A0A077YXV7_TRITR Loading...

Ribosome production factor 2 homolog

AlphaFold DB , UniProt , Accession A0A077YXV7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 299 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	34.3	Very low	47.8	Very low	240 Å²	240	123.6 Å²	123.6	100%	1.182	68%	0.679	S	S	*	*				0	88.5	0	-82	175.5	174.1	0	0	105.7	E3	M1-E3 PolarHBondContact O-N 3.13Å
2	D	32	Very low	49.3	Very low	157 Å²	157	116.3 Å²	116.3	84%	0.84	64%	0.638	S	S	*	*			trans	-71.2	117	176.8	-67.1	-40.2	0	0	0	107.5	V4	D2-V4 VanDerWaalsContact C-N 3.27Å; D2-V4 PolarHBondContact O-N 3.2Å
3	E	32.6	Very low	51.1	Low	186 Å²	186	121.4 Å²	121.4	87%	0.869	66%	0.661	S	S	*	*			trans	-54.9	98.4	164.1	-94.6	-177.9	152	0	0	107.2	M1 K5	M1-E3 PolarHBondContact O-N 3.13Å; E3-K5 VanDerWaalsContact C-N 3.26Å; E3-K5 PolarHBondContact O-N 3.13Å
4	V	42	Very low	52.9	Low	120 Å²	120	127.9 Å²	127.9	73%	0.727	67%	0.67	S	S	*	*			trans	-59.2	99.9	166.5	178.4	0	0	0	0	104.6	D2 S6	D2-V4 VanDerWaalsContact C-N 3.27Å; D2-V4 PolarHBondContact O-N 3.2Å; V4-S6 VanDerWaalsContact C-N 3.29Å; V4-S6 PolarHBondContact O-N 2.85Å
5	K	42.3	Very low	54.6	Low	200 Å²	200	130.5 Å²	130.5	87%	0.87	67%	0.674	S	S	*	*			trans	-48.5	98.7	175.4	-76.5	-176.8	174.5	-177.7	0	107.6	E3 V7	E3-K5 VanDerWaalsContact C-N 3.26Å; E3-K5 PolarHBondContact O-N 3.13Å; K5-V7 PolarHBondContact O-N 2.99Å
6	S	48.6	Very low	56.5	Low	89 Å²	89	125.1 Å²	125.1	62%	0.622	65%	0.65	S	S	*	*			trans	-59.9	131	175.2	54.3	0	0	0	0	106.7	V4 D8	V4-S6 VanDerWaalsContact C-N 3.29Å; V4-S6 PolarHBondContact O-N 2.85Å; S6-D8 PolarHBondContact O-N 2.97Å
7	V	54.1	Low	58.3	Low	67 Å²	67	129.8 Å²	129.8	41%	0.406	66%	0.664	S	S	.	*			trans	-47.5	128.4	175.5	179.7	0	0	0	0	108.8	K5 A9 L29 P30	K5-V7 PolarHBondContact O-N 2.99Å; V7-A9 PolarHBondContact O-N 3.05Å; V7-L29 HydrophobicContact CB-CB 4.49Å; V7-L29 HydrophobicContact CB-CD1 4.21Å; V7-L29 HydrophobicContact CG1-CD1 4.46Å; V7-P30 WeakPolarHBondContact CG2-O 3.13Å
8	D	58.2	Low	60.2	Low	115 Å²	115	127.5 Å²	127.5	62%	0.615	66%	0.658	S	S	*	*			trans	-59.8	110.5	-172.7	-169.6	7.9	0	0	0	109.9	S6 S10 S11	S6-D8 PolarHBondContact O-N 2.97Å; D8-S10 PolarHBondContact O-N 2.96Å; D8-S10 PolarHBondContact OD1-N 3.05Å; D8-S10 PolarHBondContact OD1-OG 3.19Å; D8-S10 PolarHBondContact OD2-OG 3.12Å; D8-S11 PolarHBondContact O-N 2.96Å; D8-S11 VanDerWaalsContact O-N 3.17Å; D8-S11 PolarHBondContact O-OG 2.9Å
9	A	57.8	Low	61.8	Low	26 Å²	26	127.9 Å²	127.9	22%	0.215	66%	0.656	C	S	.	*	G	3₁₀ helix	trans	-63.6	-8.1	-176	0	0	0	0	0	112.6	V7 S11 L12	V7-A9 PolarHBondContact O-N 3.05Å; A9-S11 PolarHBondContact O-N 3.37Å; A9-L12 HydrophobicContact CB-CD1 4.17Å; A9-L12 PolarHBondContact O-N 3.02Å
10	S	58.8	Low	63.3	Low	77 Å²	77	125.2 Å²	125.2	54%	0.538	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-56.7	-26.7	170.4	66.5	0	0	0	0	113.4	D8 L12	D8-S10 PolarHBondContact O-N 2.96Å; D8-S10 PolarHBondContact OD1-N 3.05Å; D8-S10 PolarHBondContact OD1-OG 3.19Å; D8-S10 PolarHBondContact OD2-OG 3.12Å; S10-L12 VanDerWaalsContact C-N 3.33Å; S10-L12 PolarHBondContact O-N 3.14Å
11	S	65	Low	64.6	Low	83 Å²	83	120.4 Å²	120.4	58%	0.58	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-77.3	-8.3	-179.6	57.7	0	0	0	0	115.3	D8 A9	D8-S11 PolarHBondContact O-N 2.96Å; D8-S11 VanDerWaalsContact O-N 3.17Å; D8-S11 PolarHBondContact O-OG 2.9Å; A9-S11 PolarHBondContact O-N 3.37Å
12	L	66.5	Low	67.2	Low	36 Å²	36	113.6 Å²	113.6	19%	0.188	60%	0.598	C	S	.	*			trans	-75.1	128.1	-177.8	-71.4	164.9	0	0	0	111.4	A9 S10 R14 L25 L29	A9-L12 HydrophobicContact CB-CD1 4.17Å; A9-L12 PolarHBondContact O-N 3.02Å; S10-L12 VanDerWaalsContact C-N 3.33Å; S10-L12 PolarHBondContact O-N 3.14Å; L12-R14 PolarHBondContact O-N 3.43Å; L12-L25 HydrophobicContact CD1-CB 3.98Å; L12-L25 HydrophobicContact CD1-CD1 4.02Å; L12-L29 HydrophobicContact CD2-CD2 3.88Å; L12-L29 HydrophobicContact CG-CD2 4.48Å
13	I	72.3	Confident	70.1	Confident	182 Å²	182	113.6 Å²	113.6	93%	0.933	59%	0.587	S	S	*	*	S	Bend	trans	-52	-34.7	176.2	-61.5	169	0	0	0	111.6
14	R	75.8	Confident	72.8	Confident	212 Å²	212	109.5 Å²	109.5	80%	0.8	57%	0.567	S	S	*	*	S	Bend	trans	-126.5	113	178.9	-139.1	178.5	-171.3	-174.7	3.8	110.2	L12	L12-R14 PolarHBondContact O-N 3.43Å
15	K	79.5	Confident	75	Confident	167 Å²	167	106.3 Å²	106.3	73%	0.726	55%	0.546	S	S	*	.			trans	-64.9	136.2	176.7	-65.8	-173.7	-179.8	-179.1	0	110.4
16	P	84.5	Confident	77.3	Confident	44 Å²	44	99.7 Å²	99.7	29%	0.286	52%	0.518	S	S	.	.			trans	-66	135.7	177.5	24.9	-31.3	0	0	0	110.9	K22 L25	P16-K22 HydrophobicContact CB-CB 3.84Å; P16-K22 HydrophobicContact CG-CB 3.64Å; P16-K22 HydrophobicContact CG-CG 3.98Å; P16-L25 HydrophobicContact CB-CD1 4.03Å; P16-L25 HydrophobicContact CG-CD1 4.35Å
17	K	87.4	Confident	79.3	Confident	205 Å²	205	101.7 Å²	101.7	89%	0.891	52%	0.515	S	S	*	.	S	Bend	trans	-83.7	-24.8	175.5	-64.3	-172.6	178.2	-172.7	0	113.3
18	T	92.8	Very high	81	Confident	89 Å²	89	102.5 Å²	102.5	55%	0.546	51%	0.511	S	S	.	.	S	Bend	trans	-128.5	154.4	-175.9	65.1	0	0	0	0	110.7	A20 G21 K22	T18-A20 VanDerWaalsContact C-N 3.3Å; T18-A20 PolarHBondContact O-N 2.91Å; T18-G21 PolarHBondContact O-N 3.2Å; T18-G21 VanDerWaalsContact O-N 3.15Å; T18-G21 PolarHBondContact OG1-N 3.36Å; T18-K22 PolarHBondContact O-N 3.14Å
19	Q	89.7	Confident	82.5	Confident	135 Å²	135	98.3 Å²	98.3	63%	0.631	49%	0.489	S	S	*	.	H	α-helix	trans	-62	-37.5	177.7	-167.7	-176.8	18.7	0	0	112.1	K22 R23	Q19-K22 WeakPolarHBondContact O-CB 3.48Å; Q19-K22 PolarHBondContact O-N 3.44Å; Q19-R23 WeakPolarHBondContact O-CG 3.41Å; Q19-R23 PolarHBondContact O-N 3.37Å
20	A	91.8	Very high	84.1	Confident	74 Å²	74	101.9 Å²	101.9	61%	0.612	51%	0.51	S	S	*	.	H	α-helix	trans	-61.8	-43	174.1	0	0	0	0	0	111.7	T18 K22 R23 H24	T18-A20 VanDerWaalsContact C-N 3.3Å; T18-A20 PolarHBondContact O-N 2.91Å; A20-K22 VanDerWaalsContact C-N 3.34Å; A20-K22 PolarHBondContact O-N 3.26Å; A20-R23 PolarHBondContact O-N 3.26Å; A20-H24 PolarHBondContact O-N 3.24Å
21	G	90.7	Very high	85.7	Confident	24 Å²	24	102.1 Å²	102.1	25%	0.247	50%	0.501	C	S	.	.	H	α-helix	trans	-63.3	-38.6	174.1	0	0	0	0	0	112.6	T18 H24 L25	T18-G21 PolarHBondContact O-N 3.2Å; T18-G21 VanDerWaalsContact O-N 3.15Å; T18-G21 PolarHBondContact OG1-N 3.36Å; G21-H24 PolarHBondContact O-N 2.91Å; G21-L25 WeakPolarHBondContact O-CG 3.29Å; G21-L25 PolarHBondContact O-N 2.78Å
22	K	89.9	Confident	86.9	Confident	97 Å²	97	102.1 Å²	102.1	42%	0.422	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-51	174.3	-177.9	175	170.5	177	0	111.2	P16 T18 Q19 A20 H24 L25 E26	P16-K22 HydrophobicContact CB-CB 3.84Å; P16-K22 HydrophobicContact CG-CB 3.64Å; P16-K22 HydrophobicContact CG-CG 3.98Å; T18-K22 PolarHBondContact O-N 3.14Å; Q19-K22 WeakPolarHBondContact O-CB 3.48Å; Q19-K22 PolarHBondContact O-N 3.44Å; A20-K22 VanDerWaalsContact C-N 3.34Å; A20-K22 PolarHBondContact O-N 3.26Å; K22-H24 VanDerWaalsContact C-N 3.27Å; K22-H24 PolarHBondContact O-N 3.08Å; K22-L25 PolarHBondContact O-N 2.81Å; K22-E26 WeakPolarHBondContact CE-OE1 3.45Å; K22-E26 HydrophobicContact CG-CG 4.4Å; K22-E26 WeakPolarHBondContact CG-OE1 3.44Å; K22-E26 IonicContact NZ-OE1 3.18Å; K22-E26 WeakPolarHBondContact O-CB 2.83Å; K22-E26 WeakPolarHBondContact O-CG 3.49Å; K22-E26 PolarHBondContact O-N 3.3Å
23	R	91.1	Very high	88	Confident	158 Å²	158	105.8 Å²	105.8	60%	0.596	52%	0.518	S	S	*	.	H	α-helix	trans	-58.4	-39	177.1	-69.1	177.6	-174.1	176.7	4.2	112.3	Q19 A20 K27	Q19-R23 WeakPolarHBondContact O-CG 3.41Å; Q19-R23 PolarHBondContact O-N 3.37Å; A20-R23 PolarHBondContact O-N 3.26Å; R23-K27 WeakPolarHBondContact O-CB 3.18Å; R23-K27 PolarHBondContact O-N 2.72Å
24	H	89.8	Confident	88.9	Confident	100 Å²	100	104.1 Å²	104.1	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-44.9	176.9	-176.8	76.8	0	0	0	112.3	A20 G21 K22 K27 R28	A20-H24 PolarHBondContact O-N 3.24Å; G21-H24 PolarHBondContact O-N 2.91Å; K22-H24 VanDerWaalsContact C-N 3.27Å; K22-H24 PolarHBondContact O-N 3.08Å; H24-K27 PolarHBondContact O-N 3.45Å; H24-R28 PolarHBondContact NE2-NE 2.98Å; H24-R28 PolarHBondContact O-N 3.2Å
25	L	88.8	Confident	89.7	Confident	52 Å²	52	97.9 Å²	97.9	27%	0.272	49%	0.488	S	S	.	.	H	α-helix	trans	-67.2	-42.8	177.2	-67.5	173.9	0	0	0	111.6	L12 P16 G21 K22 K27 R28 L29	L12-L25 HydrophobicContact CD1-CB 3.98Å; L12-L25 HydrophobicContact CD1-CD1 4.02Å; P16-L25 HydrophobicContact CB-CD1 4.03Å; P16-L25 HydrophobicContact CG-CD1 4.35Å; G21-L25 WeakPolarHBondContact O-CG 3.29Å; G21-L25 PolarHBondContact O-N 2.78Å; K22-L25 PolarHBondContact O-N 2.81Å; L25-K27 PolarHBondContact O-N 3.12Å; L25-R28 PolarHBondContact O-N 3.02Å; L25-L29 PolarHBondContact O-N 3.27Å; L25-L29 VanDerWaalsContact O-N 3.09Å
26	E	89.3	Confident	90.4	Very high	61 Å²	61	92.8 Å²	92.8	29%	0.285	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-34.1	175.5	-74.7	171.9	171	0	0	112.7	K22 R28 L29	K22-E26 WeakPolarHBondContact CE-OE1 3.45Å; K22-E26 HydrophobicContact CG-CG 4.4Å; K22-E26 WeakPolarHBondContact CG-OE1 3.44Å; K22-E26 IonicContact NZ-OE1 3.18Å; K22-E26 WeakPolarHBondContact O-CB 2.83Å; K22-E26 WeakPolarHBondContact O-CG 3.49Å; K22-E26 PolarHBondContact O-N 3.3Å; E26-R28 VanDerWaalsContact C-N 3.27Å; E26-R28 PolarHBondContact O-N 2.81Å; E26-L29 PolarHBondContact O-N 2.84Å
27	K	90.6	Very high	90.9	Very high	131 Å²	131	93.2 Å²	93.2	57%	0.57	47%	0.467	S	S	*	.	H	α-helix	trans	-64.5	-33.8	176.6	-172	176.2	176.9	-177.3	0	112.5	R23 H24 L25 K31	R23-K27 WeakPolarHBondContact O-CB 3.18Å; R23-K27 PolarHBondContact O-N 2.72Å; H24-K27 PolarHBondContact O-N 3.45Å; L25-K27 PolarHBondContact O-N 3.12Å; K27-K31 VanDerWaalsContact O-CE 3.24Å; K27-K31 WeakPolarHBondContact O-CE 3.37Å; K27-K31 PolarHBondContact O-NZ 3.14Å
28	R	91.2	Very high	91.3	Very high	84 Å²	84	85 Å²	85	32%	0.317	43%	0.434	S	S	.	.	H	α-helix	trans	-84.8	-20.4	-179.3	-63.9	-169.2	171.4	-155.3	-7.3	113.9	H24 L25 E26 M89 K90 D92	H24-R28 PolarHBondContact NE2-NE 2.98Å; H24-R28 PolarHBondContact O-N 3.2Å; L25-R28 PolarHBondContact O-N 3.02Å; E26-R28 VanDerWaalsContact C-N 3.27Å; E26-R28 PolarHBondContact O-N 2.81Å; R28-M89 PolarHBondContact NH1-O 3.48Å; R28-K90 PolarHBondContact NH1-O 3.28Å; R28-K90 PolarHBondContact NH2-O 3.3Å; R28-D92 HydrophobicContact CG-CB 4.26Å
29	L	90	Very high	91.5	Very high	27 Å²	27	80.8 Å²	80.8	14%	0.141	41%	0.408	C	S	.	.	S	Bend	trans	-61.5	149.6	178.6	-76.4	174.6	0	0	0	110.7	V7 L12 L25 E26 K31	V7-L29 HydrophobicContact CB-CB 4.49Å; V7-L29 HydrophobicContact CB-CD1 4.21Å; V7-L29 HydrophobicContact CG1-CD1 4.46Å; L12-L29 HydrophobicContact CD2-CD2 3.88Å; L12-L29 HydrophobicContact CG-CD2 4.48Å; L25-L29 PolarHBondContact O-N 3.27Å; L25-L29 VanDerWaalsContact O-N 3.09Å; E26-L29 PolarHBondContact O-N 2.84Å; L29-K31 WeakPolarHBondContact O-CG 3.35Å
30	P	91.6	Very high	91.9	Very high	102 Å²	102	74.3 Å²	74.3	66%	0.662	38%	0.378	S	S	*	.			trans	-54.1	140.9	173.3	-24.5	33.8	0	0	0	111.3	V7	V7-P30 WeakPolarHBondContact CG2-O 3.13Å
31	K	91.2	Very high	92.2	Very high	82 Å²	82	70.8 Å²	70.8	36%	0.357	35%	0.349	S	S	.	.			trans	-126	151.9	-177.8	-56.3	-174.5	-172.8	-179.6	0	110.4	K27 L29 V33 N35	K27-K31 VanDerWaalsContact O-CE 3.24Å; K27-K31 WeakPolarHBondContact O-CE 3.37Å; K27-K31 PolarHBondContact O-NZ 3.14Å; L29-K31 WeakPolarHBondContact O-CG 3.35Å; K31-V33 WeakPolarHBondContact CB-O 3.49Å; K31-N35 PolarHBondContact NZ-ND2 2.99Å; K31-N35 PolarHBondContact NZ-OD1 2.72Å
32	L	90	Very high	92.6	Very high	82 Å²	82	69.7 Å²	69.7	43%	0.429	34%	0.337	S	S	.	.	S	Bend	trans	-65.9	-43.1	172.6	-169.2	77.8	0	0	0	111.4	P249 A251 V252	L32-P249 HydrophobicContact CD1-CB 3.68Å; L32-P249 HydrophobicContact CD1-CG 4.17Å; L32-A251 HydrophobicContact CD1-CB 3.83Å; L32-A251 HydrophobicContact CD2-CB 4.13Å; L32-V252 HydrophobicContact CD1-CG2 3.85Å; L32-V252 HydrophobicContact CD2-CG2 3.89Å; L32-V252 HydrophobicContact CG-CG2 3.54Å
33	V	89.9	Confident	92.9	Very high	113 Å²	113	67 Å²	67	69%	0.685	32%	0.324	S	S	*	.	S	Bend	trans	-107.1	111.6	170.1	179.1	0	0	0	0	106.9	K31	K31-V33 WeakPolarHBondContact CB-O 3.49Å
34	E	91.2	Very high	93.2	Very high	147 Å²	147	59.5 Å²	59.5	69%	0.687	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-68.4	153.5	-177.6	-60.5	-173.9	146.4	0	0	111.7
35	N	92.7	Very high	93.4	Very high	81 Å²	81	57.3 Å²	57.3	43%	0.433	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-78.8	170.6	169.9	-45.9	-48.3	0	0	0	110.1	K31	K31-N35 PolarHBondContact NZ-ND2 2.99Å; K31-N35 PolarHBondContact NZ-OD1 2.72Å
36	D	93.6	Very high	93.7	Very high	60 Å²	60	62 Å²	62	32%	0.321	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-63.3	140.6	169.3	-63.2	-30.9	0	0	0	111.8	T38 N65 P176	D36-T38 PolarHBondContact O-N 2.82Å; D36-N65 VanDerWaalsContact CB-ND2 3.31Å; D36-N65 WeakPolarHBondContact CB-ND2 3.28Å; D36-P176 VanDerWaalsContact OD1-CA 3.31Å; D36-P176 WeakPolarHBondContact OD1-CA 3.21Å; D36-P176 WeakPolarHBondContact OD2-CB 3.25Å
37	K	95.2	Very high	94	Very high	54 Å²	54	60.6 Å²	60.6	24%	0.235	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-72.7	122.3	-174.9	-72.9	-173.9	178.5	165.1	0	112	K62 S94 L95 D171	K37-K62 VanDerWaalsContact O-CE 3.31Å; K37-K62 WeakPolarHBondContact O-CE 3.39Å; K37-S94 WeakPolarHBondContact CB-OG 3.4Å; K37-S94 VanDerWaalsContact CG-OG 3.22Å; K37-S94 WeakPolarHBondContact CG-OG 3.48Å; K37-L95 HydrophobicContact CB-CD1 3.95Å; K37-L95 HydrophobicContact CB-CG 4.27Å; K37-L95 HydrophobicContact CD-CG 4.47Å; K37-D171 WeakPolarHBondContact CD-OD1 3.49Å; K37-D171 VanDerWaalsContact CD-OD2 3.28Å; K37-D171 WeakPolarHBondContact CD-OD2 3.24Å; K37-D171 WeakPolarHBondContact CE-OD2 3.41Å; K37-D171 IonicContact NZ-OD1 3.89Å; K37-D171 PolarHBondContact NZ-OD1 3.45Å; K37-D171 IonicContact NZ-OD2 3.73Å; K37-D171 PolarHBondContact NZ-OD2 2.81Å
38	T	96.6	Very high	94.3	Very high	32 Å²	32	55.3 Å²	55.3	20%	0.196	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-83.7	134.8	175	-60	0	0	0	0	110.4	D36 N65 V67 A93 S94 L95	D36-T38 PolarHBondContact O-N 2.82Å; T38-N65 WeakPolarHBondContact CA-O 3.14Å; T38-V67 HydrophobicContact CG2-CG2 3.85Å; T38-A93 HydrophobicContact CG2-CB 4.28Å; T38-S94 PolarHBondContact O-N 3.17Å; T38-L95 PolarHBondContact O-N 3.22Å; T38-L95 VanDerWaalsContact O-N 3.15Å
39	T	97.7	Very high	94.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.4	174.7	-60.2	0	0	0	0	111.1	F41 K62 N65 E66 V67 L95 C97 F172	T39-F41 HydrophobicContact CG2-CD2 4.11Å; T39-F41 HydrophobicContact CG2-CE1 4.27Å; T39-F41 HydrophobicContact CG2-CE2 3.71Å; T39-F41 HydrophobicContact CG2-CZ 3.81Å; T39-K62 WeakPolarHBondContact OG1-CE 3.22Å; T39-N65 PolarHBondContact N-O 3.25Å; T39-E66 CarbonylContact O-C 3.55Å; T39-E66 WeakPolarHBondContact O-CA 3.33Å; T39-V67 PolarHBondContact O-N 3.38Å; T39-L95 CarbonylContact C-O 3.58Å; T39-L95 WeakPolarHBondContact CA-O 3.27Å; T39-L95 HydrophobicContact CG2-CB 4.22Å; T39-L95 WeakPolarHBondContact OG1-CB 3.39Å; T39-C97 HydrophobicContact CG2-CB 4.22Å; T39-F172 HydrophobicContact CG2-CE2 3.63Å; T39-F172 HydrophobicContact CG2-CZ 3.94Å
40	I	97.7	Very high	94.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	134.6	167.4	-165.5	174.3	0	0	0	111	I42 V67 L69 F87 Y91 A93 L95 F96 C97	I40-I42 HydrophobicContact CD1-CD1 4.44Å; I40-I42 HydrophobicContact CD1-CG1 4.37Å; I40-I42 HydrophobicContact CG1-CG1 4.13Å; I40-I42 HydrophobicContact CG2-CD1 4.1Å; I40-I42 HydrophobicContact CG2-CG1 4.26Å; I40-V67 CarbonylContact C-O 3.59Å; I40-V67 WeakPolarHBondContact CA-O 3.31Å; I40-V67 HydrophobicContact CB-CB 4.48Å; I40-V67 HydrophobicContact CG1-CB 4.21Å; I40-V67 HydrophobicContact CG1-CG1 4.16Å; I40-L69 HydrophobicContact CD1-CD1 3.98Å; I40-L69 HydrophobicContact CD1-CD2 4.2Å; I40-L69 HydrophobicContact CD1-CG 4.06Å; I40-L69 HydrophobicContact CG1-CD1 4.43Å; I40-L69 HydrophobicContact CG1-CG 4.16Å; I40-F87 HydrophobicContact CD1-CB 4.01Å; I40-F87 HydrophobicContact CD1-CD1 4.13Å; I40-Y91 HydrophobicContact CD1-CD2 3.5Å; I40-Y91 HydrophobicContact CD1-CE2 4.18Å; I40-Y91 HydrophobicContact CD1-CG 4.01Å; I40-A93 HydrophobicContact CB-CB 3.87Å; I40-A93 HydrophobicContact CG2-CB 4.1Å; I40-L95 PolarHBondContact N-O 3.38Å; I40-F96 HydrophobicContact CG2-CB 3.55Å; I40-F96 CarbonylContact O-C 3.49Å; I40-F96 VanDerWaalsContact O-CA 3.31Å; I40-F96 WeakPolarHBondContact O-CA 3.3Å; I40-C97 PolarHBondContact O-N 3.28Å
41	F	98.3	Very high	95	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	116.6	179.8	-67.9	-91.7	0	0	0	109.5	T39 M55 L58 V59 K62 E66 V67 R68 L69 C97 F172	T39-F41 HydrophobicContact CG2-CD2 4.11Å; T39-F41 HydrophobicContact CG2-CE1 4.27Å; T39-F41 HydrophobicContact CG2-CE2 3.71Å; T39-F41 HydrophobicContact CG2-CZ 3.81Å; F41-M55 HydrophobicContact CB-CE 3.43Å; F41-M55 VanDerWaalsContact CB-CE 3.43Å; F41-M55 HydrophobicContact CB-CG 4.44Å; F41-M55 HydrophobicContact CD1-CG 4.13Å; F41-L58 HydrophobicContact CE1-CB 3.72Å; F41-L58 HydrophobicContact CZ-CB 4.3Å; F41-V59 HydrophobicContact CB-CG2 4.17Å; F41-V59 HydrophobicContact CD1-CG2 3.72Å; F41-V59 HydrophobicContact CD2-CG2 3.62Å; F41-V59 HydrophobicContact CE1-CG2 3.9Å; F41-V59 HydrophobicContact CE2-CG2 3.81Å; F41-V59 HydrophobicContact CG-CG2 3.57Å; F41-V59 HydrophobicContact CZ-CG2 3.93Å; F41-K62 HydrophobicContact CE2-CB 4.12Å; F41-K62 HydrophobicContact CE2-CG 4.35Å; F41-K62 HydrophobicContact CZ-CB 3.99Å; F41-K62 HydrophobicContact CZ-CG 4.43Å; F41-E66 HydrophobicContact CD2-CB 4.14Å; F41-E66 HydrophobicContact CE2-CB 3.75Å; F41-V67 PolarHBondContact N-O 3.1Å; F41-R68 HydrophobicContact CB-CG 4.39Å; F41-L69 WeakPolarHBondContact O-CB 3.24Å; F41-L69 PolarHBondContact O-N 3.23Å; F41-C97 CarbonylContact C-O 3.5Å; F41-C97 WeakPolarHBondContact CA-O 3.31Å; F41-C97 HydrophobicContact CD1-CB 3.58Å; F41-C97 HydrophobicContact CE1-CB 3.82Å; F41-C97 HydrophobicContact CG-CB 4.35Å; F41-F172 HydrophobicContact CE1-CZ 4.36Å; F41-F172 HydrophobicContact CZ-CZ 4.37Å
42	I	97.7	Very high	95.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.4	-169.4	-51.2	-179.7	0	0	0	110.1	I40 L69 F75 F84 C97 F98 I99	I40-I42 HydrophobicContact CD1-CD1 4.44Å; I40-I42 HydrophobicContact CD1-CG1 4.37Å; I40-I42 HydrophobicContact CG1-CG1 4.13Å; I40-I42 HydrophobicContact CG2-CD1 4.1Å; I40-I42 HydrophobicContact CG2-CG1 4.26Å; I42-L69 HydrophobicContact CB-CD1 4.44Å; I42-L69 HydrophobicContact CG1-CD1 3.88Å; I42-L69 HydrophobicContact CG2-CD1 4.3Å; I42-F75 HydrophobicContact CG2-CD2 4.21Å; I42-F75 HydrophobicContact CG2-CE2 4.44Å; I42-F84 HydrophobicContact CD1-CD1 3.85Å; I42-F84 HydrophobicContact CD1-CE1 4.06Å; I42-C97 PolarHBondContact N-O 3.2Å; I42-F98 HydrophobicContact CB-CD2 4.09Å; I42-F98 HydrophobicContact CG2-CD2 3.86Å; I42-F98 HydrophobicContact CG2-CE2 4.37Å; I42-F98 WeakPolarHBondContact O-CA 2.99Å; I42-I99 PolarHBondContact O-N 3.42Å; I42-I99 VanDerWaalsContact O-N 3.07Å
43	R	97.3	Very high	95.6	Very high	41 Å²	41	52.8 Å²	52.8	16%	0.155	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.3	173.6	-64.5	-179.3	170.9	131.3	-3.6	111.2	T47 E52 M55 R70 K72 N73 I99	R43-T47 HydrophobicContact CB-CG2 4.44Å; R43-E52 IonicContact CZ-OE2 3.9Å; R43-E52 VanDerWaalsContact CZ-OE2 3.28Å; R43-E52 IonicContact NE-OE1 2.73Å; R43-E52 PolarHBondContact NE-OE1 3.41Å; R43-E52 IonicContact NE-OE2 2.79Å; R43-E52 PolarHBondContact NE-OE2 3.2Å; R43-E52 IonicContact NH2-OE2 3.62Å; R43-E52 PolarHBondContact NH2-OE2 3.39Å; R43-M55 HydrophobicContact CG-CE 3.93Å; R43-M55 HydrophobicContact CG-SD 4.07Å; R43-R70 PolarHBondContact NH1-O 2.81Å; R43-K72 HydrophobicContact CB-CG 4.38Å; R43-N73 PolarHBondContact O-N 2.59Å; R43-N73 PolarHBondContact O-ND2 3.38Å; R43-N73 VanDerWaalsContact O-ND2 3.14Å; R43-I99 HydrophobicContact CG-CD1 4.37Å; R43-I99 HydrophobicContact CG-CG1 4.38Å
44	G	96.2	Very high	95.9	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	178	164.6	0	0	0	0	0	112.7	K46 N73 F98 I99	G44-K46 VanDerWaalsContact C-N 3.3Å; G44-K46 PolarHBondContact O-N 3.17Å; G44-N73 CarbonylContact C-O 3.55Å; G44-N73 WeakPolarHBondContact CA-O 3.2Å; G44-F98 VanDerWaalsContact CA-CE2 3.46Å; G44-I99 WeakPolarHBondContact CA-O 3.34Å; G44-I99 PolarHBondContact N-O 2.92Å
45	S	94.4	Very high	96.2	Very high	53 Å²	53	40.5 Å²	40.5	37%	0.371	20%	0.202	S	C	.	.	S	Bend	trans	-61.2	-39.1	-179.7	-39.1	0	0	0	0	112.6	N73 E74	S45-N73 PolarHBondContact N-O 2.79Å; S45-N73 PolarHBondContact OG-O 3.15Å; S45-E74 VanDerWaalsContact OG-CA 3.28Å; S45-E74 WeakPolarHBondContact OG-CA 3.4Å; S45-E74 WeakPolarHBondContact OG-CG 2.96Å
46	K	96	Very high	96.3	Very high	152 Å²	152	38.9 Å²	38.9	66%	0.661	19%	0.194	S	C	*	.	S	Bend	trans	-123.9	131	180	-65	-176.4	-178.2	-178.4	0	109	G44 S100 N101	G44-K46 VanDerWaalsContact C-N 3.3Å; G44-K46 PolarHBondContact O-N 3.17Å; K46-S100 CarbonylContact O-C 3Å; K46-S100 VanDerWaalsContact O-CA 3.3Å; K46-S100 WeakPolarHBondContact O-CA 3.18Å; K46-N101 WeakPolarHBondContact CB-O 3.49Å; K46-N101 PolarHBondContact O-N 3.1Å
