A0A087X8G4_POEFO Loading...

Phosphoribosyl pyrophosphate synthase-associated protein 2

Seems to play a negative regulatory role in 5-phosphoribose 1-diphosphate synthesis.

AlphaFold DB , UniProt , Accession A0A087X8G4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 370 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	C	40	Very low	36.7	Very low	186 Å²	186	132.2 Å²	132.2	100%	1.257	83%	0.825	S	S	*	*				0	109.7	0	-65.4	0	0	0	0	107.5
2	G	33.4	Very low	38	Very low	85 Å²	85	124.1 Å²	124.1	88%	0.876	77%	0.77	S	S	*	*			trans	-77.9	133.7	-169.9	0	0	0	0	0	112.5
3	E	32.5	Very low	38.2	Very low	197 Å²	197	125.1 Å²	125.1	92%	0.921	77%	0.767	S	S	*	*			trans	-76.1	117.6	170.5	-71.4	177.7	148.8	0	0	109.8	G5	E3-G5 PolarHBondContact O-N 3.2Å
4	S	36.3	Very low	38.4	Very low	122 Å²	122	129.2 Å²	129.2	85%	0.853	77%	0.773	S	S	*	*			trans	-77.5	94.5	172.1	51.1	0	0	0	0	109.8	G6	S4-G6 PolarHBondContact O-N 3.33Å
5	G	31	Very low	38.7	Very low	70 Å²	70	123.8 Å²	123.8	72%	0.722	74%	0.741	S	S	*	*			trans	-65.2	110.7	170.8	0	0	0	0	0	111.5	E3 R7	E3-G5 PolarHBondContact O-N 3.2Å; G5-R7 PolarHBondContact O-N 3.22Å
6	G	30.8	Very low	39.2	Very low	79 Å²	79	129.7 Å²	129.7	81%	0.814	75%	0.754	S	S	*	*			trans	-62.3	120.1	168.5	0	0	0	0	0	110.2	S4 G8	S4-G6 PolarHBondContact O-N 3.33Å; G6-G8 PolarHBondContact O-N 3.35Å
7	R	37.1	Very low	40.5	Very low	202 Å²	202	122.4 Å²	122.4	76%	0.762	71%	0.713	S	S	*	*			trans	-76	113.2	171.7	-70.4	-176.8	-161.5	-156.6	1.6	108.3	G5	G5-R7 PolarHBondContact O-N 3.22Å
8	G	36.7	Very low	43	Very low	53 Å²	53	117.6 Å²	117.6	55%	0.546	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-62.2	173.3	163.4	0	0	0	0	0	112.3	G6 R10	G6-G8 PolarHBondContact O-N 3.35Å; G8-R10 PolarHBondContact O-N 3.48Å
9	P	37.3	Very low	45.7	Very low	131 Å²	131	113.1 Å²	113.1	85%	0.851	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-61.7	123.5	-178.6	26.1	-29.7	0	0	0	108.9	D11	P9-D11 PolarHBondContact O-N 3.22Å
10	R	46.7	Very low	48.2	Very low	184 Å²	184	107.9 Å²	107.9	69%	0.694	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-75.3	125.2	176.8	-65.2	-174.5	-153.3	166.3	15.9	108.5	G8 M12	G8-R10 PolarHBondContact O-N 3.48Å; R10-M12 PolarHBondContact O-N 3.25Å
11	D	42.1	Very low	50.6	Low	145 Å²	145	102.8 Å²	102.8	78%	0.775	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-52.3	122.7	170.4	-72.2	-37.3	0	0	0	110.5	P9 N13	P9-D11 PolarHBondContact O-N 3.22Å; D11-N13 PolarHBondContact O-N 3.17Å
12	M	51.5	Low	53.3	Low	35 Å²	35	93.9 Å²	93.9	17%	0.172	55%	0.546	C	S	.	.	G	3₁₀ helix	trans	-69.9	2.5	-179	-78.9	-136.9	-66.5	0	0	114.3	R10 H14 L19 L41 V43 R351	R10-M12 PolarHBondContact O-N 3.25Å; M12-H14 PolarHBondContact O-N 3.06Å; M12-L19 HydrophobicContact CE-CD2 3.38Å; M12-L19 HydrophobicContact SD-CD2 4.45Å; M12-L41 HydrophobicContact CE-CB 3.98Å; M12-L41 HydrophobicContact CE-CD1 4.43Å; M12-L41 HydrophobicContact CE-CD2 3.76Å; M12-L41 HydrophobicContact CE-CG 4.26Å; M12-V43 HydrophobicContact CE-CG1 4.49Å; M12-R351 HydrophobicContact SD-CG 3.88Å
13	N	41.6	Very low	56.3	Low	137 Å²	137	90.1 Å²	90.1	73%	0.733	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-76.5	5.8	-177.5	-82.5	-17.9	0	0	0	115.2	D11	D11-N13 PolarHBondContact O-N 3.17Å
14	H	39.9	Very low	59.3	Low	183 Å²	183	80.8 Å²	80.8	85%	0.847	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-120.9	18.4	-173.6	-86	6	0	0	0	116.3	M12	M12-H14 PolarHBondContact O-N 3.06Å
15	T	43.7	Very low	62	Low	48 Å²	48	75.1 Å²	75.1	29%	0.294	42%	0.422	S	S	.	.	S	Bend	trans	-83.2	135.3	169.6	52.5	0	0	0	0	111.6	G17 H354	T15-G17 CarbonylContact O-C 3.44Å; T15-G17 PolarHBondContact O-N 2.9Å; T15-G17 PolarHBondContact OG1-O 2.77Å; T15-H354 PolarHBondContact OG1-NE2 2.68Å
16	K	47.2	Very low	64.5	Low	218 Å²	218	73.1 Å²	73.1	95%	0.948	40%	0.397	S	S	*	.	S	Bend	trans	-60.5	-2	-178.6	-75.4	-179.5	174.6	178.9	0	115.5
17	G	60	Low	67.2	Low	6 Å²	6	73 Å²	73	6%	0.062	38%	0.375	C	S	.	.	S	Bend	trans	-128.1	122.4	162.1	0	0	0	0	0	107.2	T15 R103 H354	T15-G17 CarbonylContact O-C 3.44Å; T15-G17 PolarHBondContact O-N 2.9Å; T15-G17 PolarHBondContact OG1-O 2.77Å; G17-R103 VanDerWaalsContact CA-NH2 3.35Å; G17-H354 PolarHBondContact O-CE1 3.07Å
18	G	86.2	Confident	69.4	Low	36 Å²	36	67.3 Å²	67.3	37%	0.371	37%	0.365	S	S	.	.			trans	-66.5	141.3	-178.7	0	0	0	0	0	111.3	K69 D70	G18-K69 WeakPolarHBondContact O-CA 3.43Å; G18-K69 VanDerWaalsContact O-CB 3.28Å; G18-K69 WeakPolarHBondContact O-CB 3.28Å; G18-D70 PolarHBondContact O-N 2.81Å
19	L	93.4	Very high	71.7	Confident	31 Å²	31	66.9 Å²	66.9	16%	0.162	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	137.5	170.7	177.3	69.2	0	0	0	109.7	M12 I21 V43 F72 I350 H354	M12-L19 HydrophobicContact CE-CD2 3.38Å; M12-L19 HydrophobicContact SD-CD2 4.45Å; L19-I21 HydrophobicContact CD2-CD1 4.44Å; L19-I21 HydrophobicContact CG-CG1 4.36Å; L19-V43 HydrophobicContact CD2-CG1 4.39Å; L19-F72 HydrophobicContact CD1-CD2 3.21Å; L19-F72 HydrophobicContact CD1-CE2 3.18Å; L19-F72 HydrophobicContact CD1-CG 4.36Å; L19-F72 HydrophobicContact CD1-CZ 4.3Å; L19-I350 HydrophobicContact CD1-CG2 4.44Å; L19-H354 HydrophobicContact CD1-CB 4.46Å
20	V	96.8	Very high	74.1	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.055	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.2	167.9	-175.8	0	0	0	0	109.8	F22 K69 D70 V71 F72	V20-F22 HydrophobicContact CB-CE2 4.39Å; V20-F22 HydrophobicContact CG1-CD2 4.04Å; V20-F22 HydrophobicContact CG1-CE1 4.02Å; V20-F22 HydrophobicContact CG1-CE2 3.47Å; V20-F22 VanDerWaalsContact CG1-CE2 3.47Å; V20-F22 HydrophobicContact CG1-CZ 3.46Å; V20-F22 VanDerWaalsContact CG1-CZ 3.46Å; V20-K69 HydrophobicContact CG2-CB 4.31Å; V20-K69 HydrophobicContact CG2-CD 3.33Å; V20-K69 HydrophobicContact CG2-CG 4.47Å; V20-D70 PolarHBondContact N-O 2.83Å; V20-V71 WeakPolarHBondContact O-CA 3.46Å; V20-F72 PolarHBondContact O-N 3.17Å
21	I	97.6	Very high	76.2	Confident	1 Å²	1	55 Å²	55	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.6	177.2	-54.6	-175.1	0	0	0	108.9	L19 L41 V43 L45 G46 F72 I74	L19-I21 HydrophobicContact CD2-CD1 4.44Å; L19-I21 HydrophobicContact CG-CG1 4.36Å; I21-L41 HydrophobicContact CD1-CD1 3.47Å; I21-L41 VanDerWaalsContact CD1-CD1 3.47Å; I21-V43 HydrophobicContact CD1-CG2 3.63Å; I21-V43 HydrophobicContact CG1-CG2 4.27Å; I21-L45 HydrophobicContact CB-CD2 4.17Å; I21-L45 HydrophobicContact CG2-CD2 3.73Å; I21-G46 PolarHBondContact O-N 3.28Å; I21-F72 CarbonylContact C-O 3.44Å; I21-F72 WeakPolarHBondContact CA-O 3.36Å; I21-F72 HydrophobicContact CG1-CB 4.41Å; I21-I74 HydrophobicContact CG2-CD1 3.43Å; I21-I74 VanDerWaalsContact CG2-CD1 3.43Å; I21-I74 HydrophobicContact CG2-CG1 4Å
22	F	97.9	Very high	78.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	154.1	171.5	-65.2	-68.5	0	0	0	110.9	V20 G46 V48 I62 E64 V66 V71 F72 I74 M93	V20-F22 HydrophobicContact CB-CE2 4.39Å; V20-F22 HydrophobicContact CG1-CD2 4.04Å; V20-F22 HydrophobicContact CG1-CE1 4.02Å; V20-F22 HydrophobicContact CG1-CE2 3.47Å; V20-F22 VanDerWaalsContact CG1-CE2 3.47Å; V20-F22 HydrophobicContact CG1-CZ 3.46Å; V20-F22 VanDerWaalsContact CG1-CZ 3.46Å; F22-G46 WeakPolarHBondContact CD1-O 3.46Å; F22-G46 VanDerWaalsContact CE1-C 3.45Å; F22-G46 VanDerWaalsContact CE1-CA 3.47Å; F22-V48 HydrophobicContact CD1-CB 3.9Å; F22-V48 HydrophobicContact CD1-CG1 3.94Å; F22-V48 HydrophobicContact CE1-CB 4.24Å; F22-I62 HydrophobicContact CE1-CG2 4.19Å; F22-I62 HydrophobicContact CE2-CG2 4.41Å; F22-I62 HydrophobicContact CZ-CG2 3.7Å; F22-E64 HydrophobicContact CE1-CG 4.21Å; F22-E64 HydrophobicContact CZ-CG 4Å; F22-V66 HydrophobicContact CE2-CG1 3.58Å; F22-V66 HydrophobicContact CZ-CG1 3.69Å; F22-V71 HydrophobicContact CD2-CG1 3.63Å; F22-V71 HydrophobicContact CE2-CG1 3.84Å; F22-F72 PolarHBondContact N-O 2.86Å; F22-I74 PolarHBondContact O-N 3.35Å; F22-M93 HydrophobicContact CB-SD 3.76Å; F22-M93 HydrophobicContact CG-SD 4.44Å
23	T	96.9	Very high	80.8	Confident	6 Å²	6	50.5 Å²	50.5	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.7	162.7	59.9	0	0	0	0	109	N25 R31 L45 I74	T23-N25 VanDerWaalsContact C-N 3.28Å; T23-N25 PolarHBondContact O-N 3.43Å; T23-R31 HydrophobicContact CG2-CB 4.39Å; T23-L45 HydrophobicContact CG2-CD1 3.91Å; T23-L45 HydrophobicContact CG2-CD2 4.11Å; T23-I74 WeakPolarHBondContact CA-O 3.4Å
24	A	94.3	Very high	83.3	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.			trans	-79.6	-9.6	179.2	0	0	0	0	0	114	V50 I73 I74 Q75 M93	A24-V50 WeakPolarHBondContact O-CG1 3.44Å; A24-I73 HydrophobicContact CB-CG2 3.71Å; A24-I74 PolarHBondContact N-O 2.95Å; A24-Q75 HydrophobicContact CB-CB 4.36Å; A24-Q75 HydrophobicContact CB-CG 4.46Å; A24-M93 VanDerWaalsContact CA-CE 3.47Å; A24-M93 HydrophobicContact CB-CB 4.45Å; A24-M93 HydrophobicContact CB-CE 3.85Å; A24-M93 HydrophobicContact CB-SD 3.7Å
25	N	92.6	Very high	86	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	21%	0.213	C	C	.	.			trans	-70.7	131.7	-179.8	-64.2	106.9	0	0	0	112.4	T23 S30 R31 Q75 T76	T23-N25 VanDerWaalsContact C-N 3.28Å; T23-N25 PolarHBondContact O-N 3.43Å; N25-S30 VanDerWaalsContact CG-CB 3.48Å; N25-S30 WeakPolarHBondContact ND2-CB 3.18Å; N25-S30 PolarHBondContact OD1-O 3.02Å; N25-S30 VanDerWaalsContact OD1-O 3.12Å; N25-R31 HydrophobicContact CB-CG 4.12Å; N25-R31 VanDerWaalsContact O-CZ 3.28Å; N25-R31 PolarHBondContact O-NE 2.99Å; N25-R31 PolarHBondContact O-NH2 3.12Å; N25-Q75 PolarHBondContact ND2-OE1 3.02Å; N25-Q75 VanDerWaalsContact ND2-OE1 3.08Å; N25-Q75 PolarHBondContact OD1-OE1 2.85Å; N25-T76 PolarHBondContact ND2-O 3.27Å; N25-T76 PolarHBondContact OD1-N 3.25Å; N25-T76 VanDerWaalsContact OD1-N 3.17Å; N25-T76 PolarHBondContact OD1-OG1 2.98Å
26	S	85.2	Confident	88.5	Confident	28 Å²	28	41.9 Å²	41.9	20%	0.196	21%	0.213	C	C	.	.	S	Bend	trans	-74.2	-34.2	168.1	66.1	0	0	0	0	113.6	R31 V50 R81 E89	S26-R31 PolarHBondContact O-NH2 3.18Å; S26-V50 WeakPolarHBondContact CB-O 3.41Å; S26-R81 PolarHBondContact OG-NH1 2.96Å; S26-R81 PolarHBondContact OG-NH2 3.49Å; S26-E89 WeakPolarHBondContact CB-OE1 3.38Å; S26-E89 PolarHBondContact N-OE1 2.94Å; S26-E89 PolarHBondContact OG-OE1 2.75Å; S26-E89 VanDerWaalsContact OG-OE1 3.1Å
27	H	86.4	Confident	90.9	Very high	76 Å²	76	31.5 Å²	31.5	35%	0.352	17%	0.168	S	C	.	.	S	Bend	trans	-82	133.5	-174.8	-165	-92.8	0	0	0	111.9	S29 S30	H27-S29 PolarHBondContact CE1-OG 3.3Å; H27-S29 VanDerWaalsContact CE1-OG 3.27Å; H27-S29 PolarHBondContact ND1-N 3.5Å; H27-S29 PolarHBondContact ND1-OG 3.05Å; H27-S29 PolarHBondContact O-N 3.39Å; H27-S30 PolarHBondContact O-N 3.01Å
28	P	84.6	Confident	92.6	Very high	83 Å²	83	31.4 Å²	31.4	54%	0.539	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-59.7	-39.5	-175.6	-27.3	35.3	0	0	0	115.1	S30 R31	P28-S30 PolarHBondContact O-N 3Å; P28-R31 WeakPolarHBondContact O-CB 3.44Å; P28-R31 PolarHBondContact O-N 3.1Å
29	S	84.4	Confident	93.1	Very high	45 Å²	45	37.1 Å²	37.1	32%	0.315	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-62.9	-29.7	179.9	64.4	0	0	0	0	112.5	H27 R31	H27-S29 PolarHBondContact CE1-OG 3.3Å; H27-S29 VanDerWaalsContact CE1-OG 3.27Å; H27-S29 PolarHBondContact ND1-N 3.5Å; H27-S29 PolarHBondContact ND1-OG 3.05Å; H27-S29 PolarHBondContact O-N 3.39Å; S29-R31 VanDerWaalsContact C-N 3.26Å; S29-R31 PolarHBondContact O-N 2.97Å
30	S	87	Confident	93.1	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.014	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-78.9	-9.2	177.9	-53.7	0	0	0	0	113.6	N25 H27 P28 T76 S78	N25-S30 VanDerWaalsContact CG-CB 3.48Å; N25-S30 WeakPolarHBondContact ND2-CB 3.18Å; N25-S30 PolarHBondContact OD1-O 3.02Å; N25-S30 VanDerWaalsContact OD1-O 3.12Å; H27-S30 PolarHBondContact O-N 3.01Å; P28-S30 PolarHBondContact O-N 3Å; S30-T76 WeakPolarHBondContact CB-OG1 3.3Å; S30-T76 PolarHBondContact O-OG1 3.19Å; S30-S78 WeakPolarHBondContact OG-CB 3.45Å
31	R	91.3	Very high	93	Very high	63 Å²	63	41.5 Å²	41.5	24%	0.238	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-88.8	-8.8	176.6	-60.6	-177.1	-178.6	175.7	1	113.4	T23 N25 S26 P28 S29 L33 G34 K35	T23-R31 HydrophobicContact CG2-CB 4.39Å; N25-R31 HydrophobicContact CB-CG 4.12Å; N25-R31 VanDerWaalsContact O-CZ 3.28Å; N25-R31 PolarHBondContact O-NE 2.99Å; N25-R31 PolarHBondContact O-NH2 3.12Å; S26-R31 PolarHBondContact O-NH2 3.18Å; P28-R31 WeakPolarHBondContact O-CB 3.44Å; P28-R31 PolarHBondContact O-N 3.1Å; S29-R31 VanDerWaalsContact C-N 3.26Å; S29-R31 PolarHBondContact O-N 2.97Å; R31-L33 PolarHBondContact O-N 2.84Å; R31-G34 WeakPolarHBondContact O-CA 3.45Å; R31-G34 PolarHBondContact O-N 3.49Å; R31-K35 PolarHBondContact O-N 2.78Å
32	E	93.9	Very high	92.9	Very high	78 Å²	78	44.6 Å²	44.6	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-57.6	-47.5	-172.2	179.6	55.8	-158.9	0	0	112.5	G34 K35 R36	E32-G34 VanDerWaalsContact C-N 3.28Å; E32-G34 PolarHBondContact O-N 2.87Å; E32-K35 WeakPolarHBondContact O-CB 3.46Å; E32-K35 PolarHBondContact O-N 2.84Å; E32-R36 WeakPolarHBondContact O-CG 3.39Å; E32-R36 PolarHBondContact O-N 3.36Å; E32-R36 IonicContact OE1-CZ 3.35Å; E32-R36 IonicContact OE1-NE 2.72Å; E32-R36 PolarHBondContact OE1-NE 2.75Å; E32-R36 IonicContact OE1-NH2 3.85Å; E32-R36 PolarHBondContact OE1-NH2 3.23Å
33	L	95.6	Very high	92.7	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-38.8	177	-179.1	61.5	0	0	0	112.1	R31 R36 I37 T76 P110 I342 L346	R31-L33 PolarHBondContact O-N 2.84Å; L33-R36 PolarHBondContact O-N 3.28Å; L33-I37 HydrophobicContact CD1-CD1 4.16Å; L33-I37 HydrophobicContact CD1-CG1 4.42Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CD1 3.49Å; L33-I37 VanDerWaalsContact O-CG1 3.28Å; L33-I37 WeakPolarHBondContact O-CG1 3.42Å; L33-I37 PolarHBondContact O-N 2.88Å; L33-T76 HydrophobicContact CB-CG2 4.23Å; L33-T76 HydrophobicContact CD2-CG2 3.95Å; L33-P110 HydrophobicContact CD2-CB 4.16Å; L33-P110 HydrophobicContact CD2-CG 3.44Å; L33-P110 VanDerWaalsContact CD2-CG 3.44Å; L33-I342 HydrophobicContact CD1-CD1 3.88Å; L33-I342 HydrophobicContact CD2-CD1 4.11Å; L33-L346 HydrophobicContact CD1-CD1 4.29Å; L33-L346 HydrophobicContact CD2-CD1 3.89Å; L33-L346 HydrophobicContact CG-CD1 4.35Å
34	G	95.7	Very high	92.6	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-39.7	176.3	0	0	0	0	0	113	R31 E32 I37 A38	R31-G34 WeakPolarHBondContact O-CA 3.45Å; R31-G34 PolarHBondContact O-N 3.49Å; E32-G34 VanDerWaalsContact C-N 3.28Å; E32-G34 PolarHBondContact O-N 2.87Å; G34-I37 PolarHBondContact O-N 2.75Å; G34-A38 WeakPolarHBondContact O-CB 3.07Å; G34-A38 PolarHBondContact O-N 3.13Å
35	K	96.1	Very high	92.7	Very high	108 Å²	108	56.4 Å²	56.4	47%	0.47	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-47	174.3	-68.3	177	-178.8	177.8	0	111.8	R31 E32 I37 A38 E39 L45	R31-K35 PolarHBondContact O-N 2.78Å; E32-K35 WeakPolarHBondContact O-CB 3.46Å; E32-K35 PolarHBondContact O-N 2.84Å; K35-I37 VanDerWaalsContact C-N 3.32Å; K35-I37 PolarHBondContact O-N 2.72Å; K35-A38 PolarHBondContact O-N 3.48Å; K35-E39 WeakPolarHBondContact O-CB 3.48Å; K35-E39 PolarHBondContact O-N 3.41Å; K35-L45 HydrophobicContact CG-CD1 3.84Å
36	R	96.8	Very high	92.9	Very high	78 Å²	78	56.7 Å²	56.7	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-41	177.9	-68.1	-177.9	-174.9	-162.8	-0.7	112.3	E32 L33 E39 R40 D341	E32-R36 WeakPolarHBondContact O-CG 3.39Å; E32-R36 PolarHBondContact O-N 3.36Å; E32-R36 IonicContact OE1-CZ 3.35Å; E32-R36 IonicContact OE1-NE 2.72Å; E32-R36 PolarHBondContact OE1-NE 2.75Å; E32-R36 IonicContact OE1-NH2 3.85Å; E32-R36 PolarHBondContact OE1-NH2 3.23Å; L33-R36 PolarHBondContact O-N 3.28Å; R36-E39 PolarHBondContact O-N 2.87Å; R36-R40 VanDerWaalsContact O-CG 3.31Å; R36-R40 WeakPolarHBondContact O-CG 3.34Å; R36-R40 PolarHBondContact O-N 2.78Å; R36-D341 IonicContact NH1-OD1 3.78Å
37	I	97.1	Very high	93.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-45.2	175.4	-71.7	165.2	0	0	0	110.7	L33 G34 K35 R40 L41 I74 L346 I350	L33-I37 HydrophobicContact CD1-CD1 4.16Å; L33-I37 HydrophobicContact CD1-CG1 4.42Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CD1 3.49Å; L33-I37 VanDerWaalsContact O-CG1 3.28Å; L33-I37 WeakPolarHBondContact O-CG1 3.42Å; L33-I37 PolarHBondContact O-N 2.88Å; G34-I37 PolarHBondContact O-N 2.75Å; K35-I37 VanDerWaalsContact C-N 3.32Å; K35-I37 PolarHBondContact O-N 2.72Å; I37-R40 PolarHBondContact O-N 3.45Å; I37-L41 HydrophobicContact CG2-CD1 3.98Å; I37-L41 WeakPolarHBondContact O-CG 3.29Å; I37-L41 PolarHBondContact O-N 3.39Å; I37-L41 VanDerWaalsContact O-N 3.1Å; I37-I74 HydrophobicContact CB-CD1 4.03Å; I37-I74 HydrophobicContact CD1-CD1 3.88Å; I37-I74 HydrophobicContact CG2-CD1 3.89Å; I37-L346 HydrophobicContact CD1-CB 3.7Å; I37-L346 HydrophobicContact CD1-CD1 3.77Å; I37-L346 HydrophobicContact CD1-CG 4.4Å; I37-L346 HydrophobicContact CG1-CB 4.12Å; I37-I350 HydrophobicContact CG2-CD1 3.55Å
38	A	95.4	Very high	93.9	Very high	4 Å²	4	59 Å²	59	3%	0.033	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-43.5	178.8	0	0	0	0	0	112	G34 K35 R40 L41 G42 V43 L45	G34-A38 WeakPolarHBondContact O-CB 3.07Å; G34-A38 PolarHBondContact O-N 3.13Å; K35-A38 PolarHBondContact O-N 3.48Å; A38-R40 PolarHBondContact O-N 2.97Å; A38-L41 CarbonylContact O-C 3.51Å; A38-L41 PolarHBondContact O-N 3.44Å; A38-G42 PolarHBondContact O-N 2.96Å; A38-V43 CarbonylContact C-O 3.56Å; A38-V43 HydrophobicContact CB-CG2 4.32Å; A38-V43 WeakPolarHBondContact CB-O 3.46Å; A38-V43 PolarHBondContact O-N 2.97Å; A38-L45 HydrophobicContact CB-CD2 3.73Å; A38-L45 HydrophobicContact CB-CG 3.9Å
