
329	A	98.5	Very high	97.2	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.3	163.9	0	0	0	0	0	109.4	V221 L319 L331 M413 I415	V221-A329 HydrophobicContact CG1-CB 3.96Å; V221-A329 CarbonylContact O-C 3.45Å; V221-A329 WeakPolarHBondContact O-CA 3.36Å; L319-A329 HydrophobicContact CD1-CB 3.9Å; A329-L331 HydrophobicContact CB-CD1 4.41Å; A329-M413 PolarHBondContact N-O 3.34Å; A329-M413 PolarHBondContact O-N 3.07Å; A329-I415 HydrophobicContact CB-CD1 3.93Å; A329-I415 HydrophobicContact CB-CG1 3.96Å
330	L	98.6	Very high	97.2	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.4	174.5	178.1	65.4	0	0	0	109.4	T220 V221 V222 C223 V332 V338 W346 K410 F412	T220-L330 HydrophobicContact CG2-CB 3.98Å; V221-L330 PolarHBondContact O-N 2.88Å; V222-L330 CarbonylContact C-O 3.56Å; V222-L330 WeakPolarHBondContact CA-O 3.28Å; C223-L330 PolarHBondContact N-O 3.45Å; L330-V332 HydrophobicContact CD1-CG1 4.13Å; L330-V332 HydrophobicContact CD2-CG1 4.01Å; L330-V332 HydrophobicContact CD2-CG2 4.3Å; L330-V332 HydrophobicContact CG-CG1 3.87Å; L330-V332 HydrophobicContact CG-CG2 4.23Å; L330-V338 HydrophobicContact CD1-CG2 4.25Å; L330-V338 HydrophobicContact CD2-CB 4.31Å; L330-V338 HydrophobicContact CD2-CG2 4.07Å; L330-W346 HydrophobicContact CD2-CH2 3.82Å; L330-W346 HydrophobicContact CD2-CZ2 3.92Å; L330-W346 HydrophobicContact CD2-CZ3 4.16Å; L330-K410 HydrophobicContact CD1-CB 4.36Å; L330-F412 HydrophobicContact CB-CD1 4.05Å; L330-F412 HydrophobicContact CB-CE1 4.15Å; L330-F412 HydrophobicContact CD1-CD1 4.29Å; L330-F412 HydrophobicContact CD1-CD2 4.47Å; L330-F412 HydrophobicContact CD1-CE1 4.3Å; L330-F412 HydrophobicContact CD1-CE2 4.48Å; L330-F412 HydrophobicContact CD1-CG 4.37Å; L330-F412 HydrophobicContact CD1-CZ 4.39Å; L330-F412 HydrophobicContact CD2-CD1 4.42Å; L330-F412 HydrophobicContact CD2-CE1 3.76Å; L330-F412 HydrophobicContact CD2-CZ 3.92Å; L330-F412 HydrophobicContact CG-CD1 4.47Å; L330-F412 HydrophobicContact CG-CE1 4.28Å
331	L	97.9	Very high	97.2	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	114.6	175.6	-73	60.7	0	0	0	108	C223 Y315 A329 K410 M413 A421	C223-L331 HydrophobicContact CB-CD1 4.13Å; C223-L331 HydrophobicContact CB-CG 4.04Å; Y315-L331 HydrophobicContact CD1-CD2 3.86Å; Y315-L331 HydrophobicContact CD1-CG 4.22Å; Y315-L331 HydrophobicContact CD2-CD2 3.84Å; Y315-L331 HydrophobicContact CG-CD2 3.5Å; Y315-L331 HydrophobicContact CG-CG 4.33Å; A329-L331 HydrophobicContact CB-CD1 4.41Å; L331-K410 WeakPolarHBondContact O-CD 3.48Å; L331-K410 VanDerWaalsContact O-CE 3.27Å; L331-K410 WeakPolarHBondContact O-CE 3.45Å; L331-K410 WeakPolarHBondContact O-CG 3.36Å; L331-K410 PolarHBondContact O-NZ 2.99Å; L331-M413 HydrophobicContact CD1-CE 3.89Å; L331-M413 HydrophobicContact CD1-SD 4.21Å; L331-M413 HydrophobicContact CD2-CE 3.91Å; L331-M413 HydrophobicContact CG-CE 4.42Å; L331-A421 HydrophobicContact CD2-CB 4.17Å
332	V	97.4	Very high	97.3	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	143.2	-179.8	-83.7	0	0	0	0	110	V222 C223 W240 L330 V338 K410	V222-V332 HydrophobicContact CG1-CG2 3.33Å; C223-V332 PolarHBondContact O-N 3.11Å; W240-V332 HydrophobicContact CZ2-CB 4.48Å; W240-V332 HydrophobicContact CZ2-CG2 3.71Å; L330-V332 HydrophobicContact CD1-CG1 4.13Å; L330-V332 HydrophobicContact CD2-CG1 4.01Å; L330-V332 HydrophobicContact CD2-CG2 4.3Å; L330-V332 HydrophobicContact CG-CG1 3.87Å; L330-V332 HydrophobicContact CG-CG2 4.23Å; V332-V338 HydrophobicContact CG1-CG2 4.16Å; V332-K410 HydrophobicContact CG1-CB 4.28Å; V332-K410 HydrophobicContact CG1-CG 4.2Å
333	D	96.6	Very high	97.4	Very high	22 Å²	22	21.2 Å²	21.2	12%	0.118	11%	0.107	C	C	.	.			trans	-84.8	165.2	178.8	-63.7	21.5	0	0	0	109.7	K225 W240 D335 E336 K410	K225-D333 IonicContact NZ-OD2 3.92Å; W240-D333 PolarHBondContact NE1-O 2.88Å; D333-D335 VanDerWaalsContact CB-OD1 3.29Å; D333-D335 WeakPolarHBondContact CB-OD1 3.23Å; D333-D335 PolarHBondContact O-N 3.19Å; D333-E336 HydrophobicContact CB-CG 4.08Å; D333-E336 PolarHBondContact N-OE2 2.84Å; D333-E336 VanDerWaalsContact N-OE2 3.13Å; D333-E336 PolarHBondContact O-N 2.95Å; D333-E336 VanDerWaalsContact O-N 3.09Å; D333-K410 IonicContact OD1-NZ 3.88Å; D333-K410 PolarHBondContact OD1-NZ 3.03Å
334	L	97.1	Very high	97.4	Very high	10 Å²	10	23.8 Å²	23.8	5%	0.052	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.9	-176	-175.1	62.3	0	0	0	113.2	L224 L227 Y229 L237 W240 M263 M392	L224-L334 HydrophobicContact CD1-CB 4.36Å; L227-L334 HydrophobicContact CD2-CD2 4.39Å; Y229-L334 HydrophobicContact CD2-CD2 4.35Å; Y229-L334 HydrophobicContact CE1-CD2 4.46Å; Y229-L334 HydrophobicContact CE2-CD2 3.78Å; L237-L334 HydrophobicContact CB-CD1 4.26Å; L237-L334 HydrophobicContact CD1-CD1 3.66Å; W240-L334 HydrophobicContact CB-CD1 4.01Å; W240-L334 HydrophobicContact CD2-CD1 4.24Å; W240-L334 HydrophobicContact CG-CD1 4.01Å; M263-L334 HydrophobicContact CE-CD2 4.32Å; L334-M392 WeakPolarHBondContact O-CE 3.47Å
335	D	96.5	Very high	97.5	Very high	50 Å²	50	24.1 Å²	24.1	27%	0.267	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	15.3	-179.3	60.3	-18.9	0	0	0	112.6	D333 H449 Y450	D333-D335 VanDerWaalsContact CB-OD1 3.29Å; D333-D335 WeakPolarHBondContact CB-OD1 3.23Å; D333-D335 PolarHBondContact O-N 3.19Å; D335-H449 IonicContact OD2-CD2 2.84Å; D335-H449 IonicContact OD2-NE2 3.89Å; D335-Y450 WeakPolarHBondContact CB-O 3.13Å; D335-Y450 WeakPolarHBondContact O-CD2 3.39Å; D335-Y450 PolarHBondContact O-N 2.67Å
336	E	98.1	Very high	97.7	Very high	5 Å²	5	22.8 Å²	22.8	2%	0.023	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.7	-177.6	-61.9	177.1	150.3	0	0	112.4	W240 D333 K410 K447 N448 H449	W240-E336 PolarHBondContact NE1-O 3.18Å; D333-E336 HydrophobicContact CB-CG 4.08Å; D333-E336 PolarHBondContact N-OE2 2.84Å; D333-E336 VanDerWaalsContact N-OE2 3.13Å; D333-E336 PolarHBondContact O-N 2.95Å; D333-E336 VanDerWaalsContact O-N 3.09Å; E336-K410 WeakPolarHBondContact OE2-CE 3.39Å; E336-K410 IonicContact OE2-NZ 2.73Å; E336-K447 HydrophobicContact CB-CD 4.24Å; E336-K447 HydrophobicContact CB-CG 4.48Å; E336-K447 VanDerWaalsContact CD-NZ 3.31Å; E336-K447 HydrophobicContact CG-CD 4.37Å; E336-K447 IonicContact OE1-NZ 2.77Å; E336-K447 PolarHBondContact OE1-NZ 3.42Å; E336-K447 IonicContact OE2-NZ 3.15Å; E336-N448 CarbonylContact C-O 3.57Å; E336-N448 VanDerWaalsContact CA-O 3.25Å; E336-N448 WeakPolarHBondContact CA-O 3.49Å; E336-H449 HydrophobicContact CG-CB 4.33Å; E336-H449 IonicContact OE1-ND1 3.91Å
337	L	98.2	Very high	97.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.5	178.9	-167.7	65.1	0	0	0	110.7	A243 L247 V339 M392 K447 N448 Y450 L475	A243-L337 HydrophobicContact CB-CD1 3.86Å; A243-L337 HydrophobicContact CB-CD2 3.85Å; L247-L337 HydrophobicContact CD1-CD1 3.54Å; L247-L337 HydrophobicContact CD1-CD2 3.9Å; L247-L337 HydrophobicContact CD1-CG 3.61Å; L337-V339 HydrophobicContact CB-CG2 4.47Å; L337-V339 HydrophobicContact CD2-CG2 4.09Å; L337-V339 HydrophobicContact CG-CG2 4.05Å; L337-M392 HydrophobicContact CB-SD 4.16Å; L337-M392 HydrophobicContact CD2-SD 4.11Å; L337-K447 CarbonylContact O-C 3.59Å; L337-K447 WeakPolarHBondContact O-CA 3.05Å; L337-N448 PolarHBondContact N-O 3.4Å; L337-N448 PolarHBondContact O-N 2.93Å; L337-Y450 HydrophobicContact CB-CE2 4.5Å; L337-L475 HydrophobicContact CD2-CD1 4.15Å; L337-L475 HydrophobicContact CD2-CD2 3.72Å
338	V	98.5	Very high	97.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	113.7	174.7	173.6	0	0	0	0	109.3	L247 L330 V332 W346 I369 F412 K447	L247-V338 WeakPolarHBondContact CD1-O 3.35Å; L330-V338 HydrophobicContact CD1-CG2 4.25Å; L330-V338 HydrophobicContact CD2-CB 4.31Å; L330-V338 HydrophobicContact CD2-CG2 4.07Å; V332-V338 HydrophobicContact CG1-CG2 4.16Å; V338-W346 HydrophobicContact CB-CZ2 4.48Å; V338-W346 PolarHBondContact O-NE1 3.46Å; V338-I369 HydrophobicContact CG1-CB 4.43Å; V338-I369 HydrophobicContact CG1-CG1 3.91Å; V338-I369 HydrophobicContact CG1-CG2 4.23Å; V338-F412 HydrophobicContact CG1-CE2 3.84Å; V338-F412 HydrophobicContact CG1-CZ 3.87Å; V338-K447 HydrophobicContact CG2-CB 4.18Å; V338-K447 HydrophobicContact CG2-CG 3.92Å
339	V	98.4	Very high	97.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	116.5	-173.6	-172.8	0	0	0	0	110	L337 A445 V446 N474 L475 F478	L337-V339 HydrophobicContact CB-CG2 4.47Å; L337-V339 HydrophobicContact CD2-CG2 4.09Å; L337-V339 HydrophobicContact CG-CG2 4.05Å; V339-A445 VanDerWaalsContact O-CA 3.27Å; V339-A445 WeakPolarHBondContact O-CA 3.4Å; V339-V446 PolarHBondContact N-O 3.14Å; V339-V446 PolarHBondContact O-N 2.7Å; V339-N474 HydrophobicContact CG1-CB 4.17Å; V339-L475 HydrophobicContact CG1-CD2 4.07Å; V339-L475 HydrophobicContact CG2-CD2 3.64Å; V339-F478 HydrophobicContact CG1-CE2 4.17Å
340	P	98.2	Very high	97.8	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.013	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	140.9	164.7	-19.2	33.6	0	0	0	111.2	T343 M349	P340-T343 WeakPolarHBondContact CB-OG1 3.47Å; P340-M349 HydrophobicContact CB-CB 4.07Å; P340-M349 HydrophobicContact CB-CG 4.18Å; P340-M349 HydrophobicContact CG-CB 4.23Å
341	L	97.8	Very high	97.7	Very high	72 Å²	72	34.3 Å²	34.3	38%	0.377	17%	0.168	S	C	.	.	S	Bend	trans	-106.5	-17.2	-177.2	-59.1	-177.8	0	0	0	113.6	A442 Y444 V446 N474	L341-A442 WeakPolarHBondContact CD1-O 3.39Å; L341-Y444 PolarHBondContact N-O 2.87Å; L341-V446 HydrophobicContact CD1-CG1 4.38Å; L341-V446 HydrophobicContact CD2-CG1 4.16Å; L341-N474 HydrophobicContact CD2-CB 3.61Å
342	R	96.4	Very high	97.7	Very high	138 Å²	138	36.8 Å²	36.8	52%	0.521	18%	0.181	S	C	.	.	S	Bend	trans	-119.8	-8.2	-177.4	-63.2	-175.8	-177.4	-173.2	-0.3	114.2	L352 D443	R342-L352 HydrophobicContact CB-CD2 4.19Å; R342-D443 WeakPolarHBondContact CD-O 3.49Å; R342-D443 WeakPolarHBondContact CG-O 3.32Å; R342-D443 IonicContact CZ-OD2 3.17Å; R342-D443 VanDerWaalsContact CZ-OD2 3.24Å; R342-D443 PolarHBondContact NE-O 2.8Å; R342-D443 IonicContact NE-OD2 2.98Å; R342-D443 IonicContact NH1-OD2 3.12Å; R342-D443 IonicContact NH2-OD2 2.8Å; R342-D443 PolarHBondContact NH2-OD2 2.78Å
343	T	97.9	Very high	97.8	Very high	23 Å²	23	38.2 Å²	38.2	14%	0.141	19%	0.186	C	C	.	.	S	Bend	trans	-137	167.8	-172.1	63	0	0	0	0	109.8	P340 N345 E348 M349 L352	P340-T343 WeakPolarHBondContact CB-OG1 3.47Å; T343-N345 PolarHBondContact OG1-O 2.91Å; T343-N345 VanDerWaalsContact OG1-O 3.11Å; T343-E348 HydrophobicContact CG2-CB 3.86Å; T343-M349 WeakPolarHBondContact OG1-CA 3.27Å; T343-M349 WeakPolarHBondContact OG1-CB 3.34Å; T343-M349 PolarHBondContact OG1-N 2.65Å; T343-L352 HydrophobicContact CG2-CB 4.4Å; T343-L352 HydrophobicContact CG2-CD2 3.82Å
344	S	96.2	Very high	97.8	Very high	73 Å²	73	37.5 Å²	37.5	51%	0.51	18%	0.182	S	C	.	.	S	Bend	trans	-86.9	-18	-174.7	-52.3	0	0	0	0	112.8	E348 F478	S344-E348 PolarHBondContact N-OE2 3.05Å; S344-F478 VanDerWaalsContact O-CE1 3.25Å; S344-F478 WeakPolarHBondContact O-CE1 3.46Å
345	N	98.1	Very high	97.8	Very high	38 Å²	38	40.7 Å²	40.7	20%	0.203	21%	0.205	C	C	.	.	S	Bend	trans	-154.6	171	-176.2	59	67.5	0	0	0	112.1	L247 T343 R347 E348 M349	L247-N345 CarbonylContact O-C 3.5Å; L247-N345 VanDerWaalsContact O-CA 3.24Å; L247-N345 WeakPolarHBondContact O-CA 3.44Å; L247-N345 WeakPolarHBondContact O-CB 3.48Å; T343-N345 PolarHBondContact OG1-O 2.91Å; T343-N345 VanDerWaalsContact OG1-O 3.11Å; N345-R347 PolarHBondContact O-N 2.93Å; N345-R347 WeakPolarHBondContact OD1-CB 3.3Å; N345-R347 PolarHBondContact OD1-N 2.69Å; N345-R347 VanDerWaalsContact OD1-N 3.14Å; N345-E348 VanDerWaalsContact ND2-CD 3.31Å; N345-E348 PolarHBondContact ND2-OE1 2.94Å; N345-E348 PolarHBondContact OD1-N 2.06Å; N345-M349 WeakPolarHBondContact O-CB 3.32Å; N345-M349 PolarHBondContact O-N 2.83Å; N345-M349 VanDerWaalsContact O-N 3.07Å
346	W	98.5	Very high	97.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-31.7	-179	-59	-33.8	0	0	0	114.4	T220 V222 N244 L247 A249 L330 V338 M349 I350 F412	T220-W346 HydrophobicContact CG2-CE3 3.81Å; T220-W346 HydrophobicContact CG2-CZ3 3.84Å; V222-W346 HydrophobicContact CG2-CH2 3.66Å; V222-W346 HydrophobicContact CG2-CZ3 3.61Å; N244-W346 HydrophobicContact CB-CH2 4.27Å; N244-W346 VanDerWaalsContact OD1-CH2 3.31Å; N244-W346 WeakPolarHBondContact OD1-CH2 3.24Å; L247-W346 HydrophobicContact CB-CD2 4.48Å; L247-W346 HydrophobicContact CB-CZ2 3.84Å; L247-W346 VanDerWaalsContact O-CG 3.31Å; L247-W346 PolarHBondContact O-N 3Å; A249-W346 HydrophobicContact CB-CH2 4.08Å; A249-W346 HydrophobicContact CB-CZ3 3.72Å; L330-W346 HydrophobicContact CD2-CH2 3.82Å; L330-W346 HydrophobicContact CD2-CZ2 3.92Å; L330-W346 HydrophobicContact CD2-CZ3 4.16Å; V338-W346 HydrophobicContact CB-CZ2 4.48Å; V338-W346 PolarHBondContact O-NE1 3.46Å; W346-M349 PolarHBondContact O-N 3.42Å; W346-I350 WeakPolarHBondContact O-CB 3.43Å; W346-I350 VanDerWaalsContact O-CG1 3.27Å; W346-I350 WeakPolarHBondContact O-CG1 3.4Å; W346-I350 PolarHBondContact O-N 2.78Å; W346-F412 HydrophobicContact CB-CE1 3.96Å; W346-F412 HydrophobicContact CB-CZ 3.94Å; W346-F412 AromaticContact CD1-CZ 3.71Å; W346-F412 AromaticContact CD2-CE1 3.76Å; W346-F412 HydrophobicContact CD2-CE1 3.76Å; W346-F412 AromaticContact CD2-CZ 3.79Å; W346-F412 HydrophobicContact CD2-CZ 3.79Å; W346-F412 AromaticContact CE3-CE1 3.9Å; W346-F412 HydrophobicContact CE3-CE1 3.9Å; W346-F412 HydrophobicContact CE3-CZ 4.39Å; W346-F412 AromaticContact CG-CE1 3.8Å; W346-F412 HydrophobicContact CG-CE1 3.8Å; W346-F412 AromaticContact CG-CZ 3.55Å; W346-F412 HydrophobicContact CG-CZ 3.55Å
347	R	98.1	Very high	97.6	Very high	116 Å²	116	45.2 Å²	45.2	44%	0.438	23%	0.231	S	C	.	.	H	α-helix	trans	-63	-54.7	178.1	179.4	-175.9	-73.1	-91.8	12.7	110.1	H219 N345 M349 I350 D351	H219-R347 WeakPolarHBondContact CE1-CA 3.39Å; N345-R347 PolarHBondContact O-N 2.93Å; N345-R347 WeakPolarHBondContact OD1-CB 3.3Å; N345-R347 PolarHBondContact OD1-N 2.69Å; N345-R347 VanDerWaalsContact OD1-N 3.14Å; R347-M349 VanDerWaalsContact C-N 3.27Å; R347-M349 PolarHBondContact O-N 2.73Å; R347-I350 PolarHBondContact O-N 3.24Å; R347-D351 WeakPolarHBondContact O-CB 3.26Å; R347-D351 VanDerWaalsContact O-CG 3.28Å; R347-D351 PolarHBondContact O-N 2.93Å
348	E	98.3	Very high	97.5	Very high	84 Å²	84	50.4 Å²	50.4	39%	0.393	27%	0.267	S	S	.	.	H	α-helix	trans	-58.5	-39.6	175.4	-71.5	166.8	-154.5	0	0	112	T343 S344 N345 L352	T343-E348 HydrophobicContact CG2-CB 3.86Å; S344-E348 PolarHBondContact N-OE2 3.05Å; N345-E348 VanDerWaalsContact ND2-CD 3.31Å; N345-E348 PolarHBondContact ND2-OE1 2.94Å; N345-E348 PolarHBondContact OD1-N 2.06Å; E348-L352 WeakPolarHBondContact O-CB 3.31Å; E348-L352 PolarHBondContact O-N 3.03Å