47	T	95.7	Very high	96.4	Very high	31 Å²	31	36.1 Å²	36.1	19%	0.19	18%	0.179	C	C	.	.			trans	-133.6	148.3	177.5	52.7	0	0	0	0	108.8	R43 E52 I99	R43-T47 HydrophobicContact CB-CG2 4.44Å; T47-E52 VanDerWaalsContact CB-OE1 3.26Å; T47-E52 WeakPolarHBondContact CB-OE1 3.27Å; T47-E52 PolarHBondContact OG1-OE1 3.17Å; T47-I99 HydrophobicContact CG2-CD1 3.65Å; T47-I99 HydrophobicContact CG2-CG1 3.82Å
48	S	95.8	Very high	96.4	Very high	20 Å²	20	33.6 Å²	33.6	14%	0.14	17%	0.168	C	C	.	.			trans	-93.5	159.9	173.1	64.3	0	0	0	0	110.3	T50 M51 E52 N107	S48-T50 VanDerWaalsContact C-N 3.27Å; S48-T50 PolarHBondContact O-N 3.24Å; S48-M51 PolarHBondContact O-N 2.92Å; S48-M51 VanDerWaalsContact O-N 3.15Å; S48-M51 WeakPolarHBondContact OG-CB 3.47Å; S48-M51 VanDerWaalsContact OG-CG 3.3Å; S48-M51 WeakPolarHBondContact OG-CG 3.31Å; S48-M51 PolarHBondContact OG-N 3.49Å; S48-E52 PolarHBondContact O-N 3.31Å; S48-N107 PolarHBondContact OG-OD1 3.07Å
49	K	95.6	Very high	96.4	Very high	168 Å²	168	32.7 Å²	32.7	73%	0.73	16%	0.163	S	C	*	.	H	α-helix	trans	-57.1	-43.2	175.7	-174.1	-179.8	178.2	-176.3	0	111.5	M51 E52 Q53	K49-M51 VanDerWaalsContact C-N 3.34Å; K49-M51 PolarHBondContact O-N 2.98Å; K49-E52 PolarHBondContact O-N 2.89Å; K49-Q53 WeakPolarHBondContact O-CG 3.34Å; K49-Q53 PolarHBondContact O-N 3.07Å
50	T	95.7	Very high	96.2	Very high	51 Å²	51	34.9 Å²	34.9	31%	0.313	17%	0.173	S	C	.	.	H	α-helix	trans	-59	-43.7	176.2	-46.1	0	0	0	0	111.7	S48 Q53 C54 F130	S48-T50 VanDerWaalsContact C-N 3.27Å; S48-T50 PolarHBondContact O-N 3.24Å; T50-Q53 PolarHBondContact O-N 3.41Å; T50-C54 WeakPolarHBondContact O-CB 3.42Å; T50-C54 PolarHBondContact O-N 3.18Å; T50-F130 HydrophobicContact CG2-CB 3.74Å; T50-F130 HydrophobicContact CG2-CD1 3.74Å; T50-F130 HydrophobicContact CG2-CG 4.01Å
51	M	96.3	Very high	96	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69.2	-35.2	177.9	-76	-51.9	-53.5	0	0	113.3	S48 K49 C54 M55 I99 N107 L109 V127	S48-M51 PolarHBondContact O-N 2.92Å; S48-M51 VanDerWaalsContact O-N 3.15Å; S48-M51 WeakPolarHBondContact OG-CB 3.47Å; S48-M51 VanDerWaalsContact OG-CG 3.3Å; S48-M51 WeakPolarHBondContact OG-CG 3.31Å; S48-M51 PolarHBondContact OG-N 3.49Å; K49-M51 VanDerWaalsContact C-N 3.34Å; K49-M51 PolarHBondContact O-N 2.98Å; M51-C54 PolarHBondContact O-N 3.38Å; M51-M55 WeakPolarHBondContact O-CB 3.37Å; M51-M55 PolarHBondContact O-N 3Å; M51-I99 HydrophobicContact CB-CB 4.49Å; M51-I99 HydrophobicContact CB-CD1 4.36Å; M51-I99 HydrophobicContact CE-CB 3.85Å; M51-I99 HydrophobicContact CE-CG2 3.44Å; M51-I99 VanDerWaalsContact CE-CG2 3.44Å; M51-N107 HydrophobicContact CG-CB 3.97Å; M51-N107 VanDerWaalsContact SD-C 3.58Å; M51-N107 HydrophobicContact SD-CB 3.8Å; M51-L109 HydrophobicContact CE-CB 3.9Å; M51-L109 HydrophobicContact CE-CD1 4.26Å; M51-V127 HydrophobicContact CE-CG2 4.22Å; M51-V127 HydrophobicContact SD-CB 3.95Å; M51-V127 HydrophobicContact SD-CG2 3.8Å
52	E	96.7	Very high	95.8	Very high	34 Å²	34	38.5 Å²	38.5	16%	0.159	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-43.3	173.6	-68.7	-72	163	0	0	110.9	R43 T47 S48 K49 M55 D56 R68	R43-E52 IonicContact CZ-OE2 3.9Å; R43-E52 VanDerWaalsContact CZ-OE2 3.28Å; R43-E52 IonicContact NE-OE1 2.73Å; R43-E52 PolarHBondContact NE-OE1 3.41Å; R43-E52 IonicContact NE-OE2 2.79Å; R43-E52 PolarHBondContact NE-OE2 3.2Å; R43-E52 IonicContact NH2-OE2 3.62Å; R43-E52 PolarHBondContact NH2-OE2 3.39Å; T47-E52 VanDerWaalsContact CB-OE1 3.26Å; T47-E52 WeakPolarHBondContact CB-OE1 3.27Å; T47-E52 PolarHBondContact OG1-OE1 3.17Å; S48-E52 PolarHBondContact O-N 3.31Å; K49-E52 PolarHBondContact O-N 2.89Å; E52-M55 PolarHBondContact O-N 3.33Å; E52-D56 VanDerWaalsContact O-CG 3.22Å; E52-D56 PolarHBondContact O-N 3.01Å; E52-R68 IonicContact OE2-NH2 3.88Å
53	Q	96.5	Very high	95.6	Very high	71 Å²	71	42.6 Å²	42.6	33%	0.332	21%	0.209	S	C	.	.	H	α-helix	trans	-63.7	-41.5	174.5	-71.5	176.6	-43.6	0	0	112	K49 T50 D56 N57 F130	K49-Q53 WeakPolarHBondContact O-CG 3.34Å; K49-Q53 PolarHBondContact O-N 3.07Å; T50-Q53 PolarHBondContact O-N 3.41Å; Q53-D56 WeakPolarHBondContact O-CB 3.31Å; Q53-D56 PolarHBondContact O-N 3.04Å; Q53-N57 PolarHBondContact O-N 3.43Å; Q53-N57 PolarHBondContact O-ND2 3.43Å; Q53-F130 HydrophobicContact CB-CE1 3.84Å; Q53-F130 HydrophobicContact CB-CZ 4.39Å
54	C	97.1	Very high	95.4	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-47.8	173.4	-179.6	0	0	0	0	111.3	T50 M51 D56 N57 L58 F130	T50-C54 WeakPolarHBondContact O-CB 3.42Å; T50-C54 PolarHBondContact O-N 3.18Å; M51-C54 PolarHBondContact O-N 3.38Å; C54-D56 VanDerWaalsContact C-N 3.34Å; C54-D56 PolarHBondContact O-N 3.07Å; C54-N57 PolarHBondContact O-N 3.3Å; C54-L58 WeakPolarHBondContact O-CG 3.29Å; C54-L58 PolarHBondContact O-N 3.09Å; C54-F130 VanDerWaalsContact CA-CZ 3.41Å; C54-F130 HydrophobicContact CB-CD2 3.92Å; C54-F130 HydrophobicContact CB-CE1 4.43Å; C54-F130 HydrophobicContact CB-CE2 3.62Å; C54-F130 HydrophobicContact CB-CG 4.49Å; C54-F130 HydrophobicContact CB-CZ 3.91Å
55	M	97.1	Very high	95.3	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61	-40.4	175.1	-171.6	-169.9	-162.9	0	0	112	F41 R43 M51 E52 N57 L58 V59 I99	F41-M55 HydrophobicContact CB-CE 3.43Å; F41-M55 VanDerWaalsContact CB-CE 3.43Å; F41-M55 HydrophobicContact CB-CG 4.44Å; F41-M55 HydrophobicContact CD1-CG 4.13Å; R43-M55 HydrophobicContact CG-CE 3.93Å; R43-M55 HydrophobicContact CG-SD 4.07Å; M51-M55 WeakPolarHBondContact O-CB 3.37Å; M51-M55 PolarHBondContact O-N 3Å; E52-M55 PolarHBondContact O-N 3.33Å; M55-N57 VanDerWaalsContact C-N 3.3Å; M55-N57 PolarHBondContact O-N 3.38Å; M55-L58 PolarHBondContact O-N 2.8Å; M55-V59 VanDerWaalsContact O-CB 3.3Å; M55-V59 WeakPolarHBondContact O-CB 3.41Å; M55-V59 WeakPolarHBondContact O-CG2 3.43Å; M55-V59 PolarHBondContact O-N 3.21Å; M55-I99 HydrophobicContact CB-CD1 3.96Å; M55-I99 HydrophobicContact CB-CG2 4.19Å; M55-I99 HydrophobicContact CE-CG1 4.39Å; M55-I99 HydrophobicContact CG-CD1 4.25Å; M55-I99 HydrophobicContact CG-CG2 4.45Å; M55-I99 HydrophobicContact SD-CD1 3.42Å; M55-I99 WeakPolarHBondContact SD-CD1 3.47Å; M55-I99 HydrophobicContact SD-CG1 3.79Å
56	D	96.1	Very high	95.4	Very high	48 Å²	48	47.9 Å²	47.9	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-59.8	-40.7	175.2	-71.2	-31.6	0	0	0	112.2	E52 Q53 C54 Q60 R68	E52-D56 VanDerWaalsContact O-CG 3.22Å; E52-D56 PolarHBondContact O-N 3.01Å; Q53-D56 WeakPolarHBondContact O-CB 3.31Å; Q53-D56 PolarHBondContact O-N 3.04Å; C54-D56 VanDerWaalsContact C-N 3.34Å; C54-D56 PolarHBondContact O-N 3.07Å; D56-Q60 WeakPolarHBondContact O-CG 3.37Å; D56-Q60 PolarHBondContact O-N 3.37Å; D56-Q60 VanDerWaalsContact O-N 3.07Å; D56-Q60 PolarHBondContact O-NE2 3.5Å; D56-R68 IonicContact OD1-CZ 2.64Å; D56-R68 IonicContact OD1-NH1 2.83Å; D56-R68 PolarHBondContact OD1-NH1 3.01Å; D56-R68 IonicContact OD1-NH2 3.28Å; D56-R68 PolarHBondContact OD1-NH2 2.98Å
57	N	94.8	Very high	95.4	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-70.5	-45.6	180	-78.6	-135.5	0	0	0	110.7	Q53 C54 M55 V59 Q60 L61 S132 I133 P225	Q53-N57 PolarHBondContact O-N 3.43Å; Q53-N57 PolarHBondContact O-ND2 3.43Å; C54-N57 PolarHBondContact O-N 3.3Å; M55-N57 VanDerWaalsContact C-N 3.3Å; M55-N57 PolarHBondContact O-N 3.38Å; N57-V59 VanDerWaalsContact C-N 3.29Å; N57-V59 PolarHBondContact O-N 3.2Å; N57-Q60 WeakPolarHBondContact O-CB 3.23Å; N57-Q60 PolarHBondContact O-N 2.93Å; N57-Q60 VanDerWaalsContact O-N 3.13Å; N57-L61 WeakPolarHBondContact O-CG 3.17Å; N57-L61 PolarHBondContact O-N 2.89Å; N57-S132 PolarHBondContact ND2-OG 3.03Å; N57-S132 WeakPolarHBondContact OD1-CA 3.44Å; N57-S132 PolarHBondContact OD1-OG 3.4Å; N57-I133 HydrophobicContact CB-CD1 3.87Å; N57-I133 HydrophobicContact CB-CG1 4.46Å; N57-I133 WeakPolarHBondContact OD1-CD1 3.49Å; N57-I133 WeakPolarHBondContact OD1-CG1 3.31Å; N57-I133 PolarHBondContact OD1-N 3.25Å; N57-P225 HydrophobicContact CB-CB 4.09Å; N57-P225 HydrophobicContact CB-CG 4.26Å
58	L	95.9	Very high	95.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-36.8	175.4	-67.8	175.2	0	0	0	112.3	F41 C54 M55 L61 K62 L109 F172 F173 M227	F41-L58 HydrophobicContact CE1-CB 3.72Å; F41-L58 HydrophobicContact CZ-CB 4.3Å; C54-L58 WeakPolarHBondContact O-CG 3.29Å; C54-L58 PolarHBondContact O-N 3.09Å; M55-L58 PolarHBondContact O-N 2.8Å; L58-L61 PolarHBondContact O-N 2.8Å; L58-K62 WeakPolarHBondContact O-CB 3.45Å; L58-K62 PolarHBondContact O-N 3.47Å; L58-K62 VanDerWaalsContact O-N 3.11Å; L58-L109 HydrophobicContact CD1-CD1 4.19Å; L58-L109 HydrophobicContact CD1-CD2 4.35Å; L58-F172 HydrophobicContact CD2-CE1 4.35Å; L58-F173 HydrophobicContact CD2-CE1 3.84Å; L58-F173 HydrophobicContact CD2-CZ 3.88Å; L58-M227 HydrophobicContact CD2-CE 4.22Å
59	V	95.8	Very high	95.5	Very high	13 Å²	13	44.7 Å²	44.7	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-44.4	172.7	158.7	0	0	0	0	111	F41 M55 N57 K62 K63 E66	F41-V59 HydrophobicContact CB-CG2 4.17Å; F41-V59 HydrophobicContact CD1-CG2 3.72Å; F41-V59 HydrophobicContact CD2-CG2 3.62Å; F41-V59 HydrophobicContact CE1-CG2 3.9Å; F41-V59 HydrophobicContact CE2-CG2 3.81Å; F41-V59 HydrophobicContact CG-CG2 3.57Å; F41-V59 HydrophobicContact CZ-CG2 3.93Å; M55-V59 VanDerWaalsContact O-CB 3.3Å; M55-V59 WeakPolarHBondContact O-CB 3.41Å; M55-V59 WeakPolarHBondContact O-CG2 3.43Å; M55-V59 PolarHBondContact O-N 3.21Å; N57-V59 VanDerWaalsContact C-N 3.29Å; N57-V59 PolarHBondContact O-N 3.2Å; V59-K62 PolarHBondContact O-N 3.28Å; V59-K63 WeakPolarHBondContact O-CG 3.43Å; V59-K63 PolarHBondContact O-N 3.16Å; V59-E66 HydrophobicContact CG1-CG 4.17Å
60	Q	93.4	Very high	95.4	Very high	47 Å²	47	47.2 Å²	47.2	22%	0.22	23%	0.227	C	C	.	.	H	α-helix	trans	-61.9	-43.2	177.2	-75.5	173.8	77.6	0	0	112.3	D56 N57 K62 K63 Y134 L143	D56-Q60 WeakPolarHBondContact O-CG 3.37Å; D56-Q60 PolarHBondContact O-N 3.37Å; D56-Q60 VanDerWaalsContact O-N 3.07Å; D56-Q60 PolarHBondContact O-NE2 3.5Å; N57-Q60 WeakPolarHBondContact O-CB 3.23Å; N57-Q60 PolarHBondContact O-N 2.93Å; N57-Q60 VanDerWaalsContact O-N 3.13Å; Q60-K62 PolarHBondContact O-N 3.37Å; Q60-K63 PolarHBondContact O-N 2.84Å; Q60-Y134 PolarHBondContact NE2-OH 3.21Å; Q60-Y134 VanDerWaalsContact NE2-OH 3.14Å; Q60-L143 HydrophobicContact CB-CD2 4.38Å
61	L	93.1	Very high	95.3	Very high	56 Å²	56	54.9 Å²	54.9	29%	0.293	25%	0.25	S	S	.	.	H	α-helix	trans	-63.5	-27.8	176.4	-71	177.9	0	0	0	113.2	N57 L58 F173 Y188 P225	N57-L61 WeakPolarHBondContact O-CG 3.17Å; N57-L61 PolarHBondContact O-N 2.89Å; L58-L61 PolarHBondContact O-N 2.8Å; L61-F173 HydrophobicContact CD1-CD1 4.47Å; L61-F173 HydrophobicContact CD1-CE1 4.08Å; L61-Y188 HydrophobicContact CD2-CE1 3.63Å; L61-P225 HydrophobicContact CD1-CG 3.86Å
62	K	94.5	Very high	95.3	Very high	19 Å²	19	61 Å²	61	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-92.5	-4.8	-175.8	-157.7	54.9	173.5	-177.5	0	114.2	K37 T39 F41 L58 V59 Q60 N65 E66 F172	K37-K62 VanDerWaalsContact O-CE 3.31Å; K37-K62 WeakPolarHBondContact O-CE 3.39Å; T39-K62 WeakPolarHBondContact OG1-CE 3.22Å; F41-K62 HydrophobicContact CE2-CB 4.12Å; F41-K62 HydrophobicContact CE2-CG 4.35Å; F41-K62 HydrophobicContact CZ-CB 3.99Å; F41-K62 HydrophobicContact CZ-CG 4.43Å; L58-K62 WeakPolarHBondContact O-CB 3.45Å; L58-K62 PolarHBondContact O-N 3.47Å; L58-K62 VanDerWaalsContact O-N 3.11Å; V59-K62 PolarHBondContact O-N 3.28Å; Q60-K62 PolarHBondContact O-N 3.37Å; K62-N65 CarbonylContact O-C 3.52Å; K62-N65 PolarHBondContact O-N 3.26Å; K62-E66 HydrophobicContact CB-CB 4.37Å; K62-F172 PolarHBondContact NZ-O 3.01Å
63	K	93.2	Very high	95.2	Very high	86 Å²	86	60.6 Å²	60.6	37%	0.374	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	135.6	176.6	-63.4	-155.4	168.1	-164.4	0	111.7	V59 Q60 E66	V59-K63 WeakPolarHBondContact O-CG 3.43Å; V59-K63 PolarHBondContact O-N 3.16Å; Q60-K63 PolarHBondContact O-N 2.84Å; K63-E66 VanDerWaalsContact CA-OE2 3.3Å; K63-E66 WeakPolarHBondContact CA-OE2 3.09Å; K63-E66 VanDerWaalsContact CE-OE1 3.32Å; K63-E66 WeakPolarHBondContact CE-OE1 3.17Å; K63-E66 WeakPolarHBondContact CG-OE1 3.15Å
64	P	94	Very high	95.1	Very high	109 Å²	109	65.2 Å²	65.2	71%	0.708	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95	7.5	5.7	38.4	-37	0	0	0	115.1	E66	P64-E66 VanDerWaalsContact C-N 3.32Å; P64-E66 VanDerWaalsContact CA-OE2 3.31Å; P64-E66 WeakPolarHBondContact CA-OE2 3.16Å; P64-E66 PolarHBondContact O-N 3.23Å; P64-E66 VanDerWaalsContact O-OE2 3.12Å
65	N	94.9	Very high	95	Very high	47 Å²	47	67.2 Å²	67.2	25%	0.251	31%	0.306	S	S	.	.	S	Bend	trans	-96.6	47.1	-171.6	-65.3	-40.3	0	0	0	111.9	D36 T38 T39 K62	D36-N65 VanDerWaalsContact CB-ND2 3.31Å; D36-N65 WeakPolarHBondContact CB-ND2 3.28Å; T38-N65 WeakPolarHBondContact CA-O 3.14Å; T39-N65 PolarHBondContact N-O 3.25Å; K62-N65 CarbonylContact O-C 3.52Å; K62-N65 PolarHBondContact O-N 3.26Å
66	E	95.6	Very high	94.9	Very high	50 Å²	50	72.4 Å²	72.4	23%	0.234	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	147.3	178.5	83	-78.4	-164.2	0	0	113.4	T39 F41 V59 K62 K63 P64	T39-E66 CarbonylContact O-C 3.55Å; T39-E66 WeakPolarHBondContact O-CA 3.33Å; F41-E66 HydrophobicContact CD2-CB 4.14Å; F41-E66 HydrophobicContact CE2-CB 3.75Å; V59-E66 HydrophobicContact CG1-CG 4.17Å; K62-E66 HydrophobicContact CB-CB 4.37Å; K63-E66 VanDerWaalsContact CA-OE2 3.3Å; K63-E66 WeakPolarHBondContact CA-OE2 3.09Å; K63-E66 VanDerWaalsContact CE-OE1 3.32Å; K63-E66 WeakPolarHBondContact CE-OE1 3.17Å; K63-E66 WeakPolarHBondContact CG-OE1 3.15Å; P64-E66 VanDerWaalsContact C-N 3.32Å; P64-E66 VanDerWaalsContact CA-OE2 3.31Å; P64-E66 WeakPolarHBondContact CA-OE2 3.16Å; P64-E66 PolarHBondContact O-N 3.23Å; P64-E66 VanDerWaalsContact O-OE2 3.12Å
67	V	96.9	Very high	94.8	Very high	34 Å²	34	70.6 Å²	70.6	21%	0.206	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	108.3	166.6	178	0	0	0	0	108.7	T38 T39 I40 F41 Y91	T38-V67 HydrophobicContact CG2-CG2 3.85Å; T39-V67 PolarHBondContact O-N 3.38Å; I40-V67 CarbonylContact C-O 3.59Å; I40-V67 WeakPolarHBondContact CA-O 3.31Å; I40-V67 HydrophobicContact CB-CB 4.48Å; I40-V67 HydrophobicContact CG1-CB 4.21Å; I40-V67 HydrophobicContact CG1-CG1 4.16Å; F41-V67 PolarHBondContact N-O 3.1Å; V67-Y91 HydrophobicContact CG1-CD1 3.54Å; V67-Y91 HydrophobicContact CG1-CE1 4Å; V67-Y91 HydrophobicContact CG1-CG 3.89Å
68	R	96.2	Very high	94.8	Very high	88 Å²	88	72.9 Å²	72.9	33%	0.332	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119.1	179.6	-171.9	179.7	-175.7	171.2	7.7	112.4	F41 E52 D56	F41-R68 HydrophobicContact CB-CG 4.39Å; E52-R68 IonicContact OE2-NH2 3.88Å; D56-R68 IonicContact OD1-CZ 2.64Å; D56-R68 IonicContact OD1-NH1 2.83Å; D56-R68 PolarHBondContact OD1-NH1 3.01Å; D56-R68 IonicContact OD1-NH2 3.28Å; D56-R68 PolarHBondContact OD1-NH2 2.98Å
69	L	95.8	Very high	94.8	Very high	15 Å²	15	78.3 Å²	78.3	8%	0.079	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	134.2	171.8	-58.1	-173.9	0	0	0	111.1	I40 F41 I42 F87 Y91	I40-L69 HydrophobicContact CD1-CD1 3.98Å; I40-L69 HydrophobicContact CD1-CD2 4.2Å; I40-L69 HydrophobicContact CD1-CG 4.06Å; I40-L69 HydrophobicContact CG1-CD1 4.43Å; I40-L69 HydrophobicContact CG1-CG 4.16Å; F41-L69 WeakPolarHBondContact O-CB 3.24Å; F41-L69 PolarHBondContact O-N 3.23Å; I42-L69 HydrophobicContact CB-CD1 4.44Å; I42-L69 HydrophobicContact CG1-CD1 3.88Å; I42-L69 HydrophobicContact CG2-CD1 4.3Å; L69-F87 HydrophobicContact CD1-CD1 3.46Å; L69-F87 VanDerWaalsContact CD1-CD1 3.46Å; L69-F87 HydrophobicContact CD1-CE1 3.44Å; L69-F87 VanDerWaalsContact CD1-CE1 3.44Å; L69-F87 HydrophobicContact CD1-CG 4.45Å; L69-F87 HydrophobicContact CD1-CZ 4.4Å; L69-F87 HydrophobicContact CD2-CD1 4.45Å; L69-F87 HydrophobicContact CD2-CE1 4.39Å; L69-Y91 HydrophobicContact CD2-CD2 4.47Å; L69-Y91 HydrophobicContact CD2-CE1 4.43Å; L69-Y91 HydrophobicContact CD2-CE2 3.76Å
70	R	93.4	Very high	94.8	Very high	221 Å²	221	81.2 Å²	81.2	83%	0.834	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	-39.3	178.6	-65.3	-174.6	180	-170.9	-0.1	112.7	R43	R43-R70 PolarHBondContact NH1-O 2.81Å
71	R	94.8	Very high	94.9	Very high	212 Å²	212	81.6 Å²	81.6	80%	0.8	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	145.4	-175.1	-65.2	-175.5	-179.6	177.9	-0.6	111.3	N73	R71-N73 PolarHBondContact O-ND2 3.4Å
72	K	95.4	Very high	95	Very high	129 Å²	129	81.3 Å²	81.3	56%	0.561	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	146.1	169.6	-64.7	179.2	173.6	-175.7	0	109.2	R43	R43-K72 HydrophobicContact CB-CG 4.38Å
73	N	95.3	Very high	95.1	Very high	24 Å²	24	81.4 Å²	81.4	13%	0.128	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	144	-176.9	-50.6	-87.2	0	0	0	110	R43 G44 S45 R71 F75	R43-N73 PolarHBondContact O-N 2.59Å; R43-N73 PolarHBondContact O-ND2 3.38Å; R43-N73 VanDerWaalsContact O-ND2 3.14Å; G44-N73 CarbonylContact C-O 3.55Å; G44-N73 WeakPolarHBondContact CA-O 3.2Å; S45-N73 PolarHBondContact N-O 2.79Å; S45-N73 PolarHBondContact OG-O 3.15Å; R71-N73 PolarHBondContact O-ND2 3.4Å; N73-F75 HydrophobicContact CB-CD1 3.95Å; N73-F75 HydrophobicContact CB-CD2 3.53Å; N73-F75 HydrophobicContact CB-CE1 3.83Å; N73-F75 HydrophobicContact CB-CE2 3.4Å; N73-F75 VanDerWaalsContact CB-CE2 3.4Å; N73-F75 HydrophobicContact CB-CG 3.79Å; N73-F75 HydrophobicContact CB-CZ 3.54Å; N73-F75 PolarHBondContact O-N 2.93Å; N73-F75 VanDerWaalsContact O-N 3.12Å
74	E	94.2	Very high	95.2	Very high	168 Å²	168	77.3 Å²	77.3	79%	0.785	37%	0.369	S	S	*	.			trans	-87.8	37.2	-180	-47.3	-162.1	139	0	0	112.7	S45	S45-E74 VanDerWaalsContact OG-CA 3.28Å; S45-E74 WeakPolarHBondContact OG-CA 3.4Å; S45-E74 WeakPolarHBondContact OG-CG 2.96Å
75	F	94.2	Very high	95.4	Very high	43 Å²	43	74 Å²	74	19%	0.189	34%	0.344	C	S	.	.			trans	-80.3	144.5	-176.6	-54.6	-23.7	0	0	0	111.3	I42 N73 P83 F84 F87 F98	I42-F75 HydrophobicContact CG2-CD2 4.21Å; I42-F75 HydrophobicContact CG2-CE2 4.44Å; N73-F75 HydrophobicContact CB-CD1 3.95Å; N73-F75 HydrophobicContact CB-CD2 3.53Å; N73-F75 HydrophobicContact CB-CE1 3.83Å; N73-F75 HydrophobicContact CB-CE2 3.4Å; N73-F75 VanDerWaalsContact CB-CE2 3.4Å; N73-F75 HydrophobicContact CB-CG 3.79Å; N73-F75 HydrophobicContact CB-CZ 3.54Å; N73-F75 PolarHBondContact O-N 2.93Å; N73-F75 VanDerWaalsContact O-N 3.12Å; F75-P83 HydrophobicContact CD1-CB 3.69Å; F75-P83 HydrophobicContact CD1-CG 3.84Å; F75-P83 HydrophobicContact CD2-CB 3.76Å; F75-P83 HydrophobicContact CE1-CB 3.72Å; F75-P83 HydrophobicContact CE1-CG 4.13Å; F75-P83 HydrophobicContact CE2-CB 3.78Å; F75-P83 HydrophobicContact CG-CB 3.74Å; F75-P83 HydrophobicContact CG-CG 4.16Å; F75-P83 HydrophobicContact CZ-CB 3.78Å; F75-F84 HydrophobicContact CB-CE2 3.88Å; F75-F84 HydrophobicContact CB-CZ 3.73Å; F75-F84 HydrophobicContact CD2-CZ 4.36Å; F75-F87 AromaticContact CE2-CD2 4Å; F75-F87 HydrophobicContact CE2-CD2 4Å; F75-F87 AromaticContact CE2-CE2 3.66Å; F75-F87 HydrophobicContact CE2-CE2 3.66Å; F75-F87 HydrophobicContact CE2-CZ 4.28Å; F75-F87 HydrophobicContact CZ-CD2 4.24Å; F75-F87 AromaticContact CZ-CE2 3.54Å; F75-F87 HydrophobicContact CZ-CE2 3.54Å; F75-F87 HydrophobicContact CZ-CZ 4.21Å; F75-F98 HydrophobicContact CB-CE2 4.29Å; F75-F98 VanDerWaalsContact O-CZ 3.3Å; F75-F98 WeakPolarHBondContact O-CZ 3.46Å
76	L	94.5	Very high	95.4	Very high	109 Å²	109	78.5 Å²	78.5	57%	0.571	36%	0.362	S	S	*	.			trans	-124.8	94.4	177.1	-65.1	177.1	0	0	0	108.4	F78 V79 D80	L76-F78 PolarHBondContact O-N 3.49Å; L76-V79 HydrophobicContact CB-CB 3.88Å; L76-V79 HydrophobicContact CB-CG2 3.92Å; L76-V79 HydrophobicContact CD1-CG2 4.2Å; L76-V79 PolarHBondContact O-N 3.2Å; L76-D80 PolarHBondContact O-N 3.36Å
77	P	95	Very high	95.5	Very high	10 Å²	10	78.3 Å²	78.3	7%	0.065	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-35.3	-170.1	-22.1	23.3	0	0	0	115.6	F84 F98 V110 M122	P77-F84 VanDerWaalsContact CA-CE2 3.5Å; P77-F84 HydrophobicContact CB-CE2 3.89Å; P77-F84 HydrophobicContact CB-CZ 3.94Å; P77-F84 HydrophobicContact CG-CE1 4.27Å; P77-F84 HydrophobicContact CG-CE2 3.92Å; P77-F84 HydrophobicContact CG-CZ 3.5Å; P77-F84 VanDerWaalsContact CG-CZ 3.5Å; P77-F98 HydrophobicContact CG-CD1 3.54Å; P77-F98 HydrophobicContact CG-CE1 3.77Å; P77-F98 HydrophobicContact CG-CG 4.09Å; P77-F98 HydrophobicContact CG-CZ 4.49Å; P77-V110 HydrophobicContact CB-CG1 4.21Å; P77-V110 HydrophobicContact CG-CB 4.44Å; P77-V110 HydrophobicContact CG-CG1 4.32Å; P77-V110 HydrophobicContact CG-CG2 4.23Å; P77-M122 HydrophobicContact CB-SD 3.97Å; P77-M122 WeakPolarHBondContact O-CE 3.41Å
78	F	95.7	Very high	95.5	Very high	49 Å²	49	76.7 Å²	76.7	22%	0.215	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	3.4	-177.3	-70.5	-91.9	0	0	0	113.8	L76 V110 M122 E124 R233 K235	L76-F78 PolarHBondContact O-N 3.49Å; F78-V110 HydrophobicContact CE2-CG1 4.24Å; F78-V110 HydrophobicContact CE2-CG2 4.21Å; F78-M122 HydrophobicContact CE1-CG 4.32Å; F78-M122 HydrophobicContact CE1-SD 4.3Å; F78-M122 HydrophobicContact CE2-SD 4.24Å; F78-M122 HydrophobicContact CZ-CG 4.18Å; F78-M122 HydrophobicContact CZ-SD 4.15Å; F78-E124 HydrophobicContact CE2-CB 3.68Å; F78-E124 HydrophobicContact CE2-CG 4.34Å; F78-E124 HydrophobicContact CZ-CB 3.79Å; F78-R233 HydrophobicContact CD1-CB 3.99Å; F78-R233 HydrophobicContact CE1-CB 3.58Å; F78-R233 HydrophobicContact CE2-CB 4.37Å; F78-R233 HydrophobicContact CZ-CB 3.8Å; F78-R233 WeakPolarHBondContact CZ-O 2.85Å; F78-K235 HydrophobicContact CE1-CB 4.3Å