39	E	96.1	Very high	94.4	Very high	156 Å²	156	59.2 Å²	59.2	73%	0.729	29%	0.294	S	S	*	.	H	α-helix	trans	-59.1	-46.8	174.9	-176.5	179.6	-170	0	0	111.9	K35 R36 L41 G42	K35-E39 WeakPolarHBondContact O-CB 3.48Å; K35-E39 PolarHBondContact O-N 3.41Å; R36-E39 PolarHBondContact O-N 2.87Å; E39-L41 PolarHBondContact O-N 2.83Å; E39-G42 PolarHBondContact O-N 2.81Å
40	R	94.9	Very high	94.9	Very high	111 Å²	111	57.5 Å²	57.5	42%	0.419	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-31.5	177	-73.9	-173.8	-175.1	-70.3	2.1	113.4	R36 I37 A38 G42 D341 S343 M344	R36-R40 VanDerWaalsContact O-CG 3.31Å; R36-R40 WeakPolarHBondContact O-CG 3.34Å; R36-R40 PolarHBondContact O-N 2.78Å; I37-R40 PolarHBondContact O-N 3.45Å; A38-R40 PolarHBondContact O-N 2.97Å; R40-G42 VanDerWaalsContact C-N 3.33Å; R40-D341 IonicContact CZ-OD2 2.77Å; R40-D341 IonicContact NE-OD2 2.75Å; R40-D341 IonicContact NH2-OD2 3.83Å; R40-D341 PolarHBondContact NH2-OD2 3.15Å; R40-S343 PolarHBondContact NE-OG 3.24Å; R40-M344 VanDerWaalsContact NH1-CE 3.33Å
41	L	94.3	Very high	95.2	Very high	21 Å²	21	61.7 Å²	61.7	11%	0.11	30%	0.298	C	S	.	.	H	α-helix	trans	-85.3	-7.9	177.4	-68.7	175.2	0	0	0	113.1	M12 I21 I37 A38 E39 V43 S347 I350 R351	M12-L41 HydrophobicContact CE-CB 3.98Å; M12-L41 HydrophobicContact CE-CD1 4.43Å; M12-L41 HydrophobicContact CE-CD2 3.76Å; M12-L41 HydrophobicContact CE-CG 4.26Å; I21-L41 HydrophobicContact CD1-CD1 3.47Å; I21-L41 VanDerWaalsContact CD1-CD1 3.47Å; I37-L41 HydrophobicContact CG2-CD1 3.98Å; I37-L41 WeakPolarHBondContact O-CG 3.29Å; I37-L41 PolarHBondContact O-N 3.39Å; I37-L41 VanDerWaalsContact O-N 3.1Å; A38-L41 CarbonylContact O-C 3.51Å; A38-L41 PolarHBondContact O-N 3.44Å; E39-L41 PolarHBondContact O-N 2.83Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 HydrophobicContact CB-CG1 4.49Å; L41-V43 HydrophobicContact CB-CG2 3.95Å; L41-S347 WeakPolarHBondContact CD2-O 3.41Å; L41-I350 HydrophobicContact CD1-CB 4.18Å; L41-I350 HydrophobicContact CD1-CD1 4.42Å; L41-I350 HydrophobicContact CD1-CG2 3.76Å; L41-R351 HydrophobicContact CD2-CB 3.97Å; L41-R351 HydrophobicContact CD2-CG 4.44Å
42	G	94.4	Very high	95.3	Very high	66 Å²	66	62.4 Å²	62.4	68%	0.68	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	32.3	-175.9	0	0	0	0	0	113.1	A38 E39 R40	A38-G42 PolarHBondContact O-N 2.96Å; E39-G42 PolarHBondContact O-N 2.81Å; R40-G42 VanDerWaalsContact C-N 3.33Å
43	V	94.6	Very high	95.3	Very high	32 Å²	32	61.4 Å²	61.4	19%	0.194	30%	0.299	C	S	.	.			trans	-124.2	153.2	-179.1	-58.1	0	0	0	0	111.4	M12 L19 I21 A38 L41	M12-V43 HydrophobicContact CE-CG1 4.49Å; L19-V43 HydrophobicContact CD2-CG1 4.39Å; I21-V43 HydrophobicContact CD1-CG2 3.63Å; I21-V43 HydrophobicContact CG1-CG2 4.27Å; A38-V43 CarbonylContact C-O 3.56Å; A38-V43 HydrophobicContact CB-CG2 4.32Å; A38-V43 WeakPolarHBondContact CB-O 3.46Å; A38-V43 PolarHBondContact O-N 2.97Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 HydrophobicContact CB-CG1 4.49Å; L41-V43 HydrophobicContact CB-CG2 3.95Å
44	E	95.3	Very high	95.1	Very high	172 Å²	172	66.5 Å²	66.5	80%	0.804	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-83.2	148.8	171.2	-65.5	-173	169.7	0	0	111
45	L	96	Very high	95.1	Very high	50 Å²	50	70.8 Å²	70.8	26%	0.262	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-69	137.2	169.3	-69.9	176.3	0	0	0	109.9	I21 T23 K35 A38	I21-L45 HydrophobicContact CB-CD2 4.17Å; I21-L45 HydrophobicContact CG2-CD2 3.73Å; T23-L45 HydrophobicContact CG2-CD1 3.91Å; T23-L45 HydrophobicContact CG2-CD2 4.11Å; K35-L45 HydrophobicContact CG-CD1 3.84Å; A38-L45 HydrophobicContact CB-CD2 3.73Å; A38-L45 HydrophobicContact CB-CG 3.9Å
46	G	95.6	Very high	94.9	Very high	10 Å²	10	75.7 Å²	75.7	10%	0.103	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-63.4	147.9	176.3	0	0	0	0	0	112.1	I21 F22 V48 E64	I21-G46 PolarHBondContact O-N 3.28Å; F22-G46 WeakPolarHBondContact CD1-O 3.46Å; F22-G46 VanDerWaalsContact CE1-C 3.45Å; F22-G46 VanDerWaalsContact CE1-CA 3.47Å; G46-V48 PolarHBondContact O-N 3.39Å; G46-E64 WeakPolarHBondContact CA-OE1 3.35Å
47	K	95.7	Very high	94.9	Very high	133 Å²	133	77.6 Å²	77.6	58%	0.578	39%	0.393	S	S	*	.			trans	-75.9	112.7	-176.7	-61.2	-179.2	-175.7	178.3	0	110.3	Q63 E64	K47-Q63 HydrophobicContact CB-CB 3.91Å; K47-Q63 WeakPolarHBondContact O-CB 3.47Å; K47-Q63 PolarHBondContact O-N 3.23Å; K47-E64 PolarHBondContact N-OE1 3.06Å
48	V	96.6	Very high	94.9	Very high	19 Å²	19	78.7 Å²	78.7	12%	0.115	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140.2	179.8	67.4	0	0	0	0	111.1	F22 G46 V50 V60 Q61 I62 M93	F22-V48 HydrophobicContact CD1-CB 3.9Å; F22-V48 HydrophobicContact CD1-CG1 3.94Å; F22-V48 HydrophobicContact CE1-CB 4.24Å; G46-V48 PolarHBondContact O-N 3.39Å; V48-V50 HydrophobicContact CG1-CG2 4.49Å; V48-V50 HydrophobicContact CG2-CG2 4.06Å; V48-V60 HydrophobicContact CG2-CG1 3.93Å; V48-Q61 WeakPolarHBondContact CA-O 3.4Å; V48-Q61 WeakPolarHBondContact CG2-O 3.46Å; V48-I62 HydrophobicContact CG2-CG1 4.41Å; V48-M93 HydrophobicContact CG1-CE 4.23Å; V48-M93 HydrophobicContact CG2-CE 3.6Å
49	Q	95.9	Very high	94.9	Very high	87 Å²	87	84.3 Å²	84.3	41%	0.407	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.1	168.3	-71.1	-177.9	-3.8	0	0	109	Y51 V60 Q61	Q49-Y51 HydrophobicContact CB-CD1 4.38Å; Q49-V60 CarbonylContact O-C 3.57Å; Q49-V60 WeakPolarHBondContact O-CA 3.3Å; Q49-Q61 HydrophobicContact CB-CB 4.44Å; Q49-Q61 PolarHBondContact N-O 2.78Å; Q49-Q61 PolarHBondContact O-N 3.06Å
50	V	95.3	Very high	95	Very high	10 Å²	10	78 Å²	78	6%	0.061	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.8	173.3	-171.4	0	0	0	0	107.4	A24 S26 V48 R59 V60 E89 M93	A24-V50 WeakPolarHBondContact O-CG1 3.44Å; S26-V50 WeakPolarHBondContact CB-O 3.41Å; V48-V50 HydrophobicContact CG1-CG2 4.49Å; V48-V50 HydrophobicContact CG2-CG2 4.06Å; V50-R59 WeakPolarHBondContact CA-O 3.31Å; V50-V60 HydrophobicContact CG1-CG2 4.12Å; V50-V60 HydrophobicContact CG2-CG1 4.36Å; V50-V60 HydrophobicContact CG2-CG2 4.31Å; V50-E89 HydrophobicContact CG1-CB 4.32Å; V50-E89 HydrophobicContact CG1-CG 3.7Å; V50-E89 VanDerWaalsContact CG1-OE1 3.27Å; V50-E89 WeakPolarHBondContact CG1-OE1 3.45Å; V50-M93 HydrophobicContact CG2-CE 3.5Å
51	Y	93.4	Very high	95.1	Very high	90 Å²	90	77.7 Å²	77.7	35%	0.353	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	166.3	-177.6	63.3	-86.4	0	0	0	110.8	Q49 E53 R59	Q49-Y51 HydrophobicContact CB-CD1 4.38Å; Y51-E53 HydrophobicContact CE2-CG 4.09Å; Y51-R59 HydrophobicContact CD2-CB 4.48Å; Y51-R59 HydrophobicContact CE1-CB 4.05Å; Y51-R59 HydrophobicContact CE2-CB 4Å; Y51-R59 HydrophobicContact CE2-CG 4.49Å; Y51-R59 PolarHBondContact N-O 2.84Å; Y51-R59 VanDerWaalsContact N-O 3.09Å; Y51-R59 PolarHBondContact O-N 2.91Å
52	Q	92.3	Very high	95.3	Very high	77 Å²	77	78.2 Å²	78.2	36%	0.36	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.1	170.9	-79	176.8	-73.6	0	0	110.3	R56 E57 T85	Q52-R56 PolarHBondContact NE2-O 2.59Å; Q52-E57 CarbonylContact C-O 3.48Å; Q52-E57 VanDerWaalsContact CA-O 3.26Å; Q52-E57 WeakPolarHBondContact CA-O 3.46Å; Q52-T85 HydrophobicContact CG-CG2 4.43Å
53	E	93.4	Very high	95.4	Very high	57 Å²	57	79.6 Å²	79.6	27%	0.266	39%	0.387	S	S	.	.			trans	-74.7	168.8	171.4	-66	-161.2	131.4	0	0	111	Y51 N55 R56 E57 R59	Y51-E53 HydrophobicContact CE2-CG 4.09Å; E53-N55 VanDerWaalsContact CB-OD1 3.28Å; E53-N55 WeakPolarHBondContact CB-OD1 3.46Å; E53-N55 PolarHBondContact O-N 3.45Å; E53-N55 VanDerWaalsContact O-N 3.13Å; E53-R56 WeakPolarHBondContact O-CA 3.41Å; E53-R56 PolarHBondContact O-N 3.47Å; E53-E57 PolarHBondContact N-O 2.8Å; E53-R59 VanDerWaalsContact CD-CZ 3.47Å; E53-R59 HydrophobicContact CG-CG 4.05Å; E53-R59 WeakPolarHBondContact OE1-CD 3.33Å; E53-R59 IonicContact OE1-CZ 3.57Å; E53-R59 IonicContact OE1-NE 3.15Å; E53-R59 PolarHBondContact OE1-NE 2.96Å; E53-R59 IonicContact OE1-NH1 2.83Å; E53-R59 IonicContact OE1-NH2 3.06Å; E53-R59 PolarHBondContact OE1-NH2 3.47Å; E53-R59 IonicContact OE2-CZ 3.64Å; E53-R59 VanDerWaalsContact OE2-CZ 3.31Å; E53-R59 IonicContact OE2-NE 3.13Å; E53-R59 PolarHBondContact OE2-NE 2.87Å; E53-R59 IonicContact OE2-NH2 2.81Å; E53-R59 PolarHBondContact OE2-NH2 3.45Å
54	A	93.4	Very high	95.4	Very high	115 Å²	115	81.1 Å²	81.1	95%	0.95	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.3	-179.3	0	0	0	0	0	113.2	R56	A54-R56 VanDerWaalsContact C-N 3.26Å; A54-R56 PolarHBondContact O-N 3.45Å
55	N	94.6	Very high	95.4	Very high	91 Å²	91	76.8 Å²	76.8	49%	0.487	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	5.8	174.6	67.6	-4.5	0	0	0	113.8	E53 E57	E53-N55 VanDerWaalsContact CB-OD1 3.28Å; E53-N55 WeakPolarHBondContact CB-OD1 3.46Å; E53-N55 PolarHBondContact O-N 3.45Å; E53-N55 VanDerWaalsContact O-N 3.13Å; N55-E57 VanDerWaalsContact C-N 3.26Å; N55-E57 PolarHBondContact ND2-OE2 2.95Å; N55-E57 PolarHBondContact O-N 2.77Å; N55-E57 WeakPolarHBondContact OD1-CB 3.39Å; N55-E57 PolarHBondContact OD1-N 3.3Å
56	R	92.6	Very high	95.5	Very high	211 Å²	211	74.5 Å²	74.5	80%	0.796	37%	0.368	S	S	*	.	S	Bend	trans	72.4	2.9	-177.1	-50.5	179.1	176.5	-177.7	-2.1	116	Q52 E53 A54	Q52-R56 PolarHBondContact NE2-O 2.59Å; E53-R56 WeakPolarHBondContact O-CA 3.41Å; E53-R56 PolarHBondContact O-N 3.47Å; A54-R56 VanDerWaalsContact C-N 3.26Å; A54-R56 PolarHBondContact O-N 3.45Å
57	E	95.9	Very high	95.5	Very high	118 Å²	118	81.9 Å²	81.9	55%	0.551	39%	0.393	S	S	*	.			trans	-66.2	143.1	172.2	-68.3	-179.9	164.3	0	0	110.6	Q52 E53 N55	Q52-E57 CarbonylContact C-O 3.48Å; Q52-E57 VanDerWaalsContact CA-O 3.26Å; Q52-E57 WeakPolarHBondContact CA-O 3.46Å; E53-E57 PolarHBondContact N-O 2.8Å; N55-E57 VanDerWaalsContact C-N 3.26Å; N55-E57 PolarHBondContact ND2-OE2 2.95Å; N55-E57 PolarHBondContact O-N 2.77Å; N55-E57 WeakPolarHBondContact OD1-CB 3.39Å; N55-E57 PolarHBondContact OD1-N 3.3Å
58	T	96.3	Very high	95.5	Very high	22 Å²	22	77 Å²	77	14%	0.135	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.9	-179.7	-64.1	0	0	0	0	110	V60 E89 I92	T58-V60 HydrophobicContact CG2-CG2 4.49Å; T58-E89 HydrophobicContact CG2-CB 4.27Å; T58-E89 HydrophobicContact CG2-CG 3.42Å; T58-E89 VanDerWaalsContact CG2-CG 3.42Å; T58-I92 HydrophobicContact CG2-CD1 3.95Å; T58-I92 WeakPolarHBondContact O-CD1 3.31Å
59	R	96.9	Very high	95.5	Very high	123 Å²	123	78.9 Å²	78.9	46%	0.464	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.3	170.4	-71.7	-159.3	179	-157.7	18.9	111.5	V50 Y51 E53	V50-R59 WeakPolarHBondContact CA-O 3.31Å; Y51-R59 HydrophobicContact CD2-CB 4.48Å; Y51-R59 HydrophobicContact CE1-CB 4.05Å; Y51-R59 HydrophobicContact CE2-CB 4Å; Y51-R59 HydrophobicContact CE2-CG 4.49Å; Y51-R59 PolarHBondContact N-O 2.84Å; Y51-R59 VanDerWaalsContact N-O 3.09Å; Y51-R59 PolarHBondContact O-N 2.91Å; E53-R59 VanDerWaalsContact CD-CZ 3.47Å; E53-R59 HydrophobicContact CG-CG 4.05Å; E53-R59 WeakPolarHBondContact OE1-CD 3.33Å; E53-R59 IonicContact OE1-CZ 3.57Å; E53-R59 IonicContact OE1-NE 3.15Å; E53-R59 PolarHBondContact OE1-NE 2.96Å; E53-R59 IonicContact OE1-NH1 2.83Å; E53-R59 IonicContact OE1-NH2 3.06Å; E53-R59 PolarHBondContact OE1-NH2 3.47Å; E53-R59 IonicContact OE2-CZ 3.64Å; E53-R59 VanDerWaalsContact OE2-CZ 3.31Å; E53-R59 IonicContact OE2-NE 3.13Å; E53-R59 PolarHBondContact OE2-NE 2.87Å; E53-R59 IonicContact OE2-NH2 2.81Å; E53-R59 PolarHBondContact OE2-NH2 3.45Å
60	V	97.6	Very high	95.6	Very high	23 Å²	23	75.8 Å²	75.8	14%	0.139	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.1	174	179.6	0	0	0	0	108.2	V48 Q49 V50 T58 I92 M93	V48-V60 HydrophobicContact CG2-CG1 3.93Å; Q49-V60 CarbonylContact O-C 3.57Å; Q49-V60 WeakPolarHBondContact O-CA 3.3Å; V50-V60 HydrophobicContact CG1-CG2 4.12Å; V50-V60 HydrophobicContact CG2-CG1 4.36Å; V50-V60 HydrophobicContact CG2-CG2 4.31Å; T58-V60 HydrophobicContact CG2-CG2 4.49Å; V60-I92 HydrophobicContact CB-CG2 3.82Å; V60-I92 HydrophobicContact CG2-CB 4.04Å; V60-I92 HydrophobicContact CG2-CG2 3.76Å; V60-M93 HydrophobicContact CG1-CB 4.04Å; V60-M93 HydrophobicContact CG1-CE 3.68Å; V60-M93 HydrophobicContact CG1-CG 4.16Å; V60-M93 HydrophobicContact CG2-CB 4.44Å
61	Q	97.4	Very high	95.7	Very high	104 Å²	104	75.3 Å²	75.3	49%	0.486	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	109.3	175.1	-171.4	178	13.8	0	0	109.7	V48 Q49	V48-Q61 WeakPolarHBondContact CA-O 3.4Å; V48-Q61 WeakPolarHBondContact CG2-O 3.46Å; Q49-Q61 HydrophobicContact CB-CB 4.44Å; Q49-Q61 PolarHBondContact N-O 2.78Å; Q49-Q61 PolarHBondContact O-N 3.06Å
62	I	97.3	Very high	96	Very high	33 Å²	33	71.1 Å²	71.1	17%	0.169	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.9	173.2	-56.2	172.7	0	0	0	107.7	F22 V48 E64 V66 A96 C97	F22-I62 HydrophobicContact CE1-CG2 4.19Å; F22-I62 HydrophobicContact CE2-CG2 4.41Å; F22-I62 HydrophobicContact CZ-CG2 3.7Å; V48-I62 HydrophobicContact CG2-CG1 4.41Å; I62-E64 HydrophobicContact CG2-CG 4.4Å; I62-E64 WeakPolarHBondContact CG2-O 3.43Å; I62-V66 HydrophobicContact CG2-CG1 4.04Å; I62-A96 HydrophobicContact CD1-CB 3.78Å; I62-A96 HydrophobicContact CG1-CB 4.43Å; I62-C97 HydrophobicContact CD1-CB 4.5Å; I62-C97 WeakPolarHBondContact CD1-SG 3.38Å
63	Q	96.9	Very high	96.3	Very high	94 Å²	94	67.5 Å²	67.5	44%	0.439	34%	0.337	S	S	.	.			trans	-103.3	13.7	-172.7	-58.6	-173	-36.1	0	0	113.2	K47	K47-Q63 HydrophobicContact CB-CB 3.91Å; K47-Q63 WeakPolarHBondContact O-CB 3.47Å; K47-Q63 PolarHBondContact O-N 3.23Å
64	E	95.4	Very high	96.5	Very high	65 Å²	65	64.8 Å²	64.8	30%	0.304	33%	0.325	S	S	.	.	S	Bend	trans	-145	160.9	177.9	64.3	175.7	86.2	0	0	111.9	F22 G46 K47 I62 V66 K69	F22-E64 HydrophobicContact CE1-CG 4.21Å; F22-E64 HydrophobicContact CZ-CG 4Å; G46-E64 WeakPolarHBondContact CA-OE1 3.35Å; K47-E64 PolarHBondContact N-OE1 3.06Å; I62-E64 HydrophobicContact CG2-CG 4.4Å; I62-E64 WeakPolarHBondContact CG2-O 3.43Å; E64-V66 PolarHBondContact O-N 3.41Å; E64-K69 IonicContact OE2-NZ 3.74Å
65	S	95.9	Very high	96.6	Very high	81 Å²	81	59.6 Å²	59.6	57%	0.566	28%	0.281	S	S	*	.			trans	-75	127.4	178.6	-176.7	0	0	0	0	111.5	K69	S65-K69 WeakPolarHBondContact O-CE 3.48Å; S65-K69 PolarHBondContact O-NZ 3.02Å
66	V	97.1	Very high	96.7	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	26%	0.258	C	S	.	.			trans	-108.9	3.7	174.2	-60	0	0	0	0	112.9	F22 I62 E64 G68 K69 V71 A102	F22-V66 HydrophobicContact CE2-CG1 3.58Å; F22-V66 HydrophobicContact CZ-CG1 3.69Å; I62-V66 HydrophobicContact CG2-CG1 4.04Å; E64-V66 PolarHBondContact O-N 3.41Å; V66-G68 PolarHBondContact O-N 3Å; V66-K69 WeakPolarHBondContact O-CB 3.3Å; V66-K69 PolarHBondContact O-N 3.03Å; V66-K69 VanDerWaalsContact O-N 3.12Å; V66-V71 HydrophobicContact CB-CG2 3.99Å; V66-V71 HydrophobicContact CG1-CG2 4.26Å; V66-A102 HydrophobicContact CG2-CB 4.48Å; V66-A102 WeakPolarHBondContact O-CA 3.5Å
67	R	96.6	Very high	96.6	Very high	165 Å²	165	45.9 Å²	45.9	62%	0.623	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	123.5	-175.1	179.7	179.5	-64.8	-78.8	-3.8	111.1	K69 S100 C101	R67-K69 PolarHBondContact O-N 3.17Å; R67-S100 WeakPolarHBondContact CA-O 3.36Å; R67-C101 HydrophobicContact CG-CB 4.29Å; R67-C101 PolarHBondContact NH1-SG 3.48Å; R67-C101 VanDerWaalsContact NH1-SG 3.36Å
68	G	95.5	Very high	95.7	Very high	30 Å²	30	40.5 Å²	40.5	31%	0.309	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	9.6	177.6	0	0	0	0	0	114.9	V66 C101 R103	V66-G68 PolarHBondContact O-N 3Å; G68-C101 PolarHBondContact N-O 3.38Å; G68-R103 VanDerWaalsContact O-CZ 3.24Å; G68-R103 PolarHBondContact O-NE 3.33Å; G68-R103 PolarHBondContact O-NH2 3.09Å
69	K	96.7	Very high	94.6	Very high	59 Å²	59	42.1 Å²	42.1	26%	0.257	21%	0.207	S	C	.	.			trans	-93	159	177	-63	-168.5	-173.9	169	0	111.6	G18 V20 E64 S65 V66 R67 R103	G18-K69 WeakPolarHBondContact O-CA 3.43Å; G18-K69 VanDerWaalsContact O-CB 3.28Å; G18-K69 WeakPolarHBondContact O-CB 3.28Å; V20-K69 HydrophobicContact CG2-CB 4.31Å; V20-K69 HydrophobicContact CG2-CD 3.33Å; V20-K69 HydrophobicContact CG2-CG 4.47Å; E64-K69 IonicContact OE2-NZ 3.74Å; S65-K69 WeakPolarHBondContact O-CE 3.48Å; S65-K69 PolarHBondContact O-NZ 3.02Å; V66-K69 WeakPolarHBondContact O-CB 3.3Å; V66-K69 PolarHBondContact O-N 3.03Å; V66-K69 VanDerWaalsContact O-N 3.12Å; R67-K69 PolarHBondContact O-N 3.17Å; K69-R103 WeakPolarHBondContact O-CB 3.47Å; K69-R103 PolarHBondContact O-N 2.77Å
70	D	97.1	Very high	93.2	Very high	23 Å²	23	40.5 Å²	40.5	12%	0.123	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	113.5	172.3	-64.3	-51.3	0	0	0	108.5	G18 V20 F72 R103 S104	G18-D70 PolarHBondContact O-N 2.81Å; V20-D70 PolarHBondContact N-O 2.83Å; D70-F72 HydrophobicContact CB-CE2 4.43Å; D70-R103 WeakPolarHBondContact OD1-CD 3.38Å; D70-S104 WeakPolarHBondContact CA-OG 3.31Å; D70-S104 WeakPolarHBondContact CB-OG 3.49Å; D70-S104 WeakPolarHBondContact OD1-CB 3.36Å; D70-S104 PolarHBondContact OD1-OG 2.88Å
71	V	98.3	Very high	91.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.7	-169.9	-177.2	0	0	0	0	110.2	V20 F22 V66 I73 A102 S104 I105 T106	V20-V71 WeakPolarHBondContact O-CA 3.46Å; F22-V71 HydrophobicContact CD2-CG1 3.63Å; F22-V71 HydrophobicContact CE2-CG1 3.84Å; V66-V71 HydrophobicContact CB-CG2 3.99Å; V66-V71 HydrophobicContact CG1-CG2 4.26Å; V71-I73 HydrophobicContact CG1-CG1 4.06Å; V71-A102 HydrophobicContact CG2-CB 3.79Å; V71-S104 PolarHBondContact N-O 2.98Å; V71-I105 CarbonylContact O-C 3.58Å; V71-I105 WeakPolarHBondContact O-CA 3.48Å; V71-T106 PolarHBondContact O-N 2.85Å