349	M	98.4	Very high	97.2	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-62.2	-45.9	178.6	-176.3	-85.7	-66	0	0	111.7	P340 T343 N345 W346 R347 Y353 I369 F412 V440 A445	P340-M349 HydrophobicContact CB-CB 4.07Å; P340-M349 HydrophobicContact CB-CG 4.18Å; P340-M349 HydrophobicContact CG-CB 4.23Å; T343-M349 WeakPolarHBondContact OG1-CA 3.27Å; T343-M349 WeakPolarHBondContact OG1-CB 3.34Å; T343-M349 PolarHBondContact OG1-N 2.65Å; N345-M349 WeakPolarHBondContact O-CB 3.32Å; N345-M349 PolarHBondContact O-N 2.83Å; N345-M349 VanDerWaalsContact O-N 3.07Å; W346-M349 PolarHBondContact O-N 3.42Å; R347-M349 VanDerWaalsContact C-N 3.27Å; R347-M349 PolarHBondContact O-N 2.73Å; M349-Y353 WeakPolarHBondContact O-CB 3.38Å; M349-Y353 PolarHBondContact O-N 2.73Å; M349-I369 HydrophobicContact CE-CD1 4.18Å; M349-F412 HydrophobicContact CE-CD2 4.35Å; M349-F412 HydrophobicContact CE-CE2 3.62Å; M349-F412 HydrophobicContact CE-CZ 4.12Å; M349-V440 HydrophobicContact SD-CG1 4.12Å; M349-A445 HydrophobicContact CE-CB 4.1Å; M349-A445 HydrophobicContact CG-CB 4.03Å; M349-A445 HydrophobicContact SD-CB 3.99Å
350	I	98.3	Very high	96.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68	-45.6	179.9	-71.5	175.9	0	0	0	110.3	Y328 W346 R347 L352 Y353 L354 L367 F412	Y328-I350 HydrophobicContact CD2-CD1 4.07Å; Y328-I350 HydrophobicContact CE2-CD1 3.97Å; Y328-I350 HydrophobicContact CE2-CG2 4.15Å; Y328-I350 HydrophobicContact CG-CD1 4.5Å; W346-I350 WeakPolarHBondContact O-CB 3.43Å; W346-I350 VanDerWaalsContact O-CG1 3.27Å; W346-I350 WeakPolarHBondContact O-CG1 3.4Å; W346-I350 PolarHBondContact O-N 2.78Å; R347-I350 PolarHBondContact O-N 3.24Å; I350-L352 VanDerWaalsContact C-N 3.34Å; I350-L352 PolarHBondContact O-N 3.08Å; I350-Y353 PolarHBondContact O-N 2.89Å; I350-L354 HydrophobicContact CG2-CD1 3.57Å; I350-L354 HydrophobicContact CG2-CG 4.14Å; I350-L354 VanDerWaalsContact O-CB 3.32Å; I350-L354 WeakPolarHBondContact O-CB 3.03Å; I350-L354 VanDerWaalsContact O-CG 3.28Å; I350-L354 WeakPolarHBondContact O-CG 3.09Å; I350-L354 PolarHBondContact O-N 3.46Å; I350-L367 HydrophobicContact CD1-CD1 4.04Å; I350-L367 HydrophobicContact CG1-CD1 4.16Å; I350-L367 HydrophobicContact CG2-CD1 3.95Å; I350-L367 HydrophobicContact CG2-CD2 4.49Å; I350-F412 HydrophobicContact CD1-CB 4.21Å; I350-F412 HydrophobicContact CD1-CD1 4.01Å; I350-F412 HydrophobicContact CD1-CD2 4.2Å; I350-F412 HydrophobicContact CD1-CE1 4.43Å; I350-F412 HydrophobicContact CD1-CG 3.89Å
351	D	97.6	Very high	96.5	Very high	85 Å²	85	60.4 Å²	60.4	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-42.9	178.4	-67.9	-21.2	0	0	0	111.3	R347 S355	R347-D351 WeakPolarHBondContact O-CB 3.26Å; R347-D351 VanDerWaalsContact O-CG 3.28Å; R347-D351 PolarHBondContact O-N 2.93Å; D351-S355 WeakPolarHBondContact O-CB 3.17Å; D351-S355 PolarHBondContact O-N 3.33Å; D351-S355 PolarHBondContact O-OG 3.48Å
352	L	98.1	Very high	96.2	Very high	52 Å²	52	61.4 Å²	61.4	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-62.4	-49.1	174.8	-173.7	72.5	0	0	0	111.1	R342 T343 E348 I350 S355 H356 Y444	R342-L352 HydrophobicContact CB-CD2 4.19Å; T343-L352 HydrophobicContact CG2-CB 4.4Å; T343-L352 HydrophobicContact CG2-CD2 3.82Å; E348-L352 WeakPolarHBondContact O-CB 3.31Å; E348-L352 PolarHBondContact O-N 3.03Å; I350-L352 VanDerWaalsContact C-N 3.34Å; I350-L352 PolarHBondContact O-N 3.08Å; L352-S355 PolarHBondContact O-OG 3.15Å; L352-H356 WeakPolarHBondContact CD1-CE1 3.49Å; L352-H356 PolarHBondContact O-N 2.81Å; L352-H356 VanDerWaalsContact O-N 3.14Å; L352-H356 PolarHBondContact O-ND1 3.13Å; L352-Y444 HydrophobicContact CD2-CD1 4.02Å; L352-Y444 HydrophobicContact CD2-CE1 3.94Å; L352-Y444 HydrophobicContact CG-CD1 4.35Å; L352-Y444 HydrophobicContact CG-CE1 3.97Å
353	Y	98.1	Very high	95.9	Very high	32 Å²	32	59 Å²	59	13%	0.125	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-44.6	-178.9	174.4	-98.6	0	0	0	112.3	M349 I350 H356 A357 L367 L438 Y439 V440 Y444	M349-Y353 WeakPolarHBondContact O-CB 3.38Å; M349-Y353 PolarHBondContact O-N 2.73Å; I350-Y353 PolarHBondContact O-N 2.89Å; Y353-H356 PolarHBondContact O-N 3.08Å; Y353-A357 HydrophobicContact CE1-CB 4.34Å; Y353-A357 VanDerWaalsContact O-CB 3.29Å; Y353-A357 WeakPolarHBondContact O-CB 3.5Å; Y353-A357 PolarHBondContact O-N 3.08Å; Y353-L367 HydrophobicContact CD1-CD2 3.49Å; Y353-L367 VanDerWaalsContact CD1-CD2 3.49Å; Y353-L367 HydrophobicContact CE1-CD2 3.81Å; Y353-L438 HydrophobicContact CE1-CB 4.01Å; Y353-L438 HydrophobicContact CE1-CD1 4Å; Y353-Y439 PolarHBondContact OH-O 2.83Å; Y353-V440 HydrophobicContact CD1-CG2 4.02Å; Y353-V440 HydrophobicContact CD2-CB 4.49Å; Y353-V440 HydrophobicContact CD2-CG1 4Å; Y353-V440 HydrophobicContact CD2-CG2 4.49Å; Y353-V440 HydrophobicContact CE1-CG2 4.01Å; Y353-V440 HydrophobicContact CE2-CB 4.42Å; Y353-V440 HydrophobicContact CE2-CG1 4.36Å; Y353-V440 HydrophobicContact CE2-CG2 4.49Å; Y353-V440 HydrophobicContact CG-CG1 4.23Å; Y353-V440 HydrophobicContact CG-CG2 4.26Å; Y353-Y444 HydrophobicContact CD2-CD1 4.39Å; Y353-Y444 HydrophobicContact CD2-CD2 4.11Å; Y353-Y444 HydrophobicContact CD2-CE1 4.48Å; Y353-Y444 HydrophobicContact CD2-CE2 4.23Å; Y353-Y444 HydrophobicContact CD2-CG 4.21Å
354	L	97	Very high	95.7	Very high	6 Å²	6	58 Å²	58	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-38.1	-178.1	-72.4	176.4	0	0	0	112.6	I350 A357 S358 K359 P361 V364 L367 L438	I350-L354 HydrophobicContact CG2-CD1 3.57Å; I350-L354 HydrophobicContact CG2-CG 4.14Å; I350-L354 VanDerWaalsContact O-CB 3.32Å; I350-L354 WeakPolarHBondContact O-CB 3.03Å; I350-L354 VanDerWaalsContact O-CG 3.28Å; I350-L354 WeakPolarHBondContact O-CG 3.09Å; I350-L354 PolarHBondContact O-N 3.46Å; L354-A357 PolarHBondContact O-N 3.49Å; L354-S358 PolarHBondContact O-N 3.19Å; L354-K359 HydrophobicContact CD2-CB 3.95Å; L354-K359 PolarHBondContact O-N 2.93Å; L354-P361 HydrophobicContact CD1-CB 3.69Å; L354-V364 HydrophobicContact CD2-CG1 4.29Å; L354-L367 HydrophobicContact CD2-CD2 3.99Å; L354-L367 HydrophobicContact CG-CD2 4.22Å; L354-L438 HydrophobicContact CD2-CD1 3.86Å
355	S	96.7	Very high	95.7	Very high	77 Å²	77	54.9 Å²	54.9	54%	0.538	30%	0.298	S	S	.	.	H	α-helix	trans	-62.6	-46.1	172.9	55.7	0	0	0	0	111.5	D351 L352 A357 S358	D351-S355 WeakPolarHBondContact O-CB 3.17Å; D351-S355 PolarHBondContact O-N 3.33Å; D351-S355 PolarHBondContact O-OG 3.48Å; L352-S355 PolarHBondContact O-OG 3.15Å; S355-A357 PolarHBondContact O-N 2.8Å; S355-S358 PolarHBondContact O-N 3.23Å; S355-S358 VanDerWaalsContact O-N 3.15Å
356	H	96.7	Very high	95.6	Very high	115 Å²	115	53.1 Å²	53.1	53%	0.532	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-40.8	175.5	-76.5	74.1	0	0	0	112.3	L352 Y353 S358 Y444	L352-H356 WeakPolarHBondContact CD1-CE1 3.49Å; L352-H356 PolarHBondContact O-N 2.81Å; L352-H356 VanDerWaalsContact O-N 3.14Å; L352-H356 PolarHBondContact O-ND1 3.13Å; Y353-H356 PolarHBondContact O-N 3.08Å; H356-S358 PolarHBondContact O-N 2.95Å; H356-Y444 WeakPolarHBondContact CB-OH 3.36Å; H356-Y444 PolarHBondContact CD2-OH 3.27Å; H356-Y444 VanDerWaalsContact CD2-OH 3.23Å; H356-Y444 VanDerWaalsContact CG-OH 3.22Å
357	A	94.6	Very high	95.6	Very high	35 Å²	35	53.1 Å²	53.1	29%	0.289	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-5.2	178.6	0	0	0	0	0	113.5	Y353 L354 S355 K359	Y353-A357 HydrophobicContact CE1-CB 4.34Å; Y353-A357 VanDerWaalsContact O-CB 3.29Å; Y353-A357 WeakPolarHBondContact O-CB 3.5Å; Y353-A357 PolarHBondContact O-N 3.08Å; L354-A357 PolarHBondContact O-N 3.49Å; S355-A357 PolarHBondContact O-N 2.8Å; A357-K359 HydrophobicContact CB-CB 4.5Å; A357-K359 HydrophobicContact CB-CG 3.97Å; A357-K359 WeakPolarHBondContact O-CG 3.16Å; A357-K359 PolarHBondContact O-N 3.16Å
358	S	94.7	Very high	95.5	Very high	109 Å²	109	47.7 Å²	47.7	76%	0.762	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	43.7	-173.4	-59.1	0	0	0	0	112.3	L354 S355 H356	L354-S358 PolarHBondContact O-N 3.19Å; S355-S358 PolarHBondContact O-N 3.23Å; S355-S358 VanDerWaalsContact O-N 3.15Å; H356-S358 PolarHBondContact O-N 2.95Å
359	K	92.9	Very high	95.5	Very high	103 Å²	103	43.7 Å²	43.7	45%	0.448	25%	0.25	S	C	.	.			trans	-114.1	139.1	-179.9	-64.6	-58.5	-177.7	-176.2	0	110.8	L354 A357 V364 L438	L354-K359 HydrophobicContact CD2-CB 3.95Å; L354-K359 PolarHBondContact O-N 2.93Å; A357-K359 HydrophobicContact CB-CB 4.5Å; A357-K359 HydrophobicContact CB-CG 3.97Å; A357-K359 WeakPolarHBondContact O-CG 3.16Å; A357-K359 PolarHBondContact O-N 3.16Å; K359-V364 HydrophobicContact CB-CG1 4.42Å; K359-L438 HydrophobicContact CB-CD1 4.06Å; K359-L438 HydrophobicContact CG-CD1 3.83Å
360	S	92.4	Very high	95.5	Very high	54 Å²	54	46.8 Å²	46.8	38%	0.378	26%	0.261	S	S	.	.			trans	-70	133.2	173.4	169.6	0	0	0	0	110.5	D362 N363	S360-D362 PolarHBondContact O-N 3.09Å; S360-D362 PolarHBondContact OG-N 2.61Å; S360-N363 PolarHBondContact O-N 3.28Å
361	P	90.3	Very high	95.4	Very high	56 Å²	56	46.8 Å²	46.8	36%	0.364	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.8	175.3	26.8	-34.7	0	0	0	113.7	L354 K414	L354-P361 HydrophobicContact CD1-CB 3.69Å; P361-K414 WeakPolarHBondContact O-CD 3.35Å; P361-K414 VanDerWaalsContact O-CE 3.3Å; P361-K414 WeakPolarHBondContact O-CE 3.5Å; P361-K414 PolarHBondContact O-NZ 3.02Å
362	D	91.4	Very high	95.4	Very high	92 Å²	92	42.8 Å²	42.8	49%	0.492	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-22.7	-177.7	-64.7	-36.3	0	0	0	113.3	S360 K414 N417	S360-D362 PolarHBondContact O-N 3.09Å; S360-D362 PolarHBondContact OG-N 2.61Å; D362-K414 IonicContact OD1-NZ 3.53Å; D362-K414 PolarHBondContact OD1-NZ 2.91Å; D362-N417 PolarHBondContact O-ND2 2.83Å
363	N	89.9	Confident	95.3	Very high	88 Å²	88	40.3 Å²	40.3	47%	0.471	23%	0.227	S	C	.	.	S	Bend	trans	-105.8	26.6	-174.8	-68.1	-12.6	0	0	0	113.2	S360 A435	S360-N363 PolarHBondContact O-N 3.28Å; N363-A435 WeakPolarHBondContact O-CA 3.2Å; N363-A435 WeakPolarHBondContact O-CB 3.24Å; N363-A435 PolarHBondContact O-N 2.94Å
364	V	94.6	Very high	95.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-111.5	143	175	-65.9	0	0	0	0	111	L354 K359 K414 N417 V434 A435 L438	L354-V364 HydrophobicContact CD2-CG1 4.29Å; K359-V364 HydrophobicContact CB-CG1 4.42Å; V364-K414 WeakPolarHBondContact O-CB 3.39Å; V364-N417 PolarHBondContact O-ND2 2.97Å; V364-V434 VanDerWaalsContact C-CG1 3.41Å; V364-A435 HydrophobicContact CG1-CB 4.43Å; V364-L438 HydrophobicContact CG1-CD1 3.65Å; V364-L438 HydrophobicContact CG1-CG 4.13Å
365	T	95	Very high	94.9	Very high	9 Å²	9	38.5 Å²	38.5	6%	0.055	22%	0.22	C	C	.	.	S	Bend	trans	-74.5	-35.6	175.2	-56	0	0	0	0	110.8	K414 V418 P426 I429 V434 A435	T365-K414 PolarHBondContact O-N 3.12Å; T365-V418 HydrophobicContact CG2-CG2 3.89Å; T365-V418 WeakPolarHBondContact O-CG2 3.3Å; T365-P426 HydrophobicContact CG2-CB 3.51Å; T365-P426 HydrophobicContact CG2-CG 3.79Å; T365-I429 HydrophobicContact CG2-CG2 3.62Å; T365-V434 WeakPolarHBondContact OG1-CG1 3.4Å; T365-A435 WeakPolarHBondContact CB-O 3.11Å; T365-A435 PolarHBondContact N-O 3.07Å; T365-A435 PolarHBondContact OG1-O 2.94Å
366	G	96.1	Very high	94.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.8	178.3	175.5	0	0	0	0	0	112.7	F412 T437 L438	G366-F412 CarbonylContact C-O 3.57Å; G366-F412 WeakPolarHBondContact CA-O 3.02Å; G366-T437 CarbonylContact O-C 3.48Å; G366-T437 WeakPolarHBondContact O-CA 3.47Å; G366-L438 PolarHBondContact O-N 3.39Å
367	L	97.6	Very high	94.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.9	178.6	-59.7	113.8	0	0	0	109.6	Y328 I350 Y353 L354 S411 F412 L438 V440	Y328-L367 HydrophobicContact CD1-CD1 4.45Å; Y328-L367 HydrophobicContact CE1-CD1 3.69Å; I350-L367 HydrophobicContact CD1-CD1 4.04Å; I350-L367 HydrophobicContact CG1-CD1 4.16Å; I350-L367 HydrophobicContact CG2-CD1 3.95Å; I350-L367 HydrophobicContact CG2-CD2 4.49Å; Y353-L367 HydrophobicContact CD1-CD2 3.49Å; Y353-L367 VanDerWaalsContact CD1-CD2 3.49Å; Y353-L367 HydrophobicContact CE1-CD2 3.81Å; L354-L367 HydrophobicContact CD2-CD2 3.99Å; L354-L367 HydrophobicContact CG-CD2 4.22Å; L367-S411 CarbonylContact O-C 3.56Å; L367-S411 WeakPolarHBondContact O-CA 3.28Å; L367-F412 HydrophobicContact CB-CB 4.33Å; L367-F412 HydrophobicContact CB-CD2 4.49Å; L367-F412 HydrophobicContact CD1-CB 4.31Å; L367-F412 PolarHBondContact N-O 3.32Å; L367-F412 PolarHBondContact O-N 3.28Å; L367-L438 CarbonylContact C-O 3.54Å; L367-L438 WeakPolarHBondContact CA-O 3.39Å; L367-V440 HydrophobicContact CB-CG2 3.84Å; L367-V440 HydrophobicContact CD2-CG2 3.99Å
368	S	97.6	Very high	93.6	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.5	-176.3	-160.9	0	0	0	0	111.7	S409 S411 L438 V440	S368-S409 VanDerWaalsContact OG-CB 3.26Å; S368-S409 WeakPolarHBondContact OG-CB 3.39Å; S368-S411 WeakPolarHBondContact CA-OG 3.48Å; S368-S411 WeakPolarHBondContact CB-OG 3.38Å; S368-S411 PolarHBondContact OG-OG 2.9Å; S368-L438 PolarHBondContact N-O 2.79Å; S368-V440 PolarHBondContact O-N 2.82Å
369	I	98.2	Very high	92.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.4	179.9	-45.4	-52.5	0	0	0	109.5	V338 M349 S409 K410 F412 V440 A445 K447	V338-I369 HydrophobicContact CG1-CB 4.43Å; V338-I369 HydrophobicContact CG1-CG1 3.91Å; V338-I369 HydrophobicContact CG1-CG2 4.23Å; M349-I369 HydrophobicContact CE-CD1 4.18Å; I369-S409 WeakPolarHBondContact O-CA 3.1Å; I369-S409 WeakPolarHBondContact O-CB 3.47Å; I369-K410 PolarHBondContact N-O 3.23Å; I369-K410 PolarHBondContact O-N 3.15Å; I369-F412 HydrophobicContact CD1-CD2 4.22Å; I369-F412 HydrophobicContact CD1-CE2 4.06Å; I369-F412 HydrophobicContact CG1-CD2 4.1Å; I369-F412 HydrophobicContact CG1-CE2 3.8Å; I369-V440 HydrophobicContact CD1-CB 3.57Å; I369-V440 HydrophobicContact CD1-CG1 4Å; I369-V440 HydrophobicContact CD1-CG2 3.54Å; I369-A445 HydrophobicContact CD1-CB 4.24Å; I369-A445 HydrophobicContact CG2-CB 4.07Å; I369-K447 HydrophobicContact CG2-CB 4.22Å
370	R	97.3	Very high	91.4	Very high	66 Å²	66	32.5 Å²	32.5	25%	0.249	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-73.4	153.7	-178.1	-62.3	173.5	61.7	-163.7	-4.4	111.5	I402 T403 K447	R370-I402 HydrophobicContact CB-CG2 3.54Å; R370-I402 PolarHBondContact NH2-O 2.99Å; R370-T403 PolarHBondContact NE-O 3.15Å; R370-T403 PolarHBondContact NH2-O 3.45Å; R370-K447 PolarHBondContact O-N 3.49Å
371	N	97	Very high	90.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	135.9	-173.6	173.1	113.5	0	0	0	111.9	F373 I402 T403 F408 K447 H449	N371-F373 WeakPolarHBondContact ND2-CD2 3.33Å; N371-F373 VanDerWaalsContact ND2-CE2 3.27Å; N371-F373 WeakPolarHBondContact ND2-CE2 3.46Å; N371-F373 WeakPolarHBondContact ND2-CZ 3.49Å; N371-I402 WeakPolarHBondContact O-CG2 3.42Å; N371-T403 HydrophobicContact CB-CG2 3.8Å; N371-T403 WeakPolarHBondContact CB-OG1 3.3Å; N371-T403 PolarHBondContact N-OG1 3.23Å; N371-T403 VanDerWaalsContact N-OG1 3.14Å; N371-T403 PolarHBondContact O-N 2.64Å; N371-T403 PolarHBondContact O-OG1 3.18Å; N371-F408 HydrophobicContact CB-CB 3.93Å; N371-K447 CarbonylContact C-O 3.55Å; N371-K447 WeakPolarHBondContact CA-O 2.94Å; N371-K447 WeakPolarHBondContact OD1-CE 3.01Å; N371-K447 PolarHBondContact OD1-NZ 3.31Å; N371-H449 WeakPolarHBondContact OD1-CB 3.38Å; N371-H449 PolarHBondContact OD1-ND1 3.2Å