79	V	95.3	Very high	95.4	Very high	116 Å²	116	78.1 Å²	78.1	70%	0.703	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-48.2	176.8	-178.7	0	0	0	0	109.5	L76	L76-V79 HydrophobicContact CB-CB 3.88Å; L76-V79 HydrophobicContact CB-CG2 3.92Å; L76-V79 HydrophobicContact CD1-CG2 4.2Å; L76-V79 PolarHBondContact O-N 3.2Å
80	D	95	Very high	95.4	Very high	74 Å²	74	83.7 Å²	83.7	40%	0.396	39%	0.386	S	S	.	.			trans	-138.8	120.9	176.7	179.9	20.1	0	0	0	110.2	L76 T82 P83	L76-D80 PolarHBondContact O-N 3.36Å; D80-T82 WeakPolarHBondContact OD1-CB 3.4Å; D80-T82 PolarHBondContact OD1-N 3.26Å; D80-T82 PolarHBondContact OD1-OG1 2.85Å; D80-P83 WeakPolarHBondContact OD2-CD 3.36Å
81	E	95.1	Very high	95.5	Very high	54 Å²	54	77.1 Å²	77.1	25%	0.252	36%	0.361	S	S	.	.			trans	-93.4	-17	-179.9	60.8	-161.6	155.4	0	0	113.6	P83 F84 E85 V119 M122 K235	E81-P83 VanDerWaalsContact C-N 3.29Å; E81-P83 VanDerWaalsContact O-N 3.11Å; E81-F84 WeakPolarHBondContact O-CB 3.02Å; E81-F84 PolarHBondContact O-N 2.91Å; E81-E85 PolarHBondContact O-N 3.23Å; E81-V119 HydrophobicContact CB-CG2 3.91Å; E81-V119 HydrophobicContact CG-CG2 4.5Å; E81-M122 HydrophobicContact CB-CE 4.28Å; E81-K235 IonicContact OE1-NZ 3.48Å; E81-K235 PolarHBondContact OE1-NZ 2.9Å; E81-K235 IonicContact OE2-NZ 3.71Å; E81-K235 PolarHBondContact OE2-NZ 3.35Å
82	T	96.1	Very high	95.5	Very high	51 Å²	51	69 Å²	69	31%	0.313	33%	0.334	S	S	.	.	H	α-helix	trans	-49.2	-40.7	-178.6	-46.3	0	0	0	0	113.6	D80 F84 E85 K86	D80-T82 WeakPolarHBondContact OD1-CB 3.4Å; D80-T82 PolarHBondContact OD1-N 3.26Å; D80-T82 PolarHBondContact OD1-OG1 2.85Å; T82-F84 PolarHBondContact O-N 2.96Å; T82-E85 PolarHBondContact O-N 2.96Å; T82-K86 HydrophobicContact CG2-CD 4.01Å; T82-K86 HydrophobicContact CG2-CG 4.4Å; T82-K86 WeakPolarHBondContact O-CB 3.3Å; T82-K86 VanDerWaalsContact O-CG 3.31Å; T82-K86 WeakPolarHBondContact O-CG 3.47Å; T82-K86 PolarHBondContact O-N 3.37Å
83	P	96	Very high	95.5	Very high	20 Å²	20	63 Å²	63	13%	0.13	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-42.4	177.1	-21.6	34.1	0	0	0	111.8	F75 D80 E81 E85 K86 F87	F75-P83 HydrophobicContact CD1-CB 3.69Å; F75-P83 HydrophobicContact CD1-CG 3.84Å; F75-P83 HydrophobicContact CD2-CB 3.76Å; F75-P83 HydrophobicContact CE1-CB 3.72Å; F75-P83 HydrophobicContact CE1-CG 4.13Å; F75-P83 HydrophobicContact CE2-CB 3.78Å; F75-P83 HydrophobicContact CG-CB 3.74Å; F75-P83 HydrophobicContact CG-CG 4.16Å; F75-P83 HydrophobicContact CZ-CB 3.78Å; D80-P83 WeakPolarHBondContact OD2-CD 3.36Å; E81-P83 VanDerWaalsContact C-N 3.29Å; E81-P83 VanDerWaalsContact O-N 3.11Å; P83-E85 VanDerWaalsContact C-N 3.35Å; P83-E85 PolarHBondContact O-N 3.45Å; P83-K86 PolarHBondContact O-N 2.92Å; P83-F87 WeakPolarHBondContact O-CB 3.43Å; P83-F87 WeakPolarHBondContact O-CD2 3.2Å; P83-F87 PolarHBondContact O-N 2.98Å
84	F	96.6	Very high	95.6	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-44.1	-179.2	-60.7	-86.8	0	0	0	110.6	I42 F75 P77 E81 T82 F87 C88 F96 F98 M114	I42-F84 HydrophobicContact CD1-CD1 3.85Å; I42-F84 HydrophobicContact CD1-CE1 4.06Å; F75-F84 HydrophobicContact CB-CE2 3.88Å; F75-F84 HydrophobicContact CB-CZ 3.73Å; F75-F84 HydrophobicContact CD2-CZ 4.36Å; P77-F84 VanDerWaalsContact CA-CE2 3.5Å; P77-F84 HydrophobicContact CB-CE2 3.89Å; P77-F84 HydrophobicContact CB-CZ 3.94Å; P77-F84 HydrophobicContact CG-CE1 4.27Å; P77-F84 HydrophobicContact CG-CE2 3.92Å; P77-F84 HydrophobicContact CG-CZ 3.5Å; P77-F84 VanDerWaalsContact CG-CZ 3.5Å; E81-F84 WeakPolarHBondContact O-CB 3.02Å; E81-F84 PolarHBondContact O-N 2.91Å; T82-F84 PolarHBondContact O-N 2.96Å; F84-F87 PolarHBondContact O-N 3.38Å; F84-C88 VanDerWaalsContact O-CB 3.23Å; F84-C88 WeakPolarHBondContact O-CB 3.41Å; F84-C88 PolarHBondContact O-N 3.49Å; F84-C88 PolarHBondContact O-SG 3.18Å; F84-C88 VanDerWaalsContact O-SG 3.41Å; F84-F96 AromaticContact CD1-CD2 3.63Å; F84-F96 HydrophobicContact CD1-CD2 3.63Å; F84-F96 AromaticContact CD1-CE2 3.74Å; F84-F96 HydrophobicContact CD1-CE2 3.74Å; F84-F96 HydrophobicContact CD1-CG 4.2Å; F84-F96 HydrophobicContact CD1-CZ 4.38Å; F84-F96 HydrophobicContact CE1-CD2 4.14Å; F84-F96 HydrophobicContact CE1-CE2 4.17Å; F84-F96 HydrophobicContact CG-CD2 4.49Å; F84-F96 HydrophobicContact CG-CE2 4.31Å; F84-F98 HydrophobicContact CE1-CB 3.88Å; F84-F98 AromaticContact CE1-CD2 3.83Å; F84-F98 HydrophobicContact CE1-CD2 3.83Å; F84-F98 AromaticContact CE1-CG 3.96Å; F84-F98 HydrophobicContact CE1-CG 3.96Å; F84-F98 HydrophobicContact CZ-CB 4.49Å; F84-F98 AromaticContact CZ-CD2 3.94Å; F84-F98 HydrophobicContact CZ-CD2 3.94Å; F84-F98 HydrophobicContact CZ-CE2 4.31Å; F84-F98 HydrophobicContact CZ-CG 4.14Å; F84-M114 HydrophobicContact CB-CE 3.63Å
85	E	96.6	Very high	95.7	Very high	39 Å²	39	55.4 Å²	55.4	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-49.6	176.2	-61.6	-179.1	156.7	0	0	111.6	E81 T82 P83 F87 C88 M89 F117 N118 V119	E81-E85 PolarHBondContact O-N 3.23Å; T82-E85 PolarHBondContact O-N 2.96Å; P83-E85 VanDerWaalsContact C-N 3.35Å; P83-E85 PolarHBondContact O-N 3.45Å; E85-F87 VanDerWaalsContact C-N 3.34Å; E85-F87 PolarHBondContact O-N 2.84Å; E85-C88 PolarHBondContact O-N 3.15Å; E85-M89 WeakPolarHBondContact O-CB 3.33Å; E85-M89 PolarHBondContact O-N 3.19Å; E85-F117 WeakPolarHBondContact CA-O 3.33Å; E85-F117 VanDerWaalsContact CB-O 3.24Å; E85-F117 WeakPolarHBondContact CB-O 3.32Å; E85-F117 VanDerWaalsContact CG-O 3.31Å; E85-F117 WeakPolarHBondContact CG-O 3.31Å; E85-N118 WeakPolarHBondContact OE1-CA 3.3Å; E85-V119 HydrophobicContact CG-CG2 4.15Å; E85-V119 PolarHBondContact OE1-N 2.8Å; E85-V119 VanDerWaalsContact OE1-N 3.16Å
86	K	96.5	Very high	95.9	Very high	143 Å²	143	53.4 Å²	53.4	62%	0.622	27%	0.267	S	S	*	.	H	α-helix	trans	-59.4	-42.6	177.1	-75.9	174.6	178.8	168	0	112.5	T82 P83 K90	T82-K86 HydrophobicContact CG2-CD 4.01Å; T82-K86 HydrophobicContact CG2-CG 4.4Å; T82-K86 WeakPolarHBondContact O-CB 3.3Å; T82-K86 VanDerWaalsContact O-CG 3.31Å; T82-K86 WeakPolarHBondContact O-CG 3.47Å; T82-K86 PolarHBondContact O-N 3.37Å; P83-K86 PolarHBondContact O-N 2.92Å; K86-K90 VanDerWaalsContact O-CB 3.27Å; K86-K90 WeakPolarHBondContact O-CB 3.16Å; K86-K90 PolarHBondContact O-N 3.36Å
87	F	96.3	Very high	96.1	Very high	46 Å²	46	48.2 Å²	48.2	20%	0.202	24%	0.24	C	C	.	.	H	α-helix	trans	-70.2	-44.1	178.7	-89.5	-93.4	0	0	0	111.5	I40 L69 F75 P83 F84 E85 M89 K90 Y91	I40-F87 HydrophobicContact CD1-CB 4.01Å; I40-F87 HydrophobicContact CD1-CD1 4.13Å; L69-F87 HydrophobicContact CD1-CD1 3.46Å; L69-F87 VanDerWaalsContact CD1-CD1 3.46Å; L69-F87 HydrophobicContact CD1-CE1 3.44Å; L69-F87 VanDerWaalsContact CD1-CE1 3.44Å; L69-F87 HydrophobicContact CD1-CG 4.45Å; L69-F87 HydrophobicContact CD1-CZ 4.4Å; L69-F87 HydrophobicContact CD2-CD1 4.45Å; L69-F87 HydrophobicContact CD2-CE1 4.39Å; F75-F87 AromaticContact CE2-CD2 4Å; F75-F87 HydrophobicContact CE2-CD2 4Å; F75-F87 AromaticContact CE2-CE2 3.66Å; F75-F87 HydrophobicContact CE2-CE2 3.66Å; F75-F87 HydrophobicContact CE2-CZ 4.28Å; F75-F87 HydrophobicContact CZ-CD2 4.24Å; F75-F87 AromaticContact CZ-CE2 3.54Å; F75-F87 HydrophobicContact CZ-CE2 3.54Å; F75-F87 HydrophobicContact CZ-CZ 4.21Å; P83-F87 WeakPolarHBondContact O-CB 3.43Å; P83-F87 WeakPolarHBondContact O-CD2 3.2Å; P83-F87 PolarHBondContact O-N 2.98Å; F84-F87 PolarHBondContact O-N 3.38Å; E85-F87 VanDerWaalsContact C-N 3.34Å; E85-F87 PolarHBondContact O-N 2.84Å; F87-M89 VanDerWaalsContact C-N 3.34Å; F87-M89 PolarHBondContact O-N 3.31Å; F87-K90 PolarHBondContact O-N 3.41Å; F87-Y91 HydrophobicContact CD1-CD2 4.03Å; F87-Y91 AromaticContact CD1-CE2 3.63Å; F87-Y91 HydrophobicContact CD1-CE2 3.63Å; F87-Y91 HydrophobicContact CE1-CE2 4.07Å; F87-Y91 VanDerWaalsContact O-CD2 3.29Å; F87-Y91 WeakPolarHBondContact O-CD2 3.2Å; F87-Y91 PolarHBondContact O-N 3.25Å
88	C	96.6	Very high	96.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.4	-43	174.7	-81.6	0	0	0	0	112	F84 E85 D92 A93 M114	F84-C88 VanDerWaalsContact O-CB 3.23Å; F84-C88 WeakPolarHBondContact O-CB 3.41Å; F84-C88 PolarHBondContact O-N 3.49Å; F84-C88 PolarHBondContact O-SG 3.18Å; F84-C88 VanDerWaalsContact O-SG 3.41Å; E85-C88 PolarHBondContact O-N 3.15Å; C88-D92 VanDerWaalsContact O-CA 3.3Å; C88-D92 WeakPolarHBondContact O-CA 3.45Å; C88-D92 PolarHBondContact O-N 2.83Å; C88-A93 WeakPolarHBondContact CB-O 3.33Å; C88-A93 PolarHBondContact O-N 3.46Å; C88-A93 PolarHBondContact SG-O 3.5Å; C88-M114 HydrophobicContact CB-CE 3.98Å; C88-M114 HydrophobicContact CB-CG 3.87Å; C88-M114 WeakPolarHBondContact SG-CE 3.31Å
89	M	95.2	Very high	96.3	Very high	117 Å²	117	45.6 Å²	45.6	58%	0.576	23%	0.227	S	C	*	.	H	α-helix	trans	-63.9	-43.2	174.3	-169.3	-169.4	-171.5	0	0	112.4	R28 E85 F87 F117	R28-M89 PolarHBondContact NH1-O 3.48Å; E85-M89 WeakPolarHBondContact O-CB 3.33Å; E85-M89 PolarHBondContact O-N 3.19Å; F87-M89 VanDerWaalsContact C-N 3.34Å; F87-M89 PolarHBondContact O-N 3.31Å; M89-F117 VanDerWaalsContact CA-CD1 3.42Å; M89-F117 HydrophobicContact CB-CB 4.16Å; M89-F117 HydrophobicContact CB-CD1 3.98Å; M89-F117 HydrophobicContact CB-CG 3.96Å; M89-F117 HydrophobicContact CG-CD1 4.4Å; M89-F117 HydrophobicContact CG-CD2 4.18Å; M89-F117 HydrophobicContact CG-CG 4.1Å
90	K	95.1	Very high	96.4	Very high	133 Å²	133	41 Å²	41	58%	0.578	20%	0.201	S	C	*	.	H	α-helix	trans	-62.4	-47.6	179.1	-179.9	175.5	179.2	177.5	0	111.7	R28 K86 F87	R28-K90 PolarHBondContact NH1-O 3.28Å; R28-K90 PolarHBondContact NH2-O 3.3Å; K86-K90 VanDerWaalsContact O-CB 3.27Å; K86-K90 WeakPolarHBondContact O-CB 3.16Å; K86-K90 PolarHBondContact O-N 3.36Å; F87-K90 PolarHBondContact O-N 3.41Å
91	Y	95.3	Very high	96.5	Very high	82 Å²	82	40 Å²	40	32%	0.322	20%	0.195	S	C	.	.	H	α-helix	trans	-92.5	-1.3	-174.3	-70	-77.9	0	0	0	114.3	I40 V67 L69 F87	I40-Y91 HydrophobicContact CD1-CD2 3.5Å; I40-Y91 HydrophobicContact CD1-CE2 4.18Å; I40-Y91 HydrophobicContact CD1-CG 4.01Å; V67-Y91 HydrophobicContact CG1-CD1 3.54Å; V67-Y91 HydrophobicContact CG1-CE1 4Å; V67-Y91 HydrophobicContact CG1-CG 3.89Å; L69-Y91 HydrophobicContact CD2-CD2 4.47Å; L69-Y91 HydrophobicContact CD2-CE1 4.43Å; L69-Y91 HydrophobicContact CD2-CE2 3.76Å; F87-Y91 HydrophobicContact CD1-CD2 4.03Å; F87-Y91 AromaticContact CD1-CE2 3.63Å; F87-Y91 HydrophobicContact CD1-CE2 3.63Å; F87-Y91 HydrophobicContact CE1-CE2 4.07Å; F87-Y91 VanDerWaalsContact O-CD2 3.29Å; F87-Y91 WeakPolarHBondContact O-CD2 3.2Å; F87-Y91 PolarHBondContact O-N 3.25Å
92	D	95.4	Very high	96.5	Very high	43 Å²	43	40 Å²	40	23%	0.23	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	47.7	-176.2	-166.1	41.3	0	0	0	112.3	R28 C88	R28-D92 HydrophobicContact CG-CB 4.26Å; C88-D92 VanDerWaalsContact O-CA 3.3Å; C88-D92 WeakPolarHBondContact O-CA 3.45Å; C88-D92 PolarHBondContact O-N 2.83Å
93	A	96.3	Very high	96.5	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.008	23%	0.231	C	C	.	.			trans	-111.1	122.7	-177.9	0	0	0	0	0	110.8	T38 I40 C88	T38-A93 HydrophobicContact CG2-CB 4.28Å; I40-A93 HydrophobicContact CB-CB 3.87Å; I40-A93 HydrophobicContact CG2-CB 4.1Å; C88-A93 WeakPolarHBondContact CB-O 3.33Å; C88-A93 PolarHBondContact O-N 3.46Å; C88-A93 PolarHBondContact SG-O 3.5Å
94	S	96	Very high	96.4	Very high	34 Å²	34	55 Å²	55	24%	0.238	26%	0.26	C	S	.	.	S	Bend	trans	-84.4	-15.8	176.9	56.3	0	0	0	0	113	K37 T38 R113 M114	K37-S94 WeakPolarHBondContact CB-OG 3.4Å; K37-S94 VanDerWaalsContact CG-OG 3.22Å; K37-S94 WeakPolarHBondContact CG-OG 3.48Å; T38-S94 PolarHBondContact O-N 3.17Å; S94-R113 WeakPolarHBondContact O-CA 3.29Å; S94-M114 PolarHBondContact O-N 2.78Å
95	L	97.5	Very high	96.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.4	179.9	-61.3	174.3	0	0	0	109.3	K37 T38 T39 I40 G112 R113 F172	K37-L95 HydrophobicContact CB-CD1 3.95Å; K37-L95 HydrophobicContact CB-CG 4.27Å; K37-L95 HydrophobicContact CD-CG 4.47Å; T38-L95 PolarHBondContact O-N 3.22Å; T38-L95 VanDerWaalsContact O-N 3.15Å; T39-L95 CarbonylContact C-O 3.58Å; T39-L95 WeakPolarHBondContact CA-O 3.27Å; T39-L95 HydrophobicContact CG2-CB 4.22Å; T39-L95 WeakPolarHBondContact OG1-CB 3.39Å; I40-L95 PolarHBondContact N-O 3.38Å; L95-G112 WeakPolarHBondContact CA-O 3.43Å; L95-R113 HydrophobicContact CD2-CB 3.51Å; L95-F172 HydrophobicContact CD1-CD2 4.21Å
96	F	97.8	Very high	96.3	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	148.8	171.4	70.3	-88.2	0	0	0	111.8	I40 F84 V110 G112 M114 V119 M122	I40-F96 HydrophobicContact CG2-CB 3.55Å; I40-F96 CarbonylContact O-C 3.49Å; I40-F96 VanDerWaalsContact O-CA 3.31Å; I40-F96 WeakPolarHBondContact O-CA 3.3Å; F84-F96 AromaticContact CD1-CD2 3.63Å; F84-F96 HydrophobicContact CD1-CD2 3.63Å; F84-F96 AromaticContact CD1-CE2 3.74Å; F84-F96 HydrophobicContact CD1-CE2 3.74Å; F84-F96 HydrophobicContact CD1-CG 4.2Å; F84-F96 HydrophobicContact CD1-CZ 4.38Å; F84-F96 HydrophobicContact CE1-CD2 4.14Å; F84-F96 HydrophobicContact CE1-CE2 4.17Å; F84-F96 HydrophobicContact CG-CD2 4.49Å; F84-F96 HydrophobicContact CG-CE2 4.31Å; F96-V110 HydrophobicContact CE2-CG1 4.13Å; F96-G112 WeakPolarHBondContact CD1-O 3.46Å; F96-G112 VanDerWaalsContact CE1-CA 3.45Å; F96-G112 PolarHBondContact N-O 2.78Å; F96-G112 PolarHBondContact O-N 2.63Å; F96-M114 HydrophobicContact CD1-CE 3.38Å; F96-M114 HydrophobicContact CD1-SD 4.02Å; F96-M114 HydrophobicContact CE1-CE 3.51Å; F96-M114 HydrophobicContact CE1-SD 3.92Å; F96-M114 HydrophobicContact CG-CE 4.33Å; F96-V119 HydrophobicContact CE1-CG2 4.42Å; F96-M122 HydrophobicContact CZ-CB 3.95Å; F96-M122 HydrophobicContact CZ-SD 4.47Å
97	C	98.1	Very high	96.3	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.7	171.2	170.2	0	0	0	0	107.6	T39 I40 F41 I42 L109 V110 L111 F172	T39-C97 HydrophobicContact CG2-CB 4.22Å; I40-C97 PolarHBondContact O-N 3.28Å; F41-C97 CarbonylContact C-O 3.5Å; F41-C97 WeakPolarHBondContact CA-O 3.31Å; F41-C97 HydrophobicContact CD1-CB 3.58Å; F41-C97 HydrophobicContact CE1-CB 3.82Å; F41-C97 HydrophobicContact CG-CB 4.35Å; I42-C97 PolarHBondContact N-O 3.2Å; C97-L109 VanDerWaalsContact SG-CD1 3.51Å; C97-V110 CarbonylContact C-O 3.16Å; C97-V110 WeakPolarHBondContact CA-O 3.35Å; C97-L111 HydrophobicContact CB-CD2 3.89Å; C97-F172 HydrophobicContact CB-CE2 4.39Å; C97-F172 HydrophobicContact CB-CZ 4.34Å
98	F	98.1	Very high	96.3	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.018	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	126.5	178.6	173.4	-97	0	0	0	110.3	I42 G44 F75 P77 F84 S100 V110	I42-F98 HydrophobicContact CB-CD2 4.09Å; I42-F98 HydrophobicContact CG2-CD2 3.86Å; I42-F98 HydrophobicContact CG2-CE2 4.37Å; I42-F98 WeakPolarHBondContact O-CA 2.99Å; G44-F98 VanDerWaalsContact CA-CE2 3.46Å; F75-F98 HydrophobicContact CB-CE2 4.29Å; F75-F98 VanDerWaalsContact O-CZ 3.3Å; F75-F98 WeakPolarHBondContact O-CZ 3.46Å; P77-F98 HydrophobicContact CG-CD1 3.54Å; P77-F98 HydrophobicContact CG-CE1 3.77Å; P77-F98 HydrophobicContact CG-CG 4.09Å; P77-F98 HydrophobicContact CG-CZ 4.49Å; F84-F98 HydrophobicContact CE1-CB 3.88Å; F84-F98 AromaticContact CE1-CD2 3.83Å; F84-F98 HydrophobicContact CE1-CD2 3.83Å; F84-F98 AromaticContact CE1-CG 3.96Å; F84-F98 HydrophobicContact CE1-CG 3.96Å; F84-F98 HydrophobicContact CZ-CB 4.49Å; F84-F98 AromaticContact CZ-CD2 3.94Å; F84-F98 HydrophobicContact CZ-CD2 3.94Å; F84-F98 HydrophobicContact CZ-CE2 4.31Å; F84-F98 HydrophobicContact CZ-CG 4.14Å; F98-S100 WeakPolarHBondContact CE1-OG 3.46Å; F98-V110 HydrophobicContact CB-CB 4.2Å; F98-V110 HydrophobicContact CD1-CB 4.29Å; F98-V110 HydrophobicContact CD1-CG2 4.22Å; F98-V110 PolarHBondContact N-O 3.16Å; F98-V110 PolarHBondContact O-N 3.2Å
99	I	98	Very high	96.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.6	177.1	62.2	158.3	0	0	0	111	I42 R43 G44 T47 M51 M55 N108 L109	I42-I99 PolarHBondContact O-N 3.42Å; I42-I99 VanDerWaalsContact O-N 3.07Å; R43-I99 HydrophobicContact CG-CD1 4.37Å; R43-I99 HydrophobicContact CG-CG1 4.38Å; G44-I99 WeakPolarHBondContact CA-O 3.34Å; G44-I99 PolarHBondContact N-O 2.92Å; T47-I99 HydrophobicContact CG2-CD1 3.65Å; T47-I99 HydrophobicContact CG2-CG1 3.82Å; M51-I99 HydrophobicContact CB-CB 4.49Å; M51-I99 HydrophobicContact CB-CD1 4.36Å; M51-I99 HydrophobicContact CE-CB 3.85Å; M51-I99 HydrophobicContact CE-CG2 3.44Å; M51-I99 VanDerWaalsContact CE-CG2 3.44Å; M55-I99 HydrophobicContact CB-CD1 3.96Å; M55-I99 HydrophobicContact CB-CG2 4.19Å; M55-I99 HydrophobicContact CE-CG1 4.39Å; M55-I99 HydrophobicContact CG-CD1 4.25Å; M55-I99 HydrophobicContact CG-CG2 4.45Å; M55-I99 HydrophobicContact SD-CD1 3.42Å; M55-I99 WeakPolarHBondContact SD-CD1 3.47Å; M55-I99 HydrophobicContact SD-CG1 3.79Å; I99-N108 WeakPolarHBondContact CA-O 3.42Å; I99-L109 HydrophobicContact CG2-CD1 3.97Å
100	S	97.2	Very high	96.6	Very high	21 Å²	21	46.7 Å²	46.7	15%	0.147	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	165.3	174.8	54.2	0	0	0	0	111.3	K46 F98 N108	K46-S100 CarbonylContact O-C 3Å; K46-S100 VanDerWaalsContact O-CA 3.3Å; K46-S100 WeakPolarHBondContact O-CA 3.18Å; F98-S100 WeakPolarHBondContact CE1-OG 3.46Å; S100-N108 PolarHBondContact N-O 2.73Å; S100-N108 WeakPolarHBondContact O-CA 3.25Å; S100-N108 WeakPolarHBondContact O-CB 3.41Å; S100-N108 PolarHBondContact O-N 3.05Å; S100-N108 WeakPolarHBondContact OG-CB 3.42Å; S100-N108 PolarHBondContact OG-ND2 2.78Å
101	N	97	Very high	96.7	Very high	52 Å²	52	40.5 Å²	40.5	28%	0.278	20%	0.2	S	C	.	.			trans	-143.8	127.9	176.2	-170.2	44.6	0	0	0	110.3	K46 P106 N107	K46-N101 WeakPolarHBondContact CB-O 3.49Å; K46-N101 PolarHBondContact O-N 3.1Å; N101-P106 WeakPolarHBondContact OD1-CA 3.45Å; N101-N107 PolarHBondContact OD1-N 2.88Å
102	S	95.3	Very high	96.8	Very high	54 Å²	54	36.6 Å²	36.6	38%	0.378	19%	0.185	S	C	.	.			trans	-147.2	162.9	178.4	68.6	0	0	0	0	110.7	K104 R105 P106	S102-K104 VanDerWaalsContact C-N 3.31Å; S102-K104 PolarHBondContact O-N 3.49Å; S102-R105 PolarHBondContact N-O 2.86Å; S102-R105 CarbonylContact O-C 3.59Å; S102-R105 PolarHBondContact O-N 3.43Å; S102-R105 VanDerWaalsContact O-O 3.1Å; S102-R105 WeakPolarHBondContact OG-CA 3.48Å; S102-R105 WeakPolarHBondContact OG-CB 3.3Å; S102-R105 PolarHBondContact OG-N 2.79Å; S102-R105 PolarHBondContact OG-O 3.32Å; S102-P106 WeakPolarHBondContact O-CA 3.17Å
103	K	95.3	Very high	96.9	Very high	216 Å²	216	35.7 Å²	35.7	94%	0.939	18%	0.179	S	C	*	.	S	Bend	trans	-60.1	-40.2	177.4	-167.3	179.1	-178	-179.1	0	112.3
104	K	94.5	Very high	96.9	Very high	170 Å²	170	36.5 Å²	36.5	74%	0.739	18%	0.182	S	C	*	.	S	Bend	trans	-73	-32.1	177.7	-176	171.9	-179.3	168.1	0	112.6	S102	S102-K104 VanDerWaalsContact C-N 3.31Å; S102-K104 PolarHBondContact O-N 3.49Å
105	R	93.9	Very high	96.9	Very high	56 Å²	56	39.1 Å²	39.1	21%	0.211	19%	0.188	C	C	.	.	S	Bend	trans	-135	81.2	-177.6	-63.8	-170.1	-178.4	80.4	3	109	S102 N108 E124 R233	S102-R105 PolarHBondContact N-O 2.86Å; S102-R105 CarbonylContact O-C 3.59Å; S102-R105 PolarHBondContact O-N 3.43Å; S102-R105 VanDerWaalsContact O-O 3.1Å; S102-R105 WeakPolarHBondContact OG-CA 3.48Å; S102-R105 WeakPolarHBondContact OG-CB 3.3Å; S102-R105 PolarHBondContact OG-N 2.79Å; S102-R105 PolarHBondContact OG-O 3.32Å; R105-N108 HydrophobicContact CB-CB 4.26Å; R105-E124 WeakPolarHBondContact CD-OE1 3.39Å; R105-E124 WeakPolarHBondContact CD-OE2 3.25Å; R105-E124 IonicContact NE-OE1 3.36Å; R105-E124 PolarHBondContact NE-OE1 2.88Å; R105-E124 IonicContact NE-OE2 2.78Å; R105-E124 PolarHBondContact NE-OE2 3.24Å; R105-E124 VanDerWaalsContact NE-OE2 3.16Å; R105-R233 VanDerWaalsContact NE-NH2 3.16Å; R105-R233 VanDerWaalsContact NH2-NE 3.17Å
106	P	96.1	Very high	96.7	Very high	66 Å²	66	45.1 Å²	45.1	43%	0.429	22%	0.22	S	C	.	.	S	Bend	trans	-68.4	149.1	174.7	28.7	-34.1	0	0	0	109.7	N101 S102 N108 R232	N101-P106 WeakPolarHBondContact OD1-CA 3.45Å; S102-P106 WeakPolarHBondContact O-CA 3.17Å; P106-N108 PolarHBondContact O-N 3.33Å; P106-R232 PolarHBondContact O-NH1 2.89Å; P106-R232 PolarHBondContact O-NH2 3.39Å
107	N	97	Very high	96.5	Very high	40 Å²	40	48.1 Å²	48.1	21%	0.214	23%	0.233	C	C	.	.	S	Bend	trans	41.3	61.6	177.3	-64.3	-25.5	0	0	0	113	S48 M51 N101 V127	S48-N107 PolarHBondContact OG-OD1 3.07Å; M51-N107 HydrophobicContact CG-CB 3.97Å; M51-N107 VanDerWaalsContact SD-C 3.58Å; M51-N107 HydrophobicContact SD-CB 3.8Å; N101-N107 PolarHBondContact OD1-N 2.88Å; N107-V127 HydrophobicContact CB-CB 4.18Å; N107-V127 VanDerWaalsContact CB-O 3.32Å; N107-V127 WeakPolarHBondContact CB-O 3.43Å; N107-V127 PolarHBondContact ND2-O 2.85Å; N107-V127 PolarHBondContact O-N 3.3Å
108	N	97.7	Very high	96.4	Very high	6 Å²	6	52.1 Å²	52.1	3%	0.032	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.3	-170.5	-162.2	53.7	0	0	0	110.6	I99 S100 R105 P106 E124 F125 R232	I99-N108 WeakPolarHBondContact CA-O 3.42Å; S100-N108 PolarHBondContact N-O 2.73Å; S100-N108 WeakPolarHBondContact O-CA 3.25Å; S100-N108 WeakPolarHBondContact O-CB 3.41Å; S100-N108 PolarHBondContact O-N 3.05Å; S100-N108 WeakPolarHBondContact OG-CB 3.42Å; S100-N108 PolarHBondContact OG-ND2 2.78Å; R105-N108 HydrophobicContact CB-CB 4.26Å; P106-N108 PolarHBondContact O-N 3.33Å; N108-E124 PolarHBondContact ND2-OE1 2.8Å; N108-E124 WeakPolarHBondContact OD1-CG 3.34Å; N108-E124 PolarHBondContact OD1-OE1 3.46Å; N108-F125 PolarHBondContact OD1-O 2.88Å; N108-R232 PolarHBondContact OD1-NH1 2.91Å