72	F	98.6	Very high	91.3	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.009	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.9	173.4	-66.3	-101.5	0	0	0	109.2	L19 V20 I21 F22 D70 T106 V108 I144 I350 I353 H354	L19-F72 HydrophobicContact CD1-CD2 3.21Å; L19-F72 HydrophobicContact CD1-CE2 3.18Å; L19-F72 HydrophobicContact CD1-CG 4.36Å; L19-F72 HydrophobicContact CD1-CZ 4.3Å; V20-F72 PolarHBondContact O-N 3.17Å; I21-F72 CarbonylContact C-O 3.44Å; I21-F72 WeakPolarHBondContact CA-O 3.36Å; I21-F72 HydrophobicContact CG1-CB 4.41Å; F22-F72 PolarHBondContact N-O 2.86Å; D70-F72 HydrophobicContact CB-CE2 4.43Å; F72-T106 CarbonylContact C-O 3.57Å; F72-T106 WeakPolarHBondContact CA-O 3.44Å; F72-T106 HydrophobicContact CD1-CG2 3.62Å; F72-T106 HydrophobicContact CE1-CG2 3.68Å; F72-V108 HydrophobicContact CB-CG2 4.39Å; F72-V108 HydrophobicContact CD1-CG2 4.16Å; F72-I144 HydrophobicContact CE1-CD1 4.4Å; F72-I350 HydrophobicContact CD1-CB 4.2Å; F72-I350 HydrophobicContact CD1-CD1 4.49Å; F72-I350 HydrophobicContact CD1-CG1 3.76Å; F72-I350 HydrophobicContact CD1-CG2 3.78Å; F72-I350 HydrophobicContact CD2-CG2 4.15Å; F72-I350 HydrophobicContact CE1-CB 4.15Å; F72-I350 HydrophobicContact CE1-CG1 4.09Å; F72-I350 HydrophobicContact CE1-CG2 3.8Å; F72-I350 HydrophobicContact CE2-CG2 4.18Å; F72-I350 HydrophobicContact CG-CG1 4.46Å; F72-I350 HydrophobicContact CG-CG2 3.95Å; F72-I350 HydrophobicContact CZ-CG2 4Å; F72-I353 HydrophobicContact CE1-CB 4.43Å; F72-I353 HydrophobicContact CE1-CG2 4.24Å; F72-I353 HydrophobicContact CZ-CB 4.44Å; F72-I353 HydrophobicContact CZ-CG2 4.13Å; F72-H354 HydrophobicContact CE2-CB 4.36Å; F72-H354 HydrophobicContact CZ-CB 4.23Å
73	I	98.4	Very high	91.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	108.5	-180	-61.8	167.8	0	0	0	108.1	A24 V71 M93 V94 I105 T106 V108	A24-I73 HydrophobicContact CB-CG2 3.71Å; V71-I73 HydrophobicContact CG1-CG1 4.06Å; I73-M93 HydrophobicContact CD1-CB 4.4Å; I73-M93 HydrophobicContact CD1-CG 3.85Å; I73-M93 HydrophobicContact CD1-SD 4.4Å; I73-M93 HydrophobicContact CG1-CG 4.26Å; I73-M93 HydrophobicContact CG1-SD 4.18Å; I73-M93 HydrophobicContact CG2-CG 4.32Å; I73-M93 HydrophobicContact CG2-SD 3.69Å; I73-V94 HydrophobicContact CD1-CB 4.37Å; I73-V94 HydrophobicContact CD1-CG2 3.67Å; I73-I105 HydrophobicContact CD1-CG2 3.65Å; I73-I105 HydrophobicContact CG1-CG2 4.47Å; I73-T106 PolarHBondContact N-O 3.06Å; I73-V108 PolarHBondContact O-N 2.91Å
74	I	98.2	Very high	91	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.2	176.2	-55.1	173.2	0	0	0	108.3	I21 F22 T23 A24 I37 V108	I21-I74 HydrophobicContact CG2-CD1 3.43Å; I21-I74 VanDerWaalsContact CG2-CD1 3.43Å; I21-I74 HydrophobicContact CG2-CG1 4Å; F22-I74 PolarHBondContact O-N 3.35Å; T23-I74 WeakPolarHBondContact CA-O 3.4Å; A24-I74 PolarHBondContact N-O 2.95Å; I37-I74 HydrophobicContact CB-CD1 4.03Å; I37-I74 HydrophobicContact CD1-CD1 3.88Å; I37-I74 HydrophobicContact CG2-CD1 3.89Å; I74-V108 WeakPolarHBondContact CA-O 3.28Å; I74-V108 HydrophobicContact CG1-CB 4.06Å; I74-V108 HydrophobicContact CG1-CG1 4.43Å; I74-V108 HydrophobicContact CG1-CG2 4.44Å
75	Q	96.4	Very high	91	Very high	5 Å²	5	37.6 Å²	37.6	2%	0.023	20%	0.198	C	C	.	.			trans	-132.1	118.8	176.5	-173.3	70.1	-45.6	0	0	110.7	A24 N25 T86 M90 V108 L109 P110	A24-Q75 HydrophobicContact CB-CB 4.36Å; A24-Q75 HydrophobicContact CB-CG 4.46Å; N25-Q75 PolarHBondContact ND2-OE1 3.02Å; N25-Q75 VanDerWaalsContact ND2-OE1 3.08Å; N25-Q75 PolarHBondContact OD1-OE1 2.85Å; Q75-T86 HydrophobicContact CG-CG2 3.74Å; Q75-T86 PolarHBondContact NE2-O 3.27Å; Q75-M90 HydrophobicContact CG-CB 4.1Å; Q75-V108 PolarHBondContact N-O 2.93Å; Q75-L109 HydrophobicContact CB-CG 4.45Å; Q75-P110 WeakPolarHBondContact O-CD 3.49Å
76	T	94.9	Very high	90.9	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.173	C	C	.	.			trans	-103.1	147.9	170.6	65.4	0	0	0	0	110.5	N25 S30 L33 T86 P110	N25-T76 PolarHBondContact ND2-O 3.27Å; N25-T76 PolarHBondContact OD1-N 3.25Å; N25-T76 VanDerWaalsContact OD1-N 3.17Å; N25-T76 PolarHBondContact OD1-OG1 2.98Å; S30-T76 WeakPolarHBondContact CB-OG1 3.3Å; S30-T76 PolarHBondContact O-OG1 3.19Å; L33-T76 HydrophobicContact CB-CG2 4.23Å; L33-T76 HydrophobicContact CD2-CG2 3.95Å; T76-T86 WeakPolarHBondContact O-CG2 3.32Å; T76-P110 HydrophobicContact CG2-CG 4.48Å
77	V	91.4	Very high	90.9	Very high	13 Å²	13	34.3 Å²	34.3	8%	0.079	17%	0.174	C	C	.	.			trans	-90	144.3	166.2	-177.3	0	0	0	0	107.4	V83 T86 Y111 P113 I325 P326	V77-V83 HydrophobicContact CG1-CB 4.43Å; V77-V83 HydrophobicContact CG1-CG2 4.13Å; V77-T86 HydrophobicContact CG2-CG2 4.27Å; V77-Y111 HydrophobicContact CB-CD1 3.92Å; V77-Y111 HydrophobicContact CB-CE1 4.35Å; V77-Y111 HydrophobicContact CG2-CD1 3.8Å; V77-Y111 HydrophobicContact CG2-CE1 4.24Å; V77-P113 HydrophobicContact CG2-CB 4.1Å; V77-P113 HydrophobicContact CG2-CG 4.42Å; V77-I325 WeakPolarHBondContact O-CG2 3.14Å; V77-P326 WeakPolarHBondContact O-CD 3.26Å
78	S	77.9	Confident	90.9	Very high	5 Å²	5	30.8 Å²	30.8	4%	0.035	17%	0.166	C	C	.	.			trans	-137.3	148.2	177.1	174.3	0	0	0	0	110	S30 I80 R81	S30-S78 WeakPolarHBondContact OG-CB 3.45Å; S78-I80 PolarHBondContact O-N 2.79Å; S78-I80 PolarHBondContact OG-N 2.86Å; S78-R81 PolarHBondContact O-N 3.38Å
79	N	71.3	Confident	90.9	Very high	56 Å²	56	29.4 Å²	29.4	30%	0.299	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.8	179.1	-51.7	-43.3	0	0	0	114.1	R81 L302 Q330	N79-R81 VanDerWaalsContact C-N 3.32Å; N79-L302 PolarHBondContact ND2-O 3.2Å; N79-L302 PolarHBondContact OD1-O 2.99Å; N79-L302 VanDerWaalsContact OD1-O 3.09Å; N79-Q330 PolarHBondContact ND2-NE2 3.33Å
80	I	67.5	Low	90.9	Very high	90 Å²	90	26.7 Å²	26.7	46%	0.462	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-24.2	176.5	-55.4	170.4	0	0	0	110.2	S78 L329	S78-I80 PolarHBondContact O-N 2.79Å; S78-I80 PolarHBondContact OG-N 2.86Å; I80-L329 HydrophobicContact CD1-CD1 3.59Å; I80-L329 HydrophobicContact CD1-CG 4.4Å; I80-L329 HydrophobicContact CG1-CD1 3.92Å
81	R	70.8	Confident	91	Very high	36 Å²	36	26.7 Å²	26.7	14%	0.136	14%	0.14	C	C	.	.	S	Bend	trans	-115.4	142.6	-175.2	-163.4	85.9	177.6	-75.4	8.8	109.9	S26 S78 N79 V83 T85 E89	S26-R81 PolarHBondContact OG-NH1 2.96Å; S26-R81 PolarHBondContact OG-NH2 3.49Å; S78-R81 PolarHBondContact O-N 3.38Å; N79-R81 VanDerWaalsContact C-N 3.32Å; R81-V83 PolarHBondContact O-N 2.93Å; R81-T85 VanDerWaalsContact CZ-CG2 3.4Å; R81-E89 IonicContact CZ-OE1 3.51Å; R81-E89 IonicContact CZ-OE2 2.98Å; R81-E89 IonicContact NH1-OE1 2.73Å; R81-E89 PolarHBondContact NH1-OE1 3.21Å; R81-E89 IonicContact NH1-OE2 2.82Å; R81-E89 PolarHBondContact NH1-OE2 3.12Å; R81-E89 IonicContact NH2-OE1 2.69Å; R81-E89 PolarHBondContact NH2-OE1 2.8Å; R81-E89 IonicContact NH2-OE2 3.82Å
82	D	86.2	Confident	91	Very high	78 Å²	78	29.1 Å²	29.1	42%	0.417	15%	0.152	S	C	.	.			trans	-59.6	134.4	168.5	164.8	52.3	0	0	0	111.6	N84 T85 T86	D82-N84 VanDerWaalsContact C-N 3.27Å; D82-N84 PolarHBondContact O-N 3.07Å; D82-N84 PolarHBondContact OD1-N 2.81Å; D82-N84 PolarHBondContact OD1-ND2 3.49Å; D82-N84 VanDerWaalsContact OD2-CB 3.27Å; D82-N84 WeakPolarHBondContact OD2-CB 3.49Å; D82-N84 PolarHBondContact OD2-N 3.41Å; D82-T85 PolarHBondContact O-N 2.81Å; D82-T85 PolarHBondContact OD2-N 3.31Å; D82-T85 PolarHBondContact OD2-OG1 3Å; D82-T85 VanDerWaalsContact OD2-OG1 3.07Å; D82-T86 PolarHBondContact O-N 2.98Å; D82-T86 VanDerWaalsContact O-N 3.13Å; D82-T86 PolarHBondContact O-OG1 3.31Å; D82-T86 VanDerWaalsContact O-OG1 3.12Å
83	V	92.8	Very high	91	Very high	40 Å²	40	29 Å²	29	24%	0.242	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-34.9	-179.9	64.8	0	0	0	0	111.5	V77 R81 T86 I87 P113 Y114	V77-V83 HydrophobicContact CG1-CB 4.43Å; V77-V83 HydrophobicContact CG1-CG2 4.13Å; R81-V83 PolarHBondContact O-N 2.93Å; V83-T86 WeakPolarHBondContact O-CB 3.28Å; V83-T86 PolarHBondContact O-N 3.42Å; V83-I87 HydrophobicContact CG2-CD1 4.36Å; V83-I87 WeakPolarHBondContact O-CG1 3.28Å; V83-I87 PolarHBondContact O-N 3.28Å; V83-P113 HydrophobicContact CG2-CB 3.61Å; V83-Y114 HydrophobicContact CG1-CE2 4.02Å; V83-Y114 HydrophobicContact CG2-CE2 4.01Å
84	N	94.7	Very high	91	Very high	81 Å²	81	29 Å²	29	43%	0.433	15%	0.152	S	C	.	.	H	α-helix	trans	-67.1	-43	179.4	-56.3	-76.7	0	0	0	111	D82 T86 I87 M88 Y114	D82-N84 VanDerWaalsContact C-N 3.27Å; D82-N84 PolarHBondContact O-N 3.07Å; D82-N84 PolarHBondContact OD1-N 2.81Å; D82-N84 PolarHBondContact OD1-ND2 3.49Å; D82-N84 VanDerWaalsContact OD2-CB 3.27Å; D82-N84 WeakPolarHBondContact OD2-CB 3.49Å; D82-N84 PolarHBondContact OD2-N 3.41Å; N84-T86 VanDerWaalsContact C-N 3.29Å; N84-T86 PolarHBondContact O-N 3.32Å; N84-I87 WeakPolarHBondContact O-CB 3.41Å; N84-I87 PolarHBondContact O-N 3.04Å; N84-I87 VanDerWaalsContact O-N 3.15Å; N84-M88 WeakPolarHBondContact O-CG 3.34Å; N84-M88 PolarHBondContact O-N 2.87Å; N84-Y114 PolarHBondContact OD1-OH 3.24Å
85	T	94.7	Very high	91	Very high	22 Å²	22	35.6 Å²	35.6	14%	0.135	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-42.4	174.1	-57.4	0	0	0	0	111.3	Q52 R81 D82 I87 M88 E89	Q52-T85 HydrophobicContact CG-CG2 4.43Å; R81-T85 VanDerWaalsContact CZ-CG2 3.4Å; D82-T85 PolarHBondContact O-N 2.81Å; D82-T85 PolarHBondContact OD2-N 3.31Å; D82-T85 PolarHBondContact OD2-OG1 3Å; D82-T85 VanDerWaalsContact OD2-OG1 3.07Å; T85-I87 VanDerWaalsContact C-N 3.3Å; T85-I87 PolarHBondContact O-N 3.35Å; T85-M88 PolarHBondContact O-N 3.07Å; T85-M88 VanDerWaalsContact O-N 3.17Å; T85-E89 WeakPolarHBondContact O-CG 3.45Å; T85-E89 PolarHBondContact O-N 2.9Å
86	T	94.9	Very high	91.1	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-39.4	175.9	-55.2	0	0	0	0	111.7	Q75 T76 V77 D82 V83 N84 M90	Q75-T86 HydrophobicContact CG-CG2 3.74Å; Q75-T86 PolarHBondContact NE2-O 3.27Å; T76-T86 WeakPolarHBondContact O-CG2 3.32Å; V77-T86 HydrophobicContact CG2-CG2 4.27Å; D82-T86 PolarHBondContact O-N 2.98Å; D82-T86 VanDerWaalsContact O-N 3.13Å; D82-T86 PolarHBondContact O-OG1 3.31Å; D82-T86 VanDerWaalsContact O-OG1 3.12Å; V83-T86 WeakPolarHBondContact O-CB 3.28Å; V83-T86 PolarHBondContact O-N 3.42Å; N84-T86 VanDerWaalsContact C-N 3.29Å; N84-T86 PolarHBondContact O-N 3.32Å; T86-M90 PolarHBondContact O-N 2.87Å
87	I	95.9	Very high	91.3	Very high	9 Å²	9	36.4 Å²	36.4	5%	0.046	19%	0.186	C	C	.	.	H	α-helix	trans	-65.6	-44.4	174.9	-68.8	165.8	0	0	0	110.6	V83 N84 T85 M90 L91 P113 Y114 I131	V83-I87 HydrophobicContact CG2-CD1 4.36Å; V83-I87 WeakPolarHBondContact O-CG1 3.28Å; V83-I87 PolarHBondContact O-N 3.28Å; N84-I87 WeakPolarHBondContact O-CB 3.41Å; N84-I87 PolarHBondContact O-N 3.04Å; N84-I87 VanDerWaalsContact O-N 3.15Å; T85-I87 VanDerWaalsContact C-N 3.3Å; T85-I87 PolarHBondContact O-N 3.35Å; I87-M90 PolarHBondContact O-N 2.81Å; I87-L91 HydrophobicContact CG2-CD1 3.75Å; I87-L91 HydrophobicContact CG2-CG 4.12Å; I87-L91 VanDerWaalsContact O-CG 3.3Å; I87-L91 WeakPolarHBondContact O-CG 3.37Å; I87-L91 PolarHBondContact O-N 3.06Å; I87-P113 HydrophobicContact CD1-CB 4.21Å; I87-P113 HydrophobicContact CD1-CG 4.03Å; I87-P113 HydrophobicContact CG1-CB 4.46Å; I87-P113 HydrophobicContact CG1-CG 3.9Å; I87-Y114 HydrophobicContact CD1-CD2 3.59Å; I87-Y114 HydrophobicContact CD1-CE2 3.35Å; I87-I131 HydrophobicContact CD1-CD1 3.96Å; I87-I131 HydrophobicContact CD1-CG1 4.47Å
88	M	97	Very high	91.6	Very high	92 Å²	92	41.9 Å²	41.9	45%	0.453	21%	0.205	S	C	.	.	H	α-helix	trans	-63.2	-42.6	179	-69.3	-55.6	-62.7	0	0	112.5	N84 T85 M90 L91 I92	N84-M88 WeakPolarHBondContact O-CG 3.34Å; N84-M88 PolarHBondContact O-N 2.87Å; T85-M88 PolarHBondContact O-N 3.07Å; T85-M88 VanDerWaalsContact O-N 3.17Å; M88-M90 VanDerWaalsContact C-N 3.29Å; M88-M90 PolarHBondContact O-N 2.86Å; M88-L91 PolarHBondContact O-N 3.34Å; M88-L91 HydrophobicContact SD-CD1 4.25Å; M88-I92 HydrophobicContact CE-CD1 4.42Å; M88-I92 WeakPolarHBondContact O-CB 3.49Å; M88-I92 WeakPolarHBondContact O-CD1 3.44Å; M88-I92 WeakPolarHBondContact O-CG1 3.39Å; M88-I92 PolarHBondContact O-N 2.94Å
89	E	96.3	Very high	92.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-54.5	-46.5	173.6	-77	-179.2	152.6	0	0	112.3	S26 V50 T58 R81 T85 M93	S26-E89 WeakPolarHBondContact CB-OE1 3.38Å; S26-E89 PolarHBondContact N-OE1 2.94Å; S26-E89 PolarHBondContact OG-OE1 2.75Å; S26-E89 VanDerWaalsContact OG-OE1 3.1Å; V50-E89 HydrophobicContact CG1-CB 4.32Å; V50-E89 HydrophobicContact CG1-CG 3.7Å; V50-E89 VanDerWaalsContact CG1-OE1 3.27Å; V50-E89 WeakPolarHBondContact CG1-OE1 3.45Å; T58-E89 HydrophobicContact CG2-CB 4.27Å; T58-E89 HydrophobicContact CG2-CG 3.42Å; T58-E89 VanDerWaalsContact CG2-CG 3.42Å; R81-E89 IonicContact CZ-OE1 3.51Å; R81-E89 IonicContact CZ-OE2 2.98Å; R81-E89 IonicContact NH1-OE1 2.73Å; R81-E89 PolarHBondContact NH1-OE1 3.21Å; R81-E89 IonicContact NH1-OE2 2.82Å; R81-E89 PolarHBondContact NH1-OE2 3.12Å; R81-E89 IonicContact NH2-OE1 2.69Å; R81-E89 PolarHBondContact NH2-OE1 2.8Å; R81-E89 IonicContact NH2-OE2 3.82Å; T85-E89 WeakPolarHBondContact O-CG 3.45Å; T85-E89 PolarHBondContact O-N 2.9Å; E89-M93 VanDerWaalsContact O-CB 3.31Å; E89-M93 WeakPolarHBondContact O-CB 3.32Å; E89-M93 PolarHBondContact O-N 2.89Å
90	M	96.2	Very high	93.8	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-65.6	-49.6	178	177	-172.1	58	0	0	111.5	Q75 T86 I87 M88 I92 M93 V94 L109 V135	Q75-M90 HydrophobicContact CG-CB 4.1Å; T86-M90 PolarHBondContact O-N 2.87Å; I87-M90 PolarHBondContact O-N 2.81Å; M88-M90 VanDerWaalsContact C-N 3.29Å; M88-M90 PolarHBondContact O-N 2.86Å; M90-I92 VanDerWaalsContact C-N 3.31Å; M90-I92 PolarHBondContact O-N 2.79Å; M90-M93 PolarHBondContact O-N 2.89Å; M90-V94 HydrophobicContact CG-CG2 4.27Å; M90-V94 WeakPolarHBondContact O-CB 3.49Å; M90-V94 VanDerWaalsContact O-CG2 3.26Å; M90-V94 WeakPolarHBondContact O-CG2 3.42Å; M90-V94 PolarHBondContact O-N 3.29Å; M90-L109 HydrophobicContact CE-CD2 4.2Å; M90-L109 HydrophobicContact SD-CD1 3.68Å; M90-L109 HydrophobicContact SD-CD2 3.6Å; M90-L109 HydrophobicContact SD-CG 3.93Å; M90-V135 HydrophobicContact CE-CG2 3.44Å; M90-V135 VanDerWaalsContact CE-CG2 3.44Å; M90-V135 HydrophobicContact SD-CG2 4.49Å
91	L	98.3	Very high	95.2	Very high	23 Å²	23	44 Å²	44	12%	0.12	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-43.8	-178.6	-70.4	175.6	0	0	0	111.4	I87 M88 Y95 M134 V135 A138	I87-L91 HydrophobicContact CG2-CD1 3.75Å; I87-L91 HydrophobicContact CG2-CG 4.12Å; I87-L91 VanDerWaalsContact O-CG 3.3Å; I87-L91 WeakPolarHBondContact O-CG 3.37Å; I87-L91 PolarHBondContact O-N 3.06Å; M88-L91 PolarHBondContact O-N 3.34Å; M88-L91 HydrophobicContact SD-CD1 4.25Å; L91-Y95 VanDerWaalsContact O-CB 3.29Å; L91-Y95 WeakPolarHBondContact O-CB 3.44Å; L91-Y95 PolarHBondContact O-N 2.95Å; L91-M134 HydrophobicContact CD1-CB 4.32Å; L91-M134 HydrophobicContact CD2-CB 4.17Å; L91-V135 HydrophobicContact CD2-CB 4.33Å; L91-V135 HydrophobicContact CD2-CG2 3.78Å; L91-A138 HydrophobicContact CD2-CB 3.9Å
92	I	98.4	Very high	96.5	Very high	50 Å²	50	43.2 Å²	43.2	26%	0.256	23%	0.229	S	C	.	.	H	α-helix	trans	-66.4	-42.9	178.3	-63.8	166.6	0	0	0	110.3	T58 V60 M88 M90 Y95 A96	T58-I92 HydrophobicContact CG2-CD1 3.95Å; T58-I92 WeakPolarHBondContact O-CD1 3.31Å; V60-I92 HydrophobicContact CB-CG2 3.82Å; V60-I92 HydrophobicContact CG2-CB 4.04Å; V60-I92 HydrophobicContact CG2-CG2 3.76Å; M88-I92 HydrophobicContact CE-CD1 4.42Å; M88-I92 WeakPolarHBondContact O-CB 3.49Å; M88-I92 WeakPolarHBondContact O-CD1 3.44Å; M88-I92 WeakPolarHBondContact O-CG1 3.39Å; M88-I92 PolarHBondContact O-N 2.94Å; M90-I92 VanDerWaalsContact C-N 3.31Å; M90-I92 PolarHBondContact O-N 2.79Å; I92-Y95 PolarHBondContact O-N 2.87Å; I92-A96 WeakPolarHBondContact O-CB 3.19Å; I92-A96 PolarHBondContact O-N 2.82Å
93	M	98.4	Very high	97	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-43.7	178.1	-172.4	170.7	-66.8	0	0	112.6	F22 A24 V48 V50 V60 I73 E89 M90 Y95 A96 C97	F22-M93 HydrophobicContact CB-SD 3.76Å; F22-M93 HydrophobicContact CG-SD 4.44Å; A24-M93 VanDerWaalsContact CA-CE 3.47Å; A24-M93 HydrophobicContact CB-CB 4.45Å; A24-M93 HydrophobicContact CB-CE 3.85Å; A24-M93 HydrophobicContact CB-SD 3.7Å; V48-M93 HydrophobicContact CG1-CE 4.23Å; V48-M93 HydrophobicContact CG2-CE 3.6Å; V50-M93 HydrophobicContact CG2-CE 3.5Å; V60-M93 HydrophobicContact CG1-CB 4.04Å; V60-M93 HydrophobicContact CG1-CE 3.68Å; V60-M93 HydrophobicContact CG1-CG 4.16Å; V60-M93 HydrophobicContact CG2-CB 4.44Å; I73-M93 HydrophobicContact CD1-CB 4.4Å; I73-M93 HydrophobicContact CD1-CG 3.85Å; I73-M93 HydrophobicContact CD1-SD 4.4Å; I73-M93 HydrophobicContact CG1-CG 4.26Å; I73-M93 HydrophobicContact CG1-SD 4.18Å; I73-M93 HydrophobicContact CG2-CG 4.32Å; I73-M93 HydrophobicContact CG2-SD 3.69Å; E89-M93 VanDerWaalsContact O-CB 3.31Å; E89-M93 WeakPolarHBondContact O-CB 3.32Å; E89-M93 PolarHBondContact O-N 2.89Å; M90-M93 PolarHBondContact O-N 2.89Å; M93-Y95 VanDerWaalsContact C-N 3.34Å; M93-A96 PolarHBondContact O-N 3.22Å; M93-C97 PolarHBondContact O-N 3.48Å; M93-C97 PolarHBondContact O-SG 2.82Å
94	V	98.5	Very high	97.2	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-47.9	174.1	169.2	0	0	0	0	110	I73 M90 A96 C97 R98 I105 A138 L140	I73-V94 HydrophobicContact CD1-CB 4.37Å; I73-V94 HydrophobicContact CD1-CG2 3.67Å; M90-V94 HydrophobicContact CG-CG2 4.27Å; M90-V94 WeakPolarHBondContact O-CB 3.49Å; M90-V94 VanDerWaalsContact O-CG2 3.26Å; M90-V94 WeakPolarHBondContact O-CG2 3.42Å; M90-V94 PolarHBondContact O-N 3.29Å; V94-A96 PolarHBondContact O-N 2.96Å; V94-C97 PolarHBondContact O-N 3.43Å; V94-R98 PolarHBondContact O-N 3.45Å; V94-I105 HydrophobicContact CG1-CG2 4.23Å; V94-I105 HydrophobicContact CG2-CG2 4.26Å; V94-A138 HydrophobicContact CB-CB 4.32Å; V94-A138 HydrophobicContact CG1-CB 3.87Å; V94-L140 HydrophobicContact CG1-CB 4.33Å; V94-L140 HydrophobicContact CG1-CD1 4.28Å; V94-L140 HydrophobicContact CG2-CD1 3.71Å