372	A	96.8	Very high	88.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.7	165.6	0	0	0	0	0	109.7	Y374 V446 K447 H449	A372-Y374 HydrophobicContact CB-CE2 4.17Å; A372-V446 HydrophobicContact CB-CG2 3.47Å; A372-V446 VanDerWaalsContact CB-CG2 3.47Å; A372-K447 PolarHBondContact N-O 3.18Å; A372-H449 PolarHBondContact O-N 3.46Å
373	F	96	Very high	87.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	119.9	179.5	-71.8	-72.4	0	0	0	111.1	N371 F375 R398 S399 T403 F408 H449 T451 P455 L458 L465	N371-F373 WeakPolarHBondContact ND2-CD2 3.33Å; N371-F373 VanDerWaalsContact ND2-CE2 3.27Å; N371-F373 WeakPolarHBondContact ND2-CE2 3.46Å; N371-F373 WeakPolarHBondContact ND2-CZ 3.49Å; F373-F375 HydrophobicContact CB-CD2 4.05Å; F373-F375 HydrophobicContact CB-CE2 3.53Å; F373-F375 HydrophobicContact CB-CZ 3.8Å; F373-F375 HydrophobicContact CD1-CZ 4.29Å; F373-F375 HydrophobicContact CG-CE2 4.2Å; F373-F375 HydrophobicContact CG-CZ 4Å; F373-R398 CarbonylContact O-C 3.6Å; F373-R398 VanDerWaalsContact O-CA 3.24Å; F373-R398 WeakPolarHBondContact O-CA 3.27Å; F373-R398 WeakPolarHBondContact O-CB 3.37Å; F373-S399 PolarHBondContact O-N 3.22Å; F373-T403 HydrophobicContact CD2-CG2 4.21Å; F373-T403 HydrophobicContact CE2-CG2 3.56Å; F373-T403 HydrophobicContact CZ-CG2 4.31Å; F373-F408 HydrophobicContact CE2-CD2 4.34Å; F373-F408 AromaticContact CZ-CD2 3.83Å; F373-F408 HydrophobicContact CZ-CD2 3.83Å; F373-F408 HydrophobicContact CZ-CE2 4.23Å; F373-F408 HydrophobicContact CZ-CG 4.11Å; F373-H449 HydrophobicContact CD1-CB 4.32Å; F373-H449 AromaticContact CD1-ND1 3.89Å; F373-H449 AromaticContact CE1-CE1 3.83Å; F373-H449 AromaticContact CE1-ND1 3.39Å; F373-H449 WeakPolarHBondContact CE1-ND1 3.46Å; F373-T451 HydrophobicContact CD1-CG2 4.12Å; F373-P455 HydrophobicContact CE1-CG 3.82Å; F373-P455 HydrophobicContact CZ-CG 3.92Å; F373-L458 HydrophobicContact CE2-CD1 3.73Å; F373-L458 HydrophobicContact CZ-CD1 3.78Å; F373-L465 HydrophobicContact CD2-CD1 3.93Å; F373-L465 HydrophobicContact CE2-CD1 4.1Å
374	Y	95.2	Very high	85.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	103.2	168.7	-74.2	-104	0	0	0	106.7	A372 H395 M397 R398 N448 H449 Y450 T451 D472 N474	A372-Y374 HydrophobicContact CB-CE2 4.17Å; Y374-H395 HydrophobicContact CD1-CB 4.46Å; Y374-H395 VanDerWaalsContact CD1-O 3.29Å; Y374-H395 WeakPolarHBondContact CD1-O 3.36Å; Y374-H395 WeakPolarHBondContact CE1-O 3.37Å; Y374-M397 WeakPolarHBondContact CD1-O 3.35Å; Y374-R398 HydrophobicContact CD1-CB 3.8Å; Y374-R398 HydrophobicContact CD2-CB 3.81Å; Y374-R398 HydrophobicContact CE1-CB 3.77Å; Y374-R398 HydrophobicContact CE1-CG 4.21Å; Y374-R398 HydrophobicContact CE2-CB 3.76Å; Y374-R398 HydrophobicContact CE2-CG 4.18Å; Y374-R398 HydrophobicContact CG-CB 3.82Å; Y374-N448 HydrophobicContact CD2-CB 3.91Å; Y374-N448 HydrophobicContact CE2-CB 3.76Å; Y374-N448 WeakPolarHBondContact CE2-OD1 3.36Å; Y374-H449 PolarHBondContact N-O 2.86Å; Y374-Y450 VanDerWaalsContact CB-CD1 3.48Å; Y374-Y450 HydrophobicContact CD1-CD1 4.46Å; Y374-Y450 AromaticContact CD1-CE1 3.95Å; Y374-Y450 HydrophobicContact CD1-CE1 3.95Å; Y374-Y450 HydrophobicContact CD2-CE1 4.39Å; Y374-Y450 HydrophobicContact CG-CD1 4.01Å; Y374-Y450 AromaticContact CG-CE1 3.8Å; Y374-Y450 HydrophobicContact CG-CE1 3.8Å; Y374-Y450 CarbonylContact O-C 3.53Å; Y374-Y450 VanDerWaalsContact O-CA 3.29Å; Y374-Y450 WeakPolarHBondContact O-CA 3.48Å; Y374-T451 PolarHBondContact O-N 2.96Å; Y374-D472 WeakPolarHBondContact OH-CB 3.14Å; Y374-D472 PolarHBondContact OH-O 2.8Å; Y374-D472 VanDerWaalsContact OH-O 3.08Å; Y374-N474 PolarHBondContact OH-ND2 3.36Å
375	F	92.8	Very high	84	Confident	1 Å²	1	44.5 Å²	44.5	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	131.4	-178.8	-65.2	-82.1	0	0	0	111.3	F373 N377 L378 S399 T451 C454 L465 L466	F373-F375 HydrophobicContact CB-CD2 4.05Å; F373-F375 HydrophobicContact CB-CE2 3.53Å; F373-F375 HydrophobicContact CB-CZ 3.8Å; F373-F375 HydrophobicContact CD1-CZ 4.29Å; F373-F375 HydrophobicContact CG-CE2 4.2Å; F373-F375 HydrophobicContact CG-CZ 4Å; F375-N377 WeakPolarHBondContact CB-OD1 3.43Å; F375-N377 PolarHBondContact O-N 2.96Å; F375-N377 VanDerWaalsContact O-N 3.09Å; F375-L378 HydrophobicContact CB-CD1 3.88Å; F375-L378 HydrophobicContact CB-CG 3.93Å; F375-L378 HydrophobicContact CD2-CD1 3.99Å; F375-L378 HydrophobicContact CG-CD1 4.44Å; F375-L378 WeakPolarHBondContact O-CB 3.29Å; F375-L378 PolarHBondContact O-N 2.78Å; F375-S399 WeakPolarHBondContact CE2-OG 3.47Å; F375-T451 WeakPolarHBondContact CA-O 3.37Å; F375-T451 HydrophobicContact CD1-CG2 3.7Å; F375-T451 WeakPolarHBondContact CD1-O 3.37Å; F375-T451 HydrophobicContact CE1-CG2 3.69Å; F375-C454 HydrophobicContact CE1-CB 4.49Å; F375-L465 HydrophobicContact CE2-CB 3.98Å; F375-L465 HydrophobicContact CZ-CB 4.41Å; F375-L466 HydrophobicContact CB-CD2 3.96Å; F375-L466 HydrophobicContact CD1-CD2 3.9Å; F375-L466 HydrophobicContact CD2-CD2 3.52Å; F375-L466 HydrophobicContact CD2-CG 4.44Å; F375-L466 HydrophobicContact CE1-CD2 4.24Å; F375-L466 HydrophobicContact CE2-CD2 3.87Å; F375-L466 HydrophobicContact CE2-CG 4.35Å; F375-L466 HydrophobicContact CG-CD2 3.53Å; F375-L466 HydrophobicContact CZ-CD2 4.22Å
376	D	89.3	Confident	82.3	Confident	35 Å²	35	51 Å²	51	19%	0.187	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-57.9	-28.2	-177.9	-69.1	-11.2	0	0	0	112.5	L378 H391 H395 T451 F452	D376-L378 VanDerWaalsContact C-N 3.33Å; D376-L378 PolarHBondContact O-N 3.26Å; D376-H391 IonicContact OD1-CE1 3.19Å; D376-H391 PolarHBondContact OD1-CE1 3.48Å; D376-H391 VanDerWaalsContact OD1-CE1 3.27Å; D376-H391 IonicContact OD1-NE2 3.99Å; D376-H391 PolarHBondContact OD1-NE2 2.78Å; D376-H391 IonicContact OD2-NE2 2.65Å; D376-H395 IonicContact OD1-CD2 3.47Å; D376-H395 IonicContact OD1-CE1 3.24Å; D376-H395 IonicContact OD1-NE2 3.64Å; D376-T451 PolarHBondContact N-O 3.07Å; D376-T451 VanDerWaalsContact N-O 3.08Å; D376-F452 HydrophobicContact CB-CB 4.31Å; D376-F452 HydrophobicContact CB-CD2 3.94Å
377	N	86	Confident	80.8	Confident	89 Å²	89	52.2 Å²	52.2	48%	0.476	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-83.2	-2.4	-179.7	70.2	-30.9	0	0	0	114.6	F375	F375-N377 WeakPolarHBondContact CB-OD1 3.43Å; F375-N377 PolarHBondContact O-N 2.96Å; F375-N377 VanDerWaalsContact O-N 3.09Å
378	L	83.9	Confident	79.3	Confident	36 Å²	36	59.5 Å²	59.5	19%	0.188	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-90	-9.2	175.1	-63.6	176.1	0	0	0	112.7	F375 D376 M397 L466 T469	F375-L378 HydrophobicContact CB-CD1 3.88Å; F375-L378 HydrophobicContact CB-CG 3.93Å; F375-L378 HydrophobicContact CD2-CD1 3.99Å; F375-L378 HydrophobicContact CG-CD1 4.44Å; F375-L378 WeakPolarHBondContact O-CB 3.29Å; F375-L378 PolarHBondContact O-N 2.78Å; D376-L378 VanDerWaalsContact C-N 3.33Å; D376-L378 PolarHBondContact O-N 3.26Å; L378-M397 HydrophobicContact CB-CB 3.77Å; L378-M397 WeakPolarHBondContact O-CG 3.49Å; L378-L466 WeakPolarHBondContact CD2-O 3.28Å; L378-T469 HydrophobicContact CD1-CG2 3.5Å; L378-T469 VanDerWaalsContact CD1-CG2 3.5Å; L378-T469 HydrophobicContact CD2-CG2 3.81Å; L378-T469 HydrophobicContact CG-CG2 4.25Å
379	E	74	Confident	78.7	Confident	29 Å²	29	64.8 Å²	64.8	14%	0.136	32%	0.322	C	S	.	.	S	Bend	trans	-77.7	143.6	-173.4	-161.7	49.8	-127.9	0	0	111.5	N383 H395 R396	E379-N383 HydrophobicContact CG-CB 3.83Å; E379-N383 WeakPolarHBondContact OE1-CB 3.36Å; E379-N383 PolarHBondContact OE1-ND2 3.23Å; E379-H395 VanDerWaalsContact OE2-CA 3.31Å; E379-H395 WeakPolarHBondContact OE2-CA 3.45Å; E379-R396 PolarHBondContact OE2-N 3.38Å
380	K	68.7	Low	78.4	Confident	123 Å²	123	66 Å²	66	54%	0.535	33%	0.329	S	S	.	.			trans	-70.8	144.8	-179.1	-64.8	177.6	-177.7	171.2	0	110.1	E382 N383	K380-E382 PolarHBondContact O-N 3.47Å; K380-N383 PolarHBondContact O-N 2.93Å
381	E	64	Low	78.2	Confident	182 Å²	182	63.5 Å²	63.5	85%	0.85	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-51.4	-34.9	-179.5	-68.5	-175.3	168.1	0	0	113.2	N383 V384	E381-N383 PolarHBondContact O-N 3.5Å; E381-N383 VanDerWaalsContact O-N 3.15Å; E381-V384 WeakPolarHBondContact O-CB 3.44Å; E381-V384 VanDerWaalsContact O-CG2 3.28Å; E381-V384 WeakPolarHBondContact O-CG2 3.47Å; E381-V384 PolarHBondContact O-N 2.95Å
382	E	63.1	Low	78	Confident	175 Å²	175	63.8 Å²	63.8	82%	0.818	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23.6	177.9	-63.1	178.5	-179.5	0	0	114.2	K380	K380-E382 PolarHBondContact O-N 3.47Å
383	N	60.7	Low	77.7	Confident	28 Å²	28	63.8 Å²	63.8	15%	0.15	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-97.3	-4.1	-177.6	-74.3	-32.9	0	0	0	113.6	E379 K380 E381 G385 K386 S387	E379-N383 HydrophobicContact CG-CB 3.83Å; E379-N383 WeakPolarHBondContact OE1-CB 3.36Å; E379-N383 PolarHBondContact OE1-ND2 3.23Å; K380-N383 PolarHBondContact O-N 2.93Å; E381-N383 PolarHBondContact O-N 3.5Å; E381-N383 VanDerWaalsContact O-N 3.15Å; N383-G385 VanDerWaalsContact C-N 3.31Å; N383-G385 PolarHBondContact O-N 2.91Å; N383-K386 PolarHBondContact O-N 3.48Å; N383-K386 VanDerWaalsContact O-N 3.13Å; N383-S387 VanDerWaalsContact O-CB 3.28Å; N383-S387 WeakPolarHBondContact O-CB 3.45Å; N383-S387 PolarHBondContact O-N 3.4Å
384	V	57.9	Low	77.4	Confident	97 Å²	97	64.2 Å²	64.2	59%	0.588	32%	0.324	S	S	*	.	H	α-helix	trans	-59.1	-39.9	-176.9	176.4	0	0	0	0	112	E381 S387	E381-V384 WeakPolarHBondContact O-CB 3.44Å; E381-V384 VanDerWaalsContact O-CG2 3.28Å; E381-V384 WeakPolarHBondContact O-CG2 3.47Å; E381-V384 PolarHBondContact O-N 2.95Å; V384-S387 WeakPolarHBondContact O-CB 3.33Å; V384-S387 PolarHBondContact O-N 3.18Å
385	G	57.3	Low	77.3	Confident	62 Å²	62	64.5 Å²	64.5	64%	0.639	33%	0.326	S	S	*	.	H	α-helix	trans	-68.5	-38.4	176.8	0	0	0	0	0	113.8	N383	N383-G385 VanDerWaalsContact C-N 3.31Å; N383-G385 PolarHBondContact O-N 2.91Å
386	K	59.5	Low	77.2	Confident	145 Å²	145	68 Å²	68	63%	0.63	34%	0.339	S	S	*	.	H	α-helix	trans	-71.5	-33.7	176.8	-68.9	176.7	-177	166	0	111.8	N383 H388 R389 L390	N383-K386 PolarHBondContact O-N 3.48Å; N383-K386 VanDerWaalsContact O-N 3.13Å; K386-H388 PolarHBondContact O-N 2.89Å; K386-R389 PolarHBondContact O-N 2.74Å; K386-R389 VanDerWaalsContact O-N 3.14Å; K386-L390 PolarHBondContact O-N 2.93Å; K386-L390 VanDerWaalsContact O-N 3.1Å
387	S	63.2	Low	77.4	Confident	26 Å²	26	67.9 Å²	67.9	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-58.9	-26.6	176.9	166.1	0	0	0	0	113.7	N383 V384 R389 H391 S394 H395	N383-S387 VanDerWaalsContact O-CB 3.28Å; N383-S387 WeakPolarHBondContact O-CB 3.45Å; N383-S387 PolarHBondContact O-N 3.4Å; V384-S387 WeakPolarHBondContact O-CB 3.33Å; V384-S387 PolarHBondContact O-N 3.18Å; S387-R389 VanDerWaalsContact C-N 3.35Å; S387-R389 PolarHBondContact O-N 2.89Å; S387-H391 WeakPolarHBondContact O-CA 3.39Å; S387-S394 WeakPolarHBondContact CA-OG 3.49Å; S387-S394 WeakPolarHBondContact CB-OG 3.43Å; S387-H395 PolarHBondContact OG-CE1 2.94Å
388	H	68	Low	77.8	Confident	152 Å²	152	64.7 Å²	64.7	70%	0.704	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-28.2	177.4	-162.8	61.3	0	0	0	113.7	K386	K386-H388 PolarHBondContact O-N 2.89Å
389	R	84.6	Confident	78.3	Confident	115 Å²	115	63 Å²	63	43%	0.434	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-49.8	180	-66.5	-170.9	70.1	-159	-10.9	113	L235 K386 S387 F486 D487	L235-R389 HydrophobicContact CD1-CG 4.46Å; K386-R389 PolarHBondContact O-N 2.74Å; K386-R389 VanDerWaalsContact O-N 3.14Å; S387-R389 VanDerWaalsContact C-N 3.35Å; S387-R389 PolarHBondContact O-N 2.89Å; R389-F486 HydrophobicContact CB-CE1 4.3Å; R389-F486 HydrophobicContact CB-CZ 4.34Å; R389-F486 WeakPolarHBondContact O-CE2 3.46Å; R389-F486 WeakPolarHBondContact O-CZ 3.41Å; R389-D487 IonicContact CZ-OD1 2.78Å; R389-D487 IonicContact NH2-OD1 3.67Å; R389-D487 PolarHBondContact NH2-OD1 3.4Å
390	L	90.7	Very high	79.3	Confident	26 Å²	26	68 Å²	68	14%	0.136	33%	0.328	C	S	.	.			trans	-123.1	80.8	-177.7	-74.5	166.6	0	0	0	109	E239 K386 S394 I483 F486	E239-L390 HydrophobicContact CB-CD2 4.31Å; E239-L390 HydrophobicContact CG-CD2 3.87Å; E239-L390 WeakPolarHBondContact OE1-CA 3.47Å; K386-L390 PolarHBondContact O-N 2.93Å; K386-L390 VanDerWaalsContact O-N 3.1Å; L390-S394 WeakPolarHBondContact O-CB 3.43Å; L390-S394 PolarHBondContact O-N 2.91Å; L390-S394 PolarHBondContact O-OG 2.8Å; L390-S394 VanDerWaalsContact O-OG 3.11Å; L390-I483 HydrophobicContact CD1-CB 4.39Å; L390-I483 HydrophobicContact CD1-CG1 3.52Å; L390-F486 HydrophobicContact CD2-CB 4Å; L390-F486 HydrophobicContact CD2-CD1 3.78Å; L390-F486 HydrophobicContact CD2-CD2 3.8Å; L390-F486 HydrophobicContact CD2-CE1 4.15Å; L390-F486 HydrophobicContact CD2-CE2 4.19Å; L390-F486 HydrophobicContact CD2-CG 3.58Å; L390-F486 HydrophobicContact CD2-CZ 4.35Å; L390-F486 HydrophobicContact CG-CD1 4.1Å; L390-F486 HydrophobicContact CG-CE1 4.16Å; L390-F486 HydrophobicContact CG-CG 4.41Å
391	H	92.8	Very high	80.6	Confident	12 Å²	12	65.9 Å²	65.9	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-54.7	-174	179.8	-100.2	0	0	0	111.2	E239 D376 S387 S393 S394 H395	E239-H391 PolarHBondContact OE1-N 3.14Å; E239-H391 WeakPolarHBondContact OE2-CA 3.2Å; E239-H391 PolarHBondContact OE2-N 2.89Å; D376-H391 IonicContact OD1-CE1 3.19Å; D376-H391 PolarHBondContact OD1-CE1 3.48Å; D376-H391 VanDerWaalsContact OD1-CE1 3.27Å; D376-H391 IonicContact OD1-NE2 3.99Å; D376-H391 PolarHBondContact OD1-NE2 2.78Å; D376-H391 IonicContact OD2-NE2 2.65Å; S387-H391 WeakPolarHBondContact O-CA 3.39Å; H391-S393 VanDerWaalsContact C-N 3.29Å; H391-S393 PolarHBondContact O-N 2.91Å; H391-S394 PolarHBondContact O-N 3.49Å; H391-S394 PolarHBondContact O-OG 3.07Å; H391-H395 AromaticContact CD2-CE1 3.13Å; H391-H395 PolarHBondContact CD2-CE1 3.01Å; H391-H395 AromaticContact CD2-ND1 3.57Å; H391-H395 AromaticContact CG-CE1 3.93Å; H391-H395 AromaticContact CG-ND1 3.92Å; H391-H395 AromaticContact NE2-CE1 3.18Å; H391-H395 PolarHBondContact NE2-CE1 2.94Å; H391-H395 AromaticContact NE2-ND1 3.63Å; H391-H395 AromaticContact NE2-NE2 3.77Å; H391-H395 PolarHBondContact O-N 3.2Å; H391-H395 PolarHBondContact O-ND1 3.5Å