109	L	98	Very high	96.3	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125	174.6	177	65.1	0	0	0	108.6	M51 L58 C97 I99 L111 F125 V127 L229	M51-L109 HydrophobicContact CE-CB 3.9Å; M51-L109 HydrophobicContact CE-CD1 4.26Å; L58-L109 HydrophobicContact CD1-CD1 4.19Å; L58-L109 HydrophobicContact CD1-CD2 4.35Å; C97-L109 VanDerWaalsContact SG-CD1 3.51Å; I99-L109 HydrophobicContact CG2-CD1 3.97Å; L109-L111 HydrophobicContact CD1-CD2 4.05Å; L109-L111 HydrophobicContact CD2-CD2 4.45Å; L109-L111 HydrophobicContact CD2-CG 4.41Å; L109-L111 HydrophobicContact CG-CD2 4.22Å; L109-L111 HydrophobicContact CG-CG 4.27Å; L109-F125 HydrophobicContact CB-CB 4.3Å; L109-F125 PolarHBondContact N-O 3.27Å; L109-F125 PolarHBondContact O-N 2.98Å; L109-V127 HydrophobicContact CB-CG2 3.71Å; L109-V127 HydrophobicContact CD2-CG2 4.18Å; L109-L229 HydrophobicContact CD2-CD2 4.22Å
110	V	98.1	Very high	96.2	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.9	172.5	-179.8	0	0	0	0	108.3	P77 F78 F96 C97 F98 M122 F123 E124	P77-V110 HydrophobicContact CB-CG1 4.21Å; P77-V110 HydrophobicContact CG-CB 4.44Å; P77-V110 HydrophobicContact CG-CG1 4.32Å; P77-V110 HydrophobicContact CG-CG2 4.23Å; F78-V110 HydrophobicContact CE2-CG1 4.24Å; F78-V110 HydrophobicContact CE2-CG2 4.21Å; F96-V110 HydrophobicContact CE2-CG1 4.13Å; C97-V110 CarbonylContact C-O 3.16Å; C97-V110 WeakPolarHBondContact CA-O 3.35Å; F98-V110 HydrophobicContact CB-CB 4.2Å; F98-V110 HydrophobicContact CD1-CB 4.29Å; F98-V110 HydrophobicContact CD1-CG2 4.22Å; F98-V110 PolarHBondContact N-O 3.16Å; F98-V110 PolarHBondContact O-N 3.2Å; V110-M122 HydrophobicContact CG1-CB 4.39Å; V110-F123 VanDerWaalsContact CA-O 3.32Å; V110-F123 WeakPolarHBondContact CA-O 3.46Å; V110-E124 HydrophobicContact CG2-CB 4.19Å; V110-E124 HydrophobicContact CG2-CG 4.01Å
111	L	98.2	Very high	96.2	Very high	3 Å²	3	52 Å²	52	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137.2	172.8	-59.4	-177.9	0	0	0	108.3	C97 L109 M122 F123 F125 L168 L169 F172	C97-L111 HydrophobicContact CB-CD2 3.89Å; L109-L111 HydrophobicContact CD1-CD2 4.05Å; L109-L111 HydrophobicContact CD2-CD2 4.45Å; L109-L111 HydrophobicContact CD2-CG 4.41Å; L109-L111 HydrophobicContact CG-CD2 4.22Å; L109-L111 HydrophobicContact CG-CG 4.27Å; L111-M122 CarbonylContact O-C 3.51Å; L111-M122 VanDerWaalsContact O-CA 3.25Å; L111-M122 WeakPolarHBondContact O-CA 3.3Å; L111-F123 PolarHBondContact N-O 2.79Å; L111-F123 PolarHBondContact O-N 3.07Å; L111-F125 HydrophobicContact CB-CE2 4.26Å; L111-F125 HydrophobicContact CD1-CD2 4.48Å; L111-F125 HydrophobicContact CD1-CE2 4.09Å; L111-F125 HydrophobicContact CG-CD2 4.38Å; L111-F125 HydrophobicContact CG-CE2 4.19Å; L111-L168 HydrophobicContact CB-CD2 4.04Å; L111-L169 HydrophobicContact CD1-CD2 4.32Å; L111-F172 HydrophobicContact CD2-CD2 4.4Å; L111-F172 HydrophobicContact CD2-CE2 3.81Å; L111-F172 HydrophobicContact CD2-CZ 3.99Å
112	G	97.5	Very high	96.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	164.7	175	0	0	0	0	0	113	L95 F96 D121	L95-G112 WeakPolarHBondContact CA-O 3.43Å; F96-G112 WeakPolarHBondContact CD1-O 3.46Å; F96-G112 VanDerWaalsContact CE1-CA 3.45Å; F96-G112 PolarHBondContact N-O 2.78Å; F96-G112 PolarHBondContact O-N 2.63Å; G112-D121 CarbonylContact C-O 3.59Å; G112-D121 WeakPolarHBondContact CA-O 3.32Å
113	R	96.9	Very high	96.3	Very high	25 Å²	25	47 Å²	47	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.9	-178	59.6	-172.6	-74.6	-175.7	2.9	110.5	S94 L95 L120 D121 S167 L168 D171	S94-R113 WeakPolarHBondContact O-CA 3.29Å; L95-R113 HydrophobicContact CD2-CB 3.51Å; R113-L120 HydrophobicContact CG-CB 4.31Å; R113-L120 HydrophobicContact CG-CD2 4.42Å; R113-L120 PolarHBondContact O-N 3.28Å; R113-D121 VanDerWaalsContact CD-CG 3.49Å; R113-D121 WeakPolarHBondContact CD-OD1 3.2Å; R113-D121 WeakPolarHBondContact CD-OD2 3.35Å; R113-D121 VanDerWaalsContact CG-CG 3.44Å; R113-D121 WeakPolarHBondContact CG-OD1 3.42Å; R113-D121 PolarHBondContact N-O 3.3Å; R113-D121 IonicContact NE-OD1 2.59Å; R113-D121 PolarHBondContact O-N 3.26Å; R113-S167 PolarHBondContact NH1-OG 2.88Å; R113-S167 VanDerWaalsContact NH1-OG 3.1Å; R113-L168 HydrophobicContact CB-CD1 3.88Å; R113-L168 HydrophobicContact CG-CD1 3.88Å; R113-D171 IonicContact CZ-OD2 2.74Å; R113-D171 IonicContact NE-OD2 2.72Å; R113-D171 IonicContact NH2-OD2 3.16Å
114	M	96.9	Very high	96.4	Very high	17 Å²	17	36.8 Å²	36.8	8%	0.084	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	149.6	-179.1	-54.2	-50.9	-163.8	0	0	110.5	F84 C88 S94 F96 N118 V119	F84-M114 HydrophobicContact CB-CE 3.63Å; C88-M114 HydrophobicContact CB-CE 3.98Å; C88-M114 HydrophobicContact CB-CG 3.87Å; C88-M114 WeakPolarHBondContact SG-CE 3.31Å; S94-M114 PolarHBondContact O-N 2.78Å; F96-M114 HydrophobicContact CD1-CE 3.38Å; F96-M114 HydrophobicContact CD1-SD 4.02Å; F96-M114 HydrophobicContact CE1-CE 3.51Å; F96-M114 HydrophobicContact CE1-SD 3.92Å; F96-M114 HydrophobicContact CG-CE 4.33Å; M114-N118 CarbonylContact C-O 3.49Å; M114-N118 WeakPolarHBondContact CA-O 3.27Å; M114-V119 HydrophobicContact CE-CG2 3.84Å; M114-V119 HydrophobicContact SD-CB 4.17Å; M114-V119 HydrophobicContact SD-CG2 3.66Å
115	Y	95.8	Very high	96.6	Very high	90 Å²	90	28.7 Å²	28.7	35%	0.353	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	122	165.5	177.9	-108.1	0	0	0	108.2	F117 N118 L241 A245	Y115-F117 PolarHBondContact O-N 2.89Å; Y115-N118 PolarHBondContact N-O 3.02Å; Y115-N118 PolarHBondContact O-N 2.94Å; Y115-L241 HydrophobicContact CD1-CD1 4.21Å; Y115-L241 HydrophobicContact CE1-CD1 4.43Å; Y115-A245 HydrophobicContact CD1-CB 4.29Å; Y115-A245 HydrophobicContact CD2-CB 3.58Å; Y115-A245 HydrophobicContact CE1-CB 4.48Å; Y115-A245 HydrophobicContact CE2-CB 3.83Å; Y115-A245 HydrophobicContact CG-CB 3.83Å
116	D	93.1	Very high	96.8	Very high	125 Å²	125	26 Å²	26	67%	0.668	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	43.3	-172.2	-163.9	27.9	0	0	0	112.7	N118	D116-N118 PolarHBondContact O-N 3.4Å; D116-N118 PolarHBondContact O-ND2 2.86Å; D116-N118 VanDerWaalsContact O-ND2 3.1Å
117	F	94	Very high	96.9	Very high	63 Å²	63	23.1 Å²	23.1	28%	0.276	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	4.3	-175.6	-54.4	-68.7	0	0	0	117.1	E85 M89 Y115	E85-F117 WeakPolarHBondContact CA-O 3.33Å; E85-F117 VanDerWaalsContact CB-O 3.24Å; E85-F117 WeakPolarHBondContact CB-O 3.32Å; E85-F117 VanDerWaalsContact CG-O 3.31Å; E85-F117 WeakPolarHBondContact CG-O 3.31Å; M89-F117 VanDerWaalsContact CA-CD1 3.42Å; M89-F117 HydrophobicContact CB-CB 4.16Å; M89-F117 HydrophobicContact CB-CD1 3.98Å; M89-F117 HydrophobicContact CB-CG 3.96Å; M89-F117 HydrophobicContact CG-CD1 4.4Å; M89-F117 HydrophobicContact CG-CD2 4.18Å; M89-F117 HydrophobicContact CG-CG 4.1Å; Y115-F117 PolarHBondContact O-N 2.89Å
118	N	95.5	Very high	96.8	Very high	84 Å²	84	24.9 Å²	24.9	45%	0.449	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	151.6	169.3	-56.6	-68.7	0	0	0	110.3	E85 M114 Y115 D116 L120	E85-N118 WeakPolarHBondContact OE1-CA 3.3Å; M114-N118 CarbonylContact C-O 3.49Å; M114-N118 WeakPolarHBondContact CA-O 3.27Å; Y115-N118 PolarHBondContact N-O 3.02Å; Y115-N118 PolarHBondContact O-N 2.94Å; D116-N118 PolarHBondContact O-N 3.4Å; D116-N118 PolarHBondContact O-ND2 2.86Å; D116-N118 VanDerWaalsContact O-ND2 3.1Å; N118-L120 PolarHBondContact O-N 3.29Å
119	V	96.2	Very high	96.7	Very high	17 Å²	17	30.3 Å²	30.3	10%	0.103	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	120	177.7	-176.9	0	0	0	0	110.6	E81 E85 F96 M114 M122	E81-V119 HydrophobicContact CB-CG2 3.91Å; E81-V119 HydrophobicContact CG-CG2 4.5Å; E85-V119 HydrophobicContact CG-CG2 4.15Å; E85-V119 PolarHBondContact OE1-N 2.8Å; E85-V119 VanDerWaalsContact OE1-N 3.16Å; F96-V119 HydrophobicContact CE1-CG2 4.42Å; M114-V119 HydrophobicContact CE-CG2 3.84Å; M114-V119 HydrophobicContact SD-CB 4.17Å; M114-V119 HydrophobicContact SD-CG2 3.66Å; V119-M122 HydrophobicContact CB-CE 4.26Å; V119-M122 HydrophobicContact CG1-CB 4.42Å; V119-M122 HydrophobicContact CG1-CE 3.67Å; V119-M122 HydrophobicContact CG1-CG 4.36Å; V119-M122 HydrophobicContact CG2-CE 4.12Å
120	L	96.6	Very high	96.7	Very high	6 Å²	6	31.8 Å²	31.8	3%	0.031	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-53.5	172.3	-175.9	71.4	0	0	0	109.7	R113 N118 A237 L241 Y242 A245	R113-L120 HydrophobicContact CG-CB 4.31Å; R113-L120 HydrophobicContact CG-CD2 4.42Å; R113-L120 PolarHBondContact O-N 3.28Å; N118-L120 PolarHBondContact O-N 3.29Å; L120-A237 HydrophobicContact CD1-CB 3.6Å; L120-A237 HydrophobicContact CG-CB 4.04Å; L120-A237 WeakPolarHBondContact O-CA 3.46Å; L120-A237 WeakPolarHBondContact O-CB 3.5Å; L120-A237 PolarHBondContact O-N 3.36Å; L120-L241 HydrophobicContact CD1-CD2 4.06Å; L120-L241 HydrophobicContact CD1-CG 3.87Å; L120-Y242 HydrophobicContact CD2-CD2 4.16Å; L120-A245 HydrophobicContact CD1-CB 4.09Å; L120-A245 HydrophobicContact CD2-CB 4.01Å
121	D	96.5	Very high	96.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	147	179.4	49.4	-53.2	0	0	0	111.2	G112 R113 F123 K235	G112-D121 CarbonylContact C-O 3.59Å; G112-D121 WeakPolarHBondContact CA-O 3.32Å; R113-D121 VanDerWaalsContact CD-CG 3.49Å; R113-D121 WeakPolarHBondContact CD-OD1 3.2Å; R113-D121 WeakPolarHBondContact CD-OD2 3.35Å; R113-D121 VanDerWaalsContact CG-CG 3.44Å; R113-D121 WeakPolarHBondContact CG-OD1 3.42Å; R113-D121 PolarHBondContact N-O 3.3Å; R113-D121 IonicContact NE-OD1 2.59Å; R113-D121 PolarHBondContact O-N 3.26Å; D121-F123 HydrophobicContact CB-CE2 4.35Å; D121-K235 CarbonylContact C-O 3.59Å; D121-K235 WeakPolarHBondContact CA-O 3.36Å; D121-K235 WeakPolarHBondContact CB-O 3.32Å
122	M	97.1	Very high	96.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	146.1	175.8	61.8	171.2	109.1	0	0	111.2	P77 F78 E81 F96 V110 L111 V119 N234 K235	P77-M122 HydrophobicContact CB-SD 3.97Å; P77-M122 WeakPolarHBondContact O-CE 3.41Å; F78-M122 HydrophobicContact CE1-CG 4.32Å; F78-M122 HydrophobicContact CE1-SD 4.3Å; F78-M122 HydrophobicContact CE2-SD 4.24Å; F78-M122 HydrophobicContact CZ-CG 4.18Å; F78-M122 HydrophobicContact CZ-SD 4.15Å; E81-M122 HydrophobicContact CB-CE 4.28Å; F96-M122 HydrophobicContact CZ-CB 3.95Å; F96-M122 HydrophobicContact CZ-SD 4.47Å; V110-M122 HydrophobicContact CG1-CB 4.39Å; L111-M122 CarbonylContact O-C 3.51Å; L111-M122 VanDerWaalsContact O-CA 3.25Å; L111-M122 WeakPolarHBondContact O-CA 3.3Å; V119-M122 HydrophobicContact CB-CE 4.26Å; V119-M122 HydrophobicContact CG1-CB 4.42Å; V119-M122 HydrophobicContact CG1-CE 3.67Å; V119-M122 HydrophobicContact CG1-CG 4.36Å; V119-M122 HydrophobicContact CG2-CE 4.12Å; M122-N234 CarbonylContact O-C 3.6Å; M122-N234 WeakPolarHBondContact O-CA 3.43Å; M122-K235 HydrophobicContact CE-CD 3.96Å; M122-K235 HydrophobicContact CG-CB 3.8Å; M122-K235 PolarHBondContact N-O 3.02Å; M122-K235 PolarHBondContact O-N 2.88Å
123	F	97.9	Very high	96.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.6	-179	-70	-102.6	0	0	0	109.5	V110 L111 D121 F125 V161 R164 M165 L168 N234 I236	V110-F123 VanDerWaalsContact CA-O 3.32Å; V110-F123 WeakPolarHBondContact CA-O 3.46Å; L111-F123 PolarHBondContact N-O 2.79Å; L111-F123 PolarHBondContact O-N 3.07Å; D121-F123 HydrophobicContact CB-CE2 4.35Å; F123-F125 HydrophobicContact CB-CD2 4.5Å; F123-F125 HydrophobicContact CB-CE1 4.28Å; F123-F125 HydrophobicContact CB-CE2 3.58Å; F123-F125 HydrophobicContact CB-CZ 3.46Å; F123-F125 VanDerWaalsContact CB-CZ 3.46Å; F123-F125 HydrophobicContact CG-CZ 4.27Å; F123-V161 HydrophobicContact CE1-CG1 3.92Å; F123-R164 HydrophobicContact CZ-CB 3.98Å; F123-M165 HydrophobicContact CD1-CB 4.16Å; F123-M165 HydrophobicContact CD1-CG 4.35Å; F123-M165 HydrophobicContact CD1-SD 4.45Å; F123-M165 HydrophobicContact CE1-CB 3.75Å; F123-M165 HydrophobicContact CE1-CG 4.43Å; F123-M165 HydrophobicContact CZ-CB 3.98Å; F123-L168 HydrophobicContact CB-CD2 4.36Å; F123-L168 HydrophobicContact CD2-CD2 3.49Å; F123-L168 VanDerWaalsContact CD2-CD2 3.49Å; F123-L168 HydrophobicContact CE2-CD2 4.18Å; F123-L168 HydrophobicContact CG-CD2 4.28Å; F123-N234 HydrophobicContact CD1-CB 3.74Å; F123-N234 HydrophobicContact CE1-CB 3.85Å; F123-N234 HydrophobicContact CG-CB 4.38Å; F123-I236 HydrophobicContact CE1-CD1 4.39Å; F123-I236 HydrophobicContact CZ-CD1 4.07Å; F123-I236 HydrophobicContact CZ-CG1 3.96Å
124	E	97.6	Very high	95.9	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.009	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.1	174.2	-173	173.8	-125.2	0	0	110	F78 R105 N108 V110 R232 R233	F78-E124 HydrophobicContact CE2-CB 3.68Å; F78-E124 HydrophobicContact CE2-CG 4.34Å; F78-E124 HydrophobicContact CZ-CB 3.79Å; R105-E124 WeakPolarHBondContact CD-OE1 3.39Å; R105-E124 WeakPolarHBondContact CD-OE2 3.25Å; R105-E124 IonicContact NE-OE1 3.36Å; R105-E124 PolarHBondContact NE-OE1 2.88Å; R105-E124 IonicContact NE-OE2 2.78Å; R105-E124 PolarHBondContact NE-OE2 3.24Å; R105-E124 VanDerWaalsContact NE-OE2 3.16Å; N108-E124 PolarHBondContact ND2-OE1 2.8Å; N108-E124 WeakPolarHBondContact OD1-CG 3.34Å; N108-E124 PolarHBondContact OD1-OE1 3.46Å; V110-E124 HydrophobicContact CG2-CB 4.19Å; V110-E124 HydrophobicContact CG2-CG 4.01Å; E124-R232 HydrophobicContact CB-CB 4.07Å; E124-R232 HydrophobicContact CG-CB 3.99Å; E124-R232 WeakPolarHBondContact O-CB 3.29Å; E124-R232 PolarHBondContact O-N 3Å; E124-R233 HydrophobicContact CB-CB 4.29Å; E124-R233 VanDerWaalsContact CB-O 3.27Å; E124-R233 WeakPolarHBondContact CB-O 3.41Å; E124-R233 VanDerWaalsContact CD-NH2 3.33Å; E124-R233 PolarHBondContact N-O 3.38Å; E124-R233 IonicContact OE1-CZ 2.6Å; E124-R233 IonicContact OE1-NE 3.19Å; E124-R233 IonicContact OE1-NH2 3.89Å; E124-R233 PolarHBondContact OE1-NH2 2.87Å; E124-R233 IonicContact OE2-CZ 2.63Å; E124-R233 IonicContact OE2-NE 3.77Å; E124-R233 PolarHBondContact OE2-NE 3.09Å; E124-R233 IonicContact OE2-NH2 3.83Å; E124-R233 PolarHBondContact OE2-NH2 3.09Å
125	F	97.9	Very high	95.7	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.2	179.8	-56.2	-73.4	0	0	0	110.7	N108 L109 L111 F123 M165 L229 I230 V231	N108-F125 PolarHBondContact OD1-O 2.88Å; L109-F125 HydrophobicContact CB-CB 4.3Å; L109-F125 PolarHBondContact N-O 3.27Å; L109-F125 PolarHBondContact O-N 2.98Å; L111-F125 HydrophobicContact CB-CE2 4.26Å; L111-F125 HydrophobicContact CD1-CD2 4.48Å; L111-F125 HydrophobicContact CD1-CE2 4.09Å; L111-F125 HydrophobicContact CG-CD2 4.38Å; L111-F125 HydrophobicContact CG-CE2 4.19Å; F123-F125 HydrophobicContact CB-CD2 4.5Å; F123-F125 HydrophobicContact CB-CE1 4.28Å; F123-F125 HydrophobicContact CB-CE2 3.58Å; F123-F125 HydrophobicContact CB-CZ 3.46Å; F123-F125 VanDerWaalsContact CB-CZ 3.46Å; F123-F125 HydrophobicContact CG-CZ 4.27Å; F125-M165 HydrophobicContact CE1-CG 4.47Å; F125-M165 HydrophobicContact CE1-SD 3.46Å; F125-M165 WeakPolarHBondContact CE1-SD 3.37Å; F125-M165 HydrophobicContact CZ-CG 4.14Å; F125-M165 HydrophobicContact CZ-SD 3.71Å; F125-L229 HydrophobicContact CB-CB 4.23Å; F125-L229 HydrophobicContact CB-CD2 4.13Å; F125-L229 HydrophobicContact CD1-CB 3.88Å; F125-L229 HydrophobicContact CD1-CD1 4.46Å; F125-L229 HydrophobicContact CG-CB 4.22Å; F125-L229 HydrophobicContact CG-CD1 4.46Å; F125-I230 CarbonylContact C-O 3.55Å; F125-I230 VanDerWaalsContact CA-O 3.23Å; F125-I230 WeakPolarHBondContact CA-O 3.32Å; F125-V231 HydrophobicContact CD1-CG2 4.5Å; F125-V231 HydrophobicContact CE1-CG2 4.24Å
126	G	97.5	Very high	95.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.2	159.8	0	0	0	0	0	109.7	I230	G126-I230 PolarHBondContact N-O 2.81Å; G126-I230 PolarHBondContact O-N 2.93Å
127	V	97.9	Very high	94.9	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.024	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	117.3	177.9	-175.7	0	0	0	0	109.8	M51 N107 L109 F130 M227 D228 L229	M51-V127 HydrophobicContact CE-CG2 4.22Å; M51-V127 HydrophobicContact SD-CB 3.95Å; M51-V127 HydrophobicContact SD-CG2 3.8Å; N107-V127 HydrophobicContact CB-CB 4.18Å; N107-V127 VanDerWaalsContact CB-O 3.32Å; N107-V127 WeakPolarHBondContact CB-O 3.43Å; N107-V127 PolarHBondContact ND2-O 2.85Å; N107-V127 PolarHBondContact O-N 3.3Å; L109-V127 HydrophobicContact CB-CG2 3.71Å; L109-V127 HydrophobicContact CD2-CG2 4.18Å; V127-F130 HydrophobicContact CG1-CB 4.06Å; V127-F130 HydrophobicContact CG1-CD2 4.5Å; V127-M227 HydrophobicContact CG1-CB 4.09Å; V127-M227 HydrophobicContact CG1-SD 4.47Å; V127-D228 WeakPolarHBondContact CA-O 3.34Å; V127-L229 HydrophobicContact CG2-CD2 4.01Å
128	E	96.4	Very high	94.2	Very high	78 Å²	78	49.9 Å²	49.9	36%	0.364	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	161.2	172.2	-69.1	-174.4	162.4	0	0	110.9	F130 K198 D228 I230	E128-F130 PolarHBondContact O-N 2.94Å; E128-K198 IonicContact OE2-NZ 2.87Å; E128-K198 PolarHBondContact OE2-NZ 2.85Å; E128-D228 HydrophobicContact CB-CB 4.11Å; E128-D228 PolarHBondContact N-O 2.85Å; E128-D228 PolarHBondContact O-N 3.18Å; E128-I230 HydrophobicContact CG-CD1 3.82Å; E128-I230 HydrophobicContact CG-CG1 4.44Å; E128-I230 WeakPolarHBondContact OE1-CD1 3.48Å; E128-I230 VanDerWaalsContact OE2-CD1 3.27Å; E128-I230 WeakPolarHBondContact OE2-CD1 3.26Å
129	N	95.7	Very high	93.4	Very high	120 Å²	120	46.5 Å²	46.5	64%	0.642	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	46.3	41.2	173.8	-58.2	-35.1	0	0	0	114.6	A131 D228	N129-A131 PolarHBondContact O-N 3.44Å; N129-D228 WeakPolarHBondContact CB-OD2 3.43Å; N129-D228 PolarHBondContact ND2-OD2 2.64Å
130	F	97.1	Very high	92.6	Very high	33 Å²	33	56.7 Å²	56.7	15%	0.145	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.2	-179.3	176.6	-98.3	0	0	0	111.1	T50 Q53 C54 V127 E128 P225 S226 M227	T50-F130 HydrophobicContact CG2-CB 3.74Å; T50-F130 HydrophobicContact CG2-CD1 3.74Å; T50-F130 HydrophobicContact CG2-CG 4.01Å; Q53-F130 HydrophobicContact CB-CE1 3.84Å; Q53-F130 HydrophobicContact CB-CZ 4.39Å; C54-F130 VanDerWaalsContact CA-CZ 3.41Å; C54-F130 HydrophobicContact CB-CD2 3.92Å; C54-F130 HydrophobicContact CB-CE1 4.43Å; C54-F130 HydrophobicContact CB-CE2 3.62Å; C54-F130 HydrophobicContact CB-CG 4.49Å; C54-F130 HydrophobicContact CB-CZ 3.91Å; V127-F130 HydrophobicContact CG1-CB 4.06Å; V127-F130 HydrophobicContact CG1-CD2 4.5Å; E128-F130 PolarHBondContact O-N 2.94Å; F130-P225 HydrophobicContact CE2-CB 4.1Å; F130-S226 CarbonylContact C-O 3.56Å; F130-S226 WeakPolarHBondContact CA-O 3.25Å; F130-M227 HydrophobicContact CD2-CB 4.06Å; F130-M227 HydrophobicContact CD2-SD 4.39Å
131	A	95.9	Very high	92.1	Very high	24 Å²	24	58.6 Å²	58.6	20%	0.198	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.2	166.2	0	0	0	0	0	109.6	N129 F136 P225 S226	N129-A131 PolarHBondContact O-N 3.44Å; A131-F136 HydrophobicContact CB-CE2 3.92Å; A131-F136 HydrophobicContact CB-CZ 4.07Å; A131-P225 WeakPolarHBondContact O-CA 3.38Å; A131-S226 PolarHBondContact N-O 3.18Å; A131-S226 PolarHBondContact O-N 3.14Å
132	S	94.3	Very high	91.7	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.014	30%	0.296	C	S	.	.			trans	-74.3	156.1	-179.3	-179.2	0	0	0	0	111.1	N57 Y134 D135 F136	N57-S132 PolarHBondContact ND2-OG 3.03Å; N57-S132 WeakPolarHBondContact OD1-CA 3.44Å; N57-S132 PolarHBondContact OD1-OG 3.4Å; S132-Y134 PolarHBondContact O-N 2.76Å; S132-Y134 VanDerWaalsContact O-N 3.09Å; S132-Y134 VanDerWaalsContact OG-CD2 3.27Å; S132-Y134 WeakPolarHBondContact OG-CD2 3.41Å; S132-Y134 PolarHBondContact OG-N 3.32Å; S132-D135 WeakPolarHBondContact CB-OD2 3.34Å; S132-D135 PolarHBondContact N-OD2 3.36Å; S132-D135 WeakPolarHBondContact O-CB 3.46Å; S132-D135 PolarHBondContact O-N 2.87Å; S132-F136 WeakPolarHBondContact O-CD2 3.38Å; S132-F136 WeakPolarHBondContact O-CE2 3.3Å
133	I	92.7	Very high	91.3	Very high	36 Å²	36	67.3 Å²	67.3	19%	0.185	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-50.2	-33.9	167.8	-63.3	156.1	0	0	0	111	N57 D135 F136 G224	N57-I133 HydrophobicContact CB-CD1 3.87Å; N57-I133 HydrophobicContact CB-CG1 4.46Å; N57-I133 WeakPolarHBondContact OD1-CD1 3.49Å; N57-I133 WeakPolarHBondContact OD1-CG1 3.31Å; N57-I133 PolarHBondContact OD1-N 3.25Å; I133-D135 VanDerWaalsContact C-N 3.27Å; I133-D135 PolarHBondContact O-N 3.11Å; I133-F136 PolarHBondContact O-N 3.47Å; I133-G224 VanDerWaalsContact CG1-C 3.49Å
134	Y	90.8	Very high	90.7	Very high	154 Å²	154	69.7 Å²	69.7	60%	0.604	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-71.2	-17.6	179	-55.4	-58.1	0	0	0	114.5	Q60 S132 F136	Q60-Y134 PolarHBondContact NE2-OH 3.21Å; Q60-Y134 VanDerWaalsContact NE2-OH 3.14Å; S132-Y134 PolarHBondContact O-N 2.76Å; S132-Y134 VanDerWaalsContact O-N 3.09Å; S132-Y134 VanDerWaalsContact OG-CD2 3.27Å; S132-Y134 WeakPolarHBondContact OG-CD2 3.41Å; S132-Y134 PolarHBondContact OG-N 3.32Å; Y134-F136 VanDerWaalsContact C-N 3.27Å