95	Y	98.6	Very high	97.4	Very high	138 Å²	138	41.9 Å²	41.9	54%	0.541	21%	0.212	S	C	.	.	H	α-helix	trans	-65	-37.1	179.8	-167.9	-105.3	0	0	0	112.7	L91 I92 M93 R98 T99	L91-Y95 VanDerWaalsContact O-CB 3.29Å; L91-Y95 WeakPolarHBondContact O-CB 3.44Å; L91-Y95 PolarHBondContact O-N 2.95Å; I92-Y95 PolarHBondContact O-N 2.87Å; M93-Y95 VanDerWaalsContact C-N 3.34Å; Y95-R98 PolarHBondContact O-N 3.39Å; Y95-T99 WeakPolarHBondContact O-CB 3.27Å; Y95-T99 PolarHBondContact O-N 2.87Å; Y95-T99 PolarHBondContact O-OG1 2.91Å
96	A	98.4	Very high	97.6	Very high	24 Å²	24	41 Å²	41	20%	0.198	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-42.4	174.6	0	0	0	0	0	111.9	I62 I92 M93 V94 T99 S100	I62-A96 HydrophobicContact CD1-CB 3.78Å; I62-A96 HydrophobicContact CG1-CB 4.43Å; I92-A96 WeakPolarHBondContact O-CB 3.19Å; I92-A96 PolarHBondContact O-N 2.82Å; M93-A96 PolarHBondContact O-N 3.22Å; V94-A96 PolarHBondContact O-N 2.96Å; A96-T99 PolarHBondContact O-N 3.12Å; A96-S100 VanDerWaalsContact O-CB 3.3Å; A96-S100 WeakPolarHBondContact O-CB 3.36Å; A96-S100 PolarHBondContact O-N 3.47Å; A96-S100 PolarHBondContact O-OG 3.35Å
97	C	98.3	Very high	97.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-42.2	175.3	-67.7	0	0	0	0	111.7	I62 M93 V94 S100 C101 A102 I105	I62-C97 HydrophobicContact CD1-CB 4.5Å; I62-C97 WeakPolarHBondContact CD1-SG 3.38Å; M93-C97 PolarHBondContact O-N 3.48Å; M93-C97 PolarHBondContact O-SG 2.82Å; V94-C97 PolarHBondContact O-N 3.43Å; C97-S100 CarbonylContact O-C 3.45Å; C97-S100 PolarHBondContact O-N 3.34Å; C97-C101 PolarHBondContact O-N 3.35Å; C97-A102 HydrophobicContact CB-CB 4.24Å; C97-A102 WeakPolarHBondContact O-CB 3.32Å; C97-A102 PolarHBondContact O-N 2.93Å; C97-I105 HydrophobicContact CB-CD1 3.76Å; C97-I105 HydrophobicContact CB-CG1 4.14Å
98	R	98	Very high	97.9	Very high	127 Å²	127	40.4 Å²	40.4	48%	0.479	20%	0.203	S	C	.	.	H	α-helix	trans	-62.5	-49.5	176.6	-176.7	-168.2	-178.5	167	0.4	111.5	V94 Y95 S100 C101 I105 K137 A138	V94-R98 PolarHBondContact O-N 3.45Å; Y95-R98 PolarHBondContact O-N 3.39Å; R98-S100 PolarHBondContact O-N 2.84Å; R98-C101 PolarHBondContact O-N 3.28Å; R98-I105 HydrophobicContact CB-CD1 3.74Å; R98-I105 VanDerWaalsContact N-CD1 3.34Å; R98-K137 PolarHBondContact NH1-O 3.43Å; R98-A138 VanDerWaalsContact CD-O 3.26Å; R98-A138 WeakPolarHBondContact CD-O 3.47Å; R98-A138 PolarHBondContact NH1-O 3.05Å
99	T	98.1	Very high	97.9	Very high	89 Å²	89	36.1 Å²	36.1	55%	0.546	18%	0.182	S	C	.	.	H	α-helix	trans	-58.5	-34	177	-58	0	0	0	0	111.3	Y95 A96 C101	Y95-T99 WeakPolarHBondContact O-CB 3.27Å; Y95-T99 PolarHBondContact O-N 2.87Å; Y95-T99 PolarHBondContact O-OG1 2.91Å; A96-T99 PolarHBondContact O-N 3.12Å; T99-C101 PolarHBondContact O-N 3.18Å
100	S	97.8	Very high	98	Very high	47 Å²	47	36.1 Å²	36.1	33%	0.329	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	11.9	176.4	-55.5	0	0	0	0	114.1	R67 A96 C97 R98 A102	R67-S100 WeakPolarHBondContact CA-O 3.36Å; A96-S100 VanDerWaalsContact O-CB 3.3Å; A96-S100 WeakPolarHBondContact O-CB 3.36Å; A96-S100 PolarHBondContact O-N 3.47Å; A96-S100 PolarHBondContact O-OG 3.35Å; C97-S100 CarbonylContact O-C 3.45Å; C97-S100 PolarHBondContact O-N 3.34Å; R98-S100 PolarHBondContact O-N 2.84Å; S100-A102 PolarHBondContact O-N 3.29Å
101	C	97.2	Very high	98	Very high	60 Å²	60	36.7 Å²	36.7	41%	0.405	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	39.9	177.2	-49	0	0	0	0	114	R67 G68 C97 R98 T99	R67-C101 HydrophobicContact CG-CB 4.29Å; R67-C101 PolarHBondContact NH1-SG 3.48Å; R67-C101 VanDerWaalsContact NH1-SG 3.36Å; G68-C101 PolarHBondContact N-O 3.38Å; C97-C101 PolarHBondContact O-N 3.35Å; R98-C101 PolarHBondContact O-N 3.28Å; T99-C101 PolarHBondContact O-N 3.18Å
102	A	97.8	Very high	98	Very high	19 Å²	19	35.7 Å²	35.7	16%	0.157	18%	0.179	C	C	.	.			trans	-54.5	143.5	164.4	0	0	0	0	0	110.5	V66 V71 C97 S100 I105	V66-A102 HydrophobicContact CG2-CB 4.48Å; V66-A102 WeakPolarHBondContact O-CA 3.5Å; V71-A102 HydrophobicContact CG2-CB 3.79Å; C97-A102 HydrophobicContact CB-CB 4.24Å; C97-A102 WeakPolarHBondContact O-CB 3.32Å; C97-A102 PolarHBondContact O-N 2.93Å; S100-A102 PolarHBondContact O-N 3.29Å; A102-I105 HydrophobicContact CB-CD1 4.2Å; A102-I105 HydrophobicContact CB-CG1 3.8Å
103	R	96.7	Very high	97.9	Very high	141 Å²	141	33.6 Å²	33.6	53%	0.532	17%	0.169	S	C	.	.	S	Bend	trans	-73	-46.7	-179.7	-177.8	-170.1	-52.6	-172.1	-0.7	110.9	G17 G68 K69 D70	G17-R103 VanDerWaalsContact CA-NH2 3.35Å; G68-R103 VanDerWaalsContact O-CZ 3.24Å; G68-R103 PolarHBondContact O-NE 3.33Å; G68-R103 PolarHBondContact O-NH2 3.09Å; K69-R103 WeakPolarHBondContact O-CB 3.47Å; K69-R103 PolarHBondContact O-N 2.77Å; D70-R103 WeakPolarHBondContact OD1-CD 3.38Å
104	S	97.5	Very high	97.7	Very high	26 Å²	26	35.9 Å²	35.9	18%	0.182	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	149	175	68.2	0	0	0	0	109.2	D70 V71	D70-S104 WeakPolarHBondContact CA-OG 3.31Å; D70-S104 WeakPolarHBondContact CB-OG 3.49Å; D70-S104 WeakPolarHBondContact OD1-CB 3.36Å; D70-S104 PolarHBondContact OD1-OG 2.88Å; V71-S104 PolarHBondContact N-O 2.98Å
105	I	98.5	Very high	97.6	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	100.8	178.7	-51.7	170.8	0	0	0	107.2	V71 I73 V94 C97 R98 A102 L140 T141 H142	V71-I105 CarbonylContact O-C 3.58Å; V71-I105 WeakPolarHBondContact O-CA 3.48Å; I73-I105 HydrophobicContact CD1-CG2 3.65Å; I73-I105 HydrophobicContact CG1-CG2 4.47Å; V94-I105 HydrophobicContact CG1-CG2 4.23Å; V94-I105 HydrophobicContact CG2-CG2 4.26Å; C97-I105 HydrophobicContact CB-CD1 3.76Å; C97-I105 HydrophobicContact CB-CG1 4.14Å; R98-I105 HydrophobicContact CB-CD1 3.74Å; R98-I105 VanDerWaalsContact N-CD1 3.34Å; A102-I105 HydrophobicContact CB-CD1 4.2Å; A102-I105 HydrophobicContact CB-CG1 3.8Å; I105-L140 HydrophobicContact CG2-CD1 3.94Å; I105-L140 WeakPolarHBondContact O-CD1 3.29Å; I105-T141 PolarHBondContact N-OG1 3.14Å; I105-T141 PolarHBondContact O-N 2.88Å; I105-T141 PolarHBondContact O-OG1 3.08Å; I105-T141 VanDerWaalsContact O-OG1 3.07Å; I105-H142 PolarHBondContact O-N 2.75Å
106	T	98.6	Very high	97.2	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.2	178.9	-58.5	0	0	0	0	109.7	V71 F72 I73 V108 H142 I144	V71-T106 PolarHBondContact O-N 2.85Å; F72-T106 CarbonylContact C-O 3.57Å; F72-T106 WeakPolarHBondContact CA-O 3.44Å; F72-T106 HydrophobicContact CD1-CG2 3.62Å; F72-T106 HydrophobicContact CE1-CG2 3.68Å; I73-T106 PolarHBondContact N-O 3.06Å; T106-V108 HydrophobicContact CG2-CG2 4.49Å; T106-H142 CarbonylContact C-O 3.6Å; T106-H142 VanDerWaalsContact CA-O 3.28Å; T106-H142 WeakPolarHBondContact CA-O 3.49Å; T106-H142 HydrophobicContact CG2-CB 4.07Å; T106-I144 HydrophobicContact CG2-CD1 3.96Å; T106-I144 HydrophobicContact CG2-CG1 3.81Å
107	G	98.4	Very high	97	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	126.5	173.7	0	0	0	0	0	108.7	L140 H142 L143 I144	G107-L140 VanDerWaalsContact N-CD1 3.29Å; G107-H142 PolarHBondContact N-O 2.89Å; G107-L143 CarbonylContact O-C 3.43Å; G107-L143 WeakPolarHBondContact O-CA 3.37Å; G107-I144 PolarHBondContact O-N 3.22Å
108	V	98.5	Very high	96.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	96.6	173.6	-173.9	0	0	0	0	107	F72 I73 I74 Q75 T106 P110 I144 L346 I350	F72-V108 HydrophobicContact CB-CG2 4.39Å; F72-V108 HydrophobicContact CD1-CG2 4.16Å; I73-V108 PolarHBondContact O-N 2.91Å; I74-V108 WeakPolarHBondContact CA-O 3.28Å; I74-V108 HydrophobicContact CG1-CB 4.06Å; I74-V108 HydrophobicContact CG1-CG1 4.43Å; I74-V108 HydrophobicContact CG1-CG2 4.44Å; Q75-V108 PolarHBondContact N-O 2.93Å; T106-V108 HydrophobicContact CG2-CG2 4.49Å; V108-P110 WeakPolarHBondContact O-CD 3.45Å; V108-I144 WeakPolarHBondContact CA-O 3.44Å; V108-I144 HydrophobicContact CG1-CB 4.43Å; V108-I144 HydrophobicContact CG2-CB 4.38Å; V108-I144 HydrophobicContact CG2-CD1 4.03Å; V108-L346 HydrophobicContact CG1-CD2 4.09Å; V108-I350 HydrophobicContact CG2-CD1 4.08Å; V108-I350 HydrophobicContact CG2-CG1 4.14Å
109	L	97.8	Very high	96.3	Very high	3 Å²	3	34 Å²	34	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	88	-177	-76.3	65.6	0	0	0	108.5	Q75 M90 Y111 F112 L143 I144 T145	Q75-L109 HydrophobicContact CB-CG 4.45Å; M90-L109 HydrophobicContact CE-CD2 4.2Å; M90-L109 HydrophobicContact SD-CD1 3.68Å; M90-L109 HydrophobicContact SD-CD2 3.6Å; M90-L109 HydrophobicContact SD-CG 3.93Å; L109-Y111 PolarHBondContact O-N 3.16Å; L109-F112 HydrophobicContact CD2-CD2 3.76Å; L109-F112 HydrophobicContact CD2-CE2 4.09Å; L109-L143 HydrophobicContact CB-CD1 4.14Å; L109-L143 HydrophobicContact CD1-CD1 3.79Å; L109-L143 HydrophobicContact CD2-CD1 4.2Å; L109-L143 HydrophobicContact CG-CD1 4.27Å; L109-I144 PolarHBondContact N-O 3.39Å; L109-T145 VanDerWaalsContact O-CA 3.22Å; L109-T145 WeakPolarHBondContact O-CA 3.47Å; L109-T145 VanDerWaalsContact O-CB 3.24Å; L109-T145 WeakPolarHBondContact O-CB 3.46Å; L109-T145 PolarHBondContact O-OG1 3.24Å
110	P	97.4	Very high	95.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-55.4	-39.8	-177.1	-22.1	30.8	0	0	0	112.3	L33 Q75 T76 V108 M146 H300 T324 L346	L33-P110 HydrophobicContact CD2-CB 4.16Å; L33-P110 HydrophobicContact CD2-CG 3.44Å; L33-P110 VanDerWaalsContact CD2-CG 3.44Å; Q75-P110 WeakPolarHBondContact O-CD 3.49Å; T76-P110 HydrophobicContact CG2-CG 4.48Å; V108-P110 WeakPolarHBondContact O-CD 3.45Å; P110-M146 PolarHBondContact O-N 3.37Å; P110-H300 PolarHBondContact O-CE1 2.87Å; P110-T324 HydrophobicContact CB-CG2 3.71Å; P110-L346 HydrophobicContact CB-CD1 4.21Å; P110-L346 HydrophobicContact CG-CD1 3.8Å
111	Y	97.6	Very high	94.9	Very high	14 Å²	14	34.5 Å²	34.5	6%	0.055	16%	0.162	C	C	.	.	S	Bend	trans	-113.1	124.8	167.1	168.8	-111.1	0	0	0	109.7	V77 L109 P113 I272 H300 L302 I325	V77-Y111 HydrophobicContact CB-CD1 3.92Å; V77-Y111 HydrophobicContact CB-CE1 4.35Å; V77-Y111 HydrophobicContact CG2-CD1 3.8Å; V77-Y111 HydrophobicContact CG2-CE1 4.24Å; L109-Y111 PolarHBondContact O-N 3.16Å; Y111-P113 WeakPolarHBondContact O-CD 3.15Å; Y111-I272 HydrophobicContact CE2-CD1 3.93Å; Y111-I272 HydrophobicContact CE2-CG1 4.26Å; Y111-H300 HydrophobicContact CD2-CB 4.03Å; Y111-H300 AromaticContact CD2-CD2 3.85Å; Y111-H300 AromaticContact CD2-CG 3.62Å; Y111-H300 AromaticContact CD2-ND1 3.82Å; Y111-L302 HydrophobicContact CD1-CD1 4.31Å; Y111-L302 HydrophobicContact CD2-CD1 4.25Å; Y111-L302 HydrophobicContact CE1-CD1 3.8Å; Y111-L302 HydrophobicContact CE1-CD2 4.47Å; Y111-L302 HydrophobicContact CE2-CD1 3.77Å; Y111-L302 HydrophobicContact CG-CD1 4.5Å; Y111-I325 HydrophobicContact CD1-CD1 3.76Å; Y111-I325 HydrophobicContact CD1-CG1 4.19Å; Y111-I325 HydrophobicContact CD2-CD1 4.16Å; Y111-I325 HydrophobicContact CE1-CD1 4.3Å; Y111-I325 HydrophobicContact CG-CD1 3.67Å; Y111-I325 HydrophobicContact CG-CG1 4.05Å
112	F	97.4	Very high	94.2	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.013	17%	0.168	C	C	.	.			trans	-85.8	115.9	176.4	-170.2	-109.4	0	0	0	110.8	L109 S115 I131 L143 L148 I153 F157	L109-F112 HydrophobicContact CD2-CD2 3.76Å; L109-F112 HydrophobicContact CD2-CE2 4.09Å; F112-S115 WeakPolarHBondContact O-CB 3.33Å; F112-S115 PolarHBondContact O-N 3.4Å; F112-S115 PolarHBondContact O-OG 2.99Å; F112-I131 HydrophobicContact CE1-CG2 4.48Å; F112-I131 HydrophobicContact CE2-CG2 4.1Å; F112-I131 HydrophobicContact CZ-CB 4.06Å; F112-I131 HydrophobicContact CZ-CG2 3.67Å; F112-L143 HydrophobicContact CD2-CD2 4.47Å; F112-L148 HydrophobicContact CB-CD2 3.61Å; F112-L148 HydrophobicContact CD1-CD2 4.26Å; F112-L148 HydrophobicContact CG-CD2 4.09Å; F112-I153 HydrophobicContact CD1-CG2 4.31Å; F112-I153 HydrophobicContact CE1-CG2 4.32Å; F112-F157 HydrophobicContact CD2-CZ 4.3Å; F112-F157 HydrophobicContact CE1-CZ 4.15Å; F112-F157 HydrophobicContact CE2-CE1 4.24Å; F112-F157 AromaticContact CE2-CZ 3.57Å; F112-F157 HydrophobicContact CE2-CZ 3.57Å; F112-F157 HydrophobicContact CZ-CE1 4.29Å; F112-F157 HydrophobicContact CZ-CE2 4.34Å; F112-F157 AromaticContact CZ-CZ 3.49Å; F112-F157 HydrophobicContact CZ-CZ 3.49Å; F112-F157 VanDerWaalsContact CZ-CZ 3.49Å
113	P	95.5	Very high	93.5	Very high	5 Å²	5	49 Å²	49	3%	0.032	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	155.2	-177.7	29.2	-35.2	0	0	0	111.6	V77 V83 I87 Y111 S115	V77-P113 HydrophobicContact CG2-CB 4.1Å; V77-P113 HydrophobicContact CG2-CG 4.42Å; V83-P113 HydrophobicContact CG2-CB 3.61Å; I87-P113 HydrophobicContact CD1-CB 4.21Å; I87-P113 HydrophobicContact CD1-CG 4.03Å; I87-P113 HydrophobicContact CG1-CB 4.46Å; I87-P113 HydrophobicContact CG1-CG 3.9Å; Y111-P113 WeakPolarHBondContact O-CD 3.15Å; P113-S115 PolarHBondContact O-N 3.05Å; P113-S115 VanDerWaalsContact O-N 3.11Å
114	Y	95.9	Very high	92.9	Very high	48 Å²	48	44.2 Å²	44.2	19%	0.188	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	13.1	-175.4	-65	-94.2	0	0	0	114.7	V83 N84 I87 K116 Q117 V127 S128 I131	V83-Y114 HydrophobicContact CG1-CE2 4.02Å; V83-Y114 HydrophobicContact CG2-CE2 4.01Å; N84-Y114 PolarHBondContact OD1-OH 3.24Å; I87-Y114 HydrophobicContact CD1-CD2 3.59Å; I87-Y114 HydrophobicContact CD1-CE2 3.35Å; Y114-K116 VanDerWaalsContact C-N 3.31Å; Y114-K116 PolarHBondContact O-N 3.36Å; Y114-Q117 WeakPolarHBondContact O-CA 3.47Å; Y114-Q117 WeakPolarHBondContact O-CB 3.38Å; Y114-Q117 PolarHBondContact O-N 3.36Å; Y114-V127 HydrophobicContact CD1-CB 4.13Å; Y114-V127 HydrophobicContact CD1-CG1 3.43Å; Y114-V127 VanDerWaalsContact CD1-CG1 3.43Å; Y114-V127 HydrophobicContact CE1-CG1 4Å; Y114-V127 HydrophobicContact CG-CG1 3.88Å; Y114-S128 WeakPolarHBondContact O-CB 3.45Å; Y114-I131 HydrophobicContact CD2-CD1 4.1Å; Y114-I131 HydrophobicContact CD2-CG1 3.91Å; Y114-I131 HydrophobicContact CG-CG1 4.07Å
115	S	94.8	Very high	92.6	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.014	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-61.1	-34.3	179.9	53.2	0	0	0	0	113.5	F112 P113 Q117 C118	F112-S115 WeakPolarHBondContact O-CB 3.33Å; F112-S115 PolarHBondContact O-N 3.4Å; F112-S115 PolarHBondContact O-OG 2.99Å; P113-S115 PolarHBondContact O-N 3.05Å; P113-S115 VanDerWaalsContact O-N 3.11Å; S115-Q117 PolarHBondContact O-N 3.12Å; S115-C118 VanDerWaalsContact O-CB 3.22Å; S115-C118 WeakPolarHBondContact O-CB 3.15Å; S115-C118 PolarHBondContact O-N 2.91Å; S115-C118 PolarHBondContact O-SG 3.03Å
116	K	92	Very high	92.4	Very high	46 Å²	46	49.4 Å²	49.4	20%	0.2	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-62.4	-25.8	172.4	-56.5	-177.5	89.9	-162.9	0	112.6	Y114 C118 E219 I272	Y114-K116 VanDerWaalsContact C-N 3.31Å; Y114-K116 PolarHBondContact O-N 3.36Å; K116-C118 PolarHBondContact O-N 2.98Å; K116-E219 WeakPolarHBondContact CD-OE1 3.46Å; K116-E219 WeakPolarHBondContact CE-OE1 3.26Å; K116-E219 WeakPolarHBondContact CE-OE2 3.27Å; K116-E219 IonicContact NZ-OE1 2.85Å; K116-E219 PolarHBondContact NZ-OE1 2.86Å; K116-E219 IonicContact NZ-OE2 2.88Å; K116-E219 PolarHBondContact NZ-OE2 2.94Å; K116-I272 HydrophobicContact CD-CD1 4.22Å; K116-I272 HydrophobicContact CG-CD1 3.85Å
117	Q	93.1	Very high	92.3	Very high	91 Å²	91	50.3 Å²	50.3	43%	0.425	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-90.1	42.4	176	-55.9	-175.2	26.2	0	0	112.3	Y114 S115 V127 S128	Y114-Q117 WeakPolarHBondContact O-CA 3.47Å; Y114-Q117 WeakPolarHBondContact O-CB 3.38Å; Y114-Q117 PolarHBondContact O-N 3.36Å; S115-Q117 PolarHBondContact O-N 3.12Å; Q117-V127 HydrophobicContact CB-CB 4.1Å; Q117-V127 PolarHBondContact O-N 3.33Å; Q117-S128 WeakPolarHBondContact O-CB 3.26Å; Q117-S128 PolarHBondContact O-N 2.82Å; Q117-S128 VanDerWaalsContact O-N 3.15Å
118	C	92.3	Very high	92.2	Very high	10 Å²	10	50.3 Å²	50.3	7%	0.068	24%	0.239	C	C	.	.			trans	-90.8	-8.1	178.8	59.1	0	0	0	0	114.3	S115 K116 I126 Q150 I153 F156	S115-C118 VanDerWaalsContact O-CB 3.22Å; S115-C118 WeakPolarHBondContact O-CB 3.15Å; S115-C118 PolarHBondContact O-N 2.91Å; S115-C118 PolarHBondContact O-SG 3.03Å; K116-C118 PolarHBondContact O-N 2.98Å; C118-I126 WeakPolarHBondContact O-CG2 3.47Å; C118-Q150 WeakPolarHBondContact SG-CG 3.36Å; C118-I153 HydrophobicContact CB-CD1 3.69Å; C118-I153 HydrophobicContact CB-CG1 3.68Å; C118-F156 HydrophobicContact CB-CE2 4.1Å
119	K	89.3	Confident	92.2	Very high	101 Å²	101	54.6 Å²	54.6	44%	0.439	26%	0.257	S	S	.	.	S	Bend	trans	-120	142.3	175.8	-66	175.6	-174.1	168	0	109.4	R121	K119-R121 PolarHBondContact O-N 3.07Å
120	M	87.6	Confident	92.2	Very high	67 Å²	67	59 Å²	59	33%	0.33	28%	0.28	S	S	.	.			trans	-69.9	127.9	175.2	-167	168.4	68.8	0	0	109.1	I126	M120-I126 HydrophobicContact CB-CD1 4.4Å; M120-I126 HydrophobicContact CB-CG1 3.96Å
121	R	79.4	Confident	92.2	Very high	80 Å²	80	59.3 Å²	59.3	30%	0.302	28%	0.282	S	S	.	.			trans	-114.5	129.5	177.8	-59.6	-57.5	-168.6	179.1	9.5	108.7	K119 R123 G124 Q222 V223	K119-R121 PolarHBondContact O-N 3.07Å; R121-R123 PolarHBondContact O-N 3.39Å; R121-G124 VanDerWaalsContact O-CA 3.25Å; R121-G124 WeakPolarHBondContact O-CA 3.43Å; R121-G124 PolarHBondContact O-N 3.45Å; R121-Q222 HydrophobicContact CB-CB 4.29Å; R121-Q222 WeakPolarHBondContact CB-O 3.36Å; R121-Q222 WeakPolarHBondContact CD-O 3.43Å; R121-V223 VanDerWaalsContact NH1-CG2 3.27Å
122	K	81.6	Confident	92.2	Very high	121 Å²	121	58.7 Å²	58.7	53%	0.526	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.3	-133.7	-174.7	-62.5	173.3	180	163.9	0	111.8	G124	K122-G124 PolarHBondContact O-N 3.38Å
123	R	82.8	Confident	92.3	Very high	263 Å²	263	61.1 Å²	61.1	99%	0.992	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	52.9	170	-62.8	-177	-175.9	-172.4	1	110.9	R121	R121-R123 PolarHBondContact O-N 3.39Å