392	M	93.6	Very high	82	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.03	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-40.2	-178.5	-61.1	-166.3	167.7	0	0	111.9	E239 W240 L334 L337 Y450 L475	E239-M392 VanDerWaalsContact CD-N 3.26Å; E239-M392 HydrophobicContact CG-CB 4.37Å; E239-M392 PolarHBondContact OE1-N 3.48Å; E239-M392 VanDerWaalsContact OE1-N 3.07Å; E239-M392 PolarHBondContact OE2-N 3.16Å; W240-M392 HydrophobicContact CB-CE 4.24Å; W240-M392 HydrophobicContact CG-CE 4.32Å; L334-M392 WeakPolarHBondContact O-CE 3.47Å; L337-M392 HydrophobicContact CB-SD 4.16Å; L337-M392 HydrophobicContact CD2-SD 4.11Å; M392-Y450 HydrophobicContact CB-CD2 4.33Å; M392-Y450 HydrophobicContact CB-CE1 4.23Å; M392-Y450 HydrophobicContact CB-CE2 3.72Å; M392-Y450 HydrophobicContact CE-CD2 3.98Å; M392-Y450 HydrophobicContact CE-CE2 4.24Å; M392-Y450 HydrophobicContact CG-CD2 3.78Å; M392-Y450 HydrophobicContact CG-CE2 3.57Å; M392-Y450 HydrophobicContact CG-CG 4.4Å; M392-Y450 WeakPolarHBondContact O-CE1 3.18Å; M392-Y450 PolarHBondContact O-OH 3.22Å; M392-Y450 VanDerWaalsContact O-OH 3.09Å; M392-Y450 HydrophobicContact SD-CD2 4.17Å; M392-Y450 HydrophobicContact SD-CE2 3.84Å; M392-L475 HydrophobicContact CB-CD1 4.19Å
393	S	90.6	Very high	83.3	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-72.3	-32.7	-179.8	-150.6	0	0	0	0	112.7	E239 H391 R479	E239-S393 WeakPolarHBondContact OE1-CB 3.21Å; E239-S393 PolarHBondContact OE1-N 3.37Å; H391-S393 VanDerWaalsContact C-N 3.29Å; H391-S393 PolarHBondContact O-N 2.91Å; S393-R479 VanDerWaalsContact O-CZ 3.23Å; S393-R479 PolarHBondContact O-NH1 3.37Å; S393-R479 PolarHBondContact O-NH2 2.93Å; S393-R479 VanDerWaalsContact OG-CZ 3.31Å; S393-R479 PolarHBondContact OG-NH1 3.29Å
394	S	90.2	Very high	84.8	Confident	9 Å²	9	55.2 Å²	55.2	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-77.4	-29.9	-179	68.6	0	0	0	0	113.1	S387 L390 H391 R396	S387-S394 WeakPolarHBondContact CA-OG 3.49Å; S387-S394 WeakPolarHBondContact CB-OG 3.43Å; L390-S394 WeakPolarHBondContact O-CB 3.43Å; L390-S394 PolarHBondContact O-N 2.91Å; L390-S394 PolarHBondContact O-OG 2.8Å; L390-S394 VanDerWaalsContact O-OG 3.11Å; H391-S394 PolarHBondContact O-N 3.49Å; H391-S394 PolarHBondContact O-OG 3.07Å; S394-R396 PolarHBondContact O-N 2.97Å
395	H	91.6	Very high	86.3	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.028	26%	0.255	C	S	.	.			trans	-81.6	104.3	-176.9	-71.6	79.9	0	0	0	110.9	Y374 D376 E379 S387 H391 Y450	Y374-H395 HydrophobicContact CD1-CB 4.46Å; Y374-H395 VanDerWaalsContact CD1-O 3.29Å; Y374-H395 WeakPolarHBondContact CD1-O 3.36Å; Y374-H395 WeakPolarHBondContact CE1-O 3.37Å; D376-H395 IonicContact OD1-CD2 3.47Å; D376-H395 IonicContact OD1-CE1 3.24Å; D376-H395 IonicContact OD1-NE2 3.64Å; E379-H395 VanDerWaalsContact OE2-CA 3.31Å; E379-H395 WeakPolarHBondContact OE2-CA 3.45Å; S387-H395 PolarHBondContact OG-CE1 2.94Å; H391-H395 AromaticContact CD2-CE1 3.13Å; H391-H395 PolarHBondContact CD2-CE1 3.01Å; H391-H395 AromaticContact CD2-ND1 3.57Å; H391-H395 AromaticContact CG-CE1 3.93Å; H391-H395 AromaticContact CG-ND1 3.92Å; H391-H395 AromaticContact NE2-CE1 3.18Å; H391-H395 PolarHBondContact NE2-CE1 2.94Å; H391-H395 AromaticContact NE2-ND1 3.63Å; H391-H395 AromaticContact NE2-NE2 3.77Å; H391-H395 PolarHBondContact O-N 3.2Å; H391-H395 PolarHBondContact O-ND1 3.5Å; H395-Y450 HydrophobicContact CB-CD1 3.82Å; H395-Y450 HydrophobicContact CB-CE1 3.83Å
396	R	91.7	Very high	87.7	Confident	73 Å²	73	53.3 Å²	53.3	28%	0.275	24%	0.235	S	C	.	.			trans	-112.2	-9.3	-175.9	-61	177.8	-171	-173.2	-3.6	112.8	E379 S394 E471 D472 D473	E379-R396 PolarHBondContact OE2-N 3.38Å; S394-R396 PolarHBondContact O-N 2.97Å; R396-E471 HydrophobicContact CB-CG 4.42Å; R396-E471 CarbonylContact O-C 3.46Å; R396-E471 WeakPolarHBondContact O-CA 3.32Å; R396-D472 PolarHBondContact O-N 3.37Å; R396-D473 HydrophobicContact CG-CB 4.33Å; R396-D473 IonicContact CZ-OD2 3.55Å; R396-D473 IonicContact NE-OD2 3.44Å; R396-D473 PolarHBondContact NE-OD2 2.79Å; R396-D473 IonicContact NH1-OD2 3.51Å; R396-D473 IonicContact NH2-OD2 3Å
397	M	93.4	Very high	89.1	Confident	33 Å²	33	48.4 Å²	48.4	16%	0.163	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127	174.8	-62.2	-57.7	-63.5	0	0	110.1	Y374 L378 E471	Y374-M397 WeakPolarHBondContact CD1-O 3.35Å; L378-M397 HydrophobicContact CB-CB 3.77Å; L378-M397 WeakPolarHBondContact O-CG 3.49Å; M397-E471 HydrophobicContact SD-CB 3.89Å; M397-E471 HydrophobicContact SD-CG 4.32Å
398	R	94.6	Very high	90.5	Very high	23 Å²	23	48.5 Å²	48.5	9%	0.087	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	164.1	173.1	66.9	157.7	174.6	90.1	-2.2	112.4	F373 Y374 R400 T469 I470 D472	F373-R398 CarbonylContact O-C 3.6Å; F373-R398 VanDerWaalsContact O-CA 3.24Å; F373-R398 WeakPolarHBondContact O-CA 3.27Å; F373-R398 WeakPolarHBondContact O-CB 3.37Å; Y374-R398 HydrophobicContact CD1-CB 3.8Å; Y374-R398 HydrophobicContact CD2-CB 3.81Å; Y374-R398 HydrophobicContact CE1-CB 3.77Å; Y374-R398 HydrophobicContact CE1-CG 4.21Å; Y374-R398 HydrophobicContact CE2-CB 3.76Å; Y374-R398 HydrophobicContact CE2-CG 4.18Å; Y374-R398 HydrophobicContact CG-CB 3.82Å; R398-R400 PolarHBondContact NH1-O 3.08Å; R398-R400 VanDerWaalsContact NH1-O 3.17Å; R398-R400 PolarHBondContact O-N 3.39Å; R398-T469 CarbonylContact O-C 3.54Å; R398-T469 WeakPolarHBondContact O-CA 3.46Å; R398-T469 WeakPolarHBondContact O-CB 3.33Å; R398-I470 HydrophobicContact CG-CG1 4.15Å; R398-I470 PolarHBondContact N-O 3.36Å; R398-I470 PolarHBondContact O-N 3.08Å; R398-D472 HydrophobicContact CG-CB 3.84Å; R398-D472 IonicContact CZ-OD2 2.74Å; R398-D472 IonicContact NE-OD2 2.75Å; R398-D472 PolarHBondContact NE-OD2 2.89Å; R398-D472 IonicContact NH2-OD2 2.65Å; R398-D472 PolarHBondContact NH2-OD2 2.81Å
399	S	94.8	Very high	91.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	132.2	165.2	-53.3	0	0	0	0	110.2	F373 F375 R401 L465	F373-S399 PolarHBondContact O-N 3.22Å; F375-S399 WeakPolarHBondContact CE2-OG 3.47Å; S399-R401 VanDerWaalsContact C-N 3.25Å; S399-R401 PolarHBondContact O-N 3.11Å; S399-L465 WeakPolarHBondContact CB-O 3.43Å; S399-L465 WeakPolarHBondContact OG-CB 3.34Å; S399-L465 PolarHBondContact OG-O 3.15Å
400	R	95.1	Very high	92.3	Very high	134 Å²	134	35.8 Å²	35.8	51%	0.506	16%	0.158	S	C	.	.	S	Bend	trans	-59.2	-42.2	175.1	-175.5	171.5	-67.7	147.6	4.9	110.9	R398 I402 D468 T469 I470	R398-R400 PolarHBondContact NH1-O 3.08Å; R398-R400 VanDerWaalsContact NH1-O 3.17Å; R398-R400 PolarHBondContact O-N 3.39Å; R400-I402 PolarHBondContact O-N 3.08Å; R400-D468 WeakPolarHBondContact CB-O 3.31Å; R400-D468 WeakPolarHBondContact CD-OD1 3.31Å; R400-D468 IonicContact CZ-OD1 3.01Å; R400-D468 PolarHBondContact N-O 2.94Å; R400-D468 IonicContact NE-OD1 2.79Å; R400-D468 PolarHBondContact NE-OD1 3.42Å; R400-D468 IonicContact NH1-OD1 2.81Å; R400-D468 PolarHBondContact NH1-OD1 3.01Å; R400-D468 IonicContact NH2-OD1 3.75Å; R400-T469 PolarHBondContact NH2-O 2.9Å; R400-I470 HydrophobicContact CB-CG1 4.47Å; R400-I470 HydrophobicContact CB-CG2 4Å; R400-I470 HydrophobicContact CG-CD1 4.42Å; R400-I470 HydrophobicContact CG-CG2 3.91Å
401	R	94.2	Very high	92.7	Very high	79 Å²	79	34.6 Å²	34.6	30%	0.298	15%	0.152	S	C	.	.	S	Bend	trans	-75.9	120.4	179.9	-175.9	174.2	175	-160.4	-9.9	111.6	S399 E461 L465	S399-R401 VanDerWaalsContact C-N 3.25Å; S399-R401 PolarHBondContact O-N 3.11Å; R401-E461 IonicContact CZ-OE1 3.53Å; R401-E461 IonicContact NH1-OE1 2.91Å; R401-E461 PolarHBondContact NH1-OE1 2.88Å; R401-E461 IonicContact NH2-OE1 3.68Å; R401-E461 PolarHBondContact NH2-OE1 2.84Å; R401-E461 IonicContact NH2-OE2 2.91Å; R401-L465 HydrophobicContact CB-CD2 4.05Å; R401-L465 HydrophobicContact CG-CD2 4.48Å
402	I	94.5	Very high	92.9	Very high	29 Å²	29	34 Å²	34	15%	0.149	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-82.5	142.6	168.6	-60.6	177.7	0	0	0	109.4	R370 N371 R400 A442 V446	R370-I402 HydrophobicContact CB-CG2 3.54Å; R370-I402 PolarHBondContact NH2-O 2.99Å; N371-I402 WeakPolarHBondContact O-CG2 3.42Å; R400-I402 PolarHBondContact O-N 3.08Å; I402-A442 HydrophobicContact CD1-CB 3.6Å; I402-V446 HydrophobicContact CD1-CG2 4.34Å
403	T	91.3	Very high	93.2	Very high	9 Å²	9	33.8 Å²	33.8	6%	0.055	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-59.6	157.7	-178.5	65.9	0	0	0	0	112.3	R370 N371 F373 L407 F408	R370-T403 PolarHBondContact NE-O 3.15Å; R370-T403 PolarHBondContact NH2-O 3.45Å; N371-T403 HydrophobicContact CB-CG2 3.8Å; N371-T403 WeakPolarHBondContact CB-OG1 3.3Å; N371-T403 PolarHBondContact N-OG1 3.23Å; N371-T403 VanDerWaalsContact N-OG1 3.14Å; N371-T403 PolarHBondContact O-N 2.64Å; N371-T403 PolarHBondContact O-OG1 3.18Å; F373-T403 HydrophobicContact CD2-CG2 4.21Å; F373-T403 HydrophobicContact CE2-CG2 3.56Å; F373-T403 HydrophobicContact CZ-CG2 4.31Å; T403-L407 VanDerWaalsContact CB-O 3.3Å; T403-L407 WeakPolarHBondContact CB-O 3.36Å; T403-L407 PolarHBondContact OG1-O 3.14Å; T403-F408 HydrophobicContact CG2-CD2 4.17Å
404	R	90.4	Very high	93.5	Very high	123 Å²	123	34.2 Å²	34.2	46%	0.464	15%	0.15	S	C	.	.	P	Polyproline II helix	trans	-65.6	157.9	173.5	-65.7	-175.9	-179.7	131.6	5.6	110.7	G406 L407 E461	R404-G406 PolarHBondContact O-N 3.31Å; R404-L407 WeakPolarHBondContact O-CB 3.31Å; R404-L407 PolarHBondContact O-N 3.44Å; R404-E461 IonicContact NH2-OE1 2.79Å
405	Q	90.3	Very high	93.8	Very high	98 Å²	98	33.8 Å²	33.8	46%	0.458	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	132.4	172.9	-69.7	177.6	1.8	0	0	110.9	L407 Y439	Q405-L407 PolarHBondContact O-N 3.36Å; Q405-Y439 HydrophobicContact CB-CD1 3.56Å; Q405-Y439 HydrophobicContact CB-CD2 4.32Å; Q405-Y439 HydrophobicContact CB-CE1 3.71Å; Q405-Y439 HydrophobicContact CB-CE2 4.43Å; Q405-Y439 HydrophobicContact CB-CG 3.88Å; Q405-Y439 HydrophobicContact CG-CD1 3.78Å; Q405-Y439 HydrophobicContact CG-CD2 4.28Å; Q405-Y439 HydrophobicContact CG-CE1 4.42Å; Q405-Y439 HydrophobicContact CG-CG 3.69Å
406	G	85.7	Confident	94	Very high	20 Å²	20	35.4 Å²	35.4	21%	0.206	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	-11.1	179.4	0	0	0	0	0	115.6	R404 S409	R404-G406 PolarHBondContact O-N 3.31Å; G406-S409 PolarHBondContact N-OG 3.25Å
407	L	89.8	Confident	94.2	Very high	42 Å²	42	32 Å²	32	22%	0.22	15%	0.146	C	C	.	.	S	Bend	trans	-93.4	115.7	179.5	-172.2	67.1	0	0	0	110.5	T403 R404 Q405 S409 L458	T403-L407 VanDerWaalsContact CB-O 3.3Å; T403-L407 WeakPolarHBondContact CB-O 3.36Å; T403-L407 PolarHBondContact OG1-O 3.14Å; R404-L407 WeakPolarHBondContact O-CB 3.31Å; R404-L407 PolarHBondContact O-N 3.44Å; Q405-L407 PolarHBondContact O-N 3.36Å; L407-S409 PolarHBondContact O-N 3.44Å; L407-L458 HydrophobicContact CD2-CD2 4.28Å
408	F	91.8	Very high	94.3	Very high	29 Å²	29	30.4 Å²	30.4	13%	0.127	14%	0.139	C	C	.	.	S	Bend	trans	54.5	13.2	-172.8	-53.7	-76.4	0	0	0	114.4	N371 F373 T403 K447 P455 E457 L458	N371-F408 HydrophobicContact CB-CB 3.93Å; F373-F408 HydrophobicContact CE2-CD2 4.34Å; F373-F408 AromaticContact CZ-CD2 3.83Å; F373-F408 HydrophobicContact CZ-CD2 3.83Å; F373-F408 HydrophobicContact CZ-CE2 4.23Å; F373-F408 HydrophobicContact CZ-CG 4.11Å; T403-F408 HydrophobicContact CG2-CD2 4.17Å; F408-K447 PolarHBondContact O-NZ 3.44Å; F408-P455 HydrophobicContact CD1-CG 4.49Å; F408-P455 HydrophobicContact CE1-CB 3.68Å; F408-P455 HydrophobicContact CE1-CG 3.85Å; F408-P455 HydrophobicContact CZ-CB 3.55Å; F408-P455 HydrophobicContact CZ-CG 3.93Å; F408-E457 HydrophobicContact CZ-CB 4.15Å; F408-L458 HydrophobicContact CD2-CD2 4.46Å; F408-L458 HydrophobicContact CE2-CD1 4.19Å; F408-L458 HydrophobicContact CE2-CD2 3.61Å; F408-L458 HydrophobicContact CE2-CG 3.74Å; F408-L458 HydrophobicContact CZ-CD2 4.39Å; F408-L458 HydrophobicContact CZ-CG 4.07Å
409	S	95	Very high	94.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.134	C	C	.	.			trans	-67.1	158.9	178.8	-51.1	0	0	0	0	110.8	S368 I369 G406 L407 H424	S368-S409 VanDerWaalsContact OG-CB 3.26Å; S368-S409 WeakPolarHBondContact OG-CB 3.39Å; I369-S409 WeakPolarHBondContact O-CA 3.1Å; I369-S409 WeakPolarHBondContact O-CB 3.47Å; G406-S409 PolarHBondContact N-OG 3.25Å; L407-S409 PolarHBondContact O-N 3.44Å; S409-H424 WeakPolarHBondContact O-CA 3.3Å; S409-H424 VanDerWaalsContact O-CB 3.31Å; S409-H424 WeakPolarHBondContact O-CB 3.5Å; S409-H424 PolarHBondContact O-ND1 3.14Å
410	K	97.3	Very high	94.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.4	166.1	-66.9	-62.7	-152.4	150.5	0	108.2	L330 L331 V332 D333 E336 I369 N423 K447	L330-K410 HydrophobicContact CD1-CB 4.36Å; L331-K410 WeakPolarHBondContact O-CD 3.48Å; L331-K410 VanDerWaalsContact O-CE 3.27Å; L331-K410 WeakPolarHBondContact O-CE 3.45Å; L331-K410 WeakPolarHBondContact O-CG 3.36Å; L331-K410 PolarHBondContact O-NZ 2.99Å; V332-K410 HydrophobicContact CG1-CB 4.28Å; V332-K410 HydrophobicContact CG1-CG 4.2Å; D333-K410 IonicContact OD1-NZ 3.88Å; D333-K410 PolarHBondContact OD1-NZ 3.03Å; E336-K410 WeakPolarHBondContact OE2-CE 3.39Å; E336-K410 IonicContact OE2-NZ 2.73Å; I369-K410 PolarHBondContact N-O 3.23Å; I369-K410 PolarHBondContact O-N 3.15Å; K410-N423 WeakPolarHBondContact CD-O 3.44Å; K410-N423 PolarHBondContact NZ-O 3.37Å; K410-N423 VanDerWaalsContact NZ-O 3.14Å; K410-N423 PolarHBondContact NZ-OD1 3.07Å; K410-K447 HydrophobicContact CB-CD 3.86Å; K410-K447 HydrophobicContact CG-CD 3.38Å; K410-K447 HydrophobicContact CG-CG 4.49Å
411	S	97.7	Very high	94.6	Very high	1 Å²	1	23 Å²	23	1%	0.007	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.2	-169.2	-50.6	0	0	0	0	111.3	L367 S368 M413 H424	L367-S411 CarbonylContact O-C 3.56Å; L367-S411 WeakPolarHBondContact O-CA 3.28Å; S368-S411 WeakPolarHBondContact CA-OG 3.48Å; S368-S411 WeakPolarHBondContact CB-OG 3.38Å; S368-S411 PolarHBondContact OG-OG 2.9Å; S411-M413 PolarHBondContact O-N 3.09Å; S411-H424 PolarHBondContact OG-O 2.88Å
412	F	98.4	Very high	94.6	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	106.3	161.9	-64.5	-88.6	0	0	0	107.7	T220 Y328 L330 V338 W346 M349 I350 G366 L367 I369	T220-F412 HydrophobicContact CG2-CD1 4.1Å; T220-F412 HydrophobicContact CG2-CE1 4.04Å; Y328-F412 HydrophobicContact CD1-CB 3.96Å; Y328-F412 HydrophobicContact CG-CB 4.25Å; L330-F412 HydrophobicContact CB-CD1 4.05Å; L330-F412 HydrophobicContact CB-CE1 4.15Å; L330-F412 HydrophobicContact CD1-CD1 4.29Å; L330-F412 HydrophobicContact CD1-CD2 4.47Å; L330-F412 HydrophobicContact CD1-CE1 4.3Å; L330-F412 HydrophobicContact CD1-CE2 4.48Å; L330-F412 HydrophobicContact CD1-CG 4.37Å; L330-F412 HydrophobicContact CD1-CZ 4.39Å; L330-F412 HydrophobicContact CD2-CD1 4.42Å; L330-F412 HydrophobicContact CD2-CE1 3.76Å; L330-F412 HydrophobicContact CD2-CZ 3.92Å; L330-F412 HydrophobicContact CG-CD1 4.47Å; L330-F412 HydrophobicContact CG-CE1 4.28Å; V338-F412 HydrophobicContact CG1-CE2 3.84Å; V338-F412 HydrophobicContact CG1-CZ 3.87Å; W346-F412 HydrophobicContact CB-CE1 3.96Å; W346-F412 HydrophobicContact CB-CZ 3.94Å; W346-F412 AromaticContact CD1-CZ 3.71Å; W346-F412 AromaticContact CD2-CE1 3.76Å; W346-F412 HydrophobicContact CD2-CE1 3.76Å; W346-F412 AromaticContact CD2-CZ 3.79Å; W346-F412 HydrophobicContact CD2-CZ 3.79Å; W346-F412 AromaticContact CE3-CE1 3.9Å; W346-F412 HydrophobicContact CE3-CE1 3.9Å; W346-F412 HydrophobicContact CE3-CZ 4.39Å; W346-F412 AromaticContact CG-CE1 3.8Å; W346-F412 HydrophobicContact CG-CE1 3.8Å; W346-F412 AromaticContact CG-CZ 3.55Å; W346-F412 HydrophobicContact CG-CZ 3.55Å; M349-F412 HydrophobicContact CE-CD2 4.35Å; M349-F412 HydrophobicContact CE-CE2 3.62Å; M349-F412 HydrophobicContact CE-CZ 4.12Å; I350-F412 HydrophobicContact CD1-CB 4.21Å; I350-F412 HydrophobicContact CD1-CD1 4.01Å; I350-F412 HydrophobicContact CD1-CD2 4.2Å; I350-F412 HydrophobicContact CD1-CE1 4.43Å; I350-F412 HydrophobicContact CD1-CG 3.89Å; G366-F412 CarbonylContact C-O 3.57Å; G366-F412 WeakPolarHBondContact CA-O 3.02Å; L367-F412 HydrophobicContact CB-CB 4.33Å; L367-F412 HydrophobicContact CB-CD2 4.49Å; L367-F412 HydrophobicContact CD1-CB 4.31Å; L367-F412 PolarHBondContact N-O 3.32Å; L367-F412 PolarHBondContact O-N 3.28Å; I369-F412 HydrophobicContact CD1-CD2 4.22Å; I369-F412 HydrophobicContact CD1-CE2 4.06Å; I369-F412 HydrophobicContact CG1-CD2 4.1Å; I369-F412 HydrophobicContact CG1-CE2 3.8Å