135	D	92.4	Very high	90.4	Very high	103 Å²	103	71.2 Å²	71.2	55%	0.551	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-78.3	-18.7	178.5	-58	-35.1	0	0	0	111.2	S132 I133 K137	S132-D135 WeakPolarHBondContact CB-OD2 3.34Å; S132-D135 PolarHBondContact N-OD2 3.36Å; S132-D135 WeakPolarHBondContact O-CB 3.46Å; S132-D135 PolarHBondContact O-N 2.87Å; I133-D135 VanDerWaalsContact C-N 3.27Å; I133-D135 PolarHBondContact O-N 3.11Å; D135-K137 PolarHBondContact O-N 3.05Å
136	F	91.7	Very high	90.1	Very high	46 Å²	46	74 Å²	74	20%	0.202	37%	0.37	C	S	.	.			trans	-93	79.3	179.2	-59.4	-91.4	0	0	0	111	A131 S132 I133 Y134 N138 C139 P222 A223 G224	A131-F136 HydrophobicContact CB-CE2 3.92Å; A131-F136 HydrophobicContact CB-CZ 4.07Å; S132-F136 WeakPolarHBondContact O-CD2 3.38Å; S132-F136 WeakPolarHBondContact O-CE2 3.3Å; I133-F136 PolarHBondContact O-N 3.47Å; Y134-F136 VanDerWaalsContact C-N 3.27Å; F136-N138 VanDerWaalsContact C-N 3.27Å; F136-N138 PolarHBondContact O-N 2.84Å; F136-N138 VanDerWaalsContact O-N 3.11Å; F136-C139 HydrophobicContact CB-CB 4.02Å; F136-C139 PolarHBondContact O-N 3.07Å; F136-C139 VanDerWaalsContact O-N 3.12Å; F136-P222 HydrophobicContact CD1-CB 4.29Å; F136-P222 WeakPolarHBondContact CD1-O 3.43Å; F136-P222 HydrophobicContact CE1-CB 4.09Å; F136-A223 WeakPolarHBondContact CE1-O 3.41Å; F136-A223 VanDerWaalsContact CZ-O 3.25Å; F136-A223 WeakPolarHBondContact CZ-O 3.3Å; F136-G224 VanDerWaalsContact CD2-CA 3.49Å; F136-G224 VanDerWaalsContact CD2-N 3.3Å; F136-G224 VanDerWaalsContact CE2-CA 3.42Å
137	K	81.7	Confident	89.9	Confident	185 Å²	185	74.8 Å²	74.8	80%	0.804	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-36.7	-170.6	-65.6	-176.8	-178.1	177.9	0	115.4	D135	D135-K137 PolarHBondContact O-N 3.05Å
138	N	79	Confident	89.8	Confident	153 Å²	153	76.8 Å²	76.8	82%	0.818	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	1.1	-173.6	-64.6	-12.7	0	0	0	113.4	F136	F136-N138 VanDerWaalsContact C-N 3.27Å; F136-N138 PolarHBondContact O-N 2.84Å; F136-N138 VanDerWaalsContact O-N 3.11Å
139	C	78.5	Confident	89.8	Confident	13 Å²	13	75.3 Å²	75.3	9%	0.088	38%	0.383	C	S	.	.			trans	-110.7	111.5	-175	-170.1	0	0	0	0	110.9	F136 S205 A223	F136-C139 HydrophobicContact CB-CB 4.02Å; F136-C139 PolarHBondContact O-N 3.07Å; F136-C139 VanDerWaalsContact O-N 3.12Å; C139-S205 VanDerWaalsContact SG-CB 3.57Å; C139-A223 HydrophobicContact CB-CB 4.31Å; C139-A223 WeakPolarHBondContact SG-CB 3.3Å
140	R	79.9	Confident	89.8	Confident	231 Å²	231	73.4 Å²	73.4	87%	0.872	37%	0.373	S	S	*	.			trans	-122.2	109.1	175.2	-67.4	-175.5	179.9	168.5	0.7	109.8
141	I	85.6	Confident	89.8	Confident	46 Å²	46	73.8 Å²	73.8	24%	0.236	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-97.5	130	176.8	-63.8	136.3	0	0	0	108.8	V145 Y188 A223	I141-V145 HydrophobicContact CG2-CB 4.34Å; I141-V145 HydrophobicContact CG2-CG2 4.39Å; I141-Y188 HydrophobicContact CB-CD2 4.47Å; I141-Y188 HydrophobicContact CD1-CD2 3.22Å; I141-Y188 HydrophobicContact CD1-CE2 3.2Å; I141-Y188 HydrophobicContact CD1-CG 4.2Å; I141-Y188 HydrophobicContact CG1-CD2 3.72Å; I141-Y188 HydrophobicContact CG1-CE2 4.19Å; I141-Y188 HydrophobicContact CG1-CG 4.37Å; I141-Y188 HydrophobicContact CG2-CD1 4.47Å; I141-Y188 HydrophobicContact CG2-CD2 4.1Å; I141-Y188 HydrophobicContact CG2-CG 3.93Å; I141-A223 HydrophobicContact CD1-CB 3.74Å
142	P	87.6	Confident	89.9	Confident	69 Å²	69	77.5 Å²	77.5	45%	0.448	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-59.6	147.3	175.4	-21.9	31.8	0	0	0	112.6	V145	P142-V145 HydrophobicContact CB-CG2 3.79Å; P142-V145 HydrophobicContact CG-CG2 4.17Å; P142-V145 VanDerWaalsContact O-CG2 3.27Å; P142-V145 WeakPolarHBondContact O-CG2 3.43Å
143	L	88.1	Confident	89.9	Confident	114 Å²	114	78.9 Å²	78.9	60%	0.597	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	139.3	176.8	-67.7	174	0	0	0	110.8	Q60 V145	Q60-L143 HydrophobicContact CB-CD2 4.38Å; L143-V145 VanDerWaalsContact C-N 3.33Å
144	G	87.1	Confident	90	Very high	50 Å²	50	83.7 Å²	83.7	52%	0.515	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	8.8	177.8	0	0	0	0	0	114.9
145	V	90.1	Very high	90.2	Very high	33 Å²	33	79.2 Å²	79.2	20%	0.2	41%	0.414	C	S	.	.			trans	-62.8	139.4	170.6	173.4	0	0	0	0	109.7	I141 P142 L143 P147 E187	I141-V145 HydrophobicContact CG2-CB 4.34Å; I141-V145 HydrophobicContact CG2-CG2 4.39Å; P142-V145 HydrophobicContact CB-CG2 3.79Å; P142-V145 HydrophobicContact CG-CG2 4.17Å; P142-V145 VanDerWaalsContact O-CG2 3.27Å; P142-V145 WeakPolarHBondContact O-CG2 3.43Å; L143-V145 VanDerWaalsContact C-N 3.33Å; V145-P147 VanDerWaalsContact O-CD 3.29Å; V145-P147 WeakPolarHBondContact O-CD 3.41Å; V145-E187 HydrophobicContact CG1-CB 4.47Å
146	K	92.2	Very high	90.4	Very high	59 Å²	59	74.5 Å²	74.5	26%	0.257	39%	0.389	S	S	.	.			trans	-79.4	114.1	174.5	-176	-179.8	178.5	67	0	109	R174 P176 I178	K146-R174 PolarHBondContact NZ-O 3.04Å; K146-P176 PolarHBondContact NZ-O 3.37Å; K146-I178 HydrophobicContact CD-CD1 3.54Å; K146-I178 HydrophobicContact CD-CG1 3.92Å
147	P	94	Very high	90.6	Very high	17 Å²	17	79.5 Å²	79.5	11%	0.11	41%	0.413	C	S	.	.			trans	-70.3	141.9	178.6	27.1	-32.6	0	0	0	111.4	V145 L149 F173 Y188 L190	V145-P147 VanDerWaalsContact O-CD 3.29Å; V145-P147 WeakPolarHBondContact O-CD 3.41Å; P147-L149 HydrophobicContact CB-CD2 4.04Å; P147-L149 HydrophobicContact CG-CD2 4.01Å; P147-F173 WeakPolarHBondContact CG-O 3.46Å; P147-Y188 CarbonylContact C-O 3.59Å; P147-Y188 WeakPolarHBondContact CA-O 3.14Å; P147-Y188 HydrophobicContact CB-CD1 3.74Å; P147-Y188 HydrophobicContact CB-CE1 4.22Å; P147-L190 HydrophobicContact CB-CD1 4.06Å; P147-L190 HydrophobicContact CB-CG 4.33Å; P147-L190 HydrophobicContact CG-CD1 4.32Å
148	C	94.4	Very high	91.2	Very high	46 Å²	46	74.9 Å²	74.9	31%	0.311	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.6	156.7	-67.7	0	0	0	0	108.7	L150 Y188 A189 L190	C148-L150 HydrophobicContact CB-CD1 4.48Å; C148-Y188 PolarHBondContact N-O 2.63Å; C148-A189 HydrophobicContact CB-CB 4.25Å; C148-A189 CarbonylContact O-C 3.57Å; C148-A189 WeakPolarHBondContact O-CA 3.07Å; C148-L190 PolarHBondContact O-N 2.6Å
149	L	96.6	Very high	92	Very high	47 Å²	47	70.3 Å²	70.3	25%	0.246	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.8	179.1	-52.4	-178.3	0	0	0	109.1	P147 F151 I170 F173 R174 L190 F192	P147-L149 HydrophobicContact CB-CD2 4.04Å; P147-L149 HydrophobicContact CG-CD2 4.01Å; L149-F151 HydrophobicContact CB-CE2 3.89Å; L149-I170 HydrophobicContact CD1-CB 4.4Å; L149-I170 HydrophobicContact CD1-CG1 4.3Å; L149-I170 HydrophobicContact CD1-CG2 4.39Å; L149-F173 HydrophobicContact CD1-CB 4.37Å; L149-F173 HydrophobicContact CD2-CB 3.81Å; L149-R174 HydrophobicContact CD1-CB 4.45Å; L149-L190 WeakPolarHBondContact CA-O 3.07Å; L149-L190 HydrophobicContact CD2-CB 3.96Å; L149-L190 HydrophobicContact CD2-CD1 4.15Å; L149-F192 HydrophobicContact CD2-CE2 4.2Å
150	L	96.8	Very high	92.7	Very high	81 Å²	81	74.2 Å²	74.2	42%	0.424	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.4	175.9	-63.3	93.7	0	0	0	108.8	C148 A189 L190 M191 F192	C148-L150 HydrophobicContact CB-CD1 4.48Å; L150-A189 HydrophobicContact CD1-CB 3.84Å; L150-L190 PolarHBondContact N-O 3.28Å; L150-M191 HydrophobicContact CB-CB 4.41Å; L150-M191 HydrophobicContact CB-CG 4.23Å; L150-M191 CarbonylContact O-C 3.53Å; L150-M191 WeakPolarHBondContact O-CA 3.36Å; L150-F192 PolarHBondContact O-N 3.06Å
151	F	97.6	Very high	93.5	Very high	41 Å²	41	65 Å²	65	18%	0.18	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.1	176	-69	-92.1	0	0	0	108.2	L149 F156 K166 L169 I170 F192	L149-F151 HydrophobicContact CB-CE2 3.89Å; F151-F156 HydrophobicContact CB-CD2 4.11Å; F151-F156 HydrophobicContact CB-CE2 4.44Å; F151-F156 HydrophobicContact CB-CG 4.49Å; F151-F156 HydrophobicContact CD1-CD1 4.22Å; F151-F156 HydrophobicContact CD1-CD2 4.22Å; F151-F156 HydrophobicContact CD1-CE1 4.03Å; F151-F156 HydrophobicContact CD1-CE2 4.03Å; F151-F156 HydrophobicContact CD1-CG 4.31Å; F151-F156 AromaticContact CD1-CZ 3.93Å; F151-F156 HydrophobicContact CD1-CZ 3.93Å; F151-F156 HydrophobicContact CE1-CE1 4.46Å; F151-K166 HydrophobicContact CD1-CG 3.84Å; F151-K166 HydrophobicContact CD2-CG 4.42Å; F151-K166 HydrophobicContact CE1-CB 4.39Å; F151-K166 HydrophobicContact CE1-CG 3.87Å; F151-K166 HydrophobicContact CE2-CG 4.45Å; F151-K166 HydrophobicContact CG-CG 4.13Å; F151-K166 HydrophobicContact CZ-CG 4.19Å; F151-L169 HydrophobicContact CE1-CB 4.14Å; F151-L169 HydrophobicContact CE1-CD1 4.23Å; F151-L169 HydrophobicContact CZ-CB 4.16Å; F151-I170 HydrophobicContact CD2-CG1 4.5Å; F151-I170 HydrophobicContact CE2-CD1 3.97Å; F151-I170 HydrophobicContact CE2-CG1 3.44Å; F151-I170 VanDerWaalsContact CE2-CG1 3.44Å; F151-I170 HydrophobicContact CZ-CD1 4.3Å; F151-I170 HydrophobicContact CZ-CG1 3.53Å; F151-F192 CarbonylContact C-O 3.52Å; F151-F192 WeakPolarHBondContact CA-O 3.45Å; F151-F192 HydrophobicContact CD1-CB 3.71Å; F151-F192 HydrophobicContact CD1-CD2 4.16Å; F151-F192 HydrophobicContact CD1-CG 4.12Å; F151-F192 HydrophobicContact CE1-CB 3.87Å; F151-F192 AromaticContact CE1-CD2 3.7Å; F151-F192 HydrophobicContact CE1-CD2 3.7Å; F151-F192 HydrophobicContact CE1-CE2 4.42Å; F151-F192 AromaticContact CE1-CG 3.77Å; F151-F192 HydrophobicContact CE1-CG 3.77Å; F151-F192 HydrophobicContact CE2-CD2 4.23Å; F151-F192 HydrophobicContact CG-CB 4.44Å; F151-F192 AromaticContact CZ-CD2 3.73Å; F151-F192 HydrophobicContact CZ-CD2 3.73Å; F151-F192 HydrophobicContact CZ-CE2 4.11Å; F151-F192 HydrophobicContact CZ-CG 4.27Å
152	M	96.8	Very high	94	Very high	101 Å²	101	63.5 Å²	63.5	50%	0.498	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.2	-178.6	-62	-63.8	-65.5	0	0	108.7	F156 M191 F192 T193 A194	M152-F156 WeakPolarHBondContact O-CD2 3.36Å; M152-F156 WeakPolarHBondContact O-CE2 3.4Å; M152-M191 HydrophobicContact CG-CG 4.34Å; M152-M191 HydrophobicContact CG-SD 4.45Å; M152-F192 PolarHBondContact N-O 3.1Å; M152-T193 HydrophobicContact CB-CG2 4.05Å; M152-T193 CarbonylContact O-C 3.57Å; M152-T193 WeakPolarHBondContact O-CA 3.27Å; M152-A194 PolarHBondContact O-N 2.92Å
153	G	95	Very high	94.4	Very high	32 Å²	32	63 Å²	63	33%	0.33	36%	0.361	S	S	.	.	S	Bend	trans	113.9	134.6	-177.7	0	0	0	0	0	112.2	E155 F156	G153-E155 PolarHBondContact O-N 2.8Å; G153-F156 PolarHBondContact O-N 3.02Å
154	D	94.8	Very high	94.7	Very high	136 Å²	136	58.6 Å²	58.6	73%	0.727	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-20.7	-174.5	-63.6	-18.6	0	0	0	112	F156 E157 S158	D154-F156 PolarHBondContact O-N 3.48Å; D154-E157 PolarHBondContact O-N 2.94Å; D154-S158 WeakPolarHBondContact O-CB 3.44Å; D154-S158 PolarHBondContact O-N 3.2Å; D154-S158 PolarHBondContact O-OG 3.13Å
155	E	95.3	Very high	95.2	Very high	61 Å²	61	56.2 Å²	56.2	29%	0.285	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-33.9	177.3	-58.4	92.1	153.4	0	0	111.2	G153 E157 S158 D159 F162 A194	G153-E155 PolarHBondContact O-N 2.8Å; E155-E157 PolarHBondContact O-N 2.92Å; E155-E157 VanDerWaalsContact O-N 3.07Å; E155-S158 WeakPolarHBondContact CA-OG 3.42Å; E155-S158 PolarHBondContact O-N 3.31Å; E155-D159 PolarHBondContact O-N 3.07Å; E155-F162 HydrophobicContact CB-CB 4.18Å; E155-F162 HydrophobicContact CB-CD1 3.83Å; E155-F162 HydrophobicContact CB-CD2 4.26Å; E155-F162 HydrophobicContact CB-CE1 4.27Å; E155-F162 HydrophobicContact CB-CG 3.84Å; E155-F162 WeakPolarHBondContact O-CB 3.46Å; E155-A194 HydrophobicContact CB-CB 4.19Å; E155-A194 HydrophobicContact CG-CB 4.47Å; E155-A194 WeakPolarHBondContact OE2-CB 3.23Å
156	F	96.5	Very high	95.5	Very high	3 Å²	3	56.9 Å²	56.9	1%	0.013	31%	0.312	C	S	.	.	H	α-helix	trans	-65	-10	178	-76.9	-53.4	0	0	0	114.7	F151 M152 G153 D154 F162 V163 M165 K166 F192 A194 V199	F151-F156 HydrophobicContact CB-CD2 4.11Å; F151-F156 HydrophobicContact CB-CE2 4.44Å; F151-F156 HydrophobicContact CB-CG 4.49Å; F151-F156 HydrophobicContact CD1-CD1 4.22Å; F151-F156 HydrophobicContact CD1-CD2 4.22Å; F151-F156 HydrophobicContact CD1-CE1 4.03Å; F151-F156 HydrophobicContact CD1-CE2 4.03Å; F151-F156 HydrophobicContact CD1-CG 4.31Å; F151-F156 AromaticContact CD1-CZ 3.93Å; F151-F156 HydrophobicContact CD1-CZ 3.93Å; F151-F156 HydrophobicContact CE1-CE1 4.46Å; M152-F156 WeakPolarHBondContact O-CD2 3.36Å; M152-F156 WeakPolarHBondContact O-CE2 3.4Å; G153-F156 PolarHBondContact O-N 3.02Å; D154-F156 PolarHBondContact O-N 3.48Å; F156-F162 HydrophobicContact CD1-CB 4.19Å; F156-F162 HydrophobicContact CD1-CD1 4.05Å; F156-F162 AromaticContact CE1-CD1 3.94Å; F156-F162 HydrophobicContact CE1-CD1 3.94Å; F156-F162 HydrophobicContact CZ-CD1 4.45Å; F156-V163 WeakPolarHBondContact O-CG2 3.46Å; F156-M165 HydrophobicContact CE1-CE 4.16Å; F156-K166 HydrophobicContact CB-CD 4.12Å; F156-K166 HydrophobicContact CD1-CB 3.85Å; F156-K166 HydrophobicContact CD1-CG 4.39Å; F156-K166 HydrophobicContact CE1-CB 4.41Å; F156-F192 HydrophobicContact CE2-CB 4.35Å; F156-F192 HydrophobicContact CZ-CB 4.16Å; F156-A194 HydrophobicContact CD2-CB 3.98Å; F156-A194 HydrophobicContact CE2-CB 3.66Å; F156-A194 HydrophobicContact CZ-CB 4.15Å; F156-V199 HydrophobicContact CZ-CG1 4.08Å; F156-V199 HydrophobicContact CZ-CG2 4.1Å
157	E	94.7	Very high	95.7	Very high	151 Å²	151	55.5 Å²	55.5	71%	0.706	31%	0.31	S	S	*	.	H	α-helix	trans	-119.6	-33.1	177.2	-57.5	-167.3	168.2	0	0	112.4	D154 E155 K166	D154-E157 PolarHBondContact O-N 2.94Å; E155-E157 PolarHBondContact O-N 2.92Å; E155-E157 VanDerWaalsContact O-N 3.07Å; E157-K166 IonicContact OE1-NZ 3.75Å
158	S	95.2	Very high	95.8	Very high	89 Å²	89	54.7 Å²	54.7	62%	0.622	31%	0.305	S	S	*	.	H	α-helix	trans	-89.5	-43.1	-175.8	57.2	0	0	0	0	114.2	D154 E155 P160	D154-S158 WeakPolarHBondContact O-CB 3.44Å; D154-S158 PolarHBondContact O-N 3.2Å; D154-S158 PolarHBondContact O-OG 3.13Å; E155-S158 WeakPolarHBondContact CA-OG 3.42Å; E155-S158 PolarHBondContact O-N 3.31Å; S158-P160 WeakPolarHBondContact O-CD 3.38Å
159	D	95.1	Very high	96	Very high	56 Å²	56	52.6 Å²	52.6	30%	0.299	29%	0.291	S	S	.	.			trans	-87.8	119.4	-176.6	-179.7	-15.6	0	0	0	110.4	E155 V161 F162 V163	E155-D159 PolarHBondContact O-N 3.07Å; D159-V161 PolarHBondContact O-N 3.05Å; D159-V161 VanDerWaalsContact O-N 3.1Å; D159-V161 WeakPolarHBondContact OD1-CB 3.38Å; D159-V161 PolarHBondContact OD1-N 3.14Å; D159-F162 HydrophobicContact CB-CB 4.16Å; D159-F162 HydrophobicContact CB-CD2 4.13Å; D159-F162 PolarHBondContact O-N 2.8Å; D159-F162 WeakPolarHBondContact OD2-CD2 3.34Å; D159-V163 VanDerWaalsContact O-CG2 3.3Å; D159-V163 WeakPolarHBondContact O-CG2 3.38Å; D159-V163 PolarHBondContact O-N 2.88Å
160	P	94	Very high	96	Very high	95 Å²	95	53.3 Å²	53.3	62%	0.617	29%	0.294	S	S	*	.	H	α-helix	trans	-52.1	-34.7	177.6	-26.4	34.7	0	0	0	114.5	S158 R164	S158-P160 WeakPolarHBondContact O-CD 3.38Å; P160-R164 VanDerWaalsContact O-CG 3.32Å; P160-R164 WeakPolarHBondContact O-CG 3.34Å; P160-R164 PolarHBondContact O-N 3.4Å
161	V	95.2	Very high	95.9	Very high	39 Å²	39	50 Å²	50	24%	0.236	28%	0.277	C	S	.	.	H	α-helix	trans	-67	-47.6	178	176.3	0	0	0	0	110.3	F123 D159 R164 M165 N234 I236	F123-V161 HydrophobicContact CE1-CG1 3.92Å; D159-V161 PolarHBondContact O-N 3.05Å; D159-V161 VanDerWaalsContact O-N 3.1Å; D159-V161 WeakPolarHBondContact OD1-CB 3.38Å; D159-V161 PolarHBondContact OD1-N 3.14Å; V161-R164 PolarHBondContact O-N 3.11Å; V161-M165 WeakPolarHBondContact O-CB 3.44Å; V161-M165 PolarHBondContact O-N 3.01Å; V161-N234 VanDerWaalsContact CG1-ND2 3.3Å; V161-N234 WeakPolarHBondContact CG1-ND2 3.41Å; V161-I236 HydrophobicContact CB-CD1 4.43Å; V161-I236 HydrophobicContact CG1-CD1 4.41Å; V161-I236 HydrophobicContact CG2-CD1 4.11Å
162	F	96.4	Very high	95.8	Very high	14 Å²	14	48.2 Å²	48.2	6%	0.061	27%	0.269	C	S	.	.	H	α-helix	trans	-69.7	-33.6	178.1	-83.7	-106.7	0	0	0	112.3	E155 F156 D159 M165 K166 A194 V199 V231	E155-F162 HydrophobicContact CB-CB 4.18Å; E155-F162 HydrophobicContact CB-CD1 3.83Å; E155-F162 HydrophobicContact CB-CD2 4.26Å; E155-F162 HydrophobicContact CB-CE1 4.27Å; E155-F162 HydrophobicContact CB-CG 3.84Å; E155-F162 WeakPolarHBondContact O-CB 3.46Å; F156-F162 HydrophobicContact CD1-CB 4.19Å; F156-F162 HydrophobicContact CD1-CD1 4.05Å; F156-F162 AromaticContact CE1-CD1 3.94Å; F156-F162 HydrophobicContact CE1-CD1 3.94Å; F156-F162 HydrophobicContact CZ-CD1 4.45Å; D159-F162 HydrophobicContact CB-CB 4.16Å; D159-F162 HydrophobicContact CB-CD2 4.13Å; D159-F162 PolarHBondContact O-N 2.8Å; D159-F162 WeakPolarHBondContact OD2-CD2 3.34Å; F162-M165 HydrophobicContact CB-CE 4.26Å; F162-M165 HydrophobicContact CD1-CE 3.19Å; F162-M165 HydrophobicContact CD2-CE 4.18Å; F162-M165 HydrophobicContact CE1-CE 3.39Å; F162-M165 HydrophobicContact CE2-CE 4.34Å; F162-M165 HydrophobicContact CG-CE 3.62Å; F162-M165 HydrophobicContact CZ-CE 3.97Å; F162-M165 PolarHBondContact O-N 2.83Å; F162-K166 VanDerWaalsContact O-CB 3.3Å; F162-K166 WeakPolarHBondContact O-CB 3.44Å; F162-K166 PolarHBondContact O-N 2.83Å; F162-A194 HydrophobicContact CD1-CB 4.1Å; F162-A194 HydrophobicContact CE1-CB 3.83Å; F162-V199 HydrophobicContact CD1-CG2 4.5Å; F162-V199 HydrophobicContact CE1-CG2 3.88Å; F162-V231 HydrophobicContact CZ-CG2 4.17Å
163	V	95.9	Very high	95.7	Very high	58 Å²	58	44.3 Å²	44.3	35%	0.352	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-46.2	172.1	170.8	0	0	0	0	110.9	F156 D159 K166 S167	F156-V163 WeakPolarHBondContact O-CG2 3.46Å; D159-V163 VanDerWaalsContact O-CG2 3.3Å; D159-V163 WeakPolarHBondContact O-CG2 3.38Å; D159-V163 PolarHBondContact O-N 2.88Å; V163-K166 PolarHBondContact O-N 2.95Å; V163-S167 PolarHBondContact O-N 3.3Å; V163-S167 VanDerWaalsContact O-N 3.11Å
164	R	95.6	Very high	95.6	Very high	21 Å²	21	47 Å²	47	8%	0.079	25%	0.25	C	C	.	.	H	α-helix	trans	-68	-38.7	176.1	-68.7	-63	-164.8	99	7	111.6	F123 P160 V161 S167 L168 I236 A237 D239 Y242	F123-R164 HydrophobicContact CZ-CB 3.98Å; P160-R164 VanDerWaalsContact O-CG 3.32Å; P160-R164 WeakPolarHBondContact O-CG 3.34Å; P160-R164 PolarHBondContact O-N 3.4Å; V161-R164 PolarHBondContact O-N 3.11Å; R164-S167 WeakPolarHBondContact O-CB 3.3Å; R164-S167 PolarHBondContact O-N 3.12Å; R164-L168 PolarHBondContact O-N 2.8Å; R164-I236 HydrophobicContact CB-CD1 4.32Å; R164-I236 HydrophobicContact CB-CG2 4.39Å; R164-I236 HydrophobicContact CG-CD1 4.49Å; R164-I236 HydrophobicContact CG-CG2 3.9Å; R164-A237 PolarHBondContact NH1-O 3.37Å; R164-A237 PolarHBondContact NH2-O 3.34Å; R164-D239 IonicContact NH2-OD1 2.79Å; R164-D239 PolarHBondContact NH2-OD1 3.42Å; R164-Y242 VanDerWaalsContact CZ-CD1 3.5Å
165	M	96.7	Very high	95.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.7	-44	174.5	-178	171.2	55.3	0	0	112.1	F123 F125 F156 V161 F162 S167 L168 L169 V199 V231	F123-M165 HydrophobicContact CD1-CB 4.16Å; F123-M165 HydrophobicContact CD1-CG 4.35Å; F123-M165 HydrophobicContact CD1-SD 4.45Å; F123-M165 HydrophobicContact CE1-CB 3.75Å; F123-M165 HydrophobicContact CE1-CG 4.43Å; F123-M165 HydrophobicContact CZ-CB 3.98Å; F125-M165 HydrophobicContact CE1-CG 4.47Å; F125-M165 HydrophobicContact CE1-SD 3.46Å; F125-M165 WeakPolarHBondContact CE1-SD 3.37Å; F125-M165 HydrophobicContact CZ-CG 4.14Å; F125-M165 HydrophobicContact CZ-SD 3.71Å; F156-M165 HydrophobicContact CE1-CE 4.16Å; V161-M165 WeakPolarHBondContact O-CB 3.44Å; V161-M165 PolarHBondContact O-N 3.01Å; F162-M165 HydrophobicContact CB-CE 4.26Å; F162-M165 HydrophobicContact CD1-CE 3.19Å; F162-M165 HydrophobicContact CD2-CE 4.18Å; F162-M165 HydrophobicContact CE1-CE 3.39Å; F162-M165 HydrophobicContact CE2-CE 4.34Å; F162-M165 HydrophobicContact CG-CE 3.62Å; F162-M165 HydrophobicContact CZ-CE 3.97Å; F162-M165 PolarHBondContact O-N 2.83Å; M165-S167 VanDerWaalsContact C-N 3.29Å; M165-S167 PolarHBondContact O-N 2.82Å; M165-L168 WeakPolarHBondContact O-CB 3.29Å; M165-L168 PolarHBondContact O-N 3.16Å; M165-L168 VanDerWaalsContact O-N 3.14Å; M165-L169 HydrophobicContact CG-CD1 3.96Å; M165-L169 HydrophobicContact CG-CG 4.29Å; M165-L169 WeakPolarHBondContact O-CG 3.4Å; M165-L169 PolarHBondContact O-N 3.09Å; M165-V199 HydrophobicContact CE-CG2 3.49Å; M165-V199 VanDerWaalsContact CE-CG2 3.49Å; M165-V199 HydrophobicContact SD-CG2 4.1Å; M165-V231 HydrophobicContact CE-CG2 4.02Å; M165-V231 HydrophobicContact SD-CG2 3.98Å
166	K	97	Very high	95.1	Very high	47 Å²	47	41 Å²	41	20%	0.204	23%	0.228	C	C	.	.	H	α-helix	trans	-54.9	-46.8	173	-178	-174.9	-167.2	167.5	0	110.6	F151 F156 E157 F162 V163 L168 L169 I170	F151-K166 HydrophobicContact CD1-CG 3.84Å; F151-K166 HydrophobicContact CD2-CG 4.42Å; F151-K166 HydrophobicContact CE1-CB 4.39Å; F151-K166 HydrophobicContact CE1-CG 3.87Å; F151-K166 HydrophobicContact CE2-CG 4.45Å; F151-K166 HydrophobicContact CG-CG 4.13Å; F151-K166 HydrophobicContact CZ-CG 4.19Å; F156-K166 HydrophobicContact CB-CD 4.12Å; F156-K166 HydrophobicContact CD1-CB 3.85Å; F156-K166 HydrophobicContact CD1-CG 4.39Å; F156-K166 HydrophobicContact CE1-CB 4.41Å; E157-K166 IonicContact OE1-NZ 3.75Å; F162-K166 VanDerWaalsContact O-CB 3.3Å; F162-K166 WeakPolarHBondContact O-CB 3.44Å; F162-K166 PolarHBondContact O-N 2.83Å; V163-K166 PolarHBondContact O-N 2.95Å; K166-L168 PolarHBondContact O-N 2.56Å; K166-L169 PolarHBondContact O-N 3.08Å; K166-I170 HydrophobicContact CG-CD1 3.86Å; K166-I170 HydrophobicContact CG-CG1 4.47Å; K166-I170 WeakPolarHBondContact O-CB 3.28Å; K166-I170 VanDerWaalsContact O-CG1 3.25Å; K166-I170 WeakPolarHBondContact O-CG1 3.2Å; K166-I170 PolarHBondContact O-N 3.01Å