124	G	85.4	Confident	92.4	Very high	41 Å²	41	64 Å²	64	42%	0.423	31%	0.311	S	S	.	.			trans	-106.5	-163.8	-178.5	0	0	0	0	0	112.8	R121 K122	R121-G124 VanDerWaalsContact O-CA 3.25Å; R121-G124 WeakPolarHBondContact O-CA 3.43Å; R121-G124 PolarHBondContact O-N 3.45Å; K122-G124 PolarHBondContact O-N 3.38Å
125	S	90.9	Very high	92.5	Very high	75 Å²	75	61.8 Å²	61.8	52%	0.524	30%	0.302	S	S	.	.			trans	-131.5	161	176.8	65.5	0	0	0	0	111.3	V127	S125-V127 PolarHBondContact O-N 2.9Å; S125-V127 WeakPolarHBondContact OG-CG2 3.22Å
126	I	94.8	Very high	92.6	Very high	63 Å²	63	62.5 Å²	62.5	32%	0.323	31%	0.307	S	S	.	.			trans	-89.1	84.1	172	-57	176.8	0	0	0	107.6	C118 M120 S128 K129 L130 F156	C118-I126 WeakPolarHBondContact O-CG2 3.47Å; M120-I126 HydrophobicContact CB-CD1 4.4Å; M120-I126 HydrophobicContact CB-CG1 3.96Å; I126-S128 VanDerWaalsContact C-N 3.27Å; I126-S128 PolarHBondContact O-N 3.03Å; I126-K129 HydrophobicContact CB-CB 4.31Å; I126-K129 HydrophobicContact CG2-CB 3.83Å; I126-K129 WeakPolarHBondContact O-CB 3.44Å; I126-K129 PolarHBondContact O-N 3.47Å; I126-K129 VanDerWaalsContact O-N 3.13Å; I126-L130 PolarHBondContact O-N 2.93Å; I126-F156 HydrophobicContact CG2-CE2 3.81Å; I126-F156 HydrophobicContact CG2-CZ 3.87Å
127	V	96.1	Very high	92.9	Very high	23 Å²	23	68.2 Å²	68.2	14%	0.139	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-32.9	-174.4	-177.2	0	0	0	0	111.5	Y114 Q117 S125 K129 L130 I131	Y114-V127 HydrophobicContact CD1-CB 4.13Å; Y114-V127 HydrophobicContact CD1-CG1 3.43Å; Y114-V127 VanDerWaalsContact CD1-CG1 3.43Å; Y114-V127 HydrophobicContact CE1-CG1 4Å; Y114-V127 HydrophobicContact CG-CG1 3.88Å; Q117-V127 HydrophobicContact CB-CB 4.1Å; Q117-V127 PolarHBondContact O-N 3.33Å; S125-V127 PolarHBondContact O-N 2.9Å; S125-V127 WeakPolarHBondContact OG-CG2 3.22Å; V127-K129 PolarHBondContact O-N 3.45Å; V127-L130 WeakPolarHBondContact O-CA 3.4Å; V127-L130 VanDerWaalsContact O-CB 3.31Å; V127-L130 WeakPolarHBondContact O-CB 3.41Å; V127-L130 PolarHBondContact O-N 2.78Å; V127-I131 HydrophobicContact CG1-CD1 4.35Å; V127-I131 HydrophobicContact CG1-CG1 4.33Å; V127-I131 WeakPolarHBondContact O-CG1 3.26Å; V127-I131 PolarHBondContact O-N 3.08Å
128	S	96.8	Very high	93.2	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-54.5	-39.6	173.8	-173.1	0	0	0	0	112.4	Y114 Q117 I126 I131 A132	Y114-S128 WeakPolarHBondContact O-CB 3.45Å; Q117-S128 WeakPolarHBondContact O-CB 3.26Å; Q117-S128 PolarHBondContact O-N 2.82Å; Q117-S128 VanDerWaalsContact O-N 3.15Å; I126-S128 VanDerWaalsContact C-N 3.27Å; I126-S128 PolarHBondContact O-N 3.03Å; S128-I131 PolarHBondContact O-N 3.11Å; S128-A132 PolarHBondContact O-N 2.8Å
129	K	97.6	Very high	93.4	Very high	91 Å²	91	64.5 Å²	64.5	40%	0.396	32%	0.319	S	S	.	.	H	α-helix	trans	-69.5	-36.4	175.3	174	57.4	-173.8	-86.4	0	112.1	I126 V127 A132 S133 F156	I126-K129 HydrophobicContact CB-CB 4.31Å; I126-K129 HydrophobicContact CG2-CB 3.83Å; I126-K129 WeakPolarHBondContact O-CB 3.44Å; I126-K129 PolarHBondContact O-N 3.47Å; I126-K129 VanDerWaalsContact O-N 3.13Å; V127-K129 PolarHBondContact O-N 3.45Å; K129-A132 PolarHBondContact O-N 2.88Å; K129-S133 WeakPolarHBondContact CE-OG 3.05Å; K129-S133 WeakPolarHBondContact O-CB 3.28Å; K129-S133 PolarHBondContact O-N 3.33Å; K129-S133 PolarHBondContact O-OG 3.28Å; K129-F156 HydrophobicContact CB-CB 4.46Å; K129-F156 HydrophobicContact CB-CD1 4.47Å; K129-F156 HydrophobicContact CB-CD2 3.89Å; K129-F156 HydrophobicContact CB-CE2 4.22Å; K129-F156 HydrophobicContact CB-CG 4.03Å; K129-F156 HydrophobicContact CD-CB 3.64Å; K129-F156 HydrophobicContact CD-CD1 4.23Å; K129-F156 HydrophobicContact CD-CG 3.93Å; K129-F156 WeakPolarHBondContact CD-O 3.19Å; K129-F156 WeakPolarHBondContact CE-O 3.41Å
130	L	98	Very high	93.9	Very high	95 Å²	95	60 Å²	60	50%	0.497	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-48.4	173.2	173.7	63.1	0	0	0	110.5	I126 V127 A132 S133 M134	I126-L130 PolarHBondContact O-N 2.93Å; V127-L130 WeakPolarHBondContact O-CA 3.4Å; V127-L130 VanDerWaalsContact O-CB 3.31Å; V127-L130 WeakPolarHBondContact O-CB 3.41Å; V127-L130 PolarHBondContact O-N 2.78Å; L130-A132 PolarHBondContact O-N 3.45Å; L130-S133 PolarHBondContact O-N 2.84Å; L130-M134 HydrophobicContact CD1-CG 4.2Å; L130-M134 HydrophobicContact CD1-SD 4.32Å; L130-M134 HydrophobicContact CG-CE 4.07Å; L130-M134 HydrophobicContact CG-SD 4.38Å; L130-M134 WeakPolarHBondContact O-CG 3.5Å; L130-M134 PolarHBondContact O-N 2.94Å
131	I	97.9	Very high	94.4	Very high	7 Å²	7	59.6 Å²	59.6	4%	0.036	30%	0.301	C	S	.	.	H	α-helix	trans	-58.1	-49.8	177	-57.1	-45.9	0	0	0	110.6	I87 F112 Y114 V127 S128 S133 M134 V135	I87-I131 HydrophobicContact CD1-CD1 3.96Å; I87-I131 HydrophobicContact CD1-CG1 4.47Å; F112-I131 HydrophobicContact CE1-CG2 4.48Å; F112-I131 HydrophobicContact CE2-CG2 4.1Å; F112-I131 HydrophobicContact CZ-CB 4.06Å; F112-I131 HydrophobicContact CZ-CG2 3.67Å; Y114-I131 HydrophobicContact CD2-CD1 4.1Å; Y114-I131 HydrophobicContact CD2-CG1 3.91Å; Y114-I131 HydrophobicContact CG-CG1 4.07Å; V127-I131 HydrophobicContact CG1-CD1 4.35Å; V127-I131 HydrophobicContact CG1-CG1 4.33Å; V127-I131 WeakPolarHBondContact O-CG1 3.26Å; V127-I131 PolarHBondContact O-N 3.08Å; S128-I131 PolarHBondContact O-N 3.11Å; I131-S133 VanDerWaalsContact C-N 3.28Å; I131-S133 PolarHBondContact O-N 3.11Å; I131-M134 HydrophobicContact CD1-CE 3.33Å; I131-M134 HydrophobicContact CG1-CE 4.49Å; I131-M134 PolarHBondContact O-N 2.86Å; I131-V135 HydrophobicContact CG2-CG2 4.29Å; I131-V135 WeakPolarHBondContact O-CG2 3.32Å; I131-V135 PolarHBondContact O-N 3.33Å
132	A	98.1	Very high	95.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-54.5	-45.4	176.9	0	0	0	0	0	111.9	S128 K129 L130 M134 V135 C136 F156 F157	S128-A132 PolarHBondContact O-N 2.8Å; K129-A132 PolarHBondContact O-N 2.88Å; L130-A132 PolarHBondContact O-N 3.45Å; A132-M134 PolarHBondContact O-N 3.25Å; A132-V135 PolarHBondContact O-N 2.94Å; A132-C136 WeakPolarHBondContact O-CB 3.45Å; A132-C136 PolarHBondContact O-N 2.88Å; A132-C136 PolarHBondContact O-SG 3.37Å; A132-F156 HydrophobicContact CB-CB 3.9Å; A132-F157 HydrophobicContact CB-CD1 3.8Å; A132-F157 HydrophobicContact CB-CD2 4.12Å; A132-F157 HydrophobicContact CB-CE1 3.54Å; A132-F157 HydrophobicContact CB-CE2 3.89Å; A132-F157 HydrophobicContact CB-CG 4.09Å; A132-F157 HydrophobicContact CB-CZ 3.59Å
133	S	98.4	Very high	96.1	Very high	54 Å²	54	51.7 Å²	51.7	38%	0.378	27%	0.269	S	S	.	.	H	α-helix	trans	-64.8	-40.8	179.6	-54.8	0	0	0	0	112.6	K129 L130 I131 K137	K129-S133 WeakPolarHBondContact CE-OG 3.05Å; K129-S133 WeakPolarHBondContact O-CB 3.28Å; K129-S133 PolarHBondContact O-N 3.33Å; K129-S133 PolarHBondContact O-OG 3.28Å; L130-S133 PolarHBondContact O-N 2.84Å; I131-S133 VanDerWaalsContact C-N 3.28Å; I131-S133 PolarHBondContact O-N 3.11Å; S133-K137 VanDerWaalsContact O-CB 3.24Å; S133-K137 WeakPolarHBondContact O-CB 3.24Å; S133-K137 PolarHBondContact O-N 3.48Å
134	M	98.3	Very high	96.8	Very high	66 Å²	66	39.2 Å²	39.2	33%	0.325	22%	0.222	S	C	.	.	H	α-helix	trans	-65.8	-42.9	177.7	-70.8	-172	-60	0	0	111.8	L91 L130 I131 A132 K137 A138	L91-M134 HydrophobicContact CD1-CB 4.32Å; L91-M134 HydrophobicContact CD2-CB 4.17Å; L130-M134 HydrophobicContact CD1-CG 4.2Å; L130-M134 HydrophobicContact CD1-SD 4.32Å; L130-M134 HydrophobicContact CG-CE 4.07Å; L130-M134 HydrophobicContact CG-SD 4.38Å; L130-M134 WeakPolarHBondContact O-CG 3.5Å; L130-M134 PolarHBondContact O-N 2.94Å; I131-M134 HydrophobicContact CD1-CE 3.33Å; I131-M134 HydrophobicContact CG1-CE 4.49Å; I131-M134 PolarHBondContact O-N 2.86Å; A132-M134 PolarHBondContact O-N 3.25Å; M134-K137 PolarHBondContact O-N 2.69Å; M134-A138 WeakPolarHBondContact O-CB 3.29Å; M134-A138 PolarHBondContact O-N 2.95Å
135	V	97.3	Very high	97.5	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-45.2	179.6	174.6	0	0	0	0	111.2	M90 L91 I131 A132 K137 A138 G139 L140	M90-V135 HydrophobicContact CE-CG2 3.44Å; M90-V135 VanDerWaalsContact CE-CG2 3.44Å; M90-V135 HydrophobicContact SD-CG2 4.49Å; L91-V135 HydrophobicContact CD2-CB 4.33Å; L91-V135 HydrophobicContact CD2-CG2 3.78Å; I131-V135 HydrophobicContact CG2-CG2 4.29Å; I131-V135 WeakPolarHBondContact O-CG2 3.32Å; I131-V135 PolarHBondContact O-N 3.33Å; A132-V135 PolarHBondContact O-N 2.94Å; V135-K137 VanDerWaalsContact C-N 3.33Å; V135-K137 PolarHBondContact O-N 3.34Å; V135-A138 PolarHBondContact O-N 3.45Å; V135-G139 PolarHBondContact O-N 3.23Å; V135-L140 HydrophobicContact CG1-CB 3.62Å; V135-L140 HydrophobicContact CG1-CD1 4.5Å; V135-L140 HydrophobicContact CG1-CD2 3.34Å; V135-L140 HydrophobicContact CG1-CG 3.97Å; V135-L140 WeakPolarHBondContact O-CB 3.18Å; V135-L140 PolarHBondContact O-N 2.76Å
136	C	97.7	Very high	97.8	Very high	18 Å²	18	33.7 Å²	33.7	12%	0.122	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-43.3	171.9	-68.6	0	0	0	0	111.7	A132 A138 G139 N158	A132-C136 WeakPolarHBondContact O-CB 3.45Å; A132-C136 PolarHBondContact O-N 2.88Å; A132-C136 PolarHBondContact O-SG 3.37Å; C136-A138 PolarHBondContact O-N 2.91Å; C136-G139 PolarHBondContact O-N 3.42Å; C136-N158 WeakPolarHBondContact CB-OD1 3.39Å; C136-N158 PolarHBondContact SG-OD1 2.87Å
137	K	98.3	Very high	97.8	Very high	165 Å²	165	31 Å²	31	72%	0.717	16%	0.163	S	C	*	.	H	α-helix	trans	-66.6	-37.1	-179.6	-175	61.1	177.7	-175.5	0	112.6	R98 S133 M134 V135 G139	R98-K137 PolarHBondContact NH1-O 3.43Å; S133-K137 VanDerWaalsContact O-CB 3.24Å; S133-K137 WeakPolarHBondContact O-CB 3.24Å; S133-K137 PolarHBondContact O-N 3.48Å; M134-K137 PolarHBondContact O-N 2.69Å; V135-K137 VanDerWaalsContact C-N 3.33Å; V135-K137 PolarHBondContact O-N 3.34Å; K137-G139 PolarHBondContact O-N 3.26Å
138	A	98.2	Very high	97.9	Very high	12 Å²	12	30.2 Å²	30.2	10%	0.099	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-35.1	175.2	0	0	0	0	0	111.4	L91 V94 R98 M134 V135 C136	L91-A138 HydrophobicContact CD2-CB 3.9Å; V94-A138 HydrophobicContact CB-CB 4.32Å; V94-A138 HydrophobicContact CG1-CB 3.87Å; R98-A138 VanDerWaalsContact CD-O 3.26Å; R98-A138 WeakPolarHBondContact CD-O 3.47Å; R98-A138 PolarHBondContact NH1-O 3.05Å; M134-A138 WeakPolarHBondContact O-CB 3.29Å; M134-A138 PolarHBondContact O-N 2.95Å; V135-A138 PolarHBondContact O-N 3.45Å; C136-A138 PolarHBondContact O-N 2.91Å
139	G	97.8	Very high	97.7	Very high	12 Å²	12	32 Å²	32	12%	0.124	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	132.2	15	174.7	0	0	0	0	0	115.2	V135 C136 K137 T141	V135-G139 PolarHBondContact O-N 3.23Å; C136-G139 PolarHBondContact O-N 3.42Å; K137-G139 PolarHBondContact O-N 3.26Å; G139-T141 PolarHBondContact O-N 3.17Å
140	L	98.3	Very high	97.5	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.026	16%	0.16	C	C	.	.			trans	-62.9	134.2	175.5	-154.3	73.8	0	0	0	109.6	V94 I105 G107 V135 H142 L143 I159	V94-L140 HydrophobicContact CG1-CB 4.33Å; V94-L140 HydrophobicContact CG1-CD1 4.28Å; V94-L140 HydrophobicContact CG2-CD1 3.71Å; I105-L140 HydrophobicContact CG2-CD1 3.94Å; I105-L140 WeakPolarHBondContact O-CD1 3.29Å; G107-L140 VanDerWaalsContact N-CD1 3.29Å; V135-L140 HydrophobicContact CG1-CB 3.62Å; V135-L140 HydrophobicContact CG1-CD1 4.5Å; V135-L140 HydrophobicContact CG1-CD2 3.34Å; V135-L140 HydrophobicContact CG1-CG 3.97Å; V135-L140 WeakPolarHBondContact O-CB 3.18Å; V135-L140 PolarHBondContact O-N 2.76Å; L140-H142 WeakPolarHBondContact CD2-O 3.39Å; L140-H142 WeakPolarHBondContact CG-O 3.39Å; L140-L143 HydrophobicContact CD2-CB 4.23Å; L140-L143 HydrophobicContact CD2-CD1 4.19Å; L140-I159 HydrophobicContact CB-CD1 4.02Å; L140-I159 HydrophobicContact CD2-CD1 3.97Å; L140-I159 HydrophobicContact CG-CD1 4.15Å
141	T	98.3	Very high	97.2	Very high	60 Å²	60	29.2 Å²	29.2	37%	0.368	15%	0.151	S	C	.	.			trans	-105	-22	-178.4	61.2	0	0	0	0	112.9	I105 G139 P160	I105-T141 PolarHBondContact N-OG1 3.14Å; I105-T141 PolarHBondContact O-N 2.88Å; I105-T141 PolarHBondContact O-OG1 3.08Å; I105-T141 VanDerWaalsContact O-OG1 3.07Å; G139-T141 PolarHBondContact O-N 3.17Å; T141-P160 WeakPolarHBondContact O-CD 3.45Å
142	H	98.6	Very high	97.1	Very high	35 Å²	35	34.3 Å²	34.3	16%	0.162	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	144.2	178.8	-158	152.4	0	0	0	108.8	I105 T106 G107 L140 P160 D162	I105-H142 PolarHBondContact O-N 2.75Å; T106-H142 CarbonylContact C-O 3.6Å; T106-H142 VanDerWaalsContact CA-O 3.28Å; T106-H142 WeakPolarHBondContact CA-O 3.49Å; T106-H142 HydrophobicContact CG2-CB 4.07Å; G107-H142 PolarHBondContact N-O 2.89Å; L140-H142 WeakPolarHBondContact CD2-O 3.39Å; L140-H142 WeakPolarHBondContact CG-O 3.39Å; H142-P160 PolarHBondContact CD2-O 2.86Å; H142-D162 IonicContact CE1-OD2 3.95Å; H142-D162 PolarHBondContact CE1-OD2 3.03Å; H142-D162 IonicContact NE2-OD2 3.11Å; H142-D162 PolarHBondContact NE2-OD2 2.98Å
143	L	98.5	Very high	97	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.7	170	179.9	67.6	0	0	0	111.5	G107 L109 F112 L140 T145 F157 P160 V161 D162	G107-L143 CarbonylContact O-C 3.43Å; G107-L143 WeakPolarHBondContact O-CA 3.37Å; L109-L143 HydrophobicContact CB-CD1 4.14Å; L109-L143 HydrophobicContact CD1-CD1 3.79Å; L109-L143 HydrophobicContact CD2-CD1 4.2Å; L109-L143 HydrophobicContact CG-CD1 4.27Å; F112-L143 HydrophobicContact CD2-CD2 4.47Å; L140-L143 HydrophobicContact CD2-CB 4.23Å; L140-L143 HydrophobicContact CD2-CD1 4.19Å; L143-T145 HydrophobicContact CD2-CG2 4.41Å; L143-F157 HydrophobicContact CD2-CD1 4.26Å; L143-F157 HydrophobicContact CD2-CD2 4.42Å; L143-F157 HydrophobicContact CD2-CE1 3.62Å; L143-F157 HydrophobicContact CD2-CE2 3.8Å; L143-F157 HydrophobicContact CD2-CZ 3.35Å; L143-P160 PolarHBondContact N-O 3.13Å; L143-V161 HydrophobicContact CB-CG1 4.25Å; L143-V161 HydrophobicContact CB-CG2 4.2Å; L143-V161 HydrophobicContact CD2-CG1 3.96Å; L143-V161 HydrophobicContact CD2-CG2 4.38Å; L143-V161 HydrophobicContact CG-CG1 4.25Å; L143-V161 CarbonylContact O-C 3.6Å; L143-V161 WeakPolarHBondContact O-CA 3.13Å; L143-D162 PolarHBondContact O-N 3.29Å
144	I	98.5	Very high	97	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127	160.9	-52.7	176	0	0	0	107.2	F72 T106 G107 V108 L109 L164 L346 A349 I350 I353	F72-I144 HydrophobicContact CE1-CD1 4.4Å; T106-I144 HydrophobicContact CG2-CD1 3.96Å; T106-I144 HydrophobicContact CG2-CG1 3.81Å; G107-I144 PolarHBondContact O-N 3.22Å; V108-I144 WeakPolarHBondContact CA-O 3.44Å; V108-I144 HydrophobicContact CG1-CB 4.43Å; V108-I144 HydrophobicContact CG2-CB 4.38Å; V108-I144 HydrophobicContact CG2-CD1 4.03Å; L109-I144 PolarHBondContact N-O 3.39Å; I144-L164 HydrophobicContact CG2-CD1 3.53Å; I144-L164 HydrophobicContact CG2-CG 4.1Å; I144-L346 HydrophobicContact CG2-CD2 4.15Å; I144-A349 HydrophobicContact CD1-CB 4.14Å; I144-A349 HydrophobicContact CG2-CB 4.2Å; I144-I350 HydrophobicContact CD1-CG1 3.89Å; I144-I353 HydrophobicContact CD1-CD1 3.43Å; I144-I353 VanDerWaalsContact CD1-CD1 3.43Å; I144-I353 HydrophobicContact CG1-CD1 3.57Å
145	T	98.3	Very high	96.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	174.9	176	-167.1	0	0	0	0	110	L109 L143 L148 V161 D162 N163 L164	L109-T145 VanDerWaalsContact O-CA 3.22Å; L109-T145 WeakPolarHBondContact O-CA 3.47Å; L109-T145 VanDerWaalsContact O-CB 3.24Å; L109-T145 WeakPolarHBondContact O-CB 3.46Å; L109-T145 PolarHBondContact O-OG1 3.24Å; L143-T145 HydrophobicContact CD2-CG2 4.41Å; T145-L148 HydrophobicContact CG2-CD1 3.87Å; T145-L148 HydrophobicContact CG2-CD2 3.86Å; T145-L148 HydrophobicContact CG2-CG 3.65Å; T145-V161 HydrophobicContact CG2-CG1 4.16Å; T145-D162 PolarHBondContact N-O 3.26Å; T145-D162 VanDerWaalsContact O-O 3.1Å; T145-N163 HydrophobicContact CG2-CB 4.26Å; T145-L164 WeakPolarHBondContact O-CB 3.45Å; T145-L164 WeakPolarHBondContact O-CG 3.47Å; T145-L164 PolarHBondContact O-N 2.72Å
146	M	97.3	Very high	96.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.9	178.6	-164.8	167.7	63.8	0	0	110.4	P110 L148 L164 A166 T299 H300 T322 T324 I342 I345	P110-M146 PolarHBondContact O-N 3.37Å; M146-L148 PolarHBondContact O-N 3.14Å; M146-L164 WeakPolarHBondContact CA-O 3.37Å; M146-L164 HydrophobicContact CB-CB 4.37Å; M146-L164 HydrophobicContact CG-CB 4.12Å; M146-L164 WeakPolarHBondContact CG-O 3.26Å; M146-A166 HydrophobicContact CE-CB 3.91Å; M146-A166 HydrophobicContact CG-CB 4.48Å; M146-A166 HydrophobicContact SD-CB 3.86Å; M146-T299 HydrophobicContact CE-CG2 3.54Å; M146-T299 HydrophobicContact CG-CG2 4.34Å; M146-H300 PolarHBondContact O-CE1 3.38Å; M146-H300 PolarHBondContact O-NE2 2.99Å; M146-H300 VanDerWaalsContact O-NE2 3.11Å; M146-T322 HydrophobicContact CE-CG2 4.45Å; M146-T324 HydrophobicContact CE-CG2 3Å; M146-I342 HydrophobicContact CE-CB 3.99Å; M146-I342 HydrophobicContact CE-CD1 4.27Å; M146-I342 HydrophobicContact CE-CG1 3.59Å; M146-I342 HydrophobicContact CE-CG2 3.98Å; M146-I342 HydrophobicContact SD-CB 4.26Å; M146-I342 HydrophobicContact SD-CG1 4.43Å; M146-I342 HydrophobicContact SD-CG2 4.26Å; M146-I345 HydrophobicContact SD-CG2 4.32Å
147	D	96	Very high	97	Very high	6 Å²	6	37.1 Å²	37.1	3%	0.032	20%	0.196	C	C	.	.	S	Bend	trans	40.2	58.6	177.1	-72.1	-46.6	0	0	0	114.9	H149 N163 L164 R165 A166 T299 H300	D147-H149 PolarHBondContact O-N 3.26Å; D147-N163 PolarHBondContact N-OD1 3.29Å; D147-L164 PolarHBondContact N-O 3.18Å; D147-R165 WeakPolarHBondContact OD1-CD 3.22Å; D147-R165 IonicContact OD1-CZ 2.77Å; D147-R165 IonicContact OD1-NE 3.93Å; D147-R165 IonicContact OD1-NH1 3.38Å; D147-R165 PolarHBondContact OD1-NH1 3.5Å; D147-A166 VanDerWaalsContact OD2-CB 3.3Å; D147-A166 WeakPolarHBondContact OD2-CB 3.26Å; D147-A166 PolarHBondContact OD2-N 3.49Å; D147-T299 HydrophobicContact CB-CG2 3.87Å; D147-T299 WeakPolarHBondContact OD2-CG2 3.34Å; D147-T299 PolarHBondContact OD2-OG1 2.91Å; D147-H300 PolarHBondContact O-NE2 3.38Å