413	M	98	Very high	94.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	122.4	-178.6	-54.7	-167.2	-170.2	0	0	109.3	Y328 A329 L331 S411 I415 V418 A421 F422 P426	Y328-M413 CarbonylContact C-O 3.47Å; Y328-M413 VanDerWaalsContact CA-O 3.24Å; Y328-M413 WeakPolarHBondContact CA-O 3.29Å; A329-M413 PolarHBondContact N-O 3.34Å; A329-M413 PolarHBondContact O-N 3.07Å; L331-M413 HydrophobicContact CD1-CE 3.89Å; L331-M413 HydrophobicContact CD1-SD 4.21Å; L331-M413 HydrophobicContact CD2-CE 3.91Å; L331-M413 HydrophobicContact CG-CE 4.42Å; S411-M413 PolarHBondContact O-N 3.09Å; M413-I415 PolarHBondContact O-N 3.32Å; M413-I415 VanDerWaalsContact O-N 3.12Å; M413-V418 HydrophobicContact CB-CG2 4.11Å; M413-V418 HydrophobicContact SD-CG1 4.27Å; M413-A421 HydrophobicContact CE-CB 4.01Å; M413-A421 HydrophobicContact SD-CB 3.52Å; M413-A421 VanDerWaalsContact SD-CB 3.52Å; M413-F422 WeakPolarHBondContact CE-O 3.27Å; M413-P426 HydrophobicContact CB-CG 4.24Å; M413-P426 HydrophobicContact CG-CG 3.85Å; M413-P426 HydrophobicContact SD-CG 4.2Å
414	K	97.4	Very high	94.4	Very high	11 Å²	11	22 Å²	22	5%	0.048	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	106.6	176.9	-179.6	74.4	177.1	-157.3	0	108.4	T327 Y328 P361 D362 V364 T365 S416 N417 V418	T327-K414 HydrophobicContact CG2-CD 4.02Å; Y328-K414 HydrophobicContact CD1-CB 4.31Å; Y328-K414 HydrophobicContact CD1-CD 4.44Å; Y328-K414 HydrophobicContact CE1-CB 4.01Å; Y328-K414 HydrophobicContact CE1-CD 3.85Å; P361-K414 WeakPolarHBondContact O-CD 3.35Å; P361-K414 VanDerWaalsContact O-CE 3.3Å; P361-K414 WeakPolarHBondContact O-CE 3.5Å; P361-K414 PolarHBondContact O-NZ 3.02Å; D362-K414 IonicContact OD1-NZ 3.53Å; D362-K414 PolarHBondContact OD1-NZ 2.91Å; V364-K414 WeakPolarHBondContact O-CB 3.39Å; T365-K414 PolarHBondContact O-N 3.12Å; K414-S416 WeakPolarHBondContact CE-OG 3.43Å; K414-S416 WeakPolarHBondContact CG-OG 3.41Å; K414-S416 PolarHBondContact O-N 3.43Å; K414-N417 HydrophobicContact CB-CB 4.45Å; K414-N417 HydrophobicContact CG-CB 4.32Å; K414-N417 PolarHBondContact O-N 2.92Å; K414-V418 WeakPolarHBondContact O-CG2 3.36Å; K414-V418 PolarHBondContact O-N 2.9Å; K414-V418 VanDerWaalsContact O-N 3.15Å
415	I	96.9	Very high	94.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-35.3	-167.1	-60.5	-174.1	0	0	0	111.9	R111 V221 L319 H322 I323 H326 T327 A329 M413 N417	R111-I415 WeakPolarHBondContact CD-O 3.46Å; R111-I415 PolarHBondContact NH1-O 3.21Å; V221-I415 HydrophobicContact CG1-CD1 4.1Å; L319-I415 HydrophobicContact CD1-CB 4.48Å; L319-I415 HydrophobicContact CD1-CG1 4.04Å; L319-I415 HydrophobicContact CD1-CG2 4.32Å; H322-I415 HydrophobicContact CB-CD1 4.08Å; I323-I415 HydrophobicContact CG1-CG2 4.2Å; H326-I415 HydrophobicContact CB-CD1 3.92Å; T327-I415 PolarHBondContact O-N 2.74Å; A329-I415 HydrophobicContact CB-CD1 3.93Å; A329-I415 HydrophobicContact CB-CG1 3.96Å; M413-I415 PolarHBondContact O-N 3.32Å; M413-I415 VanDerWaalsContact O-N 3.12Å; I415-N417 PolarHBondContact O-N 3.1Å
416	S	95.1	Very high	94.7	Very high	40 Å²	40	14.4 Å²	14.4	28%	0.28	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.7	177	60.7	0	0	0	0	113.6	K414	K414-S416 WeakPolarHBondContact CE-OG 3.43Å; K414-S416 WeakPolarHBondContact CG-OG 3.41Å; K414-S416 PolarHBondContact O-N 3.43Å
417	N	95.6	Very high	95	Very high	1 Å²	1	14 Å²	14	1%	0.005	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-16.6	-169.4	-60.4	-6.7	0	0	0	113.1	D362 V364 K414 I415 I429 V430 V434	D362-N417 PolarHBondContact O-ND2 2.83Å; V364-N417 PolarHBondContact O-ND2 2.97Å; K414-N417 HydrophobicContact CB-CB 4.45Å; K414-N417 HydrophobicContact CG-CB 4.32Å; K414-N417 PolarHBondContact O-N 2.92Å; I415-N417 PolarHBondContact O-N 3.1Å; N417-I429 CarbonylContact O-C 3.59Å; N417-I429 WeakPolarHBondContact O-CA 3.49Å; N417-I429 WeakPolarHBondContact O-CB 3.37Å; N417-V430 PolarHBondContact O-N 2.67Å; N417-V434 HydrophobicContact CB-CG1 4.03Å; N417-V434 HydrophobicContact CB-CG2 4.24Å; N417-V434 WeakPolarHBondContact ND2-CG1 3.46Å
418	V	96.2	Very high	95.2	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	112.5	-173.5	177.2	0	0	0	0	111.1	R111 L319 T365 M413 K414 I420 P426	R111-V418 PolarHBondContact NH1-O 3.26Å; L319-V418 HydrophobicContact CD2-CG1 4.06Å; L319-V418 WeakPolarHBondContact CD2-O 3.14Å; T365-V418 HydrophobicContact CG2-CG2 3.89Å; T365-V418 WeakPolarHBondContact O-CG2 3.3Å; M413-V418 HydrophobicContact CB-CG2 4.11Å; M413-V418 HydrophobicContact SD-CG1 4.27Å; K414-V418 WeakPolarHBondContact O-CG2 3.36Å; K414-V418 PolarHBondContact O-N 2.9Å; K414-V418 VanDerWaalsContact O-N 3.15Å; V418-I420 WeakPolarHBondContact CG1-O 3.4Å; V418-P426 HydrophobicContact CB-CB 4.38Å; V418-P426 HydrophobicContact CG1-CB 3.81Å; V418-P426 HydrophobicContact CG1-CG 4.49Å; V418-P426 HydrophobicContact CG2-CB 3.62Å; V418-P426 HydrophobicContact CG2-CG 3.79Å
419	A	95.7	Very high	95.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-40.3	177.6	0	0	0	0	0	112	E428 V430	A419-E428 HydrophobicContact CB-CB 4.34Å; A419-E428 PolarHBondContact N-O 3.31Å; A419-V430 HydrophobicContact CB-CG2 4.06Å
420	I	97.5	Very high	95.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	129.8	-176.7	-60.3	175.6	0	0	0	109.9	K157 I159 L175 N316 V418 L427 E428	K157-I420 HydrophobicContact CB-CD1 4.46Å; K157-I420 HydrophobicContact CG-CD1 3.72Å; I159-I420 HydrophobicContact CB-CG2 4.17Å; I159-I420 HydrophobicContact CG1-CD1 4.15Å; I159-I420 HydrophobicContact CG1-CG2 3.94Å; I159-I420 HydrophobicContact CG2-CG2 3.39Å; L175-I420 HydrophobicContact CB-CD1 4.28Å; L175-I420 HydrophobicContact CD2-CD1 4.11Å; L175-I420 HydrophobicContact CD2-CG1 3.83Å; N316-I420 VanDerWaalsContact OD1-CA 3.3Å; N316-I420 WeakPolarHBondContact OD1-CA 3.32Å; N316-I420 WeakPolarHBondContact OD1-CG2 3.42Å; V418-I420 WeakPolarHBondContact CG1-O 3.4Å; I420-L427 HydrophobicContact CB-CB 4.24Å; I420-L427 HydrophobicContact CG2-CB 3.97Å; I420-L427 HydrophobicContact CG2-CD2 3.89Å; I420-L427 HydrophobicContact CG2-CG 4.41Å; I420-L427 WeakPolarHBondContact O-CA 3.38Å; I420-L427 WeakPolarHBondContact O-CB 3.33Å; I420-L427 PolarHBondContact O-N 2.78Å; I420-E428 HydrophobicContact CB-CB 3.99Å; I420-E428 HydrophobicContact CB-CG 4.3Å; I420-E428 HydrophobicContact CD1-CB 4.24Å; I420-E428 HydrophobicContact CD1-CG 4Å; I420-E428 HydrophobicContact CG1-CB 4.19Å; I420-E428 HydrophobicContact CG1-CG 4.45Å; I420-E428 PolarHBondContact N-O 2.89Å; I420-E428 PolarHBondContact O-N 2.9Å
421	A	96.9	Very high	94.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	141.8	173.8	0	0	0	0	0	111.9	N316 L319 L331 M413	N316-A421 PolarHBondContact ND2-O 3.34Å; N316-A421 PolarHBondContact OD1-N 3.21Å; L319-A421 HydrophobicContact CD2-CB 4.12Å; L331-A421 HydrophobicContact CD2-CB 4.17Å; M413-A421 HydrophobicContact CE-CB 4.01Å; M413-A421 HydrophobicContact SD-CB 3.52Å; M413-A421 VanDerWaalsContact SD-CB 3.52Å
422	F	94.6	Very high	94.2	Very high	35 Å²	35	17.7 Å²	17.7	15%	0.154	9%	0.093	C	C	.	.			trans	-118.5	160.4	164	-174.7	-107.3	0	0	0	109.8	W164 L312 M413 H424 Y425 L427	W164-F422 HydrophobicContact CE3-CE2 4.19Å; W164-F422 AromaticContact CH2-CD2 3.62Å; W164-F422 HydrophobicContact CH2-CD2 3.62Å; W164-F422 AromaticContact CH2-CE2 3.65Å; W164-F422 HydrophobicContact CH2-CE2 3.65Å; W164-F422 HydrophobicContact CH2-CG 4.14Å; W164-F422 HydrophobicContact CH2-CZ 4.18Å; W164-F422 HydrophobicContact CZ2-CE2 4.41Å; W164-F422 AromaticContact CZ3-CD2 3.81Å; W164-F422 HydrophobicContact CZ3-CD2 3.81Å; W164-F422 AromaticContact CZ3-CE2 3.53Å; W164-F422 HydrophobicContact CZ3-CE2 3.53Å; W164-F422 HydrophobicContact CZ3-CZ 4.26Å; L312-F422 HydrophobicContact CD1-CD2 4.28Å; L312-F422 HydrophobicContact CD1-CE2 4.28Å; L312-F422 HydrophobicContact CD2-CD2 3.48Å; L312-F422 VanDerWaalsContact CD2-CD2 3.48Å; L312-F422 HydrophobicContact CD2-CE2 3.87Å; L312-F422 HydrophobicContact CD2-CG 4.44Å; M413-F422 WeakPolarHBondContact CE-O 3.27Å; F422-H424 PolarHBondContact O-N 3.4Å; F422-Y425 WeakPolarHBondContact CA-O 3.35Å; F422-Y425 HydrophobicContact CB-CD2 4.47Å; F422-Y425 HydrophobicContact CB-CE2 4.35Å; F422-Y425 WeakPolarHBondContact CB-O 3.34Å; F422-Y425 HydrophobicContact CD1-CD1 4.2Å; F422-Y425 AromaticContact CD1-CE1 3.7Å; F422-Y425 HydrophobicContact CD1-CE1 3.7Å; F422-Y425 HydrophobicContact CD1-CE2 4.19Å; F422-Y425 AromaticContact CD1-CZ 3.7Å; F422-Y425 HydrophobicContact CE1-CE1 4.12Å; F422-Y425 PolarHBondContact N-O 2.89Å; F422-Y425 PolarHBondContact O-N 2.81Å; F422-Y425 VanDerWaalsContact O-O 3.11Å; F422-L427 HydrophobicContact CB-CB 4.07Å; F422-L427 HydrophobicContact CB-CD1 4.49Å
423	N	91	Very high	93.6	Very high	21 Å²	21	21.3 Å²	21.3	11%	0.112	13%	0.13	C	C	.	.	S	Bend	trans	-48.8	-33.4	-171.1	-172.2	34.9	0	0	0	115.2	Y315 K410	Y315-N423 HydrophobicContact CE2-CB 3.81Å; Y315-N423 PolarHBondContact OH-OD1 2.63Å; K410-N423 WeakPolarHBondContact CD-O 3.44Å; K410-N423 PolarHBondContact NZ-O 3.37Å; K410-N423 VanDerWaalsContact NZ-O 3.14Å; K410-N423 PolarHBondContact NZ-OD1 3.07Å
424	H	90.9	Very high	93.2	Very high	40 Å²	40	22.2 Å²	22.2	19%	0.185	14%	0.136	C	C	.	.	S	Bend	trans	-110.4	-24	-174.6	-63.2	-61.8	0	0	0	113.9	S409 S411 F422	S409-H424 WeakPolarHBondContact O-CA 3.3Å; S409-H424 VanDerWaalsContact O-CB 3.31Å; S409-H424 WeakPolarHBondContact O-CB 3.5Å; S409-H424 PolarHBondContact O-ND1 3.14Å; S411-H424 PolarHBondContact OG-O 2.88Å; F422-H424 PolarHBondContact O-N 3.4Å
425	Y	92.3	Very high	92.8	Very high	48 Å²	48	22.9 Å²	22.9	19%	0.188	14%	0.143	C	C	.	.	S	Bend	trans	-159	160.5	-168.1	56.4	-99.8	0	0	0	112.6	F422 L427	F422-Y425 WeakPolarHBondContact CA-O 3.35Å; F422-Y425 HydrophobicContact CB-CD2 4.47Å; F422-Y425 HydrophobicContact CB-CE2 4.35Å; F422-Y425 WeakPolarHBondContact CB-O 3.34Å; F422-Y425 HydrophobicContact CD1-CD1 4.2Å; F422-Y425 AromaticContact CD1-CE1 3.7Å; F422-Y425 HydrophobicContact CD1-CE1 3.7Å; F422-Y425 HydrophobicContact CD1-CE2 4.19Å; F422-Y425 AromaticContact CD1-CZ 3.7Å; F422-Y425 HydrophobicContact CE1-CE1 4.12Å; F422-Y425 PolarHBondContact N-O 2.89Å; F422-Y425 PolarHBondContact O-N 2.81Å; F422-Y425 VanDerWaalsContact O-O 3.11Å; Y425-L427 HydrophobicContact CE2-CD1 4.05Å; Y425-L427 PolarHBondContact O-N 2.82Å
426	P	94.6	Very high	92.6	Very high	14 Å²	14	26.5 Å²	26.5	9%	0.091	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	120.6	168.7	-26.2	37.7	0	0	0	112.3	T365 M413 V418	T365-P426 HydrophobicContact CG2-CB 3.51Å; T365-P426 HydrophobicContact CG2-CG 3.79Å; M413-P426 HydrophobicContact CB-CG 4.24Å; M413-P426 HydrophobicContact CG-CG 3.85Å; M413-P426 HydrophobicContact SD-CG 4.2Å; V418-P426 HydrophobicContact CB-CB 4.38Å; V418-P426 HydrophobicContact CG1-CB 3.81Å; V418-P426 HydrophobicContact CG1-CG 4.49Å; V418-P426 HydrophobicContact CG2-CB 3.62Å; V418-P426 HydrophobicContact CG2-CG 3.79Å
427	L	93	Very high	92.5	Very high	13 Å²	13	25.8 Å²	25.8	7%	0.068	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-39.1	-176.2	-171.3	58.4	0	0	0	113.1	I159 W164 I420 F422 Y425	I159-L427 HydrophobicContact CG2-CD2 4.22Å; W164-L427 HydrophobicContact CH2-CD1 3.56Å; W164-L427 HydrophobicContact CH2-CD2 4Å; W164-L427 HydrophobicContact CH2-CG 4.46Å; W164-L427 HydrophobicContact CZ2-CD1 3.89Å; I420-L427 HydrophobicContact CB-CB 4.24Å; I420-L427 HydrophobicContact CG2-CB 3.97Å; I420-L427 HydrophobicContact CG2-CD2 3.89Å; I420-L427 HydrophobicContact CG2-CG 4.41Å; I420-L427 WeakPolarHBondContact O-CA 3.38Å; I420-L427 WeakPolarHBondContact O-CB 3.33Å; I420-L427 PolarHBondContact O-N 2.78Å; F422-L427 HydrophobicContact CB-CB 4.07Å; F422-L427 HydrophobicContact CB-CD1 4.49Å; Y425-L427 HydrophobicContact CE2-CD1 4.05Å; Y425-L427 PolarHBondContact O-N 2.82Å
428	E	93.1	Very high	92.5	Very high	40 Å²	40	26.9 Å²	26.9	19%	0.187	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.2	-178.3	-65.8	-72.4	177.3	0	0	110	K157 A419 I420	K157-E428 WeakPolarHBondContact CE-OE1 3.1Å; K157-E428 IonicContact NZ-OE1 3.95Å; K157-E428 PolarHBondContact NZ-OE1 2.84Å; A419-E428 HydrophobicContact CB-CB 4.34Å; A419-E428 PolarHBondContact N-O 3.31Å; I420-E428 HydrophobicContact CB-CB 3.99Å; I420-E428 HydrophobicContact CB-CG 4.3Å; I420-E428 HydrophobicContact CD1-CB 4.24Å; I420-E428 HydrophobicContact CD1-CG 4Å; I420-E428 HydrophobicContact CG1-CB 4.19Å; I420-E428 HydrophobicContact CG1-CG 4.45Å; I420-E428 PolarHBondContact N-O 2.89Å; I420-E428 PolarHBondContact O-N 2.9Å
429	I	94	Very high	92.5	Very high	42 Å²	42	30.6 Å²	30.6	22%	0.215	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	153.8	-179.4	63.6	-175.6	0	0	0	111.8	T365 N417 H431	T365-I429 HydrophobicContact CG2-CG2 3.62Å; N417-I429 CarbonylContact O-C 3.59Å; N417-I429 WeakPolarHBondContact O-CA 3.49Å; N417-I429 WeakPolarHBondContact O-CB 3.37Å; I429-H431 VanDerWaalsContact CD1-O 3.23Å; I429-H431 WeakPolarHBondContact CD1-O 3.17Å; I429-H431 WeakPolarHBondContact CG1-O 3.38Å
430	V	92.1	Very high	92.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-72.6	-41.9	177.8	173.7	0	0	0	0	111.1	R111 Y112 F115 Y116 N417 A419	R111-V430 HydrophobicContact CB-CG1 4.03Å; R111-V430 HydrophobicContact CB-CG2 4.38Å; Y112-V430 HydrophobicContact CD1-CG1 3.77Å; Y112-V430 HydrophobicContact CE1-CB 4.48Å; Y112-V430 HydrophobicContact CE1-CG1 3.77Å; Y112-V430 HydrophobicContact CG-CG1 4.16Å; F115-V430 HydrophobicContact CD2-CG1 4.1Å; F115-V430 HydrophobicContact CE2-CG1 4.42Å; Y116-V430 WeakPolarHBondContact CE2-O 3.47Å; Y116-V430 PolarHBondContact OH-O 3.49Å; N417-V430 PolarHBondContact O-N 2.67Å; A419-V430 HydrophobicContact CB-CG2 4.06Å