167	S	96.5	Very high	94.8	Very high	31 Å²	31	45.9 Å²	45.9	22%	0.217	26%	0.257	C	S	.	.	H	α-helix	trans	-57.2	-46.5	175.8	179.8	0	0	0	0	112	R113 V163 R164 M165 D171 Y242	R113-S167 PolarHBondContact NH1-OG 2.88Å; R113-S167 VanDerWaalsContact NH1-OG 3.1Å; V163-S167 PolarHBondContact O-N 3.3Å; V163-S167 VanDerWaalsContact O-N 3.11Å; R164-S167 WeakPolarHBondContact O-CB 3.3Å; R164-S167 PolarHBondContact O-N 3.12Å; M165-S167 VanDerWaalsContact C-N 3.29Å; M165-S167 PolarHBondContact O-N 2.82Å; S167-D171 WeakPolarHBondContact O-CB 3.47Å; S167-D171 PolarHBondContact O-N 2.92Å; S167-D171 VanDerWaalsContact O-N 3.09Å; S167-Y242 PolarHBondContact OG-OH 3Å
168	L	96.7	Very high	94.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-46.7	175.8	174.9	65.5	0	0	0	112.2	L111 R113 F123 R164 M165 K166 D171 F172	L111-L168 HydrophobicContact CB-CD2 4.04Å; R113-L168 HydrophobicContact CB-CD1 3.88Å; R113-L168 HydrophobicContact CG-CD1 3.88Å; F123-L168 HydrophobicContact CB-CD2 4.36Å; F123-L168 HydrophobicContact CD2-CD2 3.49Å; F123-L168 VanDerWaalsContact CD2-CD2 3.49Å; F123-L168 HydrophobicContact CE2-CD2 4.18Å; F123-L168 HydrophobicContact CG-CD2 4.28Å; R164-L168 PolarHBondContact O-N 2.8Å; M165-L168 WeakPolarHBondContact O-CB 3.29Å; M165-L168 PolarHBondContact O-N 3.16Å; M165-L168 VanDerWaalsContact O-N 3.14Å; K166-L168 PolarHBondContact O-N 2.56Å; L168-D171 PolarHBondContact O-N 3.05Å; L168-F172 WeakPolarHBondContact O-CB 3.3Å; L168-F172 PolarHBondContact O-N 2.97Å
169	L	96.8	Very high	94.4	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-42.4	-178.4	-68.5	172.1	0	0	0	111.7	L111 F151 M165 K166 D171 F172 F173 F192	L111-L169 HydrophobicContact CD1-CD2 4.32Å; F151-L169 HydrophobicContact CE1-CB 4.14Å; F151-L169 HydrophobicContact CE1-CD1 4.23Å; F151-L169 HydrophobicContact CZ-CB 4.16Å; M165-L169 HydrophobicContact CG-CD1 3.96Å; M165-L169 HydrophobicContact CG-CG 4.29Å; M165-L169 WeakPolarHBondContact O-CG 3.4Å; M165-L169 PolarHBondContact O-N 3.09Å; K166-L169 PolarHBondContact O-N 3.08Å; L169-D171 VanDerWaalsContact C-N 3.33Å; L169-D171 PolarHBondContact O-N 2.82Å; L169-F172 PolarHBondContact O-N 2.88Å; L169-F173 HydrophobicContact CD2-CD2 4.43Å; L169-F173 HydrophobicContact CD2-CE2 3.94Å; L169-F173 VanDerWaalsContact O-CD2 3.29Å; L169-F173 WeakPolarHBondContact O-CD2 3.45Å; L169-F173 PolarHBondContact O-N 2.79Å; L169-F192 HydrophobicContact CD1-CD1 3.93Å; L169-F192 HydrophobicContact CD1-CE1 4.21Å; L169-F192 HydrophobicContact CD2-CE1 4.22Å
170	I	96.9	Very high	94.3	Very high	63 Å²	63	51 Å²	51	32%	0.323	28%	0.279	S	S	.	.	H	α-helix	trans	-57.3	-49.9	173	-69.5	169.3	0	0	0	109.8	L149 F151 K166 F172 F173 R174	L149-I170 HydrophobicContact CD1-CB 4.4Å; L149-I170 HydrophobicContact CD1-CG1 4.3Å; L149-I170 HydrophobicContact CD1-CG2 4.39Å; F151-I170 HydrophobicContact CD2-CG1 4.5Å; F151-I170 HydrophobicContact CE2-CD1 3.97Å; F151-I170 HydrophobicContact CE2-CG1 3.44Å; F151-I170 VanDerWaalsContact CE2-CG1 3.44Å; F151-I170 HydrophobicContact CZ-CD1 4.3Å; F151-I170 HydrophobicContact CZ-CG1 3.53Å; K166-I170 HydrophobicContact CG-CD1 3.86Å; K166-I170 HydrophobicContact CG-CG1 4.47Å; K166-I170 WeakPolarHBondContact O-CB 3.28Å; K166-I170 VanDerWaalsContact O-CG1 3.25Å; K166-I170 WeakPolarHBondContact O-CG1 3.2Å; K166-I170 PolarHBondContact O-N 3.01Å; I170-F172 VanDerWaalsContact C-N 3.27Å; I170-F172 PolarHBondContact O-N 2.79Å; I170-F173 PolarHBondContact O-N 2.85Å; I170-R174 WeakPolarHBondContact O-CB 3.45Å; I170-R174 WeakPolarHBondContact O-CG 3.37Å; I170-R174 PolarHBondContact O-N 2.82Å
171	D	95.3	Very high	94.2	Very high	12 Å²	12	51 Å²	51	6%	0.064	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-33.7	-177.8	-156.7	38.9	0	0	0	112.6	K37 R113 S167 L168 L169	K37-D171 WeakPolarHBondContact CD-OD1 3.49Å; K37-D171 VanDerWaalsContact CD-OD2 3.28Å; K37-D171 WeakPolarHBondContact CD-OD2 3.24Å; K37-D171 WeakPolarHBondContact CE-OD2 3.41Å; K37-D171 IonicContact NZ-OD1 3.89Å; K37-D171 PolarHBondContact NZ-OD1 3.45Å; K37-D171 IonicContact NZ-OD2 3.73Å; K37-D171 PolarHBondContact NZ-OD2 2.81Å; R113-D171 IonicContact CZ-OD2 2.74Å; R113-D171 IonicContact NE-OD2 2.72Å; R113-D171 IonicContact NH2-OD2 3.16Å; S167-D171 WeakPolarHBondContact O-CB 3.47Å; S167-D171 PolarHBondContact O-N 2.92Å; S167-D171 VanDerWaalsContact O-N 3.09Å; L168-D171 PolarHBondContact O-N 3.05Å; L169-D171 VanDerWaalsContact C-N 3.33Å; L169-D171 PolarHBondContact O-N 2.82Å
172	F	96.2	Very high	94	Very high	3 Å²	3	58.3 Å²	58.3	1%	0.013	30%	0.296	C	S	.	.	H	α-helix	trans	-70.7	-46.4	177.2	-163.5	-85.9	0	0	0	112.4	T39 F41 L58 K62 L95 C97 L111 L168 L169 I170	T39-F172 HydrophobicContact CG2-CE2 3.63Å; T39-F172 HydrophobicContact CG2-CZ 3.94Å; F41-F172 HydrophobicContact CE1-CZ 4.36Å; F41-F172 HydrophobicContact CZ-CZ 4.37Å; L58-F172 HydrophobicContact CD2-CE1 4.35Å; K62-F172 PolarHBondContact NZ-O 3.01Å; L95-F172 HydrophobicContact CD1-CD2 4.21Å; C97-F172 HydrophobicContact CB-CE2 4.39Å; C97-F172 HydrophobicContact CB-CZ 4.34Å; L111-F172 HydrophobicContact CD2-CD2 4.4Å; L111-F172 HydrophobicContact CD2-CE2 3.81Å; L111-F172 HydrophobicContact CD2-CZ 3.99Å; L168-F172 WeakPolarHBondContact O-CB 3.3Å; L168-F172 PolarHBondContact O-N 2.97Å; L169-F172 PolarHBondContact O-N 2.88Å; I170-F172 VanDerWaalsContact C-N 3.27Å; I170-F172 PolarHBondContact O-N 2.79Å
173	F	94.9	Very high	93.5	Very high	18 Å²	18	63.8 Å²	63.8	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-99	-17.4	-170.4	-67.8	-73	0	0	0	115.4	L58 L61 P147 L149 L169 I170 G175 L190 F192	L58-F173 HydrophobicContact CD2-CE1 3.84Å; L58-F173 HydrophobicContact CD2-CZ 3.88Å; L61-F173 HydrophobicContact CD1-CD1 4.47Å; L61-F173 HydrophobicContact CD1-CE1 4.08Å; P147-F173 WeakPolarHBondContact CG-O 3.46Å; L149-F173 HydrophobicContact CD1-CB 4.37Å; L149-F173 HydrophobicContact CD2-CB 3.81Å; L169-F173 HydrophobicContact CD2-CD2 4.43Å; L169-F173 HydrophobicContact CD2-CE2 3.94Å; L169-F173 VanDerWaalsContact O-CD2 3.29Å; L169-F173 WeakPolarHBondContact O-CD2 3.45Å; L169-F173 PolarHBondContact O-N 2.79Å; I170-F173 PolarHBondContact O-N 2.85Å; F173-G175 PolarHBondContact O-N 3.25Å; F173-L190 HydrophobicContact CB-CD1 4Å; F173-L190 HydrophobicContact CD1-CD1 3.63Å; F173-L190 HydrophobicContact CE1-CD1 4.31Å; F173-L190 HydrophobicContact CG-CD1 3.91Å; F173-F192 HydrophobicContact CD2-CE1 4.16Å; F173-F192 AromaticContact CD2-CZ 3.58Å; F173-F192 HydrophobicContact CD2-CZ 3.58Å; F173-F192 HydrophobicContact CE2-CE1 4.01Å; F173-F192 AromaticContact CE2-CZ 3.86Å; F173-F192 HydrophobicContact CE2-CZ 3.86Å; F173-F192 HydrophobicContact CG-CZ 4.23Å
174	R	91.9	Very high	93	Very high	90 Å²	90	68.4 Å²	68.4	34%	0.34	34%	0.343	S	S	.	.			trans	-56.9	-24.6	-173.2	60.4	-178.3	-81.3	-175	4.7	116.7	K146 L149 I170	K146-R174 PolarHBondContact NZ-O 3.04Å; L149-R174 HydrophobicContact CD1-CB 4.45Å; I170-R174 WeakPolarHBondContact O-CB 3.45Å; I170-R174 WeakPolarHBondContact O-CG 3.37Å; I170-R174 PolarHBondContact O-N 2.82Å
175	G	88.8	Confident	92.7	Very high	25 Å²	25	68.3 Å²	68.3	26%	0.258	35%	0.349	S	S	.	.			trans	61.6	-151.1	-171.2	0	0	0	0	0	113.6	F173	F173-G175 PolarHBondContact O-N 3.25Å
176	P	90.5	Very high	92.5	Very high	46 Å²	46	70.7 Å²	70.7	30%	0.299	36%	0.361	S	S	.	.	S	Bend	trans	-68.6	151.8	-172.2	27	-34.7	0	0	0	114	D36 K146 I178	D36-P176 VanDerWaalsContact OD1-CA 3.31Å; D36-P176 WeakPolarHBondContact OD1-CA 3.21Å; D36-P176 WeakPolarHBondContact OD2-CB 3.25Å; K146-P176 PolarHBondContact NZ-O 3.37Å; P176-I178 HydrophobicContact CB-CG2 4.35Å; P176-I178 HydrophobicContact CG-CG2 4.37Å
177	V	89.8	Confident	92.3	Very high	104 Å²	104	71.7 Å²	71.7	63%	0.63	37%	0.366	S	S	*	.			trans	-83.8	115	171.5	-160.9	0	0	0	0	109
178	I	90.8	Very high	92.2	Very high	74 Å²	74	70.4 Å²	70.4	38%	0.379	36%	0.357	S	S	.	.			trans	-123.1	147.1	-176.8	61.7	173.8	0	0	0	110.4	K146 P176 L181	K146-I178 HydrophobicContact CD-CD1 3.54Å; K146-I178 HydrophobicContact CD-CG1 3.92Å; P176-I178 HydrophobicContact CB-CG2 4.35Å; P176-I178 HydrophobicContact CG-CG2 4.37Å; I178-L181 HydrophobicContact CD1-CB 3.91Å; I178-L181 HydrophobicContact CD1-CD1 3.67Å; I178-L181 HydrophobicContact CD1-CG 4.25Å
179	T	91.7	Very high	92.1	Very high	146 Å²	146	70.6 Å²	70.6	90%	0.896	36%	0.358	S	S	*	.	S	Bend	trans	-94.8	-27.4	175.7	52.1	0	0	0	0	112.8
180	K	93.4	Very high	92.1	Very high	185 Å²	185	70.6 Å²	70.6	80%	0.804	36%	0.358	S	S	*	.			trans	-131.5	141.2	179.6	-61.7	-176	-178.8	-177.8	0	109.2
181	L	90.7	Very high	92.1	Very high	93 Å²	93	69.7 Å²	69.7	49%	0.487	35%	0.353	S	S	.	.			trans	-129.7	138.3	178	-178.4	62.1	0	0	0	108.8	I178 I186	I178-L181 HydrophobicContact CD1-CB 3.91Å; I178-L181 HydrophobicContact CD1-CD1 3.67Å; I178-L181 HydrophobicContact CD1-CG 4.25Å; L181-I186 HydrophobicContact CD2-CD1 4.18Å; L181-I186 HydrophobicContact CD2-CG1 3.67Å; L181-I186 HydrophobicContact CG-CG1 4.33Å
182	R	90.4	Very high	92.3	Very high	194 Å²	194	69.1 Å²	69.1	73%	0.732	35%	0.35	S	S	*	.			trans	-80.2	143.2	171.6	-64.2	-173.7	-66.7	169.4	1.3	108.8	Q184 G185	R182-Q184 VanDerWaalsContact C-N 3.29Å; R182-Q184 PolarHBondContact O-N 3.35Å; R182-G185 WeakPolarHBondContact O-CA 3.47Å; R182-G185 PolarHBondContact O-N 2.76Å
183	L	86.6	Confident	92.3	Very high	129 Å²	129	70.4 Å²	70.4	68%	0.675	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-55.6	-43.9	177.6	-73.7	162.8	0	0	0	112.2	G185 I186	L183-G185 PolarHBondContact O-N 2.88Å; L183-I186 WeakPolarHBondContact O-CB 3.44Å; L183-I186 PolarHBondContact O-N 3.23Å; L183-I186 VanDerWaalsContact O-N 3.07Å
184	Q	86.3	Confident	92.4	Very high	154 Å²	154	69.9 Å²	69.9	72%	0.72	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-64.1	-8.8	174.4	-68.1	169.1	-11	0	0	114.1	R182 I186 E187	R182-Q184 VanDerWaalsContact C-N 3.29Å; R182-Q184 PolarHBondContact O-N 3.35Å; Q184-I186 VanDerWaalsContact C-N 3.33Å; Q184-E187 VanDerWaalsContact O-CD 3.28Å; Q184-E187 WeakPolarHBondContact O-CG 3.42Å
185	G	89.4	Confident	92.6	Very high	19 Å²	19	68.3 Å²	68.3	20%	0.196	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-86.7	-3.9	174.1	0	0	0	0	0	113.7	R182 L183 E187	R182-G185 WeakPolarHBondContact O-CA 3.47Å; R182-G185 PolarHBondContact O-N 2.76Å; L183-G185 PolarHBondContact O-N 2.88Å; G185-E187 PolarHBondContact O-N 2.83Å
186	I	91.8	Very high	92.6	Very high	50 Å²	50	74.3 Å²	74.3	26%	0.256	38%	0.384	S	S	.	.			trans	-92.6	73.3	178.4	-55.4	171.4	0	0	0	108	L181 L183 Q184 I206	L181-I186 HydrophobicContact CD2-CD1 4.18Å; L181-I186 HydrophobicContact CD2-CG1 3.67Å; L181-I186 HydrophobicContact CG-CG1 4.33Å; L183-I186 WeakPolarHBondContact O-CB 3.44Å; L183-I186 PolarHBondContact O-N 3.23Å; L183-I186 VanDerWaalsContact O-N 3.07Å; Q184-I186 VanDerWaalsContact C-N 3.33Å; I186-I206 HydrophobicContact CG2-CD1 3.82Å
187	E	92.7	Very high	92.5	Very high	69 Å²	69	73.9 Å²	73.9	32%	0.322	39%	0.388	S	S	.	.			trans	-113.8	-15.9	-173.3	-59.8	177.3	130.8	0	0	112.7	V145 Q184 G185 S205 I206	V145-E187 HydrophobicContact CG1-CB 4.47Å; Q184-E187 VanDerWaalsContact O-CD 3.28Å; Q184-E187 WeakPolarHBondContact O-CG 3.42Å; G185-E187 PolarHBondContact O-N 2.83Å; E187-S205 CarbonylContact O-C 3.55Å; E187-S205 WeakPolarHBondContact O-CA 3.49Å; E187-I206 PolarHBondContact O-N 2.87Å
188	Y	94.4	Very high	92.7	Very high	4 Å²	4	72.3 Å²	72.3	2%	0.016	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	130.1	-170.1	-171.2	-128.1	0	0	0	112.5	L61 I141 P147 C148 L190 A203 Y204 A223 G224 P225	L61-Y188 HydrophobicContact CD2-CE1 3.63Å; I141-Y188 HydrophobicContact CB-CD2 4.47Å; I141-Y188 HydrophobicContact CD1-CD2 3.22Å; I141-Y188 HydrophobicContact CD1-CE2 3.2Å; I141-Y188 HydrophobicContact CD1-CG 4.2Å; I141-Y188 HydrophobicContact CG1-CD2 3.72Å; I141-Y188 HydrophobicContact CG1-CE2 4.19Å; I141-Y188 HydrophobicContact CG1-CG 4.37Å; I141-Y188 HydrophobicContact CG2-CD1 4.47Å; I141-Y188 HydrophobicContact CG2-CD2 4.1Å; I141-Y188 HydrophobicContact CG2-CG 3.93Å; P147-Y188 CarbonylContact C-O 3.59Å; P147-Y188 WeakPolarHBondContact CA-O 3.14Å; P147-Y188 HydrophobicContact CB-CD1 3.74Å; P147-Y188 HydrophobicContact CB-CE1 4.22Å; C148-Y188 PolarHBondContact N-O 2.63Å; Y188-L190 HydrophobicContact CE1-CD1 4.1Å; Y188-L190 HydrophobicContact CE1-CD2 4.08Å; Y188-L190 HydrophobicContact CE1-CG 3.8Å; Y188-L190 WeakPolarHBondContact OH-CD2 3.47Å; Y188-A203 HydrophobicContact CE2-CB 3.75Å; Y188-A203 WeakPolarHBondContact OH-CB 3.48Å; Y188-Y204 WeakPolarHBondContact CD2-O 3.43Å; Y188-A223 HydrophobicContact CE2-CB 4.31Å; Y188-G224 PolarHBondContact OH-O 3.48Å; Y188-P225 WeakPolarHBondContact OH-CD 3.15Å
189	A	95.3	Very high	93.1	Very high	3 Å²	3	68.8 Å²	68.8	3%	0.025	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138	173.8	0	0	0	0	0	111.6	C148 L150 A203 Y204 I206	C148-A189 HydrophobicContact CB-CB 4.25Å; C148-A189 CarbonylContact O-C 3.57Å; C148-A189 WeakPolarHBondContact O-CA 3.07Å; L150-A189 HydrophobicContact CD1-CB 3.84Å; A189-A203 CarbonylContact O-C 3.58Å; A189-A203 WeakPolarHBondContact O-CA 3.27Å; A189-Y204 PolarHBondContact N-O 2.88Å; A189-Y204 PolarHBondContact O-N 2.86Å; A189-I206 HydrophobicContact CB-CD1 3.95Å; A189-I206 HydrophobicContact CB-CG1 4.2Å
190	L	96.2	Very high	93.3	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.5	166.9	-73.2	169.8	0	0	0	108.5	P147 C148 L149 L150 F173 Y188 F192 A203	P147-L190 HydrophobicContact CB-CD1 4.06Å; P147-L190 HydrophobicContact CB-CG 4.33Å; P147-L190 HydrophobicContact CG-CD1 4.32Å; C148-L190 PolarHBondContact O-N 2.6Å; L149-L190 WeakPolarHBondContact CA-O 3.07Å; L149-L190 HydrophobicContact CD2-CB 3.96Å; L149-L190 HydrophobicContact CD2-CD1 4.15Å; L150-L190 PolarHBondContact N-O 3.28Å; F173-L190 HydrophobicContact CB-CD1 4Å; F173-L190 HydrophobicContact CD1-CD1 3.63Å; F173-L190 HydrophobicContact CE1-CD1 4.31Å; F173-L190 HydrophobicContact CG-CD1 3.91Å; Y188-L190 HydrophobicContact CE1-CD1 4.1Å; Y188-L190 HydrophobicContact CE1-CD2 4.08Å; Y188-L190 HydrophobicContact CE1-CG 3.8Å; Y188-L190 WeakPolarHBondContact OH-CD2 3.47Å; L190-F192 HydrophobicContact CB-CE2 3.83Å; L190-F192 HydrophobicContact CB-CZ 4.16Å; L190-A203 HydrophobicContact CD2-CB 3.89Å
191	M	97.4	Very high	93.5	Very high	44 Å²	44	55.1 Å²	55.1	22%	0.217	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131.2	175.7	-171.8	176.1	76.2	0	0	109.8	L150 M152 V201 R202 Y204	L150-M191 HydrophobicContact CB-CB 4.41Å; L150-M191 HydrophobicContact CB-CG 4.23Å; L150-M191 CarbonylContact O-C 3.53Å; L150-M191 WeakPolarHBondContact O-CA 3.36Å; M152-M191 HydrophobicContact CG-CG 4.34Å; M152-M191 HydrophobicContact CG-SD 4.45Å; M191-V201 WeakPolarHBondContact O-CA 3.42Å; M191-R202 HydrophobicContact CE-CB 4.26Å; M191-R202 HydrophobicContact CE-CG 4.4Å; M191-R202 PolarHBondContact N-O 2.89Å; M191-R202 PolarHBondContact O-N 3.29Å; M191-Y204 HydrophobicContact CB-CD2 4.38Å; M191-Y204 HydrophobicContact CB-CE2 3.94Å; M191-Y204 HydrophobicContact CE-CE2 3.89Å; M191-Y204 WeakPolarHBondContact CE-OH 3.45Å; M191-Y204 HydrophobicContact SD-CE2 4.23Å
192	F	98	Very high	93.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	112.2	175.8	-59.7	-89.5	0	0	0	108	L149 L150 F151 M152 F156 L169 F173 L190 V199 L200 V201	L149-F192 HydrophobicContact CD2-CE2 4.2Å; L150-F192 PolarHBondContact O-N 3.06Å; F151-F192 CarbonylContact C-O 3.52Å; F151-F192 WeakPolarHBondContact CA-O 3.45Å; F151-F192 HydrophobicContact CD1-CB 3.71Å; F151-F192 HydrophobicContact CD1-CD2 4.16Å; F151-F192 HydrophobicContact CD1-CG 4.12Å; F151-F192 HydrophobicContact CE1-CB 3.87Å; F151-F192 AromaticContact CE1-CD2 3.7Å; F151-F192 HydrophobicContact CE1-CD2 3.7Å; F151-F192 HydrophobicContact CE1-CE2 4.42Å; F151-F192 AromaticContact CE1-CG 3.77Å; F151-F192 HydrophobicContact CE1-CG 3.77Å; F151-F192 HydrophobicContact CE2-CD2 4.23Å; F151-F192 HydrophobicContact CG-CB 4.44Å; F151-F192 AromaticContact CZ-CD2 3.73Å; F151-F192 HydrophobicContact CZ-CD2 3.73Å; F151-F192 HydrophobicContact CZ-CE2 4.11Å; F151-F192 HydrophobicContact CZ-CG 4.27Å; M152-F192 PolarHBondContact N-O 3.1Å; F156-F192 HydrophobicContact CE2-CB 4.35Å; F156-F192 HydrophobicContact CZ-CB 4.16Å; L169-F192 HydrophobicContact CD1-CD1 3.93Å; L169-F192 HydrophobicContact CD1-CE1 4.21Å; L169-F192 HydrophobicContact CD2-CE1 4.22Å; F173-F192 HydrophobicContact CD2-CE1 4.16Å; F173-F192 AromaticContact CD2-CZ 3.58Å; F173-F192 HydrophobicContact CD2-CZ 3.58Å; F173-F192 HydrophobicContact CE2-CE1 4.01Å; F173-F192 AromaticContact CE2-CZ 3.86Å; F173-F192 HydrophobicContact CE2-CZ 3.86Å; F173-F192 HydrophobicContact CG-CZ 4.23Å; L190-F192 HydrophobicContact CB-CE2 3.83Å; L190-F192 HydrophobicContact CB-CZ 4.16Å; F192-V199 HydrophobicContact CB-CG1 4.11Å; F192-V199 HydrophobicContact CD1-CG1 4.08Å; F192-L200 WeakPolarHBondContact CA-O 3.42Å; F192-V201 HydrophobicContact CD1-CG1 4.37Å; F192-V201 HydrophobicContact CD1-CG2 3.81Å; F192-V201 HydrophobicContact CE1-CG1 3.94Å; F192-V201 HydrophobicContact CE1-CG2 3.86Å; F192-V201 HydrophobicContact CZ-CG1 4.47Å
193	T	98	Very high	94.1	Very high	31 Å²	31	44.4 Å²	44.4	19%	0.19	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.5	177.8	-50	0	0	0	0	109.6	M152 V195 V199 L200	M152-T193 HydrophobicContact CB-CG2 4.05Å; M152-T193 CarbonylContact O-C 3.57Å; M152-T193 WeakPolarHBondContact O-CA 3.27Å; T193-V195 HydrophobicContact CG2-CG2 3.76Å; T193-V199 CarbonylContact O-C 3.38Å; T193-V199 WeakPolarHBondContact O-CA 3.36Å; T193-L200 PolarHBondContact N-O 3.42Å; T193-L200 PolarHBondContact O-N 3.14Å
194	A	97.1	Very high	94.5	Very high	6 Å²	6	40.9 Å²	40.9	5%	0.05	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	124.4	170.2	0	0	0	0	0	109.4	M152 E155 F156 F162 K198	M152-A194 PolarHBondContact O-N 2.92Å; E155-A194 HydrophobicContact CB-CB 4.19Å; E155-A194 HydrophobicContact CG-CB 4.47Å; E155-A194 WeakPolarHBondContact OE2-CB 3.23Å; F156-A194 HydrophobicContact CD2-CB 3.98Å; F156-A194 HydrophobicContact CE2-CB 3.66Å; F156-A194 HydrophobicContact CZ-CB 4.15Å; F162-A194 HydrophobicContact CD1-CB 4.1Å; F162-A194 HydrophobicContact CE1-CB 3.83Å; A194-K198 WeakPolarHBondContact CA-O 3.39Å
195	V	94.7	Very high	94.9	Very high	58 Å²	58	34.2 Å²	34.2	35%	0.352	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	125.3	176.4	-177.4	0	0	0	0	108.1	T193 G197 K198 L200	T193-V195 HydrophobicContact CG2-CG2 3.76Å; V195-G197 VanDerWaalsContact C-N 3.28Å; V195-G197 PolarHBondContact O-N 3.37Å; V195-G197 VanDerWaalsContact O-N 3.16Å; V195-K198 PolarHBondContact N-O 3.44Å; V195-K198 WeakPolarHBondContact O-CA 3.41Å; V195-K198 WeakPolarHBondContact O-CB 3.4Å; V195-K198 PolarHBondContact O-N 3.43Å; V195-L200 HydrophobicContact CG2-CD1 4.14Å
196	D	89.9	Confident	95.1	Very high	151 Å²	151	34.1 Å²	34.1	81%	0.807	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	42	172.6	-58.9	-33.2	0	0	0	114.6	K198	D196-K198 PolarHBondContact O-N 2.95Å
197	G	87.2	Confident	95.1	Very high	37 Å²	37	35.1 Å²	35.1	38%	0.381	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	7.9	-178.4	0	0	0	0	0	114.8	V195 V231	V195-G197 VanDerWaalsContact C-N 3.28Å; V195-G197 PolarHBondContact O-N 3.37Å; V195-G197 VanDerWaalsContact O-N 3.16Å; G197-V231 WeakPolarHBondContact O-CG2 3.4Å
198	K	95.3	Very high	95.1	Very high	71 Å²	71	35.2 Å²	35.2	31%	0.309	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	154.6	170.6	-54.9	-170.8	-177	-168.2	0	110.2	E128 A194 V195 D196 L229 I230	E128-K198 IonicContact OE2-NZ 2.87Å; E128-K198 PolarHBondContact OE2-NZ 2.85Å; A194-K198 WeakPolarHBondContact CA-O 3.39Å; V195-K198 PolarHBondContact N-O 3.44Å; V195-K198 WeakPolarHBondContact O-CA 3.41Å; V195-K198 WeakPolarHBondContact O-CB 3.4Å; V195-K198 PolarHBondContact O-N 3.43Å; D196-K198 PolarHBondContact O-N 2.95Å; K198-L229 CarbonylContact C-O 3.6Å; K198-L229 WeakPolarHBondContact CA-O 3.45Å; K198-I230 HydrophobicContact CD-CG1 3.93Å; K198-I230 HydrophobicContact CG-CG1 4.08Å
199	V	97.5	Very high	94.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	110.2	169.2	179.7	0	0	0	0	108.6	F156 F162 M165 F192 T193 V201 L229 V231	F156-V199 HydrophobicContact CZ-CG1 4.08Å; F156-V199 HydrophobicContact CZ-CG2 4.1Å; F162-V199 HydrophobicContact CD1-CG2 4.5Å; F162-V199 HydrophobicContact CE1-CG2 3.88Å; M165-V199 HydrophobicContact CE-CG2 3.49Å; M165-V199 VanDerWaalsContact CE-CG2 3.49Å; M165-V199 HydrophobicContact SD-CG2 4.1Å; F192-V199 HydrophobicContact CB-CG1 4.11Å; F192-V199 HydrophobicContact CD1-CG1 4.08Å; T193-V199 CarbonylContact O-C 3.38Å; T193-V199 WeakPolarHBondContact O-CA 3.36Å; V199-V201 HydrophobicContact CG1-CG2 4.38Å; V199-V201 PolarHBondContact O-N 3.23Å; V199-L229 HydrophobicContact CB-CB 4.28Å; V199-L229 PolarHBondContact N-O 3.19Å; V199-L229 WeakPolarHBondContact O-CB 3.5Å; V199-L229 PolarHBondContact O-N 2.98Å; V199-V231 HydrophobicContact CG2-CG2 4.39Å