148	L	96.7	Very high	96.9	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.037	20%	0.196	C	C	.	.			trans	-47.5	132.3	170.7	-73.4	171.1	0	0	0	111.7	F112 T145 M146 Q150 I153 Q154 N163	F112-L148 HydrophobicContact CB-CD2 3.61Å; F112-L148 HydrophobicContact CD1-CD2 4.26Å; F112-L148 HydrophobicContact CG-CD2 4.09Å; T145-L148 HydrophobicContact CG2-CD1 3.87Å; T145-L148 HydrophobicContact CG2-CD2 3.86Å; T145-L148 HydrophobicContact CG2-CG 3.65Å; M146-L148 PolarHBondContact O-N 3.14Å; L148-Q150 PolarHBondContact O-N 3.46Å; L148-I153 HydrophobicContact CD1-CB 4.15Å; L148-I153 HydrophobicContact CD1-CG2 4.25Å; L148-I153 HydrophobicContact CD2-CB 4.48Å; L148-I153 HydrophobicContact CD2-CG2 4.08Å; L148-Q154 HydrophobicContact CD1-CG 3.64Å; L148-N163 HydrophobicContact CD1-CB 4.06Å; L148-N163 WeakPolarHBondContact CG-OD1 3.41Å; L148-N163 PolarHBondContact N-OD1 3.14Å
149	H	94.6	Very high	96.9	Very high	39 Å²	39	36.6 Å²	36.6	18%	0.181	20%	0.199	C	C	.	.	S	Bend	trans	-47.9	-38.5	-178.2	-177.7	62.8	0	0	0	113.6	D147 I153 D271 I272	D147-H149 PolarHBondContact O-N 3.26Å; H149-I153 HydrophobicContact CB-CD1 4.44Å; H149-D271 WeakPolarHBondContact CA-OD2 3.39Å; H149-D271 IonicContact CE1-OD2 3.88Å; H149-D271 IonicContact CG-OD2 3.52Å; H149-D271 IonicContact ND1-OD1 2.85Å; H149-D271 IonicContact ND1-OD2 2.78Å; H149-D271 PolarHBondContact ND1-OD2 3.49Å; H149-I272 HydrophobicContact CB-CD1 4.23Å
150	Q	92.6	Very high	96.9	Very high	52 Å²	52	39.8 Å²	39.8	24%	0.243	22%	0.218	C	C	.	.	S	Bend	trans	-130.9	129.9	165.5	-61.3	-70.5	-83.8	0	0	107.8	C118 L148 E152 I153	C118-Q150 WeakPolarHBondContact SG-CG 3.36Å; L148-Q150 PolarHBondContact O-N 3.46Å; Q150-E152 WeakPolarHBondContact CB-OE2 3.16Å; Q150-E152 PolarHBondContact O-N 3.27Å; Q150-E152 VanDerWaalsContact O-N 3.14Å; Q150-I153 HydrophobicContact CB-CD1 4.27Å; Q150-I153 HydrophobicContact CB-CG1 4.26Å; Q150-I153 VanDerWaalsContact O-CB 3.28Å; Q150-I153 WeakPolarHBondContact O-CB 3.25Å; Q150-I153 WeakPolarHBondContact O-CD1 3.28Å; Q150-I153 WeakPolarHBondContact O-CG1 3.43Å; Q150-I153 PolarHBondContact O-N 2.77Å
151	K	92.3	Very high	96.9	Very high	75 Å²	75	40.6 Å²	40.6	33%	0.326	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-61.9	-25	-177.4	64	-176.1	176.1	-170.3	0	113	I153 Q154 V368	K151-I153 PolarHBondContact O-N 3.44Å; K151-Q154 WeakPolarHBondContact O-CB 3.29Å; K151-Q154 WeakPolarHBondContact O-CG 3.45Å; K151-Q154 PolarHBondContact O-N 3.38Å; K151-Q154 PolarHBondContact O-NE2 2.64Å; K151-V368 PolarHBondContact NZ-O 3.2Å; K151-V368 VanDerWaalsContact NZ-O 3.07Å
152	E	94.8	Very high	96.9	Very high	113 Å²	113	38.9 Å²	38.9	53%	0.528	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-64.9	-18.8	177.4	-62.1	73.9	-162.4	0	0	112.8	Q150 Q154 G155	Q150-E152 WeakPolarHBondContact CB-OE2 3.16Å; Q150-E152 PolarHBondContact O-N 3.27Å; Q150-E152 VanDerWaalsContact O-N 3.14Å; E152-Q154 PolarHBondContact O-N 2.78Å; E152-Q154 VanDerWaalsContact O-N 3.13Å; E152-G155 PolarHBondContact O-N 2.68Å
153	I	97	Very high	96.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-57.2	-26.5	173.6	-65.3	168.2	0	0	0	111	F112 C118 L148 H149 Q150 K151 G155 F156 F157	F112-I153 HydrophobicContact CD1-CG2 4.31Å; F112-I153 HydrophobicContact CE1-CG2 4.32Å; C118-I153 HydrophobicContact CB-CD1 3.69Å; C118-I153 HydrophobicContact CB-CG1 3.68Å; L148-I153 HydrophobicContact CD1-CB 4.15Å; L148-I153 HydrophobicContact CD1-CG2 4.25Å; L148-I153 HydrophobicContact CD2-CB 4.48Å; L148-I153 HydrophobicContact CD2-CG2 4.08Å; H149-I153 HydrophobicContact CB-CD1 4.44Å; Q150-I153 HydrophobicContact CB-CD1 4.27Å; Q150-I153 HydrophobicContact CB-CG1 4.26Å; Q150-I153 VanDerWaalsContact O-CB 3.28Å; Q150-I153 WeakPolarHBondContact O-CB 3.25Å; Q150-I153 WeakPolarHBondContact O-CD1 3.28Å; Q150-I153 WeakPolarHBondContact O-CG1 3.43Å; Q150-I153 PolarHBondContact O-N 2.77Å; K151-I153 PolarHBondContact O-N 3.44Å; I153-G155 PolarHBondContact O-N 3.1Å; I153-F156 HydrophobicContact CB-CD2 4.29Å; I153-F156 HydrophobicContact CB-CE2 4.47Å; I153-F156 HydrophobicContact CG1-CD2 4.33Å; I153-F156 HydrophobicContact CG1-CE2 4.04Å; I153-F156 HydrophobicContact CG2-CD2 4Å; I153-F156 VanDerWaalsContact O-CB 3.24Å; I153-F156 WeakPolarHBondContact O-CB 2.85Å; I153-F156 PolarHBondContact O-N 2.73Å; I153-F157 HydrophobicContact CG2-CE2 4.12Å; I153-F157 WeakPolarHBondContact O-CD2 3.35Å
154	Q	96.7	Very high	96.6	Very high	70 Å²	70	37.5 Å²	37.5	33%	0.327	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-54.2	-37	172.3	-68.4	174.7	80.6	0	0	112.2	L148 K151 E152 F156 F157 V161 N163	L148-Q154 HydrophobicContact CD1-CG 3.64Å; K151-Q154 WeakPolarHBondContact O-CB 3.29Å; K151-Q154 WeakPolarHBondContact O-CG 3.45Å; K151-Q154 PolarHBondContact O-N 3.38Å; K151-Q154 PolarHBondContact O-NE2 2.64Å; E152-Q154 PolarHBondContact O-N 2.78Å; E152-Q154 VanDerWaalsContact O-N 3.13Å; Q154-F156 PolarHBondContact O-N 2.9Å; Q154-F157 PolarHBondContact O-N 3.04Å; Q154-V161 HydrophobicContact CG-CB 4.32Å; Q154-V161 HydrophobicContact CG-CG1 4.03Å; Q154-N163 HydrophobicContact CG-CB 4.05Å
155	G	97.5	Very high	96.4	Very high	65 Å²	65	38.5 Å²	38.5	67%	0.67	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-73	-4.2	177.1	0	0	0	0	0	114.7	E152 I153 F157	E152-G155 PolarHBondContact O-N 2.68Å; I153-G155 PolarHBondContact O-N 3.1Å; G155-F157 VanDerWaalsContact C-N 3.33Å
156	F	98.1	Very high	96.3	Very high	45 Å²	45	38.5 Å²	38.5	20%	0.197	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-78.3	-22	173.4	-66.4	-8.3	0	0	0	112.7	C118 I126 K129 A132 I153 Q154	C118-F156 HydrophobicContact CB-CE2 4.1Å; I126-F156 HydrophobicContact CG2-CE2 3.81Å; I126-F156 HydrophobicContact CG2-CZ 3.87Å; K129-F156 HydrophobicContact CB-CB 4.46Å; K129-F156 HydrophobicContact CB-CD1 4.47Å; K129-F156 HydrophobicContact CB-CD2 3.89Å; K129-F156 HydrophobicContact CB-CE2 4.22Å; K129-F156 HydrophobicContact CB-CG 4.03Å; K129-F156 HydrophobicContact CD-CB 3.64Å; K129-F156 HydrophobicContact CD-CD1 4.23Å; K129-F156 HydrophobicContact CD-CG 3.93Å; K129-F156 WeakPolarHBondContact CD-O 3.19Å; K129-F156 WeakPolarHBondContact CE-O 3.41Å; A132-F156 HydrophobicContact CB-CB 3.9Å; I153-F156 HydrophobicContact CB-CD2 4.29Å; I153-F156 HydrophobicContact CB-CE2 4.47Å; I153-F156 HydrophobicContact CG1-CD2 4.33Å; I153-F156 HydrophobicContact CG1-CE2 4.04Å; I153-F156 HydrophobicContact CG2-CD2 4Å; I153-F156 VanDerWaalsContact O-CB 3.24Å; I153-F156 WeakPolarHBondContact O-CB 2.85Å; I153-F156 PolarHBondContact O-N 2.73Å; Q154-F156 PolarHBondContact O-N 2.9Å
157	F	98.3	Very high	96.1	Very high	18 Å²	18	38.7 Å²	38.7	8%	0.079	21%	0.21	C	C	.	.			trans	-89.6	145.3	179.6	-62.8	-92.5	0	0	0	110.8	F112 A132 L143 I153 Q154 G155 I159 V161	F112-F157 HydrophobicContact CD2-CZ 4.3Å; F112-F157 HydrophobicContact CE1-CZ 4.15Å; F112-F157 HydrophobicContact CE2-CE1 4.24Å; F112-F157 AromaticContact CE2-CZ 3.57Å; F112-F157 HydrophobicContact CE2-CZ 3.57Å; F112-F157 HydrophobicContact CZ-CE1 4.29Å; F112-F157 HydrophobicContact CZ-CE2 4.34Å; F112-F157 AromaticContact CZ-CZ 3.49Å; F112-F157 HydrophobicContact CZ-CZ 3.49Å; F112-F157 VanDerWaalsContact CZ-CZ 3.49Å; A132-F157 HydrophobicContact CB-CD1 3.8Å; A132-F157 HydrophobicContact CB-CD2 4.12Å; A132-F157 HydrophobicContact CB-CE1 3.54Å; A132-F157 HydrophobicContact CB-CE2 3.89Å; A132-F157 HydrophobicContact CB-CG 4.09Å; A132-F157 HydrophobicContact CB-CZ 3.59Å; L143-F157 HydrophobicContact CD2-CD1 4.26Å; L143-F157 HydrophobicContact CD2-CD2 4.42Å; L143-F157 HydrophobicContact CD2-CE1 3.62Å; L143-F157 HydrophobicContact CD2-CE2 3.8Å; L143-F157 HydrophobicContact CD2-CZ 3.35Å; I153-F157 HydrophobicContact CG2-CE2 4.12Å; I153-F157 WeakPolarHBondContact O-CD2 3.35Å; Q154-F157 PolarHBondContact O-N 3.04Å; G155-F157 VanDerWaalsContact C-N 3.33Å; F157-I159 VanDerWaalsContact C-N 3.32Å; F157-I159 HydrophobicContact CB-CG1 3.99Å; F157-I159 HydrophobicContact CD1-CD1 4.4Å; F157-I159 HydrophobicContact CD1-CG1 4.27Å; F157-V161 HydrophobicContact CB-CG2 3.62Å; F157-V161 HydrophobicContact CD1-CG2 4.44Å; F157-V161 HydrophobicContact CD2-CG2 3.7Å; F157-V161 HydrophobicContact CE2-CG2 4.48Å; F157-V161 HydrophobicContact CG-CG2 3.66Å
158	N	96.8	Very high	96	Very high	135 Å²	135	40.5 Å²	40.5	72%	0.722	22%	0.223	S	C	*	.	S	Bend	trans	-99.5	18.5	170.2	66.5	-13.3	0	0	0	112.1	C136	C136-N158 WeakPolarHBondContact CB-OD1 3.39Å; C136-N158 PolarHBondContact SG-OD1 2.87Å
159	I	98.2	Very high	95.9	Very high	30 Å²	30	42.5 Å²	42.5	15%	0.154	23%	0.231	C	C	.	.	S	Bend	trans	-128.6	159.8	179.4	57.7	174.8	0	0	0	108.6	L140 F157	L140-I159 HydrophobicContact CB-CD1 4.02Å; L140-I159 HydrophobicContact CD2-CD1 3.97Å; L140-I159 HydrophobicContact CG-CD1 4.15Å; F157-I159 VanDerWaalsContact C-N 3.32Å; F157-I159 HydrophobicContact CB-CG1 3.99Å; F157-I159 HydrophobicContact CD1-CD1 4.4Å; F157-I159 HydrophobicContact CD1-CG1 4.27Å
160	P	98	Very high	96	Very high	80 Å²	80	40.7 Å²	40.7	52%	0.519	22%	0.223	S	C	.	.			trans	-56.4	139.9	172.1	-24.3	35.3	0	0	0	111.7	T141 H142 L143	T141-P160 WeakPolarHBondContact O-CD 3.45Å; H142-P160 PolarHBondContact CD2-O 2.86Å; L143-P160 PolarHBondContact N-O 3.13Å
161	V	98	Very high	96.1	Very high	22 Å²	22	39 Å²	39	13%	0.133	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	121.6	176.9	-176.5	0	0	0	0	108.7	L143 T145 Q154 F157	L143-V161 HydrophobicContact CB-CG1 4.25Å; L143-V161 HydrophobicContact CB-CG2 4.2Å; L143-V161 HydrophobicContact CD2-CG1 3.96Å; L143-V161 HydrophobicContact CD2-CG2 4.38Å; L143-V161 HydrophobicContact CG-CG1 4.25Å; L143-V161 CarbonylContact O-C 3.6Å; L143-V161 WeakPolarHBondContact O-CA 3.13Å; T145-V161 HydrophobicContact CG2-CG1 4.16Å; Q154-V161 HydrophobicContact CG-CB 4.32Å; Q154-V161 HydrophobicContact CG-CG1 4.03Å; F157-V161 HydrophobicContact CB-CG2 3.62Å; F157-V161 HydrophobicContact CD1-CG2 4.44Å; F157-V161 HydrophobicContact CD2-CG2 3.7Å; F157-V161 HydrophobicContact CE2-CG2 4.48Å; F157-V161 HydrophobicContact CG-CG2 3.66Å
162	D	97.3	Very high	96.3	Very high	24 Å²	24	39.6 Å²	39.6	13%	0.128	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	100.3	167.6	-75.8	-54.3	0	0	0	108.8	H142 L143 T145 L164 I353 M359	H142-D162 IonicContact CE1-OD2 3.95Å; H142-D162 PolarHBondContact CE1-OD2 3.03Å; H142-D162 IonicContact NE2-OD2 3.11Å; H142-D162 PolarHBondContact NE2-OD2 2.98Å; L143-D162 PolarHBondContact O-N 3.29Å; T145-D162 PolarHBondContact N-O 3.26Å; T145-D162 VanDerWaalsContact O-O 3.1Å; D162-L164 PolarHBondContact O-N 2.67Å; D162-I353 VanDerWaalsContact OD2-CD1 3.29Å; D162-I353 WeakPolarHBondContact OD2-CD1 3.3Å; D162-M359 HydrophobicContact CB-CE 4.13Å
163	N	96.6	Very high	96.4	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.027	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	89.7	173.1	179.5	39.7	0	0	0	110.3	T145 D147 L148 Q154 F363	T145-N163 HydrophobicContact CG2-CB 4.26Å; D147-N163 PolarHBondContact N-OD1 3.29Å; L148-N163 HydrophobicContact CD1-CB 4.06Å; L148-N163 WeakPolarHBondContact CG-OD1 3.41Å; L148-N163 PolarHBondContact N-OD1 3.14Å; Q154-N163 HydrophobicContact CG-CB 4.05Å; N163-F363 VanDerWaalsContact O-CE1 3.29Å; N163-F363 WeakPolarHBondContact O-CE1 3.49Å
164	L	95.9	Very high	96.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	167.9	180	-54.4	175.3	0	0	0	111.6	I144 T145 M146 D147 D162 I345 L346 A349 M359 L362 F363	I144-L164 HydrophobicContact CG2-CD1 3.53Å; I144-L164 HydrophobicContact CG2-CG 4.1Å; T145-L164 WeakPolarHBondContact O-CB 3.45Å; T145-L164 WeakPolarHBondContact O-CG 3.47Å; T145-L164 PolarHBondContact O-N 2.72Å; M146-L164 WeakPolarHBondContact CA-O 3.37Å; M146-L164 HydrophobicContact CB-CB 4.37Å; M146-L164 HydrophobicContact CG-CB 4.12Å; M146-L164 WeakPolarHBondContact CG-O 3.26Å; D147-L164 PolarHBondContact N-O 3.18Å; D162-L164 PolarHBondContact O-N 2.67Å; L164-I345 HydrophobicContact CB-CD1 4.19Å; L164-I345 HydrophobicContact CD1-CG1 4.27Å; L164-L346 HydrophobicContact CD1-CD2 3.82Å; L164-A349 HydrophobicContact CD1-CB 3.81Å; L164-A349 HydrophobicContact CD2-CB 4.31Å; L164-M359 HydrophobicContact CD2-CE 3.78Å; L164-L362 HydrophobicContact CD2-CD1 4.15Å; L164-F363 HydrophobicContact CD2-CE2 4.38Å; L164-F363 HydrophobicContact CD2-CZ 4.01Å
165	R	93.8	Very high	96.4	Very high	21 Å²	21	37 Å²	37	8%	0.079	21%	0.205	C	C	.	.			trans	-123.6	137.3	178.5	-58.8	-61.1	-176.3	156.1	10.2	112.5	D147 I345 I366 D370	D147-R165 WeakPolarHBondContact OD1-CD 3.22Å; D147-R165 IonicContact OD1-CZ 2.77Å; D147-R165 IonicContact OD1-NE 3.93Å; D147-R165 IonicContact OD1-NH1 3.38Å; D147-R165 PolarHBondContact OD1-NH1 3.5Å; R165-I345 WeakPolarHBondContact O-CD1 3.19Å; R165-I366 HydrophobicContact CB-CD1 3.7Å; R165-I366 HydrophobicContact CB-CG1 4.27Å; R165-I366 HydrophobicContact CG-CD1 3.47Å; R165-I366 VanDerWaalsContact CG-CD1 3.47Å; R165-I366 HydrophobicContact CG-CG1 4.13Å; R165-I366 HydrophobicContact CG-CG2 3.72Å; R165-D370 PolarHBondContact NH1-O 3.05Å; R165-D370 PolarHBondContact NH1-OXT 2.75Å; R165-D370 PolarHBondContact NH2-O 3.46Å
166	A	95	Very high	96.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-86.3	-14.6	169.2	0	0	0	0	0	112.9	M146 D147 P168 F169 L170 T299 T322	M146-A166 HydrophobicContact CE-CB 3.91Å; M146-A166 HydrophobicContact CG-CB 4.48Å; M146-A166 HydrophobicContact SD-CB 3.86Å; D147-A166 VanDerWaalsContact OD2-CB 3.3Å; D147-A166 WeakPolarHBondContact OD2-CB 3.26Å; D147-A166 PolarHBondContact OD2-N 3.49Å; A166-P168 VanDerWaalsContact C-N 3.3Å; A166-P168 VanDerWaalsContact O-N 3.13Å; A166-F169 WeakPolarHBondContact O-CB 3.35Å; A166-F169 PolarHBondContact O-N 3.3Å; A166-L170 HydrophobicContact CB-CD1 4.37Å; A166-L170 HydrophobicContact CB-CG 4.48Å; A166-L170 PolarHBondContact O-N 2.85Å; A166-T299 HydrophobicContact CB-CG2 3.54Å; A166-T322 HydrophobicContact CB-CG2 3.79Å
167	S	94	Very high	96.4	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-49.9	-39	-176.3	61.6	0	0	0	0	114.4	F169 L170 L171 R203 D370	S167-F169 VanDerWaalsContact C-N 3.33Å; S167-F169 PolarHBondContact O-N 3.01Å; S167-L170 PolarHBondContact O-N 3.4Å; S167-L171 VanDerWaalsContact O-CB 3.25Å; S167-L171 WeakPolarHBondContact O-CB 3.37Å; S167-L171 WeakPolarHBondContact O-CD1 3.22Å; S167-L171 WeakPolarHBondContact O-CG 3.27Å; S167-L171 PolarHBondContact O-N 3.05Å; S167-R203 PolarHBondContact OG-NH1 3.18Å; S167-R203 VanDerWaalsContact OG-NH1 3.14Å; S167-D370 PolarHBondContact OG-OD2 3.31Å
168	P	93.1	Very high	96.3	Very high	45 Å²	45	42.9 Å²	42.9	29%	0.292	22%	0.217	S	C	.	.	H	α-helix	trans	-62.8	-37.8	176.8	-22.2	36	0	0	0	113.3	A166 Q172	A166-P168 VanDerWaalsContact C-N 3.3Å; A166-P168 VanDerWaalsContact O-N 3.13Å; P168-Q172 WeakPolarHBondContact O-CB 3.45Å; P168-Q172 PolarHBondContact O-N 3.1Å
169	F	95.1	Very high	96.2	Very high	48 Å²	48	40.1 Å²	40.1	21%	0.211	21%	0.206	C	C	.	.	H	α-helix	trans	-74.3	-39.4	179.9	-67.4	-98.7	0	0	0	111.4	A166 S167 Q172 Y173 V340 I345	A166-F169 WeakPolarHBondContact O-CB 3.35Å; A166-F169 PolarHBondContact O-N 3.3Å; S167-F169 VanDerWaalsContact C-N 3.33Å; S167-F169 PolarHBondContact O-N 3.01Å; F169-Q172 PolarHBondContact O-N 2.83Å; F169-Y173 PolarHBondContact O-N 2.83Å; F169-V340 HydrophobicContact CB-CG1 3.79Å; F169-I345 HydrophobicContact CE2-CB 3.78Å; F169-I345 HydrophobicContact CE2-CD1 4.11Å; F169-I345 HydrophobicContact CE2-CG1 4.44Å; F169-I345 HydrophobicContact CE2-CG2 3.97Å; F169-I345 HydrophobicContact CZ-CB 3.92Å; F169-I345 HydrophobicContact CZ-CG2 4.25Å
170	L	96.6	Very high	96	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-69	-37.9	175.6	-63.4	178.2	0	0	0	111.8	A166 S167 Y173 I174 F200 V320 T322 V340	A166-L170 HydrophobicContact CB-CD1 4.37Å; A166-L170 HydrophobicContact CB-CG 4.48Å; A166-L170 PolarHBondContact O-N 2.85Å; S167-L170 PolarHBondContact O-N 3.4Å; L170-Y173 WeakPolarHBondContact O-CB 3.1Å; L170-Y173 PolarHBondContact O-N 3.41Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.21Å; L170-F200 HydrophobicContact CB-CE1 4Å; L170-F200 HydrophobicContact CB-CZ 4.09Å; L170-F200 HydrophobicContact CD1-CZ 4.24Å; L170-V320 HydrophobicContact CD2-CG1 4.2Å; L170-T322 HydrophobicContact CD2-CG2 4.29Å; L170-V340 HydrophobicContact CD2-CG2 4.2Å
171	L	95.9	Very high	96	Very high	15 Å²	15	42.3 Å²	42.3	8%	0.079	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-42.9	173.5	-76.3	168.3	0	0	0	111.8	S167 Y173 I174 Q175 F200 R203 L204	S167-L171 VanDerWaalsContact O-CB 3.25Å; S167-L171 WeakPolarHBondContact O-CB 3.37Å; S167-L171 WeakPolarHBondContact O-CD1 3.22Å; S167-L171 WeakPolarHBondContact O-CG 3.27Å; S167-L171 PolarHBondContact O-N 3.05Å; L171-Y173 VanDerWaalsContact C-N 3.33Å; L171-I174 PolarHBondContact O-N 3.01Å; L171-Q175 WeakPolarHBondContact O-CG 3.42Å; L171-Q175 PolarHBondContact O-N 3.04Å; L171-Q175 VanDerWaalsContact O-N 3.1Å; L171-F200 HydrophobicContact CD2-CD1 3.76Å; L171-F200 HydrophobicContact CD2-CE1 4.22Å; L171-F200 HydrophobicContact CD2-CG 4.25Å; L171-F200 HydrophobicContact CG-CD1 4.2Å; L171-F200 HydrophobicContact CG-CE1 4.17Å; L171-R203 HydrophobicContact CD1-CB 4.1Å; L171-R203 HydrophobicContact CD2-CB 4.45Å; L171-L204 HydrophobicContact CD2-CD1 3.73Å; L171-L204 HydrophobicContact CD2-CD2 3.7Å; L171-L204 HydrophobicContact CD2-CG 3.47Å; L171-L204 VanDerWaalsContact CD2-CG 3.47Å