431	H	88.6	Confident	92.5	Very high	20 Å²	20	31.7 Å²	31.7	9%	0.093	19%	0.193	C	C	.	.	S	Bend	trans	-144.9	163.1	-176	72.6	94.6	0	0	0	112.7	F115 Y116 I429 V434	F115-H431 HydrophobicContact CB-CB 3.87Å; F115-H431 HydrophobicContact CD1-CB 4.44Å; F115-H431 AromaticContact CD1-CD2 3.66Å; F115-H431 AromaticContact CD1-CE1 3.75Å; F115-H431 AromaticContact CD1-CG 3.72Å; F115-H431 AromaticContact CD1-ND1 3.79Å; F115-H431 AromaticContact CD1-NE2 3.72Å; F115-H431 HydrophobicContact CD2-CB 4.12Å; F115-H431 AromaticContact CD2-CD2 3.34Å; F115-H431 WeakPolarHBondContact CD2-CD2 3.48Å; F115-H431 AromaticContact CD2-CG 3.8Å; F115-H431 AromaticContact CE1-CD2 3.58Å; F115-H431 AromaticContact CE1-CE1 3.52Å; F115-H431 AromaticContact CE1-NE2 3.24Å; F115-H431 WeakPolarHBondContact CE1-NE2 3.37Å; F115-H431 AromaticContact CE2-CD2 3.27Å; F115-H431 WeakPolarHBondContact CE2-CD2 3.36Å; F115-H431 AromaticContact CE2-NE2 3.62Å; F115-H431 HydrophobicContact CG-CB 3.89Å; F115-H431 AromaticContact CG-CD2 3.55Å; F115-H431 AromaticContact CG-CG 3.58Å; F115-H431 AromaticContact CZ-CD2 3.39Å; F115-H431 WeakPolarHBondContact CZ-CD2 3.21Å; F115-H431 AromaticContact CZ-CE1 3.96Å; F115-H431 AromaticContact CZ-NE2 3.19Å; F115-H431 WeakPolarHBondContact CZ-NE2 3.23Å; Y116-H431 HydrophobicContact CE2-CB 4.17Å; Y116-H431 WeakPolarHBondContact OH-CA 3.48Å; I429-H431 VanDerWaalsContact CD1-O 3.23Å; I429-H431 WeakPolarHBondContact CD1-O 3.17Å; I429-H431 WeakPolarHBondContact CG1-O 3.38Å; H431-V434 WeakPolarHBondContact CE1-CG2 3.48Å; H431-V434 WeakPolarHBondContact NE2-CG2 3.23Å
432	S	86.6	Confident	92.4	Very high	46 Å²	46	32.9 Å²	32.9	32%	0.322	20%	0.202	S	C	.	.	S	Bend	trans	-78.3	167.1	178.2	75.6	0	0	0	0	112.5	Q61 V434	Q61-S432 WeakPolarHBondContact O-CA 3.45Å; Q61-S432 WeakPolarHBondContact O-CB 3.3Å; S432-V434 VanDerWaalsContact C-N 3.26Å; S432-V434 PolarHBondContact O-N 3.3Å
433	G	86.1	Confident	92.5	Very high	76 Å²	76	34.7 Å²	34.7	78%	0.784	21%	0.213	S	C	*	.	S	Bend	trans	78.7	4.9	177.8	0	0	0	0	0	114.7
434	V	87.9	Confident	92.8	Very high	19 Å²	19	34.9 Å²	34.9	12%	0.115	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-81.9	135.6	171.2	-170.5	0	0	0	0	109.5	V364 T365 N417 H431 S432	V364-V434 VanDerWaalsContact C-CG1 3.41Å; T365-V434 WeakPolarHBondContact OG1-CG1 3.4Å; N417-V434 HydrophobicContact CB-CG1 4.03Å; N417-V434 HydrophobicContact CB-CG2 4.24Å; N417-V434 WeakPolarHBondContact ND2-CG1 3.46Å; H431-V434 WeakPolarHBondContact CE1-CG2 3.48Å; H431-V434 WeakPolarHBondContact NE2-CG2 3.23Å; S432-V434 VanDerWaalsContact C-N 3.26Å; S432-V434 PolarHBondContact O-N 3.3Å
435	A	90.6	Very high	93.2	Very high	25 Å²	25	33 Å²	33	21%	0.207	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-60.9	145.3	172.2	0	0	0	0	0	110.7	N363 V364 T365	N363-A435 WeakPolarHBondContact O-CA 3.2Å; N363-A435 WeakPolarHBondContact O-CB 3.24Å; N363-A435 PolarHBondContact O-N 2.94Å; V364-A435 HydrophobicContact CG1-CB 4.43Å; T365-A435 WeakPolarHBondContact CB-O 3.11Å; T365-A435 PolarHBondContact N-O 3.07Å; T365-A435 PolarHBondContact OG1-O 2.94Å
436	P	91.5	Very high	93.4	Very high	77 Å²	77	30.8 Å²	30.8	50%	0.5	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-61.3	171.1	177	28.1	-36.2	0	0	0	111.5	L438	P436-L438 PolarHBondContact O-N 2.54Å
437	T	94	Very high	93.6	Very high	25 Å²	25	30.1 Å²	30.1	15%	0.153	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-58.3	123.1	174.3	-62.3	0	0	0	0	109.8	G366	G366-T437 CarbonylContact O-C 3.48Å; G366-T437 WeakPolarHBondContact O-CA 3.47Å
438	L	95.6	Very high	93.8	Very high	23 Å²	23	29.5 Å²	29.5	12%	0.12	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	140.2	177.9	-57.9	-179	0	0	0	109.8	Y353 L354 K359 V364 G366 L367 S368 P436	Y353-L438 HydrophobicContact CE1-CB 4.01Å; Y353-L438 HydrophobicContact CE1-CD1 4Å; L354-L438 HydrophobicContact CD2-CD1 3.86Å; K359-L438 HydrophobicContact CB-CD1 4.06Å; K359-L438 HydrophobicContact CG-CD1 3.83Å; V364-L438 HydrophobicContact CG1-CD1 3.65Å; V364-L438 HydrophobicContact CG1-CG 4.13Å; G366-L438 PolarHBondContact O-N 3.39Å; L367-L438 CarbonylContact C-O 3.54Å; L367-L438 WeakPolarHBondContact CA-O 3.39Å; S368-L438 PolarHBondContact N-O 2.79Å; P436-L438 PolarHBondContact O-N 2.54Å
439	Y	95.7	Very high	94	Very high	78 Å²	78	28.4 Å²	28.4	31%	0.306	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	107.3	176.1	-64.7	-78.1	0	0	0	110.2	Y353 Q405	Y353-Y439 PolarHBondContact OH-O 2.83Å; Q405-Y439 HydrophobicContact CB-CD1 3.56Å; Q405-Y439 HydrophobicContact CB-CD2 4.32Å; Q405-Y439 HydrophobicContact CB-CE1 3.71Å; Q405-Y439 HydrophobicContact CB-CE2 4.43Å; Q405-Y439 HydrophobicContact CB-CG 3.88Å; Q405-Y439 HydrophobicContact CG-CD1 3.78Å; Q405-Y439 HydrophobicContact CG-CD2 4.28Å; Q405-Y439 HydrophobicContact CG-CE1 4.42Å; Q405-Y439 HydrophobicContact CG-CG 3.69Å
440	V	96.7	Very high	94.1	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.006	17%	0.173	C	C	.	.			trans	-67	136.4	-177.5	179.8	0	0	0	0	109.9	M349 Y353 L367 S368 I369 Y444 A445	M349-V440 HydrophobicContact SD-CG1 4.12Å; Y353-V440 HydrophobicContact CD1-CG2 4.02Å; Y353-V440 HydrophobicContact CD2-CB 4.49Å; Y353-V440 HydrophobicContact CD2-CG1 4Å; Y353-V440 HydrophobicContact CD2-CG2 4.49Å; Y353-V440 HydrophobicContact CE1-CG2 4.01Å; Y353-V440 HydrophobicContact CE2-CB 4.42Å; Y353-V440 HydrophobicContact CE2-CG1 4.36Å; Y353-V440 HydrophobicContact CE2-CG2 4.49Å; Y353-V440 HydrophobicContact CG-CG1 4.23Å; Y353-V440 HydrophobicContact CG-CG2 4.26Å; L367-V440 HydrophobicContact CB-CG2 3.84Å; L367-V440 HydrophobicContact CD2-CG2 3.99Å; S368-V440 PolarHBondContact O-N 2.82Å; I369-V440 HydrophobicContact CD1-CB 3.57Å; I369-V440 HydrophobicContact CD1-CG1 4Å; I369-V440 HydrophobicContact CD1-CG2 3.54Å; V440-Y444 HydrophobicContact CG1-CG 4.43Å; V440-A445 HydrophobicContact CG1-CB 4.48Å
441	G	95.7	Very high	94.1	Very high	23 Å²	23	27.8 Å²	27.8	24%	0.237	18%	0.181	C	C	.	.			trans	-58.8	137.9	175.6	0	0	0	0	0	111	D443 Y444 A445	G441-D443 VanDerWaalsContact C-OD1 3.23Å; G441-D443 VanDerWaalsContact CA-OD1 3.27Å; G441-D443 WeakPolarHBondContact CA-OD1 3.42Å; G441-D443 PolarHBondContact O-N 2.86Å; G441-Y444 PolarHBondContact O-N 2.76Å; G441-A445 PolarHBondContact O-N 3.24Å
442	A	95.8	Very high	94.1	Very high	25 Å²	25	32.9 Å²	32.9	21%	0.207	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-7	179.6	0	0	0	0	0	113.1	L341 I402	L341-A442 WeakPolarHBondContact CD1-O 3.39Å; I402-A442 HydrophobicContact CD1-CB 3.6Å
443	D	96.1	Very high	94	Very high	72 Å²	72	39.7 Å²	39.7	39%	0.385	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-13.9	172.1	61.8	-54	0	0	0	113.3	R342 G441	R342-D443 WeakPolarHBondContact CD-O 3.49Å; R342-D443 WeakPolarHBondContact CG-O 3.32Å; R342-D443 IonicContact CZ-OD2 3.17Å; R342-D443 VanDerWaalsContact CZ-OD2 3.24Å; R342-D443 PolarHBondContact NE-O 2.8Å; R342-D443 IonicContact NE-OD2 2.98Å; R342-D443 IonicContact NH1-OD2 3.12Å; R342-D443 IonicContact NH2-OD2 2.8Å; R342-D443 PolarHBondContact NH2-OD2 2.78Å; G441-D443 VanDerWaalsContact C-OD1 3.23Å; G441-D443 VanDerWaalsContact CA-OD1 3.27Å; G441-D443 WeakPolarHBondContact CA-OD1 3.42Å; G441-D443 PolarHBondContact O-N 2.86Å
444	Y	98.1	Very high	94.1	Very high	25 Å²	25	37.4 Å²	37.4	10%	0.098	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-45.5	173.8	-70	-98	0	0	0	111.8	L341 L352 Y353 H356 V440 G441	L341-Y444 PolarHBondContact N-O 2.87Å; L352-Y444 HydrophobicContact CD2-CD1 4.02Å; L352-Y444 HydrophobicContact CD2-CE1 3.94Å; L352-Y444 HydrophobicContact CG-CD1 4.35Å; L352-Y444 HydrophobicContact CG-CE1 3.97Å; Y353-Y444 HydrophobicContact CD2-CD1 4.39Å; Y353-Y444 HydrophobicContact CD2-CD2 4.11Å; Y353-Y444 HydrophobicContact CD2-CE1 4.48Å; Y353-Y444 HydrophobicContact CD2-CE2 4.23Å; Y353-Y444 HydrophobicContact CD2-CG 4.21Å; H356-Y444 WeakPolarHBondContact CB-OH 3.36Å; H356-Y444 PolarHBondContact CD2-OH 3.27Å; H356-Y444 VanDerWaalsContact CD2-OH 3.23Å; H356-Y444 VanDerWaalsContact CG-OH 3.22Å; V440-Y444 HydrophobicContact CG1-CG 4.43Å; G441-Y444 PolarHBondContact O-N 2.76Å
445	A	98.2	Very high	94	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	152.6	-180	0	0	0	0	0	111.8	V339 M349 I369 V440 G441	V339-A445 VanDerWaalsContact O-CA 3.27Å; V339-A445 WeakPolarHBondContact O-CA 3.4Å; M349-A445 HydrophobicContact CE-CB 4.1Å; M349-A445 HydrophobicContact CG-CB 4.03Å; M349-A445 HydrophobicContact SD-CB 3.99Å; I369-A445 HydrophobicContact CD1-CB 4.24Å; I369-A445 HydrophobicContact CG2-CB 4.07Å; V440-A445 HydrophobicContact CG1-CB 4.48Å; G441-A445 PolarHBondContact O-N 3.24Å
446	V	98	Very high	93.6	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.2	172.6	67.1	0	0	0	0	109.9	V339 L341 A372 I402 N474	V339-V446 PolarHBondContact N-O 3.14Å; V339-V446 PolarHBondContact O-N 2.7Å; L341-V446 HydrophobicContact CD1-CG1 4.38Å; L341-V446 HydrophobicContact CD2-CG1 4.16Å; A372-V446 HydrophobicContact CB-CG2 3.47Å; A372-V446 VanDerWaalsContact CB-CG2 3.47Å; I402-V446 HydrophobicContact CD1-CG2 4.34Å; V446-N474 VanDerWaalsContact CG1-ND2 3.34Å; V446-N474 WeakPolarHBondContact CG1-ND2 3.32Å
447	K	98.1	Very high	93.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	106.8	170.9	-169.7	-152.3	77.1	173.1	0	108.8	E336 L337 V338 I369 R370 N371 A372 F408 K410	E336-K447 HydrophobicContact CB-CD 4.24Å; E336-K447 HydrophobicContact CB-CG 4.48Å; E336-K447 VanDerWaalsContact CD-NZ 3.31Å; E336-K447 HydrophobicContact CG-CD 4.37Å; E336-K447 IonicContact OE1-NZ 2.77Å; E336-K447 PolarHBondContact OE1-NZ 3.42Å; E336-K447 IonicContact OE2-NZ 3.15Å; L337-K447 CarbonylContact O-C 3.59Å; L337-K447 WeakPolarHBondContact O-CA 3.05Å; V338-K447 HydrophobicContact CG2-CB 4.18Å; V338-K447 HydrophobicContact CG2-CG 3.92Å; I369-K447 HydrophobicContact CG2-CB 4.22Å; R370-K447 PolarHBondContact O-N 3.49Å; N371-K447 CarbonylContact C-O 3.55Å; N371-K447 WeakPolarHBondContact CA-O 2.94Å; N371-K447 WeakPolarHBondContact OD1-CE 3.01Å; N371-K447 PolarHBondContact OD1-NZ 3.31Å; A372-K447 PolarHBondContact N-O 3.18Å; F408-K447 PolarHBondContact O-NZ 3.44Å; K410-K447 HydrophobicContact CB-CD 3.86Å; K410-K447 HydrophobicContact CG-CD 3.38Å; K410-K447 HydrophobicContact CG-CG 4.49Å
448	N	97.9	Very high	92.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	131	170.1	-63.3	1.1	0	0	0	108.2	E336 L337 Y374 Y450 N474	E336-N448 CarbonylContact C-O 3.57Å; E336-N448 VanDerWaalsContact CA-O 3.25Å; E336-N448 WeakPolarHBondContact CA-O 3.49Å; L337-N448 PolarHBondContact N-O 3.4Å; L337-N448 PolarHBondContact O-N 2.93Å; Y374-N448 HydrophobicContact CD2-CB 3.91Å; Y374-N448 HydrophobicContact CE2-CB 3.76Å; Y374-N448 WeakPolarHBondContact CE2-OD1 3.36Å; N448-Y450 HydrophobicContact CB-CD2 4.43Å; N448-Y450 HydrophobicContact CB-CE2 3.63Å; N448-Y450 PolarHBondContact ND2-OH 2.8Å; N448-Y450 VanDerWaalsContact ND2-OH 3.07Å; N448-N474 PolarHBondContact ND2-ND2 2.95Å; N448-N474 PolarHBondContact ND2-OD1 2.84Å; N448-N474 PolarHBondContact OD1-ND2 2.86Å
449	H	97	Very high	92.2	Very high	18 Å²	18	43.9 Å²	43.9	8%	0.083	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	107	175.8	-178.5	177.4	0	0	0	107.9	D335 E336 N371 A372 F373 Y374	D335-H449 IonicContact OD2-CD2 2.84Å; D335-H449 IonicContact OD2-NE2 3.89Å; E336-H449 HydrophobicContact CG-CB 4.33Å; E336-H449 IonicContact OE1-ND1 3.91Å; N371-H449 WeakPolarHBondContact OD1-CB 3.38Å; N371-H449 PolarHBondContact OD1-ND1 3.2Å; A372-H449 PolarHBondContact O-N 3.46Å; F373-H449 HydrophobicContact CD1-CB 4.32Å; F373-H449 AromaticContact CD1-ND1 3.89Å; F373-H449 AromaticContact CE1-CE1 3.83Å; F373-H449 AromaticContact CE1-ND1 3.39Å; F373-H449 WeakPolarHBondContact CE1-ND1 3.46Å; Y374-H449 PolarHBondContact N-O 2.86Å
450	Y	95.3	Very high	91.7	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	121.1	-176.5	-57.1	-88.9	0	0	0	109.4	D335 L337 Y374 M392 H395 N448 L475	D335-Y450 WeakPolarHBondContact CB-O 3.13Å; D335-Y450 WeakPolarHBondContact O-CD2 3.39Å; D335-Y450 PolarHBondContact O-N 2.67Å; L337-Y450 HydrophobicContact CB-CE2 4.5Å; Y374-Y450 VanDerWaalsContact CB-CD1 3.48Å; Y374-Y450 HydrophobicContact CD1-CD1 4.46Å; Y374-Y450 AromaticContact CD1-CE1 3.95Å; Y374-Y450 HydrophobicContact CD1-CE1 3.95Å; Y374-Y450 HydrophobicContact CD2-CE1 4.39Å; Y374-Y450 HydrophobicContact CG-CD1 4.01Å; Y374-Y450 AromaticContact CG-CE1 3.8Å; Y374-Y450 HydrophobicContact CG-CE1 3.8Å; Y374-Y450 CarbonylContact O-C 3.53Å; Y374-Y450 VanDerWaalsContact O-CA 3.29Å; Y374-Y450 WeakPolarHBondContact O-CA 3.48Å; M392-Y450 HydrophobicContact CB-CD2 4.33Å; M392-Y450 HydrophobicContact CB-CE1 4.23Å; M392-Y450 HydrophobicContact CB-CE2 3.72Å; M392-Y450 HydrophobicContact CE-CD2 3.98Å; M392-Y450 HydrophobicContact CE-CE2 4.24Å; M392-Y450 HydrophobicContact CG-CD2 3.78Å; M392-Y450 HydrophobicContact CG-CE2 3.57Å; M392-Y450 HydrophobicContact CG-CG 4.4Å; M392-Y450 WeakPolarHBondContact O-CE1 3.18Å; M392-Y450 PolarHBondContact O-OH 3.22Å; M392-Y450 VanDerWaalsContact O-OH 3.09Å; M392-Y450 HydrophobicContact SD-CD2 4.17Å; M392-Y450 HydrophobicContact SD-CE2 3.84Å; H395-Y450 HydrophobicContact CB-CD1 3.82Å; H395-Y450 HydrophobicContact CB-CE1 3.83Å; N448-Y450 HydrophobicContact CB-CD2 4.43Å; N448-Y450 HydrophobicContact CB-CE2 3.63Å; N448-Y450 PolarHBondContact ND2-OH 2.8Å; N448-Y450 VanDerWaalsContact ND2-OH 3.07Å; Y450-L475 WeakPolarHBondContact OH-CD1 3.46Å
451	T	92.6	Very high	91.1	Very high	25 Å²	25	49.1 Å²	49.1	15%	0.153	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	142.2	-175	-169.2	0	0	0	0	112.9	F373 Y374 F375 D376 R453	F373-T451 HydrophobicContact CD1-CG2 4.12Å; Y374-T451 PolarHBondContact O-N 2.96Å; F375-T451 WeakPolarHBondContact CA-O 3.37Å; F375-T451 HydrophobicContact CD1-CG2 3.7Å; F375-T451 WeakPolarHBondContact CD1-O 3.37Å; F375-T451 HydrophobicContact CE1-CG2 3.69Å; D376-T451 PolarHBondContact N-O 3.07Å; D376-T451 VanDerWaalsContact N-O 3.08Å; T451-R453 WeakPolarHBondContact CG2-O 3.01Å; T451-R453 PolarHBondContact OG1-N 3.47Å; T451-R453 PolarHBondContact OG1-O 2.96Å; T451-R453 VanDerWaalsContact OG1-O 3.1Å
452	F	88.3	Confident	90.7	Very high	127 Å²	127	49 Å²	49	56%	0.557	26%	0.258	S	S	*	.	S	Bend	trans	-75.1	-26.9	172.9	-175.5	-101.1	0	0	0	112.6	D376	D376-F452 HydrophobicContact CB-CB 4.31Å; D376-F452 HydrophobicContact CB-CD2 3.94Å
453	R	85.8	Confident	90.3	Very high	188 Å²	188	54.9 Å²	54.9	71%	0.709	28%	0.281	S	S	*	.	S	Bend	trans	-128.2	144.3	-172	-58.6	-169.2	177.7	176.4	-0.6	111.9	T451	T451-R453 WeakPolarHBondContact CG2-O 3.01Å; T451-R453 PolarHBondContact OG1-N 3.47Å; T451-R453 PolarHBondContact OG1-O 2.96Å; T451-R453 VanDerWaalsContact OG1-O 3.1Å