200	L	97.9	Very high	94.7	Very high	42 Å²	42	49.2 Å²	49.2	22%	0.22	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	117.5	174.6	-48.4	178.4	0	0	0	108.1	F192 T193 V195 D228	F192-L200 WeakPolarHBondContact CA-O 3.42Å; T193-L200 PolarHBondContact N-O 3.42Å; T193-L200 PolarHBondContact O-N 3.14Å; V195-L200 HydrophobicContact CG2-CD1 4.14Å; L200-D228 HydrophobicContact CD2-CB 4Å; L200-D228 VanDerWaalsContact CD2-CG 3.46Å; L200-D228 VanDerWaalsContact CD2-OD1 3.26Å; L200-D228 WeakPolarHBondContact CD2-OD1 3.48Å
201	V	97.6	Very high	94.4	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.2	175.3	-173.7	0	0	0	0	107.9	M191 F192 V199 S226 M227 L229	M191-V201 WeakPolarHBondContact O-CA 3.42Å; F192-V201 HydrophobicContact CD1-CG1 4.37Å; F192-V201 HydrophobicContact CD1-CG2 3.81Å; F192-V201 HydrophobicContact CE1-CG1 3.94Å; F192-V201 HydrophobicContact CE1-CG2 3.86Å; F192-V201 HydrophobicContact CZ-CG1 4.47Å; V199-V201 HydrophobicContact CG1-CG2 4.38Å; V199-V201 PolarHBondContact O-N 3.23Å; V201-S226 WeakPolarHBondContact O-CA 3.43Å; V201-M227 WeakPolarHBondContact CA-O 3.36Å; V201-M227 HydrophobicContact CB-CE 4.38Å; V201-M227 HydrophobicContact CB-CG 3.92Å; V201-M227 HydrophobicContact CG1-CE 4.18Å; V201-M227 HydrophobicContact CG2-CG 4.29Å; V201-M227 PolarHBondContact N-O 2.86Å; V201-M227 PolarHBondContact O-N 2.72Å; V201-L229 HydrophobicContact CG2-CD1 3.6Å; V201-L229 HydrophobicContact CG2-CG 3.92Å
202	R	96.5	Very high	94.1	Very high	61 Å²	61	55.2 Å²	55.2	23%	0.23	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	133.7	176.6	-60.7	-62.4	178.9	-93.2	0.6	109.6	M191 Y204 S226 M227 D228	M191-R202 HydrophobicContact CE-CB 4.26Å; M191-R202 HydrophobicContact CE-CG 4.4Å; M191-R202 PolarHBondContact N-O 2.89Å; M191-R202 PolarHBondContact O-N 3.29Å; R202-Y204 HydrophobicContact CB-CE2 3.62Å; R202-S226 WeakPolarHBondContact CD-OG 3.33Å; R202-S226 PolarHBondContact NE-OG 2.74Å; R202-S226 PolarHBondContact NH1-OG 3.16Å; R202-M227 PolarHBondContact NH1-O 3.48Å; R202-D228 IonicContact CZ-OD1 2.75Å; R202-D228 IonicContact NH1-OD1 2.7Å; R202-D228 PolarHBondContact NH1-OD1 2.88Å; R202-D228 IonicContact NH2-OD1 3.83Å; R202-D228 PolarHBondContact NH2-OD1 2.83Å; R202-D228 IonicContact NH2-OD2 3.37Å
203	A	95.5	Very high	93.8	Very high	2 Å²	2	59.7 Å²	59.7	2%	0.017	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	143.4	176.8	0	0	0	0	0	109.6	Y188 A189 L190 A223 G224 P225	Y188-A203 HydrophobicContact CE2-CB 3.75Å; Y188-A203 WeakPolarHBondContact OH-CB 3.48Å; A189-A203 CarbonylContact O-C 3.58Å; A189-A203 WeakPolarHBondContact O-CA 3.27Å; L190-A203 HydrophobicContact CD2-CB 3.89Å; A203-A223 HydrophobicContact CB-CB 4.13Å; A203-A223 WeakPolarHBondContact CB-O 3.26Å; A203-A223 CarbonylContact O-C 3.58Å; A203-A223 WeakPolarHBondContact O-CA 3.4Å; A203-A223 PolarHBondContact O-N 2.92Å; A203-A223 VanDerWaalsContact O-O 3.04Å; A203-G224 VanDerWaalsContact CB-C 3.48Å; A203-G224 WeakPolarHBondContact CB-O 3.42Å; A203-P225 WeakPolarHBondContact CB-O 3.36Å
204	Y	95.3	Very high	93.4	Very high	55 Å²	55	65.2 Å²	65.2	22%	0.216	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	141.2	177.3	-58.5	-84	0	0	0	110.6	Y188 A189 M191 R202 L220 E221	Y188-Y204 WeakPolarHBondContact CD2-O 3.43Å; A189-Y204 PolarHBondContact N-O 2.88Å; A189-Y204 PolarHBondContact O-N 2.86Å; M191-Y204 HydrophobicContact CB-CD2 4.38Å; M191-Y204 HydrophobicContact CB-CE2 3.94Å; M191-Y204 HydrophobicContact CE-CE2 3.89Å; M191-Y204 WeakPolarHBondContact CE-OH 3.45Å; M191-Y204 HydrophobicContact SD-CE2 4.23Å; R202-Y204 HydrophobicContact CB-CE2 3.62Å; Y204-L220 HydrophobicContact CD1-CB 4.21Å; Y204-L220 HydrophobicContact CG-CB 4.39Å; Y204-E221 CarbonylContact C-O 3.57Å; Y204-E221 VanDerWaalsContact CA-O 3.24Å; Y204-E221 WeakPolarHBondContact CA-O 3.24Å
205	S	94.5	Very high	93.1	Very high	13 Å²	13	69.5 Å²	69.5	9%	0.091	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	133.8	163.6	-171.7	0	0	0	0	108.9	C139 E187 L220 E221	C139-S205 VanDerWaalsContact SG-CB 3.57Å; E187-S205 CarbonylContact O-C 3.55Å; E187-S205 WeakPolarHBondContact O-CA 3.49Å; S205-L220 WeakPolarHBondContact O-CA 3.15Å; S205-E221 PolarHBondContact N-O 2.92Å; S205-E221 PolarHBondContact O-N 2.8Å
206	I	94.1	Very high	92.9	Very high	18 Å²	18	69.2 Å²	69.2	9%	0.092	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.1	179.1	-61.8	166.6	0	0	0	108.5	I186 E187 A189 L208 V218 L220	I186-I206 HydrophobicContact CG2-CD1 3.82Å; E187-I206 PolarHBondContact O-N 2.87Å; A189-I206 HydrophobicContact CB-CD1 3.95Å; A189-I206 HydrophobicContact CB-CG1 4.2Å; I206-L208 HydrophobicContact CG2-CD2 3.89Å; I206-L208 HydrophobicContact CG2-CG 4.38Å; I206-V218 HydrophobicContact CG2-CG1 3.94Å; I206-L220 HydrophobicContact CB-CD2 4.48Å; I206-L220 HydrophobicContact CG1-CD2 3.74Å
207	H	92	Very high	93	Very high	70 Å²	70	66.1 Å²	66.1	32%	0.324	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.4	171.6	-62.2	-74.2	0	0	0	109.3	H219 E221	H207-H219 HydrophobicContact CB-CB 4.4Å; H207-H219 PolarHBondContact N-O 2.85Å; H207-H219 PolarHBondContact O-N 2.86Å; H207-E221 VanDerWaalsContact CD2-CD 3.46Å; H207-E221 IonicContact CD2-OE1 2.87Å; H207-E221 IonicContact CD2-OE2 2.99Å; H207-E221 IonicContact CE1-OE2 3.23Å; H207-E221 IonicContact NE2-OE1 3.99Å; H207-E221 IonicContact NE2-OE2 3.51Å; H207-E221 PolarHBondContact NE2-OE2 2.92Å
208	L	92	Very high	93.3	Very high	71 Å²	71	68 Å²	68	37%	0.372	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115	176.5	-57.1	179.5	0	0	0	108.7	I206 P216 V218	I206-L208 HydrophobicContact CG2-CD2 3.89Å; I206-L208 HydrophobicContact CG2-CG 4.38Å; L208-P216 HydrophobicContact CB-CB 4.09Å; L208-P216 HydrophobicContact CB-CG 4.28Å; L208-P216 HydrophobicContact CD1-CG 4.33Å; L208-P216 HydrophobicContact CD2-CG 4.15Å; L208-P216 HydrophobicContact CG-CG 4.49Å; L208-V218 HydrophobicContact CD2-CG2 3.98Å
209	K	91.2	Very high	93.2	Very high	109 Å²	109	68 Å²	68	47%	0.474	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	157.8	175.7	-65.9	-166.5	-161.2	153.7	0	111.3	P216 D217 H219	K209-P216 WeakPolarHBondContact O-CA 3.37Å; K209-P216 WeakPolarHBondContact O-CB 3.14Å; K209-D217 PolarHBondContact N-O 3.23Å; K209-D217 PolarHBondContact O-N 3.32Å; K209-H219 WeakPolarHBondContact CD-CD2 3.27Å; K209-H219 WeakPolarHBondContact CD-NE2 3.43Å; K209-H219 WeakPolarHBondContact CE-CD2 3.49Å; K209-H219 PolarHBondContact NZ-CD2 2.88Å; K209-H219 VanDerWaalsContact NZ-CD2 3.32Å; K209-H219 PolarHBondContact NZ-CE1 2.83Å; K209-H219 PolarHBondContact NZ-NE2 3.47Å; K209-H219 VanDerWaalsContact NZ-NE2 3.13Å
210	E	90.8	Very high	93.1	Very high	193 Å²	193	72.5 Å²	72.5	90%	0.902	39%	0.394	S	S	*	.			trans	-61.3	135.8	175.4	-171	172.3	-174.4	0	0	110.5
211	S	90.6	Very high	92.9	Very high	39 Å²	39	74.8 Å²	74.8	27%	0.273	40%	0.404	S	S	.	.			trans	-128	165.1	175.4	94.4	0	0	0	0	109.2	T213 V215	S211-T213 PolarHBondContact O-N 3.49Å; S211-T213 PolarHBondContact OG-N 2.95Å; S211-T213 VanDerWaalsContact OG-N 3.08Å; S211-T213 PolarHBondContact OG-O 2.91Å; S211-T213 PolarHBondContact OG-OG1 3.07Å; S211-T213 VanDerWaalsContact OG-OG1 3.09Å; S211-V215 WeakPolarHBondContact CB-O 3.49Å; S211-V215 PolarHBondContact OG-O 2.85Å
212	S	90.1	Very high	92.7	Very high	131 Å²	131	78.8 Å²	78.8	92%	0.916	43%	0.43	S	S	*	.	S	Bend	trans	-74.6	-2.9	175.2	55.5	0	0	0	0	114
213	T	92.1	Very high	92.6	Very high	94 Å²	94	76 Å²	76	58%	0.577	42%	0.419	S	S	*	.	S	Bend	trans	-115.1	176.7	-177.7	69.8	0	0	0	0	111.1	S211 V215	S211-T213 PolarHBondContact O-N 3.49Å; S211-T213 PolarHBondContact OG-N 2.95Å; S211-T213 VanDerWaalsContact OG-N 3.08Å; S211-T213 PolarHBondContact OG-O 2.91Å; S211-T213 PolarHBondContact OG-OG1 3.07Å; S211-T213 VanDerWaalsContact OG-OG1 3.09Å; T213-V215 PolarHBondContact O-N 2.81Å; T213-V215 PolarHBondContact OG1-N 2.8Å; T213-V215 PolarHBondContact OG1-O 2.8Å
214	T	90.6	Very high	92.3	Very high	148 Å²	148	76 Å²	76	91%	0.908	42%	0.42	S	S	*	.	S	Bend	trans	-68.9	-12.3	175	51.5	0	0	0	0	113.7
215	V	89.4	Confident	92.3	Very high	96 Å²	96	73.4 Å²	73.4	58%	0.582	41%	0.41	S	S	*	.	S	Bend	trans	-105.5	121.8	-179	-177	0	0	0	0	108.7	S211 T213	S211-V215 WeakPolarHBondContact CB-O 3.49Å; S211-V215 PolarHBondContact OG-O 2.85Å; T213-V215 PolarHBondContact O-N 2.81Å; T213-V215 PolarHBondContact OG1-N 2.8Å; T213-V215 PolarHBondContact OG1-O 2.8Å
216	P	91.6	Very high	92.4	Very high	51 Å²	51	73.6 Å²	73.6	33%	0.331	41%	0.411	S	S	.	.			trans	-65.4	152	179.4	28.3	-34.9	0	0	0	111.4	L208 K209	L208-P216 HydrophobicContact CB-CB 4.09Å; L208-P216 HydrophobicContact CB-CG 4.28Å; L208-P216 HydrophobicContact CD1-CG 4.33Å; L208-P216 HydrophobicContact CD2-CG 4.15Å; L208-P216 HydrophobicContact CG-CG 4.49Å; K209-P216 WeakPolarHBondContact O-CA 3.37Å; K209-P216 WeakPolarHBondContact O-CB 3.14Å
217	D	92.4	Very high	92.6	Very high	86 Å²	86	72.9 Å²	72.9	46%	0.46	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	134.7	173.8	-168.2	17	0	0	0	109.9	K209 H219	K209-D217 PolarHBondContact N-O 3.23Å; K209-D217 PolarHBondContact O-N 3.32Å; D217-H219 IonicContact OD2-CD2 3.79Å; D217-H219 IonicContact OD2-CE1 3.81Å; D217-H219 IonicContact OD2-NE2 3.97Å; D217-H219 PolarHBondContact OD2-NE2 2.74Å
218	V	93.2	Very high	92.8	Very high	78 Å²	78	70.1 Å²	70.1	47%	0.473	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	104.9	-169.6	-175.7	0	0	0	0	109.3	I206 L208 L220	I206-V218 HydrophobicContact CG2-CG1 3.94Å; L208-V218 HydrophobicContact CD2-CG2 3.98Å; V218-L220 HydrophobicContact CG1-CD2 4.23Å
219	H	93.2	Very high	93.1	Very high	70 Å²	70	66.9 Å²	66.9	32%	0.324	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.4	172.8	-72	-87.6	0	0	0	110.9	H207 K209 D217	H207-H219 HydrophobicContact CB-CB 4.4Å; H207-H219 PolarHBondContact N-O 2.85Å; H207-H219 PolarHBondContact O-N 2.86Å; K209-H219 WeakPolarHBondContact CD-CD2 3.27Å; K209-H219 WeakPolarHBondContact CD-NE2 3.43Å; K209-H219 WeakPolarHBondContact CE-CD2 3.49Å; K209-H219 PolarHBondContact NZ-CD2 2.88Å; K209-H219 VanDerWaalsContact NZ-CD2 3.32Å; K209-H219 PolarHBondContact NZ-CE1 2.83Å; K209-H219 PolarHBondContact NZ-NE2 3.47Å; K209-H219 VanDerWaalsContact NZ-NE2 3.13Å; D217-H219 IonicContact OD2-CD2 3.79Å; D217-H219 IonicContact OD2-CE1 3.81Å; D217-H219 IonicContact OD2-NE2 3.97Å; D217-H219 PolarHBondContact OD2-NE2 2.74Å
220	L	94	Very high	93.4	Very high	95 Å²	95	63.6 Å²	63.6	50%	0.497	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.2	177.1	-59.6	-179.1	0	0	0	110.2	Y204 S205 I206 V218	Y204-L220 HydrophobicContact CD1-CB 4.21Å; Y204-L220 HydrophobicContact CG-CB 4.39Å; S205-L220 WeakPolarHBondContact O-CA 3.15Å; I206-L220 HydrophobicContact CB-CD2 4.48Å; I206-L220 HydrophobicContact CG1-CD2 3.74Å; V218-L220 HydrophobicContact CG1-CD2 4.23Å
221	E	94.1	Very high	93.6	Very high	90 Å²	90	56 Å²	56	42%	0.421	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.7	169.9	-75.5	-177.6	172.6	0	0	110.1	Y204 S205 H207 A223	Y204-E221 CarbonylContact C-O 3.57Å; Y204-E221 VanDerWaalsContact CA-O 3.24Å; Y204-E221 WeakPolarHBondContact CA-O 3.24Å; S205-E221 PolarHBondContact N-O 2.92Å; S205-E221 PolarHBondContact O-N 2.8Å; H207-E221 VanDerWaalsContact CD2-CD 3.46Å; H207-E221 IonicContact CD2-OE1 2.87Å; H207-E221 IonicContact CD2-OE2 2.99Å; H207-E221 IonicContact CE1-OE2 3.23Å; H207-E221 IonicContact NE2-OE1 3.99Å; H207-E221 IonicContact NE2-OE2 3.51Å; H207-E221 PolarHBondContact NE2-OE2 2.92Å; E221-A223 PolarHBondContact O-N 2.8Å
222	P	94.1	Very high	93.9	Very high	85 Å²	85	57.5 Å²	57.5	55%	0.552	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.1	130.6	176.7	-25.2	34.4	0	0	0	112.3	F136	F136-P222 HydrophobicContact CD1-CB 4.29Å; F136-P222 WeakPolarHBondContact CD1-O 3.43Å; F136-P222 HydrophobicContact CE1-CB 4.09Å
223	A	94.1	Very high	94.2	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.008	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	173.7	179.4	0	0	0	0	0	111	F136 C139 I141 Y188 A203 E221	F136-A223 WeakPolarHBondContact CE1-O 3.41Å; F136-A223 VanDerWaalsContact CZ-O 3.25Å; F136-A223 WeakPolarHBondContact CZ-O 3.3Å; C139-A223 HydrophobicContact CB-CB 4.31Å; C139-A223 WeakPolarHBondContact SG-CB 3.3Å; I141-A223 HydrophobicContact CD1-CB 3.74Å; Y188-A223 HydrophobicContact CE2-CB 4.31Å; A203-A223 HydrophobicContact CB-CB 4.13Å; A203-A223 WeakPolarHBondContact CB-O 3.26Å; A203-A223 CarbonylContact O-C 3.58Å; A203-A223 WeakPolarHBondContact O-CA 3.4Å; A203-A223 PolarHBondContact O-N 2.92Å; A203-A223 VanDerWaalsContact O-O 3.04Å; E221-A223 PolarHBondContact O-N 2.8Å
224	G	90	Very high	94.4	Very high	2 Å²	2	53.7 Å²	53.7	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	168	172.9	0	0	0	0	0	113.8	I133 F136 Y188 A203	I133-G224 VanDerWaalsContact CG1-C 3.49Å; F136-G224 VanDerWaalsContact CD2-CA 3.49Å; F136-G224 VanDerWaalsContact CD2-N 3.3Å; F136-G224 VanDerWaalsContact CE2-CA 3.42Å; Y188-G224 PolarHBondContact OH-O 3.48Å; A203-G224 VanDerWaalsContact CB-C 3.48Å; A203-G224 WeakPolarHBondContact CB-O 3.42Å
225	P	95	Very high	94.6	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.013	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	cis	-76.8	149	-7.9	31.6	-32.3	0	0	0	111.7	N57 L61 F130 A131 Y188 A203	N57-P225 HydrophobicContact CB-CB 4.09Å; N57-P225 HydrophobicContact CB-CG 4.26Å; L61-P225 HydrophobicContact CD1-CG 3.86Å; F130-P225 HydrophobicContact CE2-CB 4.1Å; A131-P225 WeakPolarHBondContact O-CA 3.38Å; Y188-P225 WeakPolarHBondContact OH-CD 3.15Å; A203-P225 WeakPolarHBondContact CB-O 3.36Å
226	S	95.9	Very high	94.9	Very high	16 Å²	16	49 Å²	49	11%	0.112	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.8	170.5	170.6	0	0	0	0	109.1	F130 A131 V201 R202	F130-S226 CarbonylContact C-O 3.56Å; F130-S226 WeakPolarHBondContact CA-O 3.25Å; A131-S226 PolarHBondContact N-O 3.18Å; A131-S226 PolarHBondContact O-N 3.14Å; V201-S226 WeakPolarHBondContact O-CA 3.43Å; R202-S226 WeakPolarHBondContact CD-OG 3.33Å; R202-S226 PolarHBondContact NE-OG 2.74Å; R202-S226 PolarHBondContact NH1-OG 3.16Å
227	M	97.4	Very high	95	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.02	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	157.3	-180	56.7	-168.3	152.1	0	0	112.3	L58 V127 F130 V201 R202 L229	L58-M227 HydrophobicContact CD2-CE 4.22Å; V127-M227 HydrophobicContact CG1-CB 4.09Å; V127-M227 HydrophobicContact CG1-SD 4.47Å; F130-M227 HydrophobicContact CD2-CB 4.06Å; F130-M227 HydrophobicContact CD2-SD 4.39Å; V201-M227 WeakPolarHBondContact CA-O 3.36Å; V201-M227 HydrophobicContact CB-CE 4.38Å; V201-M227 HydrophobicContact CB-CG 3.92Å; V201-M227 HydrophobicContact CG1-CE 4.18Å; V201-M227 HydrophobicContact CG2-CG 4.29Å; V201-M227 PolarHBondContact N-O 2.86Å; V201-M227 PolarHBondContact O-N 2.72Å; R202-M227 PolarHBondContact NH1-O 3.48Å; M227-L229 HydrophobicContact CG-CD2 4.12Å; M227-L229 HydrophobicContact CG-CG 4.45Å; M227-L229 HydrophobicContact SD-CD2 4Å
228	D	97.8	Very high	95.2	Very high	11 Å²	11	46.3 Å²	46.3	6%	0.059	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.4	173.4	-59.6	-13.6	0	0	0	108.6	V127 E128 N129 L200 R202	V127-D228 WeakPolarHBondContact CA-O 3.34Å; E128-D228 HydrophobicContact CB-CB 4.11Å; E128-D228 PolarHBondContact N-O 2.85Å; E128-D228 PolarHBondContact O-N 3.18Å; N129-D228 WeakPolarHBondContact CB-OD2 3.43Å; N129-D228 PolarHBondContact ND2-OD2 2.64Å; L200-D228 HydrophobicContact CD2-CB 4Å; L200-D228 VanDerWaalsContact CD2-CG 3.46Å; L200-D228 VanDerWaalsContact CD2-OD1 3.26Å; L200-D228 WeakPolarHBondContact CD2-OD1 3.48Å; R202-D228 IonicContact CZ-OD1 2.75Å; R202-D228 IonicContact NH1-OD1 2.7Å; R202-D228 PolarHBondContact NH1-OD1 2.88Å; R202-D228 IonicContact NH2-OD1 3.83Å; R202-D228 PolarHBondContact NH2-OD1 2.83Å; R202-D228 IonicContact NH2-OD2 3.37Å
229	L	97.7	Very high	95.2	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	104.2	-179.6	-58.3	-179.1	0	0	0	109.3	L109 F125 V127 K198 V199 V201 M227 V231	L109-L229 HydrophobicContact CD2-CD2 4.22Å; F125-L229 HydrophobicContact CB-CB 4.23Å; F125-L229 HydrophobicContact CB-CD2 4.13Å; F125-L229 HydrophobicContact CD1-CB 3.88Å; F125-L229 HydrophobicContact CD1-CD1 4.46Å; F125-L229 HydrophobicContact CG-CB 4.22Å; F125-L229 HydrophobicContact CG-CD1 4.46Å; V127-L229 HydrophobicContact CG2-CD2 4.01Å; K198-L229 CarbonylContact C-O 3.6Å; K198-L229 WeakPolarHBondContact CA-O 3.45Å; V199-L229 HydrophobicContact CB-CB 4.28Å; V199-L229 PolarHBondContact N-O 3.19Å; V199-L229 WeakPolarHBondContact O-CB 3.5Å; V199-L229 PolarHBondContact O-N 2.98Å; V201-L229 HydrophobicContact CG2-CD1 3.6Å; V201-L229 HydrophobicContact CG2-CG 3.92Å; M227-L229 HydrophobicContact CG-CD2 4.12Å; M227-L229 HydrophobicContact CG-CG 4.45Å; M227-L229 HydrophobicContact SD-CD2 4Å; L229-V231 PolarHBondContact O-N 2.83Å
230	I	97	Very high	95.3	Very high	40 Å²	40	48.2 Å²	48.2	21%	0.205	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	118.7	169.3	-59.7	173.3	0	0	0	108.3	F125 G126 E128 K198 R232	F125-I230 CarbonylContact C-O 3.55Å; F125-I230 VanDerWaalsContact CA-O 3.23Å; F125-I230 WeakPolarHBondContact CA-O 3.32Å; G126-I230 PolarHBondContact N-O 2.81Å; G126-I230 PolarHBondContact O-N 2.93Å; E128-I230 HydrophobicContact CG-CD1 3.82Å; E128-I230 HydrophobicContact CG-CG1 4.44Å; E128-I230 WeakPolarHBondContact OE1-CD1 3.48Å; E128-I230 VanDerWaalsContact OE2-CD1 3.27Å; E128-I230 WeakPolarHBondContact OE2-CD1 3.26Å; K198-I230 HydrophobicContact CD-CG1 3.93Å; K198-I230 HydrophobicContact CG-CG1 4.08Å; I230-R232 PolarHBondContact O-N 2.97Å
231	V	96	Very high	95.4	Very high	34 Å²	34	46.9 Å²	46.9	21%	0.206	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127	175.3	-173.6	0	0	0	0	109.5	F125 F162 M165 G197 V199 L229	F125-V231 HydrophobicContact CD1-CG2 4.5Å; F125-V231 HydrophobicContact CE1-CG2 4.24Å; F162-V231 HydrophobicContact CZ-CG2 4.17Å; M165-V231 HydrophobicContact CE-CG2 4.02Å; M165-V231 HydrophobicContact SD-CG2 3.98Å; G197-V231 WeakPolarHBondContact O-CG2 3.4Å; V199-V231 HydrophobicContact CG2-CG2 4.39Å; L229-V231 PolarHBondContact O-N 2.83Å
232	R	95.5	Very high	95.4	Very high	69 Å²	69	44.7 Å²	44.7	26%	0.26	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-120.4	178.2	-64.2	176.9	172.9	161.2	2.3	109.9	P106 N108 E124 I230	P106-R232 PolarHBondContact O-NH1 2.89Å; P106-R232 PolarHBondContact O-NH2 3.39Å; N108-R232 PolarHBondContact OD1-NH1 2.91Å; E124-R232 HydrophobicContact CB-CB 4.07Å; E124-R232 HydrophobicContact CG-CB 3.99Å; E124-R232 WeakPolarHBondContact O-CB 3.29Å; E124-R232 PolarHBondContact O-N 3Å; I230-R232 PolarHBondContact O-N 2.97Å
233	R	96.5	Very high	95.5	Very high	84 Å²	84	48 Å²	48	32%	0.317	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	149	177.3	-66.6	177.4	-68.8	171.7	6.3	110.6	F78 R105 E124	F78-R233 HydrophobicContact CD1-CB 3.99Å; F78-R233 HydrophobicContact CE1-CB 3.58Å; F78-R233 HydrophobicContact CE2-CB 4.37Å; F78-R233 HydrophobicContact CZ-CB 3.8Å; F78-R233 WeakPolarHBondContact CZ-O 2.85Å; R105-R233 VanDerWaalsContact NE-NH2 3.16Å; R105-R233 VanDerWaalsContact NH2-NE 3.17Å; E124-R233 HydrophobicContact CB-CB 4.29Å; E124-R233 VanDerWaalsContact CB-O 3.27Å; E124-R233 WeakPolarHBondContact CB-O 3.41Å; E124-R233 VanDerWaalsContact CD-NH2 3.33Å; E124-R233 PolarHBondContact N-O 3.38Å; E124-R233 IonicContact OE1-CZ 2.6Å; E124-R233 IonicContact OE1-NE 3.19Å; E124-R233 IonicContact OE1-NH2 3.89Å; E124-R233 PolarHBondContact OE1-NH2 2.87Å; E124-R233 IonicContact OE2-CZ 2.63Å; E124-R233 IonicContact OE2-NE 3.77Å; E124-R233 PolarHBondContact OE2-NE 3.09Å; E124-R233 IonicContact OE2-NH2 3.83Å; E124-R233 PolarHBondContact OE2-NH2 3.09Å
234	N	96.5	Very high	95.5	Very high	61 Å²	61	51.3 Å²	51.3	33%	0.326	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.3	172.5	56.6	-16.6	0	0	0	109.3	M122 F123 V161 I236	M122-N234 CarbonylContact O-C 3.6Å; M122-N234 WeakPolarHBondContact O-CA 3.43Å; F123-N234 HydrophobicContact CD1-CB 3.74Å; F123-N234 HydrophobicContact CE1-CB 3.85Å; F123-N234 HydrophobicContact CG-CB 4.38Å; V161-N234 VanDerWaalsContact CG1-ND2 3.3Å; V161-N234 WeakPolarHBondContact CG1-ND2 3.41Å; N234-I236 HydrophobicContact CB-CG1 4.36Å; N234-I236 WeakPolarHBondContact ND2-CD1 3.44Å
235	K	96	Very high	95.7	Very high	89 Å²	89	52.6 Å²	52.6	39%	0.387	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	108.9	166.9	-175.6	175.9	-179.9	-180	0	105.8	F78 E81 D121 M122	F78-K235 HydrophobicContact CE1-CB 4.3Å; E81-K235 IonicContact OE1-NZ 3.48Å; E81-K235 PolarHBondContact OE1-NZ 2.9Å; E81-K235 IonicContact OE2-NZ 3.71Å; E81-K235 PolarHBondContact OE2-NZ 3.35Å; D121-K235 CarbonylContact C-O 3.59Å; D121-K235 WeakPolarHBondContact CA-O 3.36Å; D121-K235 WeakPolarHBondContact CB-O 3.32Å; M122-K235 HydrophobicContact CE-CD 3.96Å; M122-K235 HydrophobicContact CG-CB 3.8Å; M122-K235 PolarHBondContact N-O 3.02Å; M122-K235 PolarHBondContact O-N 2.88Å