172	Q	95.1	Very high	95.9	Very high	88 Å²	88	48.4 Å²	48.4	41%	0.411	23%	0.232	S	C	.	.	H	α-helix	trans	-59.8	-45.5	174.3	-177.4	178.4	-2.8	0	0	110.7	P168 F169 I174 Q175 E176	P168-Q172 WeakPolarHBondContact O-CB 3.45Å; P168-Q172 PolarHBondContact O-N 3.1Å; F169-Q172 PolarHBondContact O-N 2.83Å; Q172-I174 VanDerWaalsContact C-N 3.35Å; Q172-I174 PolarHBondContact O-N 2.75Å; Q172-Q175 PolarHBondContact O-N 2.87Å; Q172-Q175 VanDerWaalsContact O-N 3.07Å; Q172-E176 VanDerWaalsContact CG-CD 3.42Å; Q172-E176 HydrophobicContact CG-CG 4.21Å; Q172-E176 VanDerWaalsContact CG-OE1 3.28Å; Q172-E176 WeakPolarHBondContact CG-OE1 3.46Å; Q172-E176 PolarHBondContact NE2-OE1 3.15Å; Q172-E176 PolarHBondContact NE2-OE2 3.22Å; Q172-E176 WeakPolarHBondContact O-CB 3.45Å; Q172-E176 WeakPolarHBondContact O-CG 3.3Å; Q172-E176 PolarHBondContact O-N 3.17Å
173	Y	97.6	Very high	95.9	Very high	35 Å²	35	50.6 Å²	50.6	14%	0.137	24%	0.244	C	C	.	.	H	α-helix	trans	-56.9	-45.8	175.6	-172.2	-81.5	0	0	0	112.3	F169 L170 L171 Q175 E176 E177 M297 E318 V320 K338 V340	F169-Y173 PolarHBondContact O-N 2.83Å; L170-Y173 WeakPolarHBondContact O-CB 3.1Å; L170-Y173 PolarHBondContact O-N 3.41Å; L171-Y173 VanDerWaalsContact C-N 3.33Å; Y173-Q175 VanDerWaalsContact C-N 3.26Å; Y173-Q175 PolarHBondContact O-N 2.55Å; Y173-E176 PolarHBondContact O-N 3.33Å; Y173-E177 HydrophobicContact CD1-CB 4.12Å; Y173-E177 HydrophobicContact CD2-CB 4.36Å; Y173-E177 HydrophobicContact CD2-CG 3.92Å; Y173-E177 HydrophobicContact CE1-CB 3.83Å; Y173-E177 HydrophobicContact CE1-CG 4.41Å; Y173-E177 HydrophobicContact CE2-CB 4.11Å; Y173-E177 HydrophobicContact CE2-CG 3.79Å; Y173-E177 HydrophobicContact CG-CB 4.37Å; Y173-E177 HydrophobicContact CG-CG 4.31Å; Y173-E177 WeakPolarHBondContact O-CB 3.24Å; Y173-E177 PolarHBondContact O-N 3.11Å; Y173-M297 HydrophobicContact CD1-CE 3.96Å; Y173-M297 HydrophobicContact CD1-SD 4.48Å; Y173-M297 HydrophobicContact CE1-CE 4.23Å; Y173-E318 WeakPolarHBondContact CE1-OE1 3.46Å; Y173-E318 PolarHBondContact OH-OE1 3.36Å; Y173-V320 HydrophobicContact CD1-CG1 3.95Å; Y173-V320 HydrophobicContact CD1-CG2 3.99Å; Y173-V320 HydrophobicContact CD2-CG1 4.22Å; Y173-V320 HydrophobicContact CE1-CB 4.32Å; Y173-V320 HydrophobicContact CE1-CG1 3.98Å; Y173-V320 HydrophobicContact CE1-CG2 3.39Å; Y173-V320 HydrophobicContact CE2-CG1 4.22Å; Y173-V320 HydrophobicContact CG-CG1 4.07Å; Y173-K338 WeakPolarHBondContact OH-CG 3.47Å; Y173-V340 HydrophobicContact CD2-CG2 3.71Å; Y173-V340 HydrophobicContact CE2-CG2 4.35Å; Y173-V340 HydrophobicContact CG-CG2 4.18Å
174	I	97.6	Very high	96	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-39.6	176.7	-67.7	165.1	0	0	0	111.3	L170 L171 Q172 I178 Y181 F200 L204 I267 M297	L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 3.21Å; L171-I174 PolarHBondContact O-N 3.01Å; Q172-I174 VanDerWaalsContact C-N 3.35Å; Q172-I174 PolarHBondContact O-N 2.75Å; I174-I178 HydrophobicContact CB-CD1 4.42Å; I174-I178 HydrophobicContact CG1-CD1 4.1Å; I174-I178 HydrophobicContact CG2-CD1 4.36Å; I174-I178 WeakPolarHBondContact O-CB 3.47Å; I174-I178 PolarHBondContact O-N 3.3Å; I174-Y181 HydrophobicContact CG2-CD2 4.31Å; I174-Y181 HydrophobicContact CG2-CG 4.23Å; I174-F200 HydrophobicContact CD1-CD1 4.01Å; I174-F200 HydrophobicContact CD1-CE1 4.17Å; I174-L204 HydrophobicContact CD1-CD1 3.97Å; I174-L204 HydrophobicContact CG2-CD1 3.91Å; I174-L204 HydrophobicContact CG2-CD2 4.42Å; I174-I267 HydrophobicContact CD1-CD1 4.47Å; I174-I267 HydrophobicContact CD1-CG2 4.26Å; I174-I267 HydrophobicContact CG1-CD1 4.42Å; I174-I267 HydrophobicContact CG2-CD1 3.89Å; I174-M297 HydrophobicContact CD1-CG 4.36Å; I174-M297 HydrophobicContact CD1-SD 4.43Å; I174-M297 HydrophobicContact CG1-CE 3.79Å; I174-M297 HydrophobicContact CG1-SD 4.13Å
175	Q	96.7	Very high	96.1	Very high	94 Å²	94	50.5 Å²	50.5	44%	0.439	24%	0.243	S	C	.	.	H	α-helix	trans	-76.1	-32.3	-177	-70.5	176.1	-25.7	0	0	113.5	L171 Q172 Y173 Y181 L204	L171-Q175 WeakPolarHBondContact O-CG 3.42Å; L171-Q175 PolarHBondContact O-N 3.04Å; L171-Q175 VanDerWaalsContact O-N 3.1Å; Q172-Q175 PolarHBondContact O-N 2.87Å; Q172-Q175 VanDerWaalsContact O-N 3.07Å; Y173-Q175 VanDerWaalsContact C-N 3.26Å; Y173-Q175 PolarHBondContact O-N 2.55Å; Q175-Y181 HydrophobicContact CB-CE1 4.33Å; Q175-Y181 HydrophobicContact CG-CE1 4.32Å; Q175-Y181 HydrophobicContact CG-CE2 4.18Å; Q175-L204 HydrophobicContact CG-CD2 3.92Å
176	E	96.7	Very high	96.3	Very high	126 Å²	126	49.5 Å²	49.5	59%	0.589	24%	0.239	S	C	*	.	H	α-helix	trans	-93.4	-41	-174.3	-68.8	177.1	176.2	0	0	112.5	Q172 Y173	Q172-E176 VanDerWaalsContact CG-CD 3.42Å; Q172-E176 HydrophobicContact CG-CG 4.21Å; Q172-E176 VanDerWaalsContact CG-OE1 3.28Å; Q172-E176 WeakPolarHBondContact CG-OE1 3.46Å; Q172-E176 PolarHBondContact NE2-OE1 3.15Å; Q172-E176 PolarHBondContact NE2-OE2 3.22Å; Q172-E176 WeakPolarHBondContact O-CB 3.45Å; Q172-E176 WeakPolarHBondContact O-CG 3.3Å; Q172-E176 PolarHBondContact O-N 3.17Å; Y173-E176 PolarHBondContact O-N 3.33Å
177	E	97.1	Very high	96.5	Very high	122 Å²	122	49.5 Å²	49.5	57%	0.57	24%	0.239	S	C	*	.	H	α-helix	trans	-105.8	-24.8	-168.4	-61.1	-64.3	146.4	0	0	113.6	Y173 P179	Y173-E177 HydrophobicContact CD1-CB 4.12Å; Y173-E177 HydrophobicContact CD2-CB 4.36Å; Y173-E177 HydrophobicContact CD2-CG 3.92Å; Y173-E177 HydrophobicContact CE1-CB 3.83Å; Y173-E177 HydrophobicContact CE1-CG 4.41Å; Y173-E177 HydrophobicContact CE2-CB 4.11Å; Y173-E177 HydrophobicContact CE2-CG 3.79Å; Y173-E177 HydrophobicContact CG-CB 4.37Å; Y173-E177 HydrophobicContact CG-CG 4.31Å; Y173-E177 WeakPolarHBondContact O-CB 3.24Å; Y173-E177 PolarHBondContact O-N 3.11Å; E177-P179 VanDerWaalsContact O-CD 3.26Å; E177-P179 WeakPolarHBondContact O-CD 3.42Å
178	I	96.8	Very high	96.6	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.026	24%	0.238	C	C	.	.	S	Bend	trans	-88.7	111.6	178	-59.2	-175.2	0	0	0	110.2	I174 Y181 I265 I267 F295 M297	I174-I178 HydrophobicContact CB-CD1 4.42Å; I174-I178 HydrophobicContact CG1-CD1 4.1Å; I174-I178 HydrophobicContact CG2-CD1 4.36Å; I174-I178 WeakPolarHBondContact O-CB 3.47Å; I174-I178 PolarHBondContact O-N 3.3Å; I178-Y181 PolarHBondContact O-N 2.71Å; I178-I265 HydrophobicContact CG2-CD1 4.13Å; I178-I267 HydrophobicContact CD1-CD1 3.94Å; I178-I267 HydrophobicContact CD1-CG1 4.45Å; I178-F295 HydrophobicContact CD1-CB 4.3Å; I178-F295 HydrophobicContact CD1-CD1 3.57Å; I178-F295 HydrophobicContact CD1-CD2 4.13Å; I178-F295 HydrophobicContact CD1-CE1 3.86Å; I178-F295 HydrophobicContact CD1-CE2 4.37Å; I178-F295 HydrophobicContact CD1-CG 3.74Å; I178-F295 HydrophobicContact CD1-CZ 4.25Å; I178-F295 HydrophobicContact CG1-CD1 4.03Å; I178-F295 HydrophobicContact CG1-CE1 3.8Å; I178-F295 HydrophobicContact CG1-CZ 4.12Å; I178-F295 HydrophobicContact CG2-CE2 4.02Å; I178-F295 HydrophobicContact CG2-CZ 4.02Å; I178-M297 HydrophobicContact CD1-CE 3.53Å
179	P	94.1	Very high	96.6	Very high	76 Å²	76	48.4 Å²	48.4	49%	0.494	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	142.2	175	29.1	-34.5	0	0	0	109.9	E177 Y181 I265	E177-P179 VanDerWaalsContact O-CD 3.26Å; E177-P179 WeakPolarHBondContact O-CD 3.42Å; P179-Y181 PolarHBondContact O-N 3.21Å; P179-I265 WeakPolarHBondContact O-CD1 3.33Å
180	D	95	Very high	96.3	Very high	120 Å²	120	47.5 Å²	47.5	64%	0.642	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	32.1	179.2	-59.8	-33.1	0	0	0	114.6	R182 N183	D180-R182 PolarHBondContact O-N 3.02Å; D180-N183 PolarHBondContact O-N 3.35Å
181	Y	97	Very high	95.9	Very high	37 Å²	37	51.3 Å²	51.3	15%	0.145	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-54.6	-21.5	177.1	80	-94	0	0	0	113.5	I174 Q175 I178 P179 N183 A184 L204 L206	I174-Y181 HydrophobicContact CG2-CD2 4.31Å; I174-Y181 HydrophobicContact CG2-CG 4.23Å; Q175-Y181 HydrophobicContact CB-CE1 4.33Å; Q175-Y181 HydrophobicContact CG-CE1 4.32Å; Q175-Y181 HydrophobicContact CG-CE2 4.18Å; I178-Y181 PolarHBondContact O-N 2.71Å; P179-Y181 PolarHBondContact O-N 3.21Å; Y181-N183 PolarHBondContact O-N 3.45Å; Y181-A184 WeakPolarHBondContact O-CB 3.42Å; Y181-A184 PolarHBondContact O-N 3.23Å; Y181-L204 HydrophobicContact CE2-CD2 4.41Å; Y181-L206 WeakPolarHBondContact O-CD1 3.41Å
182	R	97.4	Very high	95.4	Very high	149 Å²	149	54.9 Å²	54.9	56%	0.562	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-66.2	-24.1	174.5	-68	-67.2	-176.5	167.4	-2.4	113.5	D180 A184 L204 L206	D180-R182 PolarHBondContact O-N 3.02Å; R182-A184 VanDerWaalsContact C-N 3.28Å; R182-L204 PolarHBondContact NH1-O 3.37Å; R182-L206 WeakPolarHBondContact O-CD2 3.48Å
183	N	97.2	Very high	95.1	Very high	71 Å²	71	50.8 Å²	50.8	38%	0.38	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-92.1	15.5	170.9	-169.6	36.1	0	0	0	112	D180 Y181 G263 R264 I265	D180-N183 PolarHBondContact O-N 3.35Å; Y181-N183 PolarHBondContact O-N 3.45Å; N183-G263 PolarHBondContact ND2-O 2.92Å; N183-R264 WeakPolarHBondContact O-CA 3.4Å; N183-R264 VanDerWaalsContact O-CB 3.24Å; N183-R264 WeakPolarHBondContact O-CB 3.24Å; N183-I265 PolarHBondContact O-N 2.99Å
184	A	98.3	Very high	94.8	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.008	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	161.6	177.2	0	0	0	0	0	112.8	Y181 R182 L206 I265 I267	Y181-A184 WeakPolarHBondContact O-CB 3.42Å; Y181-A184 PolarHBondContact O-N 3.23Å; R182-A184 VanDerWaalsContact C-N 3.28Å; A184-L206 HydrophobicContact CB-CD1 4.09Å; A184-I265 CarbonylContact C-O 3.58Å; A184-I265 WeakPolarHBondContact CA-O 3.47Å; A184-I265 HydrophobicContact CB-CB 3.84Å; A184-I265 HydrophobicContact CB-CG2 4.28Å; A184-I265 WeakPolarHBondContact CB-O 3.4Å; A184-I267 HydrophobicContact CB-CD1 3.72Å; A184-I267 HydrophobicContact CB-CG1 4.11Å
185	V	98.3	Very high	94.5	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.012	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.4	168.6	58.7	0	0	0	0	108.1	V187 A209 V261 R264 I265 A266 I267	V185-V187 HydrophobicContact CG1-CG2 4.31Å; V185-A209 HydrophobicContact CG2-CB 4.01Å; V185-V261 HydrophobicContact CG1-CB 4.15Å; V185-V261 HydrophobicContact CG1-CG1 3.9Å; V185-R264 HydrophobicContact CG1-CB 4.25Å; V185-I265 PolarHBondContact N-O 3.23Å; V185-A266 HydrophobicContact CG1-CB 4.46Å; V185-I267 PolarHBondContact O-N 2.91Å
186	I	98.4	Very high	94.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	129.7	176.8	-54.1	-53.7	0	0	0	108.5	A197 F200 A201 L204 L206 G207 I208 A209 I267 V269	I186-A197 HydrophobicContact CG2-CB 3.89Å; I186-A197 WeakPolarHBondContact CG2-O 3.49Å; I186-F200 HydrophobicContact CG1-CB 4.38Å; I186-F200 HydrophobicContact CG2-CB 4.01Å; I186-A201 HydrophobicContact CB-CB 4.12Å; I186-A201 HydrophobicContact CG1-CB 4.02Å; I186-L204 HydrophobicContact CD1-CD1 3.9Å; I186-L206 HydrophobicContact CD1-CD1 4.02Å; I186-L206 HydrophobicContact CG1-CB 4.36Å; I186-L206 HydrophobicContact CG1-CD1 4.3Å; I186-G207 PolarHBondContact N-O 3.46Å; I186-I208 CarbonylContact O-C 3.51Å; I186-I208 VanDerWaalsContact O-CA 3.26Å; I186-I208 WeakPolarHBondContact O-CA 3.23Å; I186-A209 PolarHBondContact O-N 3.39Å; I186-I267 CarbonylContact C-O 3.54Å; I186-I267 HydrophobicContact CD1-CB 3.97Å; I186-I267 HydrophobicContact CD1-CD1 4.17Å; I186-I267 HydrophobicContact CD1-CG2 4.39Å; I186-V269 HydrophobicContact CG2-CB 4.4Å; I186-V269 HydrophobicContact CG2-CG2 3.71Å
187	V	98	Very high	94.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.1	-174.6	-173.4	0	0	0	0	110.2	V185 A209 I211 A266 I267 I268 V269 L286	V185-V187 HydrophobicContact CG1-CG2 4.31Å; V187-A209 CarbonylContact C-O 3.5Å; V187-A209 VanDerWaalsContact CA-O 3.3Å; V187-A209 WeakPolarHBondContact CA-O 3.34Å; V187-A209 HydrophobicContact CG2-CB 4.34Å; V187-I211 HydrophobicContact CG1-CD1 3.88Å; V187-I211 HydrophobicContact CG1-CG1 3.87Å; V187-A266 HydrophobicContact CG2-CB 3.95Å; V187-I267 PolarHBondContact N-O 3.35Å; V187-I268 HydrophobicContact CB-CG1 4.14Å; V187-I268 HydrophobicContact CG1-CG1 4.39Å; V187-I268 CarbonylContact O-C 3.58Å; V187-I268 VanDerWaalsContact O-CA 3.31Å; V187-I268 WeakPolarHBondContact O-CA 3.3Å; V187-V269 PolarHBondContact O-N 3.23Å; V187-L286 HydrophobicContact CG1-CD1 4.22Å; V187-L286 HydrophobicContact CG1-CD2 4.13Å; V187-L286 HydrophobicContact CG2-CD1 4.32Å; V187-L286 HydrophobicContact CG2-CD2 3.98Å
188	A	96.5	Very high	94.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	125.7	165.3	0	0	0	0	0	109.8	S190 A194 A197 A209 V210 I211	A188-S190 PolarHBondContact O-N 3.48Å; A188-A194 HydrophobicContact CB-CB 4.34Å; A188-A197 HydrophobicContact CB-CB 3.68Å; A188-A209 PolarHBondContact N-O 3.45Å; A188-V210 HydrophobicContact CB-CB 4.44Å; A188-V210 HydrophobicContact CB-CG1 4.2Å; A188-V210 HydrophobicContact CB-CG2 4.13Å; A188-I211 PolarHBondContact O-N 2.83Å
189	K	92.2	Very high	94.1	Very high	26 Å²	26	45.4 Å²	45.4	11%	0.113	24%	0.244	C	C	.	.	S	Bend	trans	-59.2	-30.7	175.5	-173.9	-177.6	78	80.3	0	112.7	S193 I211 D217 I268 D270 S278 F279	K189-S193 PolarHBondContact N-OG 3.21Å; K189-I211 WeakPolarHBondContact O-CB 3.14Å; K189-D217 IonicContact NZ-OD2 3.91Å; K189-D217 PolarHBondContact NZ-OD2 2.58Å; K189-I268 HydrophobicContact CB-CG2 4.11Å; K189-D270 VanDerWaalsContact CE-OD2 3.31Å; K189-D270 WeakPolarHBondContact CE-OD2 3.45Å; K189-S278 PolarHBondContact NZ-OG 3.3Å; K189-F279 HydrophobicContact CD-CD1 3.82Å; K189-F279 HydrophobicContact CD-CD2 3.74Å; K189-F279 HydrophobicContact CD-CE1 3.72Å; K189-F279 HydrophobicContact CD-CE2 3.64Å; K189-F279 HydrophobicContact CD-CG 3.84Å; K189-F279 HydrophobicContact CD-CZ 3.63Å
190	S	89.4	Confident	94.2	Very high	29 Å²	29	42 Å²	42	20%	0.203	22%	0.222	C	C	.	.	S	Bend	trans	-150.4	167.9	179.6	72.1	0	0	0	0	110.7	A188 A192 S193 A194	A188-S190 PolarHBondContact O-N 3.48Å; S190-A192 PolarHBondContact O-N 2.95Å; S190-A192 VanDerWaalsContact O-N 3.09Å; S190-A192 PolarHBondContact OG-N 3.47Å; S190-S193 PolarHBondContact N-OG 3.26Å; S190-S193 PolarHBondContact O-N 2.76Å; S190-S193 VanDerWaalsContact O-N 3.09Å; S190-S193 PolarHBondContact O-OG 2.77Å; S190-A194 PolarHBondContact O-N 3.21Å
191	P	88.6	Confident	94.2	Very high	82 Å²	82	36.6 Å²	36.6	53%	0.532	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.9	171.5	-26	36.1	0	0	0	113.6	A194	P191-A194 WeakPolarHBondContact O-CB 3.48Å; P191-A194 PolarHBondContact O-N 3.18Å
192	A	85.4	Confident	94.2	Very high	89 Å²	89	40.5 Å²	40.5	74%	0.736	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-31.7	178.6	0	0	0	0	0	112.8	S190	S190-A192 PolarHBondContact O-N 2.95Å; S190-A192 VanDerWaalsContact O-N 3.09Å; S190-A192 PolarHBondContact OG-N 3.47Å
193	S	88.3	Confident	94	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.021	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.1	176.9	46.9	0	0	0	0	113.7	K189 S190 K195 R196 A197	K189-S193 PolarHBondContact N-OG 3.21Å; S190-S193 PolarHBondContact N-OG 3.26Å; S190-S193 PolarHBondContact O-N 2.76Å; S190-S193 VanDerWaalsContact O-N 3.09Å; S190-S193 PolarHBondContact O-OG 2.77Å; S193-K195 VanDerWaalsContact C-N 3.34Å; S193-K195 PolarHBondContact O-N 3.01Å; S193-R196 PolarHBondContact O-N 2.85Å; S193-R196 VanDerWaalsContact O-N 3.12Å; S193-A197 PolarHBondContact O-N 3.23Å
194	A	91.8	Very high	93.9	Very high	24 Å²	24	33.2 Å²	33.2	20%	0.198	18%	0.181	C	C	.	.	H	α-helix	trans	-56.6	-40.9	-177.6	0	0	0	0	0	114	A188 S190 P191 R196 A197 Q198 V210	A188-A194 HydrophobicContact CB-CB 4.34Å; S190-A194 PolarHBondContact O-N 3.21Å; P191-A194 WeakPolarHBondContact O-CB 3.48Å; P191-A194 PolarHBondContact O-N 3.18Å; A194-R196 VanDerWaalsContact C-N 3.33Å; A194-R196 PolarHBondContact O-N 3.34Å; A194-A197 PolarHBondContact O-N 3.09Å; A194-Q198 WeakPolarHBondContact O-CB 3.43Å; A194-Q198 PolarHBondContact O-N 3.26Å; A194-V210 HydrophobicContact CB-CG2 4.32Å
195	K	91.4	Very high	93.8	Very high	131 Å²	131	43.4 Å²	43.4	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-61.9	-40.9	178	-69.1	-171.8	177.7	-171.8	0	112.5	S193 Q198 S199	S193-K195 VanDerWaalsContact C-N 3.34Å; S193-K195 PolarHBondContact O-N 3.01Å; K195-Q198 WeakPolarHBondContact O-CB 3.47Å; K195-Q198 PolarHBondContact O-N 3Å; K195-S199 PolarHBondContact O-N 2.93Å
196	R	92.9	Very high	93.8	Very high	29 Å²	29	44.6 Å²	44.6	11%	0.109	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-47.3	178.5	-170.3	179.1	-60.8	124.1	-1.5	111.1	S193 A194 Q198 S199 F200 V269 D270 D271	S193-R196 PolarHBondContact O-N 2.85Å; S193-R196 VanDerWaalsContact O-N 3.12Å; A194-R196 VanDerWaalsContact C-N 3.33Å; A194-R196 PolarHBondContact O-N 3.34Å; R196-Q198 VanDerWaalsContact C-N 3.27Å; R196-Q198 PolarHBondContact O-N 3.17Å; R196-S199 PolarHBondContact O-N 3.39Å; R196-F200 HydrophobicContact CG-CD2 4.45Å; R196-F200 HydrophobicContact CG-CE2 4.34Å; R196-F200 WeakPolarHBondContact O-CD2 3.43Å; R196-F200 PolarHBondContact O-N 3.49Å; R196-F200 VanDerWaalsContact O-N 3.11Å; R196-V269 HydrophobicContact CG-CG1 3.9Å; R196-D270 VanDerWaalsContact NH1-C 3.29Å; R196-D270 IonicContact NH1-OD1 2.86Å; R196-D270 PolarHBondContact NH1-OD1 2.77Å; R196-D271 IonicContact CZ-OD1 3.76Å; R196-D271 IonicContact NH1-OD1 3.48Å; R196-D271 PolarHBondContact NH1-OD1 3Å; R196-D271 IonicContact NH2-OD1 2.89Å; R196-D271 PolarHBondContact NH2-OD1 3.15Å; R196-D271 IonicContact NH2-OD2 3.59Å