454	C	86.6	Confident	89.9	Confident	29 Å²	29	60 Å²	60	20%	0.196	30%	0.295	C	S	.	.			trans	-57.8	135.7	165	-107.5	0	0	0	0	112.2	F375 T456 C462	F375-C454 HydrophobicContact CE1-CB 4.49Å; C454-T456 PolarHBondContact O-N 3.47Å; C454-C462 HydrophobicContact CB-CB 3.81Å; C454-C462 WeakPolarHBondContact CB-SG 3.43Å; C454-C462 WeakPolarHBondContact SG-CA 3.34Å; C454-C462 WeakPolarHBondContact SG-CB 3.49Å; C454-C462 CovalentContact SG-SG 2.01Å; C454-C462 PolarHBondContact SG-SG 2.84Å
455	P	85.7	Confident	89.6	Confident	22 Å²	22	59.2 Å²	59.2	14%	0.143	29%	0.292	C	S	.	.			trans	-51.5	132	160.1	-27.2	33.3	0	0	0	111.3	F373 F408 E457 L458	F373-P455 HydrophobicContact CE1-CG 3.82Å; F373-P455 HydrophobicContact CZ-CG 3.92Å; F408-P455 HydrophobicContact CD1-CG 4.49Å; F408-P455 HydrophobicContact CE1-CB 3.68Å; F408-P455 HydrophobicContact CE1-CG 3.85Å; F408-P455 HydrophobicContact CZ-CB 3.55Å; F408-P455 HydrophobicContact CZ-CG 3.93Å; P455-E457 PolarHBondContact O-N 2.91Å; P455-L458 HydrophobicContact CB-CD1 4.18Å; P455-L458 HydrophobicContact CB-CG 4.34Å; P455-L458 HydrophobicContact CG-CD1 4.05Å; P455-L458 PolarHBondContact O-N 2.74Å; P455-L458 VanDerWaalsContact O-N 3.11Å
456	T	82.6	Confident	89.2	Confident	111 Å²	111	61.8 Å²	61.8	68%	0.681	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-59.7	-30.5	-179.9	-49.5	0	0	0	0	111.4	C454 L458 G459	C454-T456 PolarHBondContact O-N 3.47Å; T456-L458 PolarHBondContact O-N 3.19Å; T456-G459 PolarHBondContact O-N 2.83Å
457	E	82.6	Confident	88.8	Confident	114 Å²	114	67.5 Å²	67.5	53%	0.533	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-63.4	-19.2	179.1	-63.9	85	171.7	0	0	114	R308 F408 P455	R308-E457 IonicContact CZ-OE1 3.61Å; R308-E457 IonicContact NH2-OE1 3.42Å; R308-E457 PolarHBondContact NH2-OE1 3.2Å; F408-E457 HydrophobicContact CZ-CB 4.15Å; P455-E457 PolarHBondContact O-N 2.91Å
458	L	83.9	Confident	88.6	Confident	14 Å²	14	70.5 Å²	70.5	7%	0.073	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-78.6	-22.6	177.6	-72.1	168.7	0	0	0	113.2	F373 L407 F408 P455 T456 N460 E461 L465	F373-L458 HydrophobicContact CE2-CD1 3.73Å; F373-L458 HydrophobicContact CZ-CD1 3.78Å; L407-L458 HydrophobicContact CD2-CD2 4.28Å; F408-L458 HydrophobicContact CD2-CD2 4.46Å; F408-L458 HydrophobicContact CE2-CD1 4.19Å; F408-L458 HydrophobicContact CE2-CD2 3.61Å; F408-L458 HydrophobicContact CE2-CG 3.74Å; F408-L458 HydrophobicContact CZ-CD2 4.39Å; F408-L458 HydrophobicContact CZ-CG 4.07Å; P455-L458 HydrophobicContact CB-CD1 4.18Å; P455-L458 HydrophobicContact CB-CG 4.34Å; P455-L458 HydrophobicContact CG-CD1 4.05Å; P455-L458 PolarHBondContact O-N 2.74Å; P455-L458 VanDerWaalsContact O-N 3.11Å; T456-L458 PolarHBondContact O-N 3.19Å; L458-N460 PolarHBondContact O-N 2.86Å; L458-E461 WeakPolarHBondContact O-CB 3.12Å; L458-E461 PolarHBondContact O-N 3.48Å; L458-L465 HydrophobicContact CD1-CD1 3.7Å; L458-L465 HydrophobicContact CD2-CD1 4.43Å
459	G	85.2	Confident	88.4	Confident	44 Å²	44	72.1 Å²	72.1	45%	0.454	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.8	-124.3	-176.9	0	0	0	0	0	112.3	T456 E461 C462	T456-G459 PolarHBondContact O-N 2.83Å; G459-E461 PolarHBondContact O-N 2.82Å; G459-C462 WeakPolarHBondContact O-CB 3.41Å; G459-C462 PolarHBondContact O-N 2.87Å; G459-C462 VanDerWaalsContact O-N 3.1Å
460	N	84.5	Confident	88.4	Confident	139 Å²	139	73.5 Å²	73.5	74%	0.743	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-14.3	-177.3	-60.2	7.3	0	0	0	114.4	L458 C462	L458-N460 PolarHBondContact O-N 2.86Å; N460-C462 PolarHBondContact O-N 3.45Å
461	E	85.2	Confident	88.3	Confident	50 Å²	50	79.2 Å²	79.2	23%	0.234	40%	0.401	C	S	.	.	H	α-helix	trans	-68.2	-18.2	173.2	-65.5	-160.7	132.8	0	0	111.7	R401 R404 L458 G459 R464 L465	R401-E461 IonicContact CZ-OE1 3.53Å; R401-E461 IonicContact NH1-OE1 2.91Å; R401-E461 PolarHBondContact NH1-OE1 2.88Å; R401-E461 IonicContact NH2-OE1 3.68Å; R401-E461 PolarHBondContact NH2-OE1 2.84Å; R401-E461 IonicContact NH2-OE2 2.91Å; R404-E461 IonicContact NH2-OE1 2.79Å; L458-E461 WeakPolarHBondContact O-CB 3.12Å; L458-E461 PolarHBondContact O-N 3.48Å; G459-E461 PolarHBondContact O-N 2.82Å; E461-R464 PolarHBondContact O-N 3.02Å; E461-L465 WeakPolarHBondContact O-CG 3.38Å; E461-L465 PolarHBondContact O-N 3.04Å
462	C	87.8	Confident	88.4	Confident	21 Å²	21	79.5 Å²	79.5	14%	0.142	40%	0.401	C	S	.	.	H	α-helix	trans	-61.4	-48.5	-176.6	-175.3	0	0	0	0	114.3	C454 G459 N460 R464 L465 L466	C454-C462 HydrophobicContact CB-CB 3.81Å; C454-C462 WeakPolarHBondContact CB-SG 3.43Å; C454-C462 WeakPolarHBondContact SG-CA 3.34Å; C454-C462 WeakPolarHBondContact SG-CB 3.49Å; C454-C462 CovalentContact SG-SG 2.01Å; C454-C462 PolarHBondContact SG-SG 2.84Å; G459-C462 WeakPolarHBondContact O-CB 3.41Å; G459-C462 PolarHBondContact O-N 2.87Å; G459-C462 VanDerWaalsContact O-N 3.1Å; N460-C462 PolarHBondContact O-N 3.45Å; C462-R464 PolarHBondContact O-N 2.81Å; C462-L465 WeakPolarHBondContact O-CB 3.44Å; C462-L465 PolarHBondContact O-N 2.84Å; C462-L466 PolarHBondContact O-N 2.01Å; C462-L466 VanDerWaalsContact O-N 3.11Å
463	E	86.8	Confident	88.6	Confident	148 Å²	148	75.5 Å²	75.5	69%	0.692	39%	0.386	S	S	*	.	H	α-helix	trans	-56.9	-39.8	-177.2	-68.2	175	179.3	0	0	111.1	L465 L466 V467	E463-L465 VanDerWaalsContact C-N 3.33Å; E463-L465 PolarHBondContact O-N 2.85Å; E463-L466 PolarHBondContact O-N 2.9Å; E463-V467 VanDerWaalsContact O-CG2 3.31Å; E463-V467 WeakPolarHBondContact O-CG2 3.25Å; E463-V467 PolarHBondContact O-N 2.78Å; E463-V467 VanDerWaalsContact O-N 3.08Å
464	R	88.8	Confident	89.1	Confident	178 Å²	178	67.3 Å²	67.3	67%	0.672	36%	0.356	S	S	*	.	H	α-helix	trans	-66.1	-36.2	177.3	-63	-176.5	-174.1	170.5	1	112.4	E461 C462 L466 D468	E461-R464 PolarHBondContact O-N 3.02Å; C462-R464 PolarHBondContact O-N 2.81Å; R464-L466 VanDerWaalsContact C-N 3.32Å; R464-D468 WeakPolarHBondContact O-CB 3.42Å; R464-D468 PolarHBondContact O-N 2.01Å
465	L	91.3	Very high	89.5	Confident	9 Å²	9	66.2 Å²	66.2	5%	0.047	35%	0.348	C	S	.	.	H	α-helix	trans	-69.8	-30.6	178.9	-67.6	172.3	0	0	0	112.3	F373 F375 S399 R401 L458 E461 C462 E463	F373-L465 HydrophobicContact CD2-CD1 3.93Å; F373-L465 HydrophobicContact CE2-CD1 4.1Å; F375-L465 HydrophobicContact CE2-CB 3.98Å; F375-L465 HydrophobicContact CZ-CB 4.41Å; S399-L465 WeakPolarHBondContact CB-O 3.43Å; S399-L465 WeakPolarHBondContact OG-CB 3.34Å; S399-L465 PolarHBondContact OG-O 3.15Å; R401-L465 HydrophobicContact CB-CD2 4.05Å; R401-L465 HydrophobicContact CG-CD2 4.48Å; L458-L465 HydrophobicContact CD1-CD1 3.7Å; L458-L465 HydrophobicContact CD2-CD1 4.43Å; E461-L465 WeakPolarHBondContact O-CG 3.38Å; E461-L465 PolarHBondContact O-N 3.04Å; C462-L465 WeakPolarHBondContact O-CB 3.44Å; C462-L465 PolarHBondContact O-N 2.84Å; E463-L465 VanDerWaalsContact C-N 3.33Å; E463-L465 PolarHBondContact O-N 2.85Å
466	L	89.6	Confident	90	Very high	54 Å²	54	67.4 Å²	67.4	28%	0.283	36%	0.36	S	S	.	.	H	α-helix	trans	-81.6	-28.7	177.2	-69.7	170.4	0	0	0	113	F375 L378 C462 E463 R464 T469	F375-L466 HydrophobicContact CB-CD2 3.96Å; F375-L466 HydrophobicContact CD1-CD2 3.9Å; F375-L466 HydrophobicContact CD2-CD2 3.52Å; F375-L466 HydrophobicContact CD2-CG 4.44Å; F375-L466 HydrophobicContact CE1-CD2 4.24Å; F375-L466 HydrophobicContact CE2-CD2 3.87Å; F375-L466 HydrophobicContact CE2-CG 4.35Å; F375-L466 HydrophobicContact CG-CD2 3.53Å; F375-L466 HydrophobicContact CZ-CD2 4.22Å; L378-L466 WeakPolarHBondContact CD2-O 3.28Å; C462-L466 PolarHBondContact O-N 2.01Å; C462-L466 VanDerWaalsContact O-N 3.11Å; E463-L466 PolarHBondContact O-N 2.9Å; R464-L466 VanDerWaalsContact C-N 3.32Å; L466-T469 WeakPolarHBondContact O-CG2 3.17Å
467	V	90.1	Very high	90.6	Very high	122 Å²	122	67 Å²	67	74%	0.739	36%	0.359	S	S	*	.	H	α-helix	trans	-89.8	-42.5	-178.1	175.4	0	0	0	0	112.5	E463 T469	E463-V467 VanDerWaalsContact O-CG2 3.31Å; E463-V467 WeakPolarHBondContact O-CG2 3.25Å; E463-V467 PolarHBondContact O-N 2.78Å; E463-V467 VanDerWaalsContact O-N 3.08Å; V467-T469 PolarHBondContact O-N 3.3Å
468	D	93.3	Very high	91.3	Very high	63 Å²	63	62.6 Å²	62.6	34%	0.337	34%	0.339	S	S	.	.	S	Bend	trans	-91.8	91	-177.6	-177.2	27.5	0	0	0	110.8	R400 R464	R400-D468 WeakPolarHBondContact CB-O 3.31Å; R400-D468 WeakPolarHBondContact CD-OD1 3.31Å; R400-D468 IonicContact CZ-OD1 3.01Å; R400-D468 PolarHBondContact N-O 2.94Å; R400-D468 IonicContact NE-OD1 2.79Å; R400-D468 PolarHBondContact NE-OD1 3.42Å; R400-D468 IonicContact NH1-OD1 2.81Å; R400-D468 PolarHBondContact NH1-OD1 3.01Å; R400-D468 IonicContact NH2-OD1 3.75Å; R464-D468 WeakPolarHBondContact O-CB 3.42Å; R464-D468 PolarHBondContact O-N 2.01Å
469	T	94.1	Very high	91.7	Very high	34 Å²	34	63.8 Å²	63.8	21%	0.209	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	160.4	-172.2	64.4	0	0	0	0	112.7	L378 R398 R400 L466 V467	L378-T469 HydrophobicContact CD1-CG2 3.5Å; L378-T469 VanDerWaalsContact CD1-CG2 3.5Å; L378-T469 HydrophobicContact CD2-CG2 3.81Å; L378-T469 HydrophobicContact CG-CG2 4.25Å; R398-T469 CarbonylContact O-C 3.54Å; R398-T469 WeakPolarHBondContact O-CA 3.46Å; R398-T469 WeakPolarHBondContact O-CB 3.33Å; R400-T469 PolarHBondContact NH2-O 2.9Å; L466-T469 WeakPolarHBondContact O-CG2 3.17Å; V467-T469 PolarHBondContact O-N 3.3Å
470	I	95.5	Very high	92.2	Very high	48 Å²	48	69.4 Å²	69.4	25%	0.246	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.8	171.4	58	179.1	0	0	0	110	R398 R400	R398-I470 HydrophobicContact CG-CG1 4.15Å; R398-I470 PolarHBondContact N-O 3.36Å; R398-I470 PolarHBondContact O-N 3.08Å; R400-I470 HydrophobicContact CB-CG1 4.47Å; R400-I470 HydrophobicContact CB-CG2 4Å; R400-I470 HydrophobicContact CG-CD1 4.42Å; R400-I470 HydrophobicContact CG-CG2 3.91Å
471	E	94.2	Very high	92.8	Very high	124 Å²	124	65.9 Å²	65.9	58%	0.579	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.6	162.9	-169.2	168.1	-179	0	0	109.1	R396 M397	R396-E471 HydrophobicContact CB-CG 4.42Å; R396-E471 CarbonylContact O-C 3.46Å; R396-E471 WeakPolarHBondContact O-CA 3.32Å; M397-E471 HydrophobicContact SD-CB 3.89Å; M397-E471 HydrophobicContact SD-CG 4.32Å
472	D	94.3	Very high	93.4	Very high	30 Å²	30	63.7 Å²	63.7	16%	0.16	33%	0.328	C	S	.	.			trans	-144.4	97.7	176	-174.1	-10.1	0	0	0	109.4	Y374 R396 R398 N474	Y374-D472 WeakPolarHBondContact OH-CB 3.14Å; Y374-D472 PolarHBondContact OH-O 2.8Å; Y374-D472 VanDerWaalsContact OH-O 3.08Å; R396-D472 PolarHBondContact O-N 3.37Å; R398-D472 HydrophobicContact CG-CB 3.84Å; R398-D472 IonicContact CZ-OD2 2.74Å; R398-D472 IonicContact NE-OD2 2.75Å; R398-D472 PolarHBondContact NE-OD2 2.89Å; R398-D472 IonicContact NH2-OD2 2.65Å; R398-D472 PolarHBondContact NH2-OD2 2.81Å; D472-N474 PolarHBondContact O-N 2.8Å; D472-N474 WeakPolarHBondContact OD1-CB 3.32Å; D472-N474 PolarHBondContact OD1-N 3.39Å; D472-N474 VanDerWaalsContact OD1-N 3.13Å
473	D	93.1	Very high	93.8	Very high	44 Å²	44	65.8 Å²	65.8	24%	0.235	34%	0.337	C	S	.	.			trans	-95.3	54.3	175.3	-165.6	-1.5	0	0	0	111.9	R396 L475 A476 R479	R396-D473 HydrophobicContact CG-CB 4.33Å; R396-D473 IonicContact CZ-OD2 3.55Å; R396-D473 IonicContact NE-OD2 3.44Å; R396-D473 PolarHBondContact NE-OD2 2.79Å; R396-D473 IonicContact NH1-OD2 3.51Å; R396-D473 IonicContact NH2-OD2 3Å; D473-L475 PolarHBondContact O-N 2.77Å; D473-L475 VanDerWaalsContact O-N 3.11Å; D473-A476 HydrophobicContact CB-CB 4.39Å; D473-A476 WeakPolarHBondContact O-CB 3.34Å; D473-A476 PolarHBondContact O-N 2.99Å; D473-A476 PolarHBondContact OD1-N 2.93Å; D473-A476 VanDerWaalsContact OD1-N 3.16Å; D473-R479 IonicContact OD1-CZ 3.91Å; D473-R479 IonicContact OD1-NE 3.43Å; D473-R479 IonicContact OD1-NH2 2.66Å; D473-R479 PolarHBondContact OD1-NH2 3.22Å; D473-R479 IonicContact OD2-CZ 3.48Å; D473-R479 IonicContact OD2-NE 3.35Å; D473-R479 IonicContact OD2-NH2 2.91Å; D473-R479 PolarHBondContact OD2-NH2 2.9Å; D473-R479 VanDerWaalsContact OD2-NH2 3.11Å
474	N	96.1	Very high	94.3	Very high	15 Å²	15	66 Å²	66	8%	0.08	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-12.6	177.8	64.6	20.6	0	0	0	114.7	V339 L341 Y374 V446 N448 D472 P477	V339-N474 HydrophobicContact CG1-CB 4.17Å; L341-N474 HydrophobicContact CD2-CB 3.61Å; Y374-N474 PolarHBondContact OH-ND2 3.36Å; V446-N474 VanDerWaalsContact CG1-ND2 3.34Å; V446-N474 WeakPolarHBondContact CG1-ND2 3.32Å; N448-N474 PolarHBondContact ND2-ND2 2.95Å; N448-N474 PolarHBondContact ND2-OD1 2.84Å; N448-N474 PolarHBondContact OD1-ND2 2.86Å; D472-N474 PolarHBondContact O-N 2.8Å; D472-N474 WeakPolarHBondContact OD1-CB 3.32Å; D472-N474 PolarHBondContact OD1-N 3.39Å; D472-N474 VanDerWaalsContact OD1-N 3.13Å; N474-P477 WeakPolarHBondContact O-CD 3.42Å
475	L	95.7	Very high	94.7	Very high	6 Å²	6	61.4 Å²	61.4	3%	0.031	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-7.9	172.9	-66.6	-175.8	0	0	0	113.4	L337 V339 M392 Y450 D473 P477 F478 R479	L337-L475 HydrophobicContact CD2-CD1 4.15Å; L337-L475 HydrophobicContact CD2-CD2 3.72Å; V339-L475 HydrophobicContact CG1-CD2 4.07Å; V339-L475 HydrophobicContact CG2-CD2 3.64Å; M392-L475 HydrophobicContact CB-CD1 4.19Å; Y450-L475 WeakPolarHBondContact OH-CD1 3.46Å; D473-L475 PolarHBondContact O-N 2.77Å; D473-L475 VanDerWaalsContact O-N 3.11Å; L475-P477 VanDerWaalsContact C-CD 3.4Å; L475-P477 VanDerWaalsContact C-N 3.33Å; L475-F478 PolarHBondContact O-N 3.42Å; L475-R479 WeakPolarHBondContact O-CB 3.3Å; L475-R479 PolarHBondContact O-N 2.76Å
476	A	95.4	Very high	95	Very high	48 Å²	48	61 Å²	61	40%	0.397	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-49.1	-44.8	179.7	0	0	0	0	0	114	D473 F478 R479	D473-A476 HydrophobicContact CB-CB 4.39Å; D473-A476 WeakPolarHBondContact O-CB 3.34Å; D473-A476 PolarHBondContact O-N 2.99Å; D473-A476 PolarHBondContact OD1-N 2.93Å; D473-A476 VanDerWaalsContact OD1-N 3.16Å; A476-F478 PolarHBondContact O-N 3.2Å; A476-R479 WeakPolarHBondContact O-CB 3.25Å; A476-R479 PolarHBondContact O-N 3.47Å
477	P	96.1	Very high	95.4	Very high	101 Å²	101	59.9 Å²	59.9	66%	0.656	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-61.4	-28.8	179.7	-24	36	0	0	0	114	N474 L475	N474-P477 WeakPolarHBondContact O-CD 3.42Å; L475-P477 VanDerWaalsContact C-CD 3.4Å; L475-P477 VanDerWaalsContact C-N 3.33Å
478	F	95.7	Very high	95.8	Very high	23 Å²	23	60.9 Å²	60.9	10%	0.101	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-101.8	-9.8	-174.1	-50.4	-68.2	0	0	0	113	I246 L247 V339 S344 L475 A476 Q480 D481 L482	I246-F478 HydrophobicContact CG2-CB 3.97Å; I246-F478 HydrophobicContact CG2-CD1 3.74Å; I246-F478 HydrophobicContact CG2-CG 4.16Å; L247-F478 HydrophobicContact CD2-CD1 4.32Å; L247-F478 HydrophobicContact CD2-CD2 3.91Å; L247-F478 HydrophobicContact CD2-CE1 4.21Å; L247-F478 HydrophobicContact CD2-CE2 3.78Å; L247-F478 HydrophobicContact CD2-CG 4.18Å; L247-F478 HydrophobicContact CD2-CZ 3.94Å; V339-F478 HydrophobicContact CG1-CE2 4.17Å; S344-F478 VanDerWaalsContact O-CE1 3.25Å; S344-F478 WeakPolarHBondContact O-CE1 3.46Å; L475-F478 PolarHBondContact O-N 3.42Å; A476-F478 PolarHBondContact O-N 3.2Å; F478-Q480 PolarHBondContact O-N 2.56Å; F478-D481 PolarHBondContact O-N 2.74Å; F478-L482 WeakPolarHBondContact O-CB 3.01Å; F478-L482 PolarHBondContact O-N 3.06Å