236	I	95.2	Very high	95.6	Very high	57 Å²	57	55.7 Å²	55.7	29%	0.292	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.5	-175.9	-59.4	176.9	0	0	0	108	F123 V161 R164 N234	F123-I236 HydrophobicContact CE1-CD1 4.39Å; F123-I236 HydrophobicContact CZ-CD1 4.07Å; F123-I236 HydrophobicContact CZ-CG1 3.96Å; V161-I236 HydrophobicContact CB-CD1 4.43Å; V161-I236 HydrophobicContact CG1-CD1 4.41Å; V161-I236 HydrophobicContact CG2-CD1 4.11Å; R164-I236 HydrophobicContact CB-CD1 4.32Å; R164-I236 HydrophobicContact CB-CG2 4.39Å; R164-I236 HydrophobicContact CG-CD1 4.49Å; R164-I236 HydrophobicContact CG-CG2 3.9Å; N234-I236 HydrophobicContact CB-CG1 4.36Å; N234-I236 WeakPolarHBondContact ND2-CD1 3.44Å
237	A	94.1	Very high	95.4	Very high	12 Å²	12	63 Å²	63	10%	0.099	33%	0.327	C	S	.	.			trans	-59.1	147.3	172.5	0	0	0	0	0	112.5	L120 R164 L241	L120-A237 HydrophobicContact CD1-CB 3.6Å; L120-A237 HydrophobicContact CG-CB 4.04Å; L120-A237 WeakPolarHBondContact O-CA 3.46Å; L120-A237 WeakPolarHBondContact O-CB 3.5Å; L120-A237 PolarHBondContact O-N 3.36Å; R164-A237 PolarHBondContact NH1-O 3.37Å; R164-A237 PolarHBondContact NH2-O 3.34Å; A237-L241 HydrophobicContact CB-CB 4.36Å; A237-L241 HydrophobicContact CB-CD2 3.97Å; A237-L241 HydrophobicContact CB-CG 4.37Å
238	S	95.3	Very high	94.9	Very high	69 Å²	69	66.5 Å²	66.5	48%	0.483	35%	0.349	S	S	.	.			trans	-53.4	151	168.1	62.5	0	0	0	0	111.5	S240 L241 Y242	S238-S240 PolarHBondContact O-N 3.12Å; S238-S240 PolarHBondContact OG-OG 2.78Å; S238-L241 PolarHBondContact O-N 2.99Å; S238-L241 WeakPolarHBondContact OG-CB 3.43Å; S238-Y242 PolarHBondContact O-N 2.87Å
239	D	93.6	Very high	94.5	Very high	105 Å²	105	68.9 Å²	68.9	56%	0.561	36%	0.364	S	S	*	.	H	α-helix	trans	-63.2	-30.5	-177.3	-72.1	-24.9	0	0	0	113	R164 K243	R164-D239 IonicContact NH2-OD1 2.79Å; R164-D239 PolarHBondContact NH2-OD1 3.42Å; D239-K243 VanDerWaalsContact O-CB 3.27Å; D239-K243 WeakPolarHBondContact O-CB 3.39Å; D239-K243 WeakPolarHBondContact O-CD 3.5Å; D239-K243 WeakPolarHBondContact O-CG 3.43Å; D239-K243 PolarHBondContact O-N 2.77Å
240	S	95.9	Very high	93.9	Very high	82 Å²	82	73.7 Å²	73.7	57%	0.573	40%	0.398	S	S	*	.	H	α-helix	trans	-66.2	-45.8	175.4	56.6	0	0	0	0	111.8	S238 K243 T244	S238-S240 PolarHBondContact O-N 3.12Å; S238-S240 PolarHBondContact OG-OG 2.78Å; S240-K243 PolarHBondContact O-N 2.65Å; S240-T244 PolarHBondContact O-N 3.26Å; S240-T244 PolarHBondContact O-OG1 3.3Å
241	L	95	Very high	93.3	Very high	68 Å²	68	75.4 Å²	75.4	36%	0.356	42%	0.419	S	S	.	.	H	α-helix	trans	-65.9	-43.8	177.5	-176.3	63.3	0	0	0	110.6	Y115 L120 A237 S238 K243 T244 A245	Y115-L241 HydrophobicContact CD1-CD1 4.21Å; Y115-L241 HydrophobicContact CE1-CD1 4.43Å; L120-L241 HydrophobicContact CD1-CD2 4.06Å; L120-L241 HydrophobicContact CD1-CG 3.87Å; A237-L241 HydrophobicContact CB-CB 4.36Å; A237-L241 HydrophobicContact CB-CD2 3.97Å; A237-L241 HydrophobicContact CB-CG 4.37Å; S238-L241 PolarHBondContact O-N 2.99Å; S238-L241 WeakPolarHBondContact OG-CB 3.43Å; L241-K243 PolarHBondContact O-N 3.44Å; L241-T244 WeakPolarHBondContact O-CB 3.42Å; L241-T244 PolarHBondContact O-N 3.42Å; L241-T244 VanDerWaalsContact O-N 3.16Å; L241-A245 PolarHBondContact O-N 2.85Å
242	Y	95.1	Very high	92.6	Very high	44 Å²	44	77.3 Å²	77.3	17%	0.173	43%	0.431	C	S	.	.	H	α-helix	trans	-63.2	-42.7	177.4	-170.6	-106	0	0	0	112.4	L120 R164 S167 S238 T244 A245 C246	L120-Y242 HydrophobicContact CD2-CD2 4.16Å; R164-Y242 VanDerWaalsContact CZ-CD1 3.5Å; S167-Y242 PolarHBondContact OG-OH 3Å; S238-Y242 PolarHBondContact O-N 2.87Å; Y242-T244 VanDerWaalsContact C-N 3.27Å; Y242-T244 PolarHBondContact O-N 2.84Å; Y242-A245 PolarHBondContact O-N 3.33Å; Y242-C246 PolarHBondContact O-N 3.13Å; Y242-C246 PolarHBondContact O-SG 3.38Å; Y242-C246 VanDerWaalsContact O-SG 3.4Å
243	K	95.5	Very high	91.7	Very high	153 Å²	153	79.9 Å²	79.9	67%	0.665	44%	0.444	S	S	*	.	H	α-helix	trans	-60.3	-38.4	173.6	-77.4	170.8	-174.2	177.4	0	112.1	D239 S240 L241 C246 K247	D239-K243 VanDerWaalsContact O-CB 3.27Å; D239-K243 WeakPolarHBondContact O-CB 3.39Å; D239-K243 WeakPolarHBondContact O-CD 3.5Å; D239-K243 WeakPolarHBondContact O-CG 3.43Å; D239-K243 PolarHBondContact O-N 2.77Å; S240-K243 PolarHBondContact O-N 2.65Å; L241-K243 PolarHBondContact O-N 3.44Å; K243-C246 PolarHBondContact O-N 3.36Å; K243-K247 PolarHBondContact O-N 2.78Å
244	T	94.9	Very high	90.8	Very high	72 Å²	72	81.4 Å²	81.4	44%	0.442	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-44.4	176.4	-55.7	0	0	0	0	110.7	S240 L241 Y242 C246 K247	S240-T244 PolarHBondContact O-N 3.26Å; S240-T244 PolarHBondContact O-OG1 3.3Å; L241-T244 WeakPolarHBondContact O-CB 3.42Å; L241-T244 PolarHBondContact O-N 3.42Å; L241-T244 VanDerWaalsContact O-N 3.16Å; Y242-T244 VanDerWaalsContact C-N 3.27Å; Y242-T244 PolarHBondContact O-N 2.84Å; T244-C246 VanDerWaalsContact C-N 3.29Å; T244-C246 PolarHBondContact O-N 3.4Å; T244-K247 VanDerWaalsContact O-CB 3.25Å; T244-K247 WeakPolarHBondContact O-CB 3.32Å; T244-K247 PolarHBondContact O-N 3.2Å
245	A	94.1	Very high	89.9	Confident	29 Å²	29	87.7 Å²	87.7	24%	0.24	49%	0.489	C	S	.	.	H	α-helix	trans	-64	-30.7	176	0	0	0	0	0	113.4	Y115 L120 L241 Y242	Y115-A245 HydrophobicContact CD1-CB 4.29Å; Y115-A245 HydrophobicContact CD2-CB 3.58Å; Y115-A245 HydrophobicContact CE1-CB 4.48Å; Y115-A245 HydrophobicContact CE2-CB 3.83Å; Y115-A245 HydrophobicContact CG-CB 3.83Å; L120-A245 HydrophobicContact CD1-CB 4.09Å; L120-A245 HydrophobicContact CD2-CB 4.01Å; L241-A245 PolarHBondContact O-N 2.85Å; Y242-A245 PolarHBondContact O-N 3.33Å
246	C	92.4	Very high	89.1	Confident	66 Å²	66	93.3 Å²	93.3	45%	0.446	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	6.6	177.4	-66.9	0	0	0	0	114.3	Y242 K243 T244 V248	Y242-C246 PolarHBondContact O-N 3.13Å; Y242-C246 PolarHBondContact O-SG 3.38Å; Y242-C246 VanDerWaalsContact O-SG 3.4Å; K243-C246 PolarHBondContact O-N 3.36Å; T244-C246 VanDerWaalsContact C-N 3.29Å; T244-C246 PolarHBondContact O-N 3.4Å; C246-V248 PolarHBondContact O-N 2.81Å
247	K	92	Very high	88.5	Confident	170 Å²	170	97 Å²	97	74%	0.739	53%	0.531	S	S	*	.			trans	-69.8	114.1	-176.5	-174	178.7	-179.6	179.6	0	111.1	K243 T244	K243-K247 PolarHBondContact O-N 2.78Å; T244-K247 VanDerWaalsContact O-CB 3.25Å; T244-K247 WeakPolarHBondContact O-CB 3.32Å; T244-K247 PolarHBondContact O-N 3.2Å
248	V	87.8	Confident	88.3	Confident	78 Å²	78	105 Å²	105	47%	0.473	56%	0.563	S	S	.	*			trans	-77.9	124.7	174.2	-178.3	0	0	0	0	110.4	C246 K253	C246-V248 PolarHBondContact O-N 2.81Å; V248-K253 HydrophobicContact CG1-CG 4.21Å
249	P	88.6	Confident	87.9	Confident	60 Å²	60	105.2 Å²	105.2	39%	0.39	56%	0.559	S	S	.	*			trans	-58.3	140.6	178.1	-24.1	33.3	0	0	0	112.6	L32 A251 V252	L32-P249 HydrophobicContact CD1-CB 3.68Å; L32-P249 HydrophobicContact CD1-CG 4.17Å; P249-A251 PolarHBondContact O-N 2.98Å; P249-V252 HydrophobicContact CB-CG2 4.35Å; P249-V252 PolarHBondContact O-N 3.4Å
250	S	84.6	Confident	87.7	Confident	105 Å²	105	103 Å²	103	73%	0.734	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.7	-179.5	53.2	0	0	0	0	113.2	V252 K253	S250-V252 VanDerWaalsContact C-N 3.28Å; S250-V252 PolarHBondContact O-N 3.41Å; S250-K253 PolarHBondContact O-N 3.22Å
251	A	84.5	Confident	87.3	Confident	77 Å²	77	105.4 Å²	105.4	64%	0.636	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-22.5	178.3	0	0	0	0	0	113.8	L32 P249	L32-A251 HydrophobicContact CD1-CB 3.83Å; L32-A251 HydrophobicContact CD2-CB 4.13Å; P249-A251 PolarHBondContact O-N 2.98Å
252	V	81.6	Confident	87.1	Confident	74 Å²	74	109.3 Å²	109.3	45%	0.448	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.1	-25.9	173.4	-176.8	0	0	0	0	111.1	L32 P249 S250	L32-V252 HydrophobicContact CD1-CG2 3.85Å; L32-V252 HydrophobicContact CD2-CG2 3.89Å; L32-V252 HydrophobicContact CG-CG2 3.54Å; P249-V252 HydrophobicContact CB-CG2 4.35Å; P249-V252 PolarHBondContact O-N 3.4Å; S250-V252 VanDerWaalsContact C-N 3.28Å; S250-V252 PolarHBondContact O-N 3.41Å
253	K	77.7	Confident	86.7	Confident	123 Å²	123	109.8 Å²	109.8	54%	0.535	57%	0.574	S	S	.	*	S	Bend	trans	-76.2	124.9	-178.6	-66.1	-174.3	-177.5	-177.8	0	109.6	V248 S250 K255	V248-K253 HydrophobicContact CG1-CG 4.21Å; S250-K253 PolarHBondContact O-N 3.22Å; K253-K255 PolarHBondContact O-N 3.03Å
254	P	76.9	Confident	86.5	Confident	115 Å²	115	109.2 Å²	109.2	75%	0.747	58%	0.583	S	S	*	*			trans	-60.9	125.1	174.4	24	-31.5	0	0	0	109.3	K256	P254-K256 PolarHBondContact O-N 2.85Å
255	K	78.2	Confident	86.2	Confident	194 Å²	194	114.5 Å²	114.5	84%	0.843	60%	0.6	S	S	*	*			trans	-68	103.3	175	-77.7	-176.1	179.1	177.9	0	108.5	K253 M257	K253-K255 PolarHBondContact O-N 3.03Å; K255-M257 PolarHBondContact O-N 2.99Å; K255-M257 VanDerWaalsContact O-N 3.14Å
256	K	78.1	Confident	85.9	Confident	206 Å²	206	115.2 Å²	115.2	90%	0.896	61%	0.61	S	S	*	*			trans	-68.5	109.2	169.2	-72.3	-171.2	176.6	-174.5	0	108.9	P254	P254-K256 PolarHBondContact O-N 2.85Å
257	M	83.4	Confident	85.8	Confident	136 Å²	136	115.8 Å²	115.8	67%	0.67	61%	0.612	S	S	*	*			trans	-87.9	120.1	168.6	-74.9	-175.5	154.4	0	0	108.8	K255 T260	K255-M257 PolarHBondContact O-N 2.99Å; K255-M257 VanDerWaalsContact O-N 3.14Å; M257-T260 PolarHBondContact O-N 2.88Å
258	K	89	Confident	85.7	Confident	180 Å²	180	111.6 Å²	111.6	78%	0.783	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	141.8	-179.9	-171.4	179.5	179.3	-179.1	0	109.9	T260	K258-T260 PolarHBondContact O-N 3.31Å; K258-T260 VanDerWaalsContact O-N 3.08Å; K258-T260 PolarHBondContact O-OG1 2.92Å
259	N	87.2	Confident	85.7	Confident	73 Å²	73	115.5 Å²	115.5	39%	0.39	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	57.8	17.7	179.3	-52.5	-20.9	0	0	0	114.7	G270 R271	N259-G270 CarbonylContact O-C 3.57Å; N259-G270 VanDerWaalsContact O-CA 3.29Å; N259-G270 WeakPolarHBondContact O-CA 3.27Å; N259-R271 HydrophobicContact CB-CB 4.45Å; N259-R271 PolarHBondContact O-N 3.41Å
260	T	88.7	Confident	85.8	Confident	58 Å²	58	115.6 Å²	115.6	36%	0.356	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.2	122	179.9	-50.9	0	0	0	0	108.2	M257 K258 T268 R269	M257-T260 PolarHBondContact O-N 2.88Å; K258-T260 PolarHBondContact O-N 3.31Å; K258-T260 VanDerWaalsContact O-N 3.08Å; K258-T260 PolarHBondContact O-OG1 2.92Å; T260-T268 HydrophobicContact CG2-CG2 3.29Å; T260-R269 WeakPolarHBondContact CA-O 3.48Å
261	E	89.1	Confident	86.1	Confident	132 Å²	132	118.3 Å²	118.3	62%	0.617	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.9	142	178.9	-68.4	174.7	-170	0	0	108.7	T268 R269	E261-T268 CarbonylContact O-C 3.58Å; E261-R269 PolarHBondContact N-O 2.7Å; E261-R269 PolarHBondContact O-N 2.75Å
262	Q	89.1	Confident	86.4	Confident	150 Å²	150	121.6 Å²	121.6	70%	0.701	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.6	127.4	170.8	-78.9	-176.9	-15.6	0	0	108.7	T267	Q262-T267 WeakPolarHBondContact CA-O 3.32Å
263	D	88	Confident	86.8	Confident	55 Å²	55	123.8 Å²	123.8	29%	0.294	62%	0.623	S	S	.	*			trans	-69.8	166.9	173.7	-158.9	-9.4	0	0	0	110.7	F265 G266 T267 R269	D263-F265 PolarHBondContact O-N 3.06Å; D263-F265 VanDerWaalsContact O-N 3.12Å; D263-G266 PolarHBondContact O-N 2.87Å; D263-T267 PolarHBondContact N-O 3.05Å; D263-R269 IonicContact OD2-CZ 3.69Å; D263-R269 IonicContact OD2-NH2 3.24Å; D263-R269 PolarHBondContact OD2-NH2 2.86Å
264	V	89.9	Confident	87.5	Confident	141 Å²	141	124 Å²	124	86%	0.855	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-27.4	177.5	-165.9	0	0	0	0	111.5	G266	V264-G266 VanDerWaalsContact C-N 3.31Å
265	F	89.9	Confident	88.1	Confident	182 Å²	182	127.6 Å²	127.6	80%	0.798	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	2.5	175.6	-56.7	-72.3	0	0	0	114.2	D263 T267	D263-F265 PolarHBondContact O-N 3.06Å; D263-F265 VanDerWaalsContact O-N 3.12Å; F265-T267 VanDerWaalsContact C-N 3.29Å; F265-T267 PolarHBondContact O-N 2.87Å
266	G	87	Confident	88.6	Confident	44 Å²	44	127.6 Å²	127.6	45%	0.454	64%	0.641	S	S	.	*			trans	82.1	-1.2	-178.2	0	0	0	0	0	114.9	D263 V264 T268	D263-G266 PolarHBondContact O-N 2.87Å; V264-G266 VanDerWaalsContact C-N 3.31Å; G266-T268 PolarHBondContact O-N 2.98Å
267	T	89.9	Confident	89.1	Confident	79 Å²	79	124.6 Å²	124.6	49%	0.485	63%	0.63	S	S	.	*			trans	-67.4	126	177	-47.8	0	0	0	0	110.4	Q262 D263 F265	Q262-T267 WeakPolarHBondContact CA-O 3.32Å; D263-T267 PolarHBondContact N-O 3.05Å; F265-T267 VanDerWaalsContact C-N 3.29Å; F265-T267 PolarHBondContact O-N 2.87Å
268	T	91	Very high	89.3	Confident	82 Å²	82	122 Å²	122	50%	0.503	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.8	121.3	-179.8	-56.5	0	0	0	0	110.1	T260 E261 G266	T260-T268 HydrophobicContact CG2-CG2 3.29Å; E261-T268 CarbonylContact O-C 3.58Å; G266-T268 PolarHBondContact O-N 2.98Å
269	R	88.2	Confident	89.2	Confident	160 Å²	160	118.9 Å²	118.9	60%	0.604	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.7	131.5	177.4	-65.2	-175.2	-177.9	177.9	6.6	110.2	T260 E261 D263	T260-R269 WeakPolarHBondContact CA-O 3.48Å; E261-R269 PolarHBondContact N-O 2.7Å; E261-R269 PolarHBondContact O-N 2.75Å; D263-R269 IonicContact OD2-CZ 3.69Å; D263-R269 IonicContact OD2-NH2 3.24Å; D263-R269 PolarHBondContact OD2-NH2 2.86Å
270	G	90.8	Very high	89.2	Confident	61 Å²	61	123.3 Å²	123.3	63%	0.629	64%	0.638	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.2	124.9	172.9	0	0	0	0	0	110.9	N259	N259-G270 CarbonylContact O-C 3.57Å; N259-G270 VanDerWaalsContact O-CA 3.29Å; N259-G270 WeakPolarHBondContact O-CA 3.27Å
271	R	90.8	Very high	89.1	Confident	162 Å²	162	125.8 Å²	125.8	61%	0.611	65%	0.653	S	S	*	*			trans	-85.8	112.5	174.7	-164	169.3	-172.8	167.6	0.8	110.1	N259	N259-R271 HydrophobicContact CB-CB 4.45Å; N259-R271 PolarHBondContact O-N 3.41Å
272	I	90.9	Very high	89	Confident	147 Å²	147	124.4 Å²	124.4	75%	0.754	65%	0.65	S	S	*	*			trans	-89.5	116.4	172.7	-57.9	174.8	0	0	0	108	V274	I272-V274 HydrophobicContact CG2-CG2 3.97Å; I272-V274 PolarHBondContact O-N 2.83Å
273	H	89.8	Confident	88.8	Confident	119 Å²	119	127.1 Å²	127.1	55%	0.551	66%	0.659	S	S	*	*			trans	-89.9	92.4	173.2	-67.2	-78.3	0	0	0	109.2	K275	H273-K275 PolarHBondContact O-N 3.41Å
274	V	91.1	Very high	88.7	Confident	129 Å²	129	131.1 Å²	131.1	78%	0.782	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-72.5	122.1	173.7	-174.7	0	0	0	0	108.2	I272	I272-V274 HydrophobicContact CG2-CG2 3.97Å; I272-V274 PolarHBondContact O-N 2.83Å
275	K	90.1	Very high	88.4	Confident	190 Å²	190	128.5 Å²	128.5	83%	0.826	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-67.1	144.9	173.2	-68.4	-176.2	178.6	-178.9	0	109.2	H273 Q277	H273-K275 PolarHBondContact O-N 3.41Å; K275-Q277 PolarHBondContact O-N 3.24Å
276	Q	89.3	Confident	88.1	Confident	193 Å²	193	128.5 Å²	128.5	90%	0.902	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-58.4	122.9	173.1	-171.4	173.2	4.9	0	0	109.5
277	Q	87.3	Confident	88	Confident	144 Å²	144	131.4 Å²	131.4	67%	0.673	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-84.2	123.5	-179.5	-173.7	176.3	3.7	0	0	109.7	K275 L279	K275-Q277 PolarHBondContact O-N 3.24Å; Q277-L279 PolarHBondContact O-N 2.84Å; Q277-L279 VanDerWaalsContact O-N 3.14Å
278	P	88.2	Confident	87.6	Confident	81 Å²	81	136.8 Å²	136.8	53%	0.526	69%	0.689	S	S	.	*			trans	-74.9	102.4	176.8	28.8	-32.6	0	0	0	110.8	D280 T281	P278-D280 VanDerWaalsContact C-N 3.28Å; P278-D280 PolarHBondContact O-N 3.16Å; P278-T281 PolarHBondContact O-OG1 3.11Å
279	L	86.9	Confident	87.1	Confident	115 Å²	115	136.6 Å²	136.6	60%	0.602	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-73.3	-17.3	-178.8	-65.8	175.1	0	0	0	113.6	Q277 T281 L282	Q277-L279 PolarHBondContact O-N 2.84Å; Q277-L279 VanDerWaalsContact O-N 3.14Å; L279-T281 PolarHBondContact O-N 2.91Å; L279-T281 VanDerWaalsContact O-N 3.14Å; L279-L282 WeakPolarHBondContact O-CB 3.11Å; L279-L282 PolarHBondContact O-N 3.3Å
280	D	87.4	Confident	86.6	Confident	165 Å²	165	135.5 Å²	135.5	88%	0.882	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-63.9	-21.2	179.4	-54.7	-34.7	0	0	0	112.7	P278 L282	P278-D280 VanDerWaalsContact C-N 3.28Å; P278-D280 PolarHBondContact O-N 3.16Å; D280-L282 VanDerWaalsContact C-N 3.31Å
281	T	87.5	Confident	86	Confident	110 Å²	110	139 Å²	139	68%	0.675	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-83.3	-8.2	176.6	63.2	0	0	0	0	113.3	P278 L279 K283	P278-T281 PolarHBondContact O-OG1 3.11Å; L279-T281 PolarHBondContact O-N 2.91Å; L279-T281 VanDerWaalsContact O-N 3.14Å; T281-K283 PolarHBondContact O-N 3.37Å; T281-K283 VanDerWaalsContact O-N 3.12Å
282	L	86	Confident	85.3	Confident	104 Å²	104	135.9 Å²	135.9	55%	0.545	72%	0.716	S	S	.	*			trans	-77.1	99.5	-175.2	-162.3	86.5	0	0	0	110.7	L279 D280 L284	L279-L282 WeakPolarHBondContact O-CB 3.11Å; L279-L282 PolarHBondContact O-N 3.3Å; D280-L282 VanDerWaalsContact C-N 3.31Å; L282-L284 HydrophobicContact CD2-CD2 3.89Å; L282-L284 PolarHBondContact O-N 3.45Å
283	K	84.2	Confident	84.3	Confident	206 Å²	206	140.3 Å²	140.3	90%	0.896	72%	0.723	S	S	*	*			trans	-73.5	105.5	171.2	-70.8	-179.3	-179.3	175	0	110.2	T281	T281-K283 PolarHBondContact O-N 3.37Å; T281-K283 VanDerWaalsContact O-N 3.12Å
284	L	86	Confident	83.3	Confident	139 Å²	139	142.4 Å²	142.4	73%	0.728	74%	0.736	S	S	*	*			trans	-70.5	145.5	173.1	-65	174.4	0	0	0	111.6	L282 K286	L282-L284 HydrophobicContact CD2-CD2 3.89Å; L282-L284 PolarHBondContact O-N 3.45Å; L284-K286 PolarHBondContact O-N 3.15Å
285	S	85	Confident	82	Confident	87 Å²	87	145.6 Å²	145.6	61%	0.608	74%	0.74	S	S	*	*			trans	-63.3	127.1	172.8	179.8	0	0	0	0	110.6	L287	S285-L287 PolarHBondContact O-N 2.77Å
286	K	82.9	Confident	80.6	Confident	181 Å²	181	145.4 Å²	145.4	79%	0.787	74%	0.739	S	S	*	*			trans	-81.2	67	178.7	-67.4	-178.6	178.7	179.7	0	111.1	L284	L284-K286 PolarHBondContact O-N 3.15Å
287	L	85.7	Confident	79	Confident	106 Å²	106	145.7 Å²	145.7	56%	0.555	74%	0.737	S	S	*	*			trans	-56.5	145	177.8	-64.7	172	0	0	0	111.2	S285 G289 L290	S285-L287 PolarHBondContact O-N 2.77Å; L287-G289 PolarHBondContact O-N 3.4Å; L287-G289 VanDerWaalsContact O-N 3.13Å; L287-L290 HydrophobicContact CB-CD1 4.17Å; L287-L290 HydrophobicContact CB-CG 4.44Å; L287-L290 HydrophobicContact CD1-CD1 4.37Å; L287-L290 PolarHBondContact O-N 2.73Å
288	K	80.4	Confident	77.7	Confident	192 Å²	192	145.9 Å²	145.9	84%	0.835	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-56.3	-32.1	-178.3	-166.5	179	-179.5	-179.8	0	112.5
289	G	80.6	Confident	75.6	Confident	78 Å²	78	152 Å²	152	80%	0.804	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-75.1	-18.8	178.5	0	0	0	0	0	115.6	L287	L287-G289 PolarHBondContact O-N 3.4Å; L287-G289 VanDerWaalsContact O-N 3.13Å
290	L	77.9	Confident	75	Confident	136 Å²	136	153.9 Å²	153.9	71%	0.712	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-92.6	-5.8	179.3	-68.1	169.3	0	0	0	112.9	L287	L287-L290 HydrophobicContact CB-CD1 4.17Å; L287-L290 HydrophobicContact CB-CG 4.44Å; L287-L290 HydrophobicContact CD1-CD1 4.37Å; L287-L290 PolarHBondContact O-N 2.73Å
291	K	78.9	Confident	74.4	Confident	134 Å²	134	153.3 Å²	153.3	58%	0.583	78%	0.783	S	S	*	*	S	Bend	trans	-75.8	129.2	174.8	-64.9	-178.3	-179.6	-178.2	0	108.6	R293	K291-R293 PolarHBondContact O-N 3.03Å
292	A	75.8	Confident	73.7	Confident	98 Å²	98	155.7 Å²	155.7	81%	0.81	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-51.9	117.6	174.4	0	0	0	0	0	109.5	I294	A292-I294 PolarHBondContact O-N 3.38Å
293	R	69	Low	72.9	Confident	240 Å²	240	158.7 Å²	158.7	91%	0.906	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-65.8	118	168	-86.3	-178.9	168.6	178.3	-3.3	106.5	K291 K295	K291-R293 PolarHBondContact O-N 3.03Å; R293-K295 VanDerWaalsContact C-N 3.3Å; R293-K295 PolarHBondContact O-N 2.92Å
294	I	69.1	Low	72.2	Confident	162 Å²	162	155.8 Å²	155.8	83%	0.831	80%	0.798	S	S	*	*			trans	-59.1	101.6	164.7	-60.5	171.1	0	0	0	105.4	A292 K296	A292-I294 PolarHBondContact O-N 3.38Å; I294-K296 PolarHBondContact O-N 3.22Å
295	K	64.4	Low	71.3	Confident	196 Å²	196	156.9 Å²	156.9	85%	0.852	80%	0.802	S	S	*	*			trans	-58.8	108.9	165.4	-102.7	-178.8	174.4	-179.9	0	104.8	R293 K297	R293-K295 VanDerWaalsContact C-N 3.3Å; R293-K295 PolarHBondContact O-N 2.92Å; K295-K297 PolarHBondContact O-N 3.41Å
296	K	60.6	Low	70.4	Confident	186 Å²	186	161.9 Å²	161.9	81%	0.809	82%	0.816	S	S	*	*			trans	-54.2	112	163.5	-93.3	-176	171.4	-176.8	0	105.9	I294 N298	I294-K296 PolarHBondContact O-N 3.22Å; K296-N298 VanDerWaalsContact C-N 3.34Å; K296-N298 PolarHBondContact O-N 2.77Å
297	K	55.1	Low	69.4	Low	200 Å²	200	160.4 Å²	160.4	87%	0.87	82%	0.818	S	S	*	*			trans	-60.3	106.6	158	-93.3	-178.8	169.8	-178.5	0	104.5	K295 T299	K295-K297 PolarHBondContact O-N 3.41Å; K297-T299 PolarHBondContact O-N 2.87Å; K297-T299 VanDerWaalsContact O-N 3.13Å
298	N	61	Low	68	Low	148 Å²	148	164.9 Å²	164.9	79%	0.791	84%	0.84	S	S	*	*			trans	-66	110.1	162.3	-74.6	-7.9	0	0	0	105.3	K296	K296-N298 VanDerWaalsContact C-N 3.34Å; K296-N298 PolarHBondContact O-N 2.77Å
299	T	43.7	Very low	66.9	Low	209 Å²	209	162.5 Å²	162.5	100%	1.282	84%	0.841	S	S	*	*			trans	-52.7	0	157.9	38.9	0	0	0	0	110.8	K297	K297-T299 PolarHBondContact O-N 2.87Å; K297-T299 VanDerWaalsContact O-N 3.13Å

Retrieved 299 of 299 residues in 147.3 ms (Link to these results)

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