479	R	94	Very high	96	Very high	38 Å²	38	58 Å²	58	14%	0.143	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-45.7	-166.4	179.5	-178.9	-65.5	-81.8	-4.5	113.6	S393 D473 L475 A476 D481 L482 I483	S393-R479 VanDerWaalsContact O-CZ 3.23Å; S393-R479 PolarHBondContact O-NH1 3.37Å; S393-R479 PolarHBondContact O-NH2 2.93Å; S393-R479 VanDerWaalsContact OG-CZ 3.31Å; S393-R479 PolarHBondContact OG-NH1 3.29Å; D473-R479 IonicContact OD1-CZ 3.91Å; D473-R479 IonicContact OD1-NE 3.43Å; D473-R479 IonicContact OD1-NH2 2.66Å; D473-R479 PolarHBondContact OD1-NH2 3.22Å; D473-R479 IonicContact OD2-CZ 3.48Å; D473-R479 IonicContact OD2-NE 3.35Å; D473-R479 IonicContact OD2-NH2 2.91Å; D473-R479 PolarHBondContact OD2-NH2 2.9Å; D473-R479 VanDerWaalsContact OD2-NH2 3.11Å; L475-R479 WeakPolarHBondContact O-CB 3.3Å; L475-R479 PolarHBondContact O-N 2.76Å; A476-R479 WeakPolarHBondContact O-CB 3.25Å; A476-R479 PolarHBondContact O-N 3.47Å; R479-D481 VanDerWaalsContact C-N 3.35Å; R479-L482 PolarHBondContact O-N 3.18Å; R479-I483 HydrophobicContact CG-CD1 3.81Å; R479-I483 WeakPolarHBondContact O-CD1 3.28Å; R479-I483 VanDerWaalsContact O-CG1 3.25Å; R479-I483 WeakPolarHBondContact O-CG1 3.48Å; R479-I483 PolarHBondContact O-N 3.05Å
480	Q	95.4	Very high	96.2	Very high	162 Å²	162	56.6 Å²	56.6	76%	0.757	28%	0.276	S	S	*	.	H	α-helix	trans	-64.5	-42.8	-177.7	-68.7	-173.5	-3.2	0	0	111.5	F478 I483 R484	F478-Q480 PolarHBondContact O-N 2.56Å; Q480-I483 PolarHBondContact O-N 2.83Å; Q480-R484 WeakPolarHBondContact O-CB 3.5Å; Q480-R484 PolarHBondContact O-N 3.26Å
481	D	96.7	Very high	96.3	Very high	66 Å²	66	62.6 Å²	62.6	35%	0.353	30%	0.296	S	S	.	.	H	α-helix	trans	-66.9	-40.6	176.8	-73	-20	0	0	0	111.5	I246 F478 R479 R484 R485	I246-D481 HydrophobicContact CD1-CB 4.13Å; F478-D481 PolarHBondContact O-N 2.74Å; R479-D481 VanDerWaalsContact C-N 3.35Å; D481-R484 PolarHBondContact O-N 2.81Å; D481-R484 IonicContact OD1-CZ 3.8Å; D481-R484 IonicContact OD1-NH1 3.63Å; D481-R484 PolarHBondContact OD1-NH1 3.09Å; D481-R484 IonicContact OD1-NH2 3.58Å; D481-R484 PolarHBondContact OD1-NH2 2.66Å; D481-R485 WeakPolarHBondContact O-CB 3.11Å; D481-R485 VanDerWaalsContact O-CG 3.28Å; D481-R485 WeakPolarHBondContact O-CG 3.42Å; D481-R485 PolarHBondContact O-N 2.99Å
482	L	97.2	Very high	96.4	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-50.4	175.1	179.6	58	0	0	0	111.5	E239 E242 A243 I246 F478 R479 R484 R485 F486	E239-L482 HydrophobicContact CG-CD1 4.4Å; E239-L482 HydrophobicContact CG-CD2 4.21Å; E242-L482 HydrophobicContact CB-CD1 3.81Å; A243-L482 HydrophobicContact CB-CD1 4.02Å; A243-L482 HydrophobicContact CB-CD2 4.37Å; I246-L482 VanDerWaalsContact CD1-CA 3.46Å; I246-L482 HydrophobicContact CD1-CB 3.79Å; I246-L482 HydrophobicContact CD1-CD1 4.19Å; F478-L482 WeakPolarHBondContact O-CB 3.01Å; F478-L482 PolarHBondContact O-N 3.06Å; R479-L482 PolarHBondContact O-N 3.18Å; L482-R484 VanDerWaalsContact C-N 3.34Å; L482-R484 PolarHBondContact O-N 2.9Å; L482-R485 PolarHBondContact O-N 3.17Å; L482-F486 WeakPolarHBondContact O-CB 3.18Å; L482-F486 PolarHBondContact O-N 2.94Å
483	I	96.3	Very high	96.6	Very high	64 Å²	64	62.5 Å²	62.5	33%	0.328	30%	0.295	S	S	.	.	H	α-helix	trans	-56.7	-49	177.3	-69.4	162.4	0	0	0	110.4	L390 R479 Q480 R485 F486 D487	L390-I483 HydrophobicContact CD1-CB 4.39Å; L390-I483 HydrophobicContact CD1-CG1 3.52Å; R479-I483 HydrophobicContact CG-CD1 3.81Å; R479-I483 WeakPolarHBondContact O-CD1 3.28Å; R479-I483 VanDerWaalsContact O-CG1 3.25Å; R479-I483 WeakPolarHBondContact O-CG1 3.48Å; R479-I483 PolarHBondContact O-N 3.05Å; Q480-I483 PolarHBondContact O-N 2.83Å; I483-R485 PolarHBondContact O-N 2.05Å; I483-F486 PolarHBondContact O-N 2.84Å; I483-D487 VanDerWaalsContact O-CB 3.31Å; I483-D487 WeakPolarHBondContact O-CB 3.46Å; I483-D487 PolarHBondContact O-N 3.01Å
484	R	97.7	Very high	96.8	Very high	152 Å²	152	67.6 Å²	67.6	57%	0.574	32%	0.322	S	S	*	.	H	α-helix	trans	-60.6	-45	-178.3	-176.5	-178.7	66.6	-125.3	-4.8	111.9	Q480 D481 L482 K488	Q480-R484 WeakPolarHBondContact O-CB 3.5Å; Q480-R484 PolarHBondContact O-N 3.26Å; D481-R484 PolarHBondContact O-N 2.81Å; D481-R484 IonicContact OD1-CZ 3.8Å; D481-R484 IonicContact OD1-NH1 3.63Å; D481-R484 PolarHBondContact OD1-NH1 3.09Å; D481-R484 IonicContact OD1-NH2 3.58Å; D481-R484 PolarHBondContact OD1-NH2 2.66Å; L482-R484 VanDerWaalsContact C-N 3.34Å; L482-R484 PolarHBondContact O-N 2.9Å; R484-K488 WeakPolarHBondContact O-CB 3.03Å; R484-K488 PolarHBondContact O-N 2.71Å
485	R	97.9	Very high	96.6	Very high	82 Å²	82	70.2 Å²	70.2	31%	0.309	34%	0.336	S	S	.	.	H	α-helix	trans	-70.2	-46.3	-179.7	-69.3	178.3	69.3	173.8	-1.5	111.3	E242 Y245 D481 L482 I483 D487 K488 V489	E242-R485 HydrophobicContact CB-CB 4.17Å; E242-R485 HydrophobicContact CG-CB 3.98Å; E242-R485 WeakPolarHBondContact OE2-CB 3.42Å; E242-R485 IonicContact OE2-CZ 3.97Å; E242-R485 IonicContact OE2-NE 2.88Å; E242-R485 PolarHBondContact OE2-NE 3.29Å; E242-R485 IonicContact OE2-NH2 3.71Å; E242-R485 PolarHBondContact OE2-NH2 2.86Å; Y245-R485 VanDerWaalsContact CB-NH2 3.32Å; D481-R485 WeakPolarHBondContact O-CB 3.11Å; D481-R485 VanDerWaalsContact O-CG 3.28Å; D481-R485 WeakPolarHBondContact O-CG 3.42Å; D481-R485 PolarHBondContact O-N 2.99Å; L482-R485 PolarHBondContact O-N 3.17Å; I483-R485 PolarHBondContact O-N 2.05Å; R485-D487 PolarHBondContact O-N 3.19Å; R485-K488 WeakPolarHBondContact O-CB 3.25Å; R485-K488 PolarHBondContact O-N 3.24Å; R485-V489 WeakPolarHBondContact O-CG2 3.04Å; R485-V489 PolarHBondContact O-N 3.18Å
486	F	97.8	Very high	96.7	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-54.9	-53.8	175	172.7	-93.4	0	0	0	111.9	L235 I238 E239 R389 L390 L482 I483 K488 V489 V490	L235-F486 HydrophobicContact CB-CE2 4.29Å; L235-F486 HydrophobicContact CB-CZ 4.25Å; L235-F486 HydrophobicContact CD2-CE2 4.44Å; L235-F486 HydrophobicContact CD2-CZ 4.06Å; I238-F486 HydrophobicContact CB-CD2 4.16Å; I238-F486 HydrophobicContact CB-CE2 4.24Å; I238-F486 HydrophobicContact CG2-CD2 3.64Å; I238-F486 HydrophobicContact CG2-CE2 4.14Å; I238-F486 HydrophobicContact CG2-CG 4.42Å; E239-F486 HydrophobicContact CB-CD2 4.08Å; E239-F486 HydrophobicContact CB-CE2 4.26Å; R389-F486 HydrophobicContact CB-CE1 4.3Å; R389-F486 HydrophobicContact CB-CZ 4.34Å; R389-F486 WeakPolarHBondContact O-CE2 3.46Å; R389-F486 WeakPolarHBondContact O-CZ 3.41Å; L390-F486 HydrophobicContact CD2-CB 4Å; L390-F486 HydrophobicContact CD2-CD1 3.78Å; L390-F486 HydrophobicContact CD2-CD2 3.8Å; L390-F486 HydrophobicContact CD2-CE1 4.15Å; L390-F486 HydrophobicContact CD2-CE2 4.19Å; L390-F486 HydrophobicContact CD2-CG 3.58Å; L390-F486 HydrophobicContact CD2-CZ 4.35Å; L390-F486 HydrophobicContact CG-CD1 4.1Å; L390-F486 HydrophobicContact CG-CE1 4.16Å; L390-F486 HydrophobicContact CG-CG 4.41Å; L482-F486 WeakPolarHBondContact O-CB 3.18Å; L482-F486 PolarHBondContact O-N 2.94Å; I483-F486 PolarHBondContact O-N 2.84Å; F486-K488 VanDerWaalsContact C-N 3.26Å; F486-K488 PolarHBondContact O-N 2.64Å; F486-V489 PolarHBondContact O-N 3.21Å; F486-V489 VanDerWaalsContact O-N 3.12Å; F486-V490 HydrophobicContact CD1-CG2 4.1Å; F486-V490 HydrophobicContact CD2-CG2 4.21Å; F486-V490 HydrophobicContact CE1-CG2 3.72Å; F486-V490 HydrophobicContact CE2-CG2 3.83Å; F486-V490 HydrophobicContact CG-CG2 4.33Å; F486-V490 HydrophobicContact CZ-CG2 3.57Å; F486-V490 WeakPolarHBondContact O-CG2 3.39Å; F486-V490 PolarHBondContact O-N 2.87Å
487	D	97.4	Very high	96.7	Very high	31 Å²	31	74.7 Å²	74.7	17%	0.166	35%	0.349	C	S	.	.	H	α-helix	trans	-60.3	-37	-179.1	-96.8	-0.6	0	0	0	112.3	R389 I483 R485 V489 R491	R389-D487 IonicContact CZ-OD1 2.78Å; R389-D487 IonicContact NH2-OD1 3.67Å; R389-D487 PolarHBondContact NH2-OD1 3.4Å; I483-D487 VanDerWaalsContact O-CB 3.31Å; I483-D487 WeakPolarHBondContact O-CB 3.46Å; I483-D487 PolarHBondContact O-N 3.01Å; R485-D487 PolarHBondContact O-N 3.19Å; D487-V489 VanDerWaalsContact C-N 3.34Å; D487-R491 VanDerWaalsContact O-CB 3.31Å; D487-R491 WeakPolarHBondContact O-CB 3.29Å; D487-R491 WeakPolarHBondContact O-CG 3.45Å; D487-R491 PolarHBondContact O-N 3.36Å; D487-R491 IonicContact OD2-NH2 2.63Å; D487-R491 PolarHBondContact OD2-NH2 2.8Å
488	K	98	Very high	96.8	Very high	144 Å²	144	73.3 Å²	73.3	63%	0.626	33%	0.331	S	S	*	.	H	α-helix	trans	-59.6	-46.5	176.4	-179.4	-173.5	175.8	-173.2	0	110.9	R484 R485 F486 H492	R484-K488 WeakPolarHBondContact O-CB 3.03Å; R484-K488 PolarHBondContact O-N 2.71Å; R485-K488 WeakPolarHBondContact O-CB 3.25Å; R485-K488 PolarHBondContact O-N 3.24Å; F486-K488 VanDerWaalsContact C-N 3.26Å; F486-K488 PolarHBondContact O-N 2.64Å; K488-H492 WeakPolarHBondContact O-CB 3.12Å; K488-H492 PolarHBondContact O-N 2.81Å; K488-H492 VanDerWaalsContact O-N 3.08Å
489	V	98.2	Very high	96.8	Very high	1 Å²	1	76.2 Å²	76.2	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-69.9	-46.6	-179.2	-180	0	0	0	0	111.1	I238 E242 Y269 R485 F486 D487 R491 H492 L493	I238-V489 HydrophobicContact CD1-CG1 4Å; I238-V489 HydrophobicContact CG1-CG1 4.06Å; I238-V489 HydrophobicContact CG2-CB 3.82Å; I238-V489 HydrophobicContact CG2-CG1 3.85Å; I238-V489 HydrophobicContact CG2-CG2 4.47Å; E242-V489 WeakPolarHBondContact OE1-CG2 3.2Å; Y269-V489 HydrophobicContact CD1-CG1 3.73Å; Y269-V489 HydrophobicContact CD1-CG2 4.45Å; Y269-V489 HydrophobicContact CE1-CB 4.19Å; Y269-V489 HydrophobicContact CE1-CG1 3.66Å; Y269-V489 HydrophobicContact CE1-CG2 3.56Å; R485-V489 WeakPolarHBondContact O-CG2 3.04Å; R485-V489 PolarHBondContact O-N 3.18Å; F486-V489 PolarHBondContact O-N 3.21Å; F486-V489 VanDerWaalsContact O-N 3.12Å; D487-V489 VanDerWaalsContact C-N 3.34Å; V489-R491 PolarHBondContact O-N 2.9Å; V489-H492 WeakPolarHBondContact O-CB 3.43Å; V489-H492 PolarHBondContact O-N 2.73Å; V489-H492 VanDerWaalsContact O-N 3.13Å; V489-L493 HydrophobicContact CG1-CD1 3.78Å; V489-L493 HydrophobicContact CG1-CG 4.36Å; V489-L493 WeakPolarHBondContact O-CB 3.46Å; V489-L493 WeakPolarHBondContact O-CG 3.43Å; V489-L493 PolarHBondContact O-N 3.41Å
490	V	97.6	Very high	97	Very high	6 Å²	6	78.6 Å²	78.6	4%	0.036	36%	0.358	C	S	.	.	H	α-helix	trans	-58.7	-45.8	179.2	170.6	0	0	0	0	111.5	L235 I238 F486 H492 L493 N494 L495	L235-V490 HydrophobicContact CD2-CG1 4.36Å; L235-V490 HydrophobicContact CD2-CG2 3.77Å; I238-V490 HydrophobicContact CD1-CG2 4.08Å; I238-V490 HydrophobicContact CG2-CG2 4.41Å; F486-V490 HydrophobicContact CD1-CG2 4.1Å; F486-V490 HydrophobicContact CD2-CG2 4.21Å; F486-V490 HydrophobicContact CE1-CG2 3.72Å; F486-V490 HydrophobicContact CE2-CG2 3.83Å; F486-V490 HydrophobicContact CG-CG2 4.33Å; F486-V490 HydrophobicContact CZ-CG2 3.57Å; F486-V490 WeakPolarHBondContact O-CG2 3.39Å; F486-V490 PolarHBondContact O-N 2.87Å; V490-H492 PolarHBondContact O-N 2.61Å; V490-L493 PolarHBondContact O-N 3.19Å; V490-N494 PolarHBondContact O-N 3.02Å; V490-L495 HydrophobicContact CG1-CB 4.28Å; V490-L495 WeakPolarHBondContact CG1-O 3.04Å; V490-L495 PolarHBondContact O-N 3.31Å; V490-L495 VanDerWaalsContact O-N 3.17Å
491	R	97.4	Very high	97.1	Very high	174 Å²	174	73.1 Å²	73.1	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-63.8	-39.9	175.2	-70.5	177.4	-140.7	175.4	3.8	112.4	D487 V489 L493 N494	D487-R491 VanDerWaalsContact O-CB 3.31Å; D487-R491 WeakPolarHBondContact O-CB 3.29Å; D487-R491 WeakPolarHBondContact O-CG 3.45Å; D487-R491 PolarHBondContact O-N 3.36Å; D487-R491 IonicContact OD2-NH2 2.63Å; D487-R491 PolarHBondContact OD2-NH2 2.8Å; V489-R491 PolarHBondContact O-N 2.9Å; R491-L493 VanDerWaalsContact C-N 3.28Å; R491-L493 PolarHBondContact O-N 3.2Å; R491-N494 PolarHBondContact O-N 3.33Å; R491-N494 PolarHBondContact O-OD1 3.3Å
492	H	97.7	Very high	97.1	Very high	124 Å²	124	73.6 Å²	73.6	57%	0.574	33%	0.329	S	S	*	.	H	α-helix	trans	-64.2	-35.8	178.4	-179.6	77.2	0	0	0	112.2	Y269 K488 V489 V490	Y269-H492 AromaticContact CD2-CD2 3.33Å; Y269-H492 WeakPolarHBondContact CD2-CD2 3.48Å; Y269-H492 AromaticContact CD2-NE2 3.61Å; Y269-H492 AromaticContact CE2-CD2 3.36Å; Y269-H492 WeakPolarHBondContact CE2-CD2 3.24Å; Y269-H492 AromaticContact CE2-NE2 3.7Å; K488-H492 WeakPolarHBondContact O-CB 3.12Å; K488-H492 PolarHBondContact O-N 2.81Å; K488-H492 VanDerWaalsContact O-N 3.08Å; V489-H492 WeakPolarHBondContact O-CB 3.43Å; V489-H492 PolarHBondContact O-N 2.73Å; V489-H492 VanDerWaalsContact O-N 3.13Å; V490-H492 PolarHBondContact O-N 2.61Å
493	L	97.8	Very high	97.1	Very high	27 Å²	27	78.9 Å²	78.9	14%	0.141	35%	0.353	C	S	.	.	H	α-helix	trans	-90.5	-5	-177.6	-68.1	179.5	0	0	0	114.5	I238 A266 Y269 V489 V490 R491 L495	I238-L493 HydrophobicContact CD1-CD1 4.21Å; A266-L493 HydrophobicContact CB-CD1 4.11Å; Y269-L493 HydrophobicContact CG-CD1 4.47Å; Y269-L493 HydrophobicContact CG-CD2 4.38Å; V489-L493 HydrophobicContact CG1-CD1 3.78Å; V489-L493 HydrophobicContact CG1-CG 4.36Å; V489-L493 WeakPolarHBondContact O-CB 3.46Å; V489-L493 WeakPolarHBondContact O-CG 3.43Å; V489-L493 PolarHBondContact O-N 3.41Å; V490-L493 PolarHBondContact O-N 3.19Å; R491-L493 VanDerWaalsContact C-N 3.28Å; R491-L493 PolarHBondContact O-N 3.2Å; L493-L495 VanDerWaalsContact C-N 3.34Å; L493-L495 HydrophobicContact CB-CD1 3.84Å; L493-L495 HydrophobicContact CB-CG 3.74Å; L493-L495 HydrophobicContact CD1-CD1 3.92Å; L493-L495 PolarHBondContact O-N 3.2Å
494	N	96.4	Very high	97.2	Very high	151 Å²	151	80.2 Å²	80.2	81%	0.807	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	51.2	-171.9	-64.6	-33.6	0	0	0	112.3	V490 R491	V490-N494 PolarHBondContact O-N 3.02Å; R491-N494 PolarHBondContact O-N 3.33Å; R491-N494 PolarHBondContact O-OD1 3.3Å
495	L	92.9	Very high	97.2	Very high	70 Å²	70	73.6 Å²	73.6	37%	0.366	34%	0.335	S	S	.	.			trans	-101	0	177.9	-64.9	177.7	0	0	0	113.2	L235 I238 N262 V490 L493	L235-L495 HydrophobicContact CD2-CB 4.22Å; I238-L495 HydrophobicContact CD1-CD1 3.66Å; N262-L495 HydrophobicContact CB-CD2 3.65Å; N262-L495 VanDerWaalsContact CG-CD2 3.41Å; V490-L495 HydrophobicContact CG1-CB 4.28Å; V490-L495 WeakPolarHBondContact CG1-O 3.04Å; V490-L495 PolarHBondContact O-N 3.31Å; V490-L495 VanDerWaalsContact O-N 3.17Å; L493-L495 VanDerWaalsContact C-N 3.34Å; L493-L495 HydrophobicContact CB-CD1 3.84Å; L493-L495 HydrophobicContact CB-CG 3.74Å; L493-L495 HydrophobicContact CD1-CD1 3.92Å; L493-L495 PolarHBondContact O-N 3.2Å

Retrieved 495 of 495 residues in 325.9 ms (Link to these results)

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