197	A	95.6	Very high	93.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58	-41.8	174.7	0	0	0	0	0	111.6	I186 A188 S193 A194 F200 A201 I208	I186-A197 HydrophobicContact CG2-CB 3.89Å; I186-A197 WeakPolarHBondContact CG2-O 3.49Å; A188-A197 HydrophobicContact CB-CB 3.68Å; S193-A197 PolarHBondContact O-N 3.23Å; A194-A197 PolarHBondContact O-N 3.09Å; A197-F200 PolarHBondContact O-N 3.49Å; A197-A201 WeakPolarHBondContact O-CB 3.44Å; A197-A201 PolarHBondContact O-N 3.12Å; A197-I208 HydrophobicContact CB-CD1 3.88Å; A197-I208 HydrophobicContact CB-CG1 4.28Å
198	Q	95.5	Very high	93.7	Very high	81 Å²	81	49.3 Å²	49.3	38%	0.379	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-46.4	175.8	-178.8	178.3	-4.8	0	0	111.8	A194 K195 R196 F200 A201 E202 I208	A194-Q198 WeakPolarHBondContact O-CB 3.43Å; A194-Q198 PolarHBondContact O-N 3.26Å; K195-Q198 WeakPolarHBondContact O-CB 3.47Å; K195-Q198 PolarHBondContact O-N 3Å; R196-Q198 VanDerWaalsContact C-N 3.27Å; R196-Q198 PolarHBondContact O-N 3.17Å; Q198-F200 VanDerWaalsContact C-N 3.27Å; Q198-F200 PolarHBondContact O-N 3.09Å; Q198-A201 PolarHBondContact O-N 3.17Å; Q198-A201 VanDerWaalsContact O-N 3.13Å; Q198-E202 HydrophobicContact CG-CG 4.3Å; Q198-E202 WeakPolarHBondContact CG-OE1 3.47Å; Q198-E202 PolarHBondContact NE2-OE1 3.23Å; Q198-E202 WeakPolarHBondContact O-CG 3.3Å; Q198-E202 PolarHBondContact O-N 3.41Å; Q198-I208 HydrophobicContact CB-CD1 3.96Å
199	S	94.2	Very high	93.7	Very high	4 Å²	4	49.3 Å²	49.3	3%	0.028	26%	0.258	C	S	.	.	H	α-helix	trans	-60.3	-35.5	177.6	-177.5	0	0	0	0	113	K195 R196 R203 D370	K195-S199 PolarHBondContact O-N 2.93Å; R196-S199 PolarHBondContact O-N 3.39Å; S199-R203 PolarHBondContact O-N 3.4Å; S199-R203 PolarHBondContact O-NE 3.15Å; S199-R203 PolarHBondContact O-NH2 2.91Å; S199-R203 PolarHBondContact OG-NH2 3.13Å; S199-D370 VanDerWaalsContact CB-OD1 3.23Å; S199-D370 WeakPolarHBondContact CB-OD1 3.45Å; S199-D370 VanDerWaalsContact OG-CG 3.26Å; S199-D370 PolarHBondContact OG-OD1 3.28Å
200	F	96.2	Very high	93.9	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-70	-45.6	172.4	-87.3	-116.3	0	0	0	111.8	L170 L171 I174 I186 R196 A197 Q198 E202 R203 L204 V269	L170-F200 HydrophobicContact CB-CE1 4Å; L170-F200 HydrophobicContact CB-CZ 4.09Å; L170-F200 HydrophobicContact CD1-CZ 4.24Å; L171-F200 HydrophobicContact CD2-CD1 3.76Å; L171-F200 HydrophobicContact CD2-CE1 4.22Å; L171-F200 HydrophobicContact CD2-CG 4.25Å; L171-F200 HydrophobicContact CG-CD1 4.2Å; L171-F200 HydrophobicContact CG-CE1 4.17Å; I174-F200 HydrophobicContact CD1-CD1 4.01Å; I174-F200 HydrophobicContact CD1-CE1 4.17Å; I186-F200 HydrophobicContact CG1-CB 4.38Å; I186-F200 HydrophobicContact CG2-CB 4.01Å; R196-F200 HydrophobicContact CG-CD2 4.45Å; R196-F200 HydrophobicContact CG-CE2 4.34Å; R196-F200 WeakPolarHBondContact O-CD2 3.43Å; R196-F200 PolarHBondContact O-N 3.49Å; R196-F200 VanDerWaalsContact O-N 3.11Å; A197-F200 PolarHBondContact O-N 3.49Å; Q198-F200 VanDerWaalsContact C-N 3.27Å; Q198-F200 PolarHBondContact O-N 3.09Å; F200-E202 PolarHBondContact O-N 2.92Å; F200-R203 PolarHBondContact O-N 3.25Å; F200-L204 WeakPolarHBondContact O-CB 3.08Å; F200-L204 WeakPolarHBondContact O-CG 3.48Å; F200-L204 PolarHBondContact O-N 3.41Å; F200-V269 HydrophobicContact CB-CG2 4.43Å; F200-V269 HydrophobicContact CD1-CG1 4.28Å; F200-V269 HydrophobicContact CD1-CG2 3.96Å; F200-V269 HydrophobicContact CD2-CG1 3.88Å; F200-V269 HydrophobicContact CE1-CG1 4.22Å; F200-V269 HydrophobicContact CE1-CG2 4.37Å; F200-V269 HydrophobicContact CE2-CG1 3.8Å; F200-V269 HydrophobicContact CG-CG1 4.11Å; F200-V269 HydrophobicContact CG-CG2 4.14Å; F200-V269 HydrophobicContact CZ-CG1 3.98Å
201	A	96.7	Very high	94	Very high	6 Å²	6	48.3 Å²	48.3	5%	0.05	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-43.8	-180	0	0	0	0	0	112.1	I186 A197 Q198 R203 L204 R205 L206 I208	I186-A201 HydrophobicContact CB-CB 4.12Å; I186-A201 HydrophobicContact CG1-CB 4.02Å; A197-A201 WeakPolarHBondContact O-CB 3.44Å; A197-A201 PolarHBondContact O-N 3.12Å; Q198-A201 PolarHBondContact O-N 3.17Å; Q198-A201 VanDerWaalsContact O-N 3.13Å; A201-R203 PolarHBondContact O-N 3.4Å; A201-L204 PolarHBondContact O-N 3.38Å; A201-R205 CarbonylContact O-C 3.5Å; A201-R205 VanDerWaalsContact O-CA 3.3Å; A201-R205 WeakPolarHBondContact O-CA 3.46Å; A201-R205 PolarHBondContact O-N 3.31Å; A201-L206 PolarHBondContact O-N 3.06Å; A201-I208 HydrophobicContact CB-CB 4.23Å
202	E	95.3	Very high	93.8	Very high	119 Å²	119	48.7 Å²	48.7	56%	0.556	25%	0.246	S	C	*	.	H	α-helix	trans	-62	-43.3	178.3	-74.5	177.4	-173.7	0	0	112.1	Q198 F200 R205	Q198-E202 HydrophobicContact CG-CG 4.3Å; Q198-E202 WeakPolarHBondContact CG-OE1 3.47Å; Q198-E202 PolarHBondContact NE2-OE1 3.23Å; Q198-E202 WeakPolarHBondContact O-CG 3.3Å; Q198-E202 PolarHBondContact O-N 3.41Å; F200-E202 PolarHBondContact O-N 2.92Å; E202-R205 PolarHBondContact O-N 3.01Å
203	R	93.7	Very high	93	Very high	65 Å²	65	45.6 Å²	45.6	25%	0.245	22%	0.223	C	C	.	.	H	α-helix	trans	-74	-32.5	-179.1	-75.1	179.2	-72.7	177.3	4.4	113.4	S167 L171 S199 F200 A201 D370	S167-R203 PolarHBondContact OG-NH1 3.18Å; S167-R203 VanDerWaalsContact OG-NH1 3.14Å; L171-R203 HydrophobicContact CD1-CB 4.1Å; L171-R203 HydrophobicContact CD2-CB 4.45Å; S199-R203 PolarHBondContact O-N 3.4Å; S199-R203 PolarHBondContact O-NE 3.15Å; S199-R203 PolarHBondContact O-NH2 2.91Å; S199-R203 PolarHBondContact OG-NH2 3.13Å; F200-R203 PolarHBondContact O-N 3.25Å; A201-R203 PolarHBondContact O-N 3.4Å; R203-D370 IonicContact CZ-OD1 2.66Å; R203-D370 IonicContact CZ-OD2 3.56Å; R203-D370 IonicContact NH1-OD1 3.76Å; R203-D370 IonicContact NH1-OD2 3.59Å; R203-D370 PolarHBondContact NH1-OD2 3.12Å; R203-D370 IonicContact NH2-OD1 2.96Å; R203-D370 PolarHBondContact NH2-OD1 3.12Å; R203-D370 IonicContact NH2-OD2 3.03Å; R203-D370 PolarHBondContact NH2-OD2 3.4Å
204	L	95.8	Very high	91.8	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-84.8	-12.7	174.5	-64.8	172	0	0	0	113.1	L171 I174 Q175 Y181 R182 I186 F200 A201 L206	L171-L204 HydrophobicContact CD2-CD1 3.73Å; L171-L204 HydrophobicContact CD2-CD2 3.7Å; L171-L204 HydrophobicContact CD2-CG 3.47Å; L171-L204 VanDerWaalsContact CD2-CG 3.47Å; I174-L204 HydrophobicContact CD1-CD1 3.97Å; I174-L204 HydrophobicContact CG2-CD1 3.91Å; I174-L204 HydrophobicContact CG2-CD2 4.42Å; Q175-L204 HydrophobicContact CG-CD2 3.92Å; Y181-L204 HydrophobicContact CE2-CD2 4.41Å; R182-L204 PolarHBondContact NH1-O 3.37Å; I186-L204 HydrophobicContact CD1-CD1 3.9Å; F200-L204 WeakPolarHBondContact O-CB 3.08Å; F200-L204 WeakPolarHBondContact O-CG 3.48Å; F200-L204 PolarHBondContact O-N 3.41Å; A201-L204 PolarHBondContact O-N 3.38Å; L204-L206 HydrophobicContact CB-CB 4.43Å; L204-L206 HydrophobicContact CB-CD1 3.68Å; L204-L206 HydrophobicContact CB-CG 3.72Å; L204-L206 HydrophobicContact CD1-CD1 3.95Å; L204-L206 HydrophobicContact CG-CD1 4.44Å
205	R	96.8	Very high	89.9	Confident	214 Å²	214	49.1 Å²	49.1	81%	0.808	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.7	48.1	-170.9	-52.7	179.7	-176.3	169	0.1	111.9	A201 E202	A201-R205 CarbonylContact O-C 3.5Å; A201-R205 VanDerWaalsContact O-CA 3.3Å; A201-R205 WeakPolarHBondContact O-CA 3.46Å; A201-R205 PolarHBondContact O-N 3.31Å; E202-R205 PolarHBondContact O-N 3.01Å
206	L	97.4	Very high	87.7	Confident	27 Å²	27	51.2 Å²	51.2	14%	0.141	25%	0.252	C	S	.	.			trans	-113.8	166.6	-179.8	-62.7	177.6	0	0	0	111.2	Y181 R182 A184 I186 A201 L204	Y181-L206 WeakPolarHBondContact O-CD1 3.41Å; R182-L206 WeakPolarHBondContact O-CD2 3.48Å; A184-L206 HydrophobicContact CB-CD1 4.09Å; I186-L206 HydrophobicContact CD1-CD1 4.02Å; I186-L206 HydrophobicContact CG1-CB 4.36Å; I186-L206 HydrophobicContact CG1-CD1 4.3Å; A201-L206 PolarHBondContact O-N 3.06Å; L204-L206 HydrophobicContact CB-CB 4.43Å; L204-L206 HydrophobicContact CB-CD1 3.68Å; L204-L206 HydrophobicContact CB-CG 3.72Å; L204-L206 HydrophobicContact CD1-CD1 3.95Å; L204-L206 HydrophobicContact CG-CD1 4.44Å
207	G	96.9	Very high	85.6	Confident	33 Å²	33	51.4 Å²	51.4	34%	0.34	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	161.7	169	0	0	0	0	0	111.8	I186	I186-G207 PolarHBondContact N-O 3.46Å
208	I	97.1	Very high	83.4	Confident	66 Å²	66	54.5 Å²	54.5	34%	0.338	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	141.4	172.2	-173.7	176.2	0	0	0	110	I186 A197 Q198 A201 V210	I186-I208 CarbonylContact O-C 3.51Å; I186-I208 VanDerWaalsContact O-CA 3.26Å; I186-I208 WeakPolarHBondContact O-CA 3.23Å; A197-I208 HydrophobicContact CB-CD1 3.88Å; A197-I208 HydrophobicContact CB-CG1 4.28Å; Q198-I208 HydrophobicContact CB-CD1 3.96Å; A201-I208 HydrophobicContact CB-CB 4.23Å; I208-V210 HydrophobicContact CD1-CG2 4.35Å; I208-V210 HydrophobicContact CG1-CG2 4.42Å
209	A	97.1	Very high	81.3	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	152.7	163.8	0	0	0	0	0	109.9	V185 I186 V187 A188 V257 V258 V261	V185-A209 HydrophobicContact CG2-CB 4.01Å; I186-A209 PolarHBondContact O-N 3.39Å; V187-A209 CarbonylContact C-O 3.5Å; V187-A209 VanDerWaalsContact CA-O 3.3Å; V187-A209 WeakPolarHBondContact CA-O 3.34Å; V187-A209 HydrophobicContact CG2-CB 4.34Å; A188-A209 PolarHBondContact N-O 3.45Å; A209-V257 HydrophobicContact CB-CG1 4.11Å; A209-V258 CarbonylContact C-O 3.58Å; A209-V258 VanDerWaalsContact CA-O 3.25Å; A209-V258 WeakPolarHBondContact CA-O 3.43Å; A209-V261 HydrophobicContact CB-CG1 3.68Å
210	V	96.2	Very high	79.2	Confident	31 Å²	31	56.5 Å²	56.5	19%	0.188	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130	-179.7	-178.1	0	0	0	0	108.8	A188 A194 I208 V258	A188-V210 HydrophobicContact CB-CB 4.44Å; A188-V210 HydrophobicContact CB-CG1 4.2Å; A188-V210 HydrophobicContact CB-CG2 4.13Å; A194-V210 HydrophobicContact CB-CG2 4.32Å; I208-V210 HydrophobicContact CD1-CG2 4.35Å; I208-V210 HydrophobicContact CG1-CG2 4.42Å; V210-V258 PolarHBondContact N-O 3.33Å; V210-V258 PolarHBondContact O-N 3.13Å
211	I	91.8	Very high	76.9	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.015	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.2	173	-62.1	177.9	0	0	0	108.6	V187 A188 K189 I255 T256 V257 A282 L286	V187-I211 HydrophobicContact CG1-CD1 3.88Å; V187-I211 HydrophobicContact CG1-CG1 3.87Å; A188-I211 PolarHBondContact O-N 2.83Å; K189-I211 WeakPolarHBondContact O-CB 3.14Å; I211-I255 HydrophobicContact CG2-CD1 3.74Å; I211-I255 HydrophobicContact CG2-CG1 3.52Å; I211-T256 WeakPolarHBondContact CA-O 3.49Å; I211-V257 HydrophobicContact CG1-CG2 4.29Å; I211-A282 HydrophobicContact CD1-CB 3.26Å; I211-L286 HydrophobicContact CD1-CD1 4.34Å; I211-L286 HydrophobicContact CD1-CG 4.32Å
212	H	83.6	Confident	74.6	Confident	89 Å²	89	63.5 Å²	63.5	41%	0.412	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.8	-179.4	175.6	75.3	0	0	0	110.2	I255 T256 V258	H212-I255 CarbonylContact O-C 3.33Å; H212-T256 PolarHBondContact N-O 3.39Å; H212-T256 PolarHBondContact O-N 3.06Å; H212-T256 VanDerWaalsContact O-O 3.11Å; H212-T256 PolarHBondContact O-OG1 3.29Å; H212-V258 HydrophobicContact CB-CG2 4.49Å
213	G	69.1	Low	72.4	Confident	24 Å²	24	62 Å²	62	25%	0.247	33%	0.328	C	S	.	.	S	Bend	trans	103.2	165.7	-170.1	0	0	0	0	0	110.4
214	E	62.6	Low	70.2	Confident	73 Å²	73	61.1 Å²	61.1	34%	0.341	33%	0.328	S	S	.	.			trans	-108.3	114.2	-173.2	-70.6	-173.1	-165	0	0	111.5	K252	E214-K252 WeakPolarHBondContact OE1-CE 3.43Å; E214-K252 IonicContact OE1-NZ 2.85Å; E214-K252 WeakPolarHBondContact OE2-CD 3.42Å; E214-K252 WeakPolarHBondContact OE2-CE 3.24Å; E214-K252 IonicContact OE2-NZ 2.63Å; E214-K252 PolarHBondContact OE2-NZ 3.46Å
215	A	51.6	Low	68.2	Low	28 Å²	28	62.2 Å²	62.2	23%	0.231	34%	0.34	C	S	.	.	S	Bend	trans	-70.5	142.5	132.4	0	0	0	0	0	106.2	D217 A281	A215-D217 VanDerWaalsContact C-N 3.29Å; A215-D217 PolarHBondContact O-N 2.99Å; A215-A281 HydrophobicContact CB-CB 3.72Å
216	Q	46.1	Very low	65.9	Low	175 Å²	175	60.9 Å²	60.9	82%	0.818	34%	0.335	S	S	*	.			trans	-55.2	91.4	-179.8	-78.4	-176.6	-15.2	0	0	110.5
217	D	48.2	Very low	63.6	Low	34 Å²	34	69 Å²	69	18%	0.182	37%	0.372	C	S	.	.			trans	-91.6	109.5	173.3	-147.6	-21.2	0	0	0	104.9	K189 A215 E219 S220	K189-D217 IonicContact NZ-OD2 3.91Å; K189-D217 PolarHBondContact NZ-OD2 2.58Å; A215-D217 VanDerWaalsContact C-N 3.29Å; A215-D217 PolarHBondContact O-N 2.99Å; D217-E219 PolarHBondContact O-N 3.33Å; D217-S220 PolarHBondContact O-N 3.46Å; D217-S220 PolarHBondContact O-OG 3.48Å
218	A	49	Very low	61.3	Low	64 Å²	64	71.1 Å²	71.1	53%	0.529	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-14.9	-174.3	0	0	0	0	0	113.3	Q222	A218-Q222 PolarHBondContact O-NE2 2.84Å
219	E	52.1	Low	58.7	Low	75 Å²	75	72.5 Å²	72.5	35%	0.35	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-30.6	-176.9	-62.4	-165	154.3	0	0	115.9	K116 D217	K116-E219 WeakPolarHBondContact CD-OE1 3.46Å; K116-E219 WeakPolarHBondContact CE-OE1 3.26Å; K116-E219 WeakPolarHBondContact CE-OE2 3.27Å; K116-E219 IonicContact NZ-OE1 2.85Å; K116-E219 PolarHBondContact NZ-OE1 2.86Å; K116-E219 IonicContact NZ-OE2 2.88Å; K116-E219 PolarHBondContact NZ-OE2 2.94Å; D217-E219 PolarHBondContact O-N 3.33Å
220	S	49.4	Very low	56.5	Low	52 Å²	52	77.8 Å²	77.8	36%	0.364	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-77.2	-26.4	179	54.7	0	0	0	0	112.4	D217 Q222 V223	D217-S220 PolarHBondContact O-N 3.46Å; D217-S220 PolarHBondContact O-OG 3.48Å; S220-Q222 PolarHBondContact O-N 3.34Å; S220-Q222 VanDerWaalsContact O-N 3.08Å; S220-V223 WeakPolarHBondContact O-CG2 3.42Å
221	D	48.1	Very low	54	Low	70 Å²	70	83.2 Å²	83.2	37%	0.374	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-75.7	5.3	-176.9	-80.2	-0.5	0	0	0	115.2	K252	D221-K252 IonicContact OD1-NZ 3.66Å; D221-K252 PolarHBondContact OD1-NZ 3.26Å; D221-K252 IonicContact OD2-NZ 3.36Å; D221-K252 PolarHBondContact OD2-NZ 3.22Å
222	Q	48.8	Very low	52.1	Low	88 Å²	88	88.8 Å²	88.8	41%	0.411	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-123.6	10.8	-172.7	-54	-160	38.7	0	0	114.7	R121 A218 S220 D224	R121-Q222 HydrophobicContact CB-CB 4.29Å; R121-Q222 WeakPolarHBondContact CB-O 3.36Å; R121-Q222 WeakPolarHBondContact CD-O 3.43Å; A218-Q222 PolarHBondContact O-NE2 2.84Å; S220-Q222 PolarHBondContact O-N 3.34Å; S220-Q222 VanDerWaalsContact O-N 3.08Å; Q222-D224 PolarHBondContact O-N 3.39Å
223	V	49	Very low	50.2	Low	86 Å²	86	94.4 Å²	94.4	52%	0.521	52%	0.519	S	S	.	.			trans	-64	131.7	169.1	-158.2	0	0	0	0	108.6	R121 S220 G225	R121-V223 VanDerWaalsContact NH1-CG2 3.27Å; S220-V223 WeakPolarHBondContact O-CG2 3.42Å; V223-G225 PolarHBondContact O-N 3.01Å
224	D	48.6	Very low	48.9	Very low	48 Å²	48	99 Å²	99	26%	0.257	54%	0.543	S	S	.	.			trans	-71.9	13.9	-171.5	72	-13.8	0	0	0	115	Q222 R226	Q222-D224 PolarHBondContact O-N 3.39Å; D224-R226 PolarHBondContact O-N 3.31Å; D224-R226 WeakPolarHBondContact OD1-CG 3.49Å; D224-R226 PolarHBondContact OD1-N 2.92Å; D224-R226 VanDerWaalsContact OD2-CD 3.28Å; D224-R226 WeakPolarHBondContact OD2-CD 3.45Å; D224-R226 WeakPolarHBondContact OD2-CG 3.37Å; D224-R226 IonicContact OD2-CZ 3.06Å; D224-R226 IonicContact OD2-NE 2.99Å; D224-R226 PolarHBondContact OD2-NE 3.27Å; D224-R226 IonicContact OD2-NH2 2.91Å
225	G	51.9	Low	48	Very low	25 Å²	25	102.7 Å²	102.7	26%	0.258	57%	0.57	S	S	.	*			trans	59.3	26.7	179.3	0	0	0	0	0	113.1	V223 H227 S228	V223-G225 PolarHBondContact O-N 3.01Å; G225-H227 PolarHBondContact O-N 3.11Å; G225-S228 CarbonylContact C-O 3.57Å; G225-S228 CarbonylContact O-C 3.55Å; G225-S228 WeakPolarHBondContact O-CA 3.46Å; G225-S228 PolarHBondContact O-N 3.45Å
226	R	49.4	Very low	47.5	Very low	186 Å²	186	104 Å²	104	70%	0.702	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-9.8	172.5	-76.8	176.5	-167.5	-148.6	-7.6	114.3	D224	D224-R226 PolarHBondContact O-N 3.31Å; D224-R226 WeakPolarHBondContact OD1-CG 3.49Å; D224-R226 PolarHBondContact OD1-N 2.92Å; D224-R226 VanDerWaalsContact OD2-CD 3.28Å; D224-R226 WeakPolarHBondContact OD2-CD 3.45Å; D224-R226 WeakPolarHBondContact OD2-CG 3.37Å; D224-R226 IonicContact OD2-CZ 3.06Å; D224-R226 IonicContact OD2-NE 2.99Å; D224-R226 PolarHBondContact OD2-NE 3.27Å; D224-R226 IonicContact OD2-NH2 2.91Å
227	H	48.3	Very low	47.6	Very low	199 Å²	199	101.1 Å²	101.1	92%	0.921	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	7.8	166.2	-67.2	-54.3	0	0	0	114.8	G225	G225-H227 PolarHBondContact O-N 3.11Å
228	S	49	Very low	47.6	Very low	76 Å²	76	105.4 Å²	105.4	53%	0.531	61%	0.614	S	S	.	*	S	Bend	trans	-133.3	126.8	178.5	-60.6	0	0	0	0	109.4	G225	G225-S228 CarbonylContact C-O 3.57Å; G225-S228 CarbonylContact O-C 3.55Å; G225-S228 WeakPolarHBondContact O-CA 3.46Å; G225-S228 PolarHBondContact O-N 3.45Å
229	P	43.8	Very low	47.7	Very low	95 Å²	95	109 Å²	109	62%	0.617	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-51.1	142.5	-178	-21.4	30.2	0	0	0	112	L247	P229-L247 HydrophobicContact CB-CD1 4.1Å; P229-L247 HydrophobicContact CG-CD1 4.39Å
230	P	49.3	Very low	47.8	Very low	113 Å²	113	111.8 Å²	111.8	73%	0.734	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-61	139.9	-169.5	24.5	-33.4	0	0	0	112
231	T	44.7	Very low	48.1	Very low	144 Å²	144	113.9 Å²	113.9	88%	0.883	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-85.4	121.2	164	17.9	0	0	0	0	108.9
232	V	51.1	Low	48.4	Very low	120 Å²	120	117.4 Å²	117.4	73%	0.727	68%	0.675	S	S	*	*			trans	-118.7	127.2	173.2	-178.1	0	0	0	0	109.4
233	K	44.8	Very low	48.7	Very low	207 Å²	207	122.4 Å²	122.4	90%	0.9	70%	0.698	S	S	*	*			trans	-75.6	119.3	162.2	-71	-176.2	176.6	-176.7	0	108
234	T	40.3	Very low	49.2	Very low	122 Å²	122	124.7 Å²	124.7	75%	0.748	71%	0.706	S	S	*	*			trans	-75.5	123.4	-178.5	-17.7	0	0	0	0	111.2
235	T	43.8	Very low	49.7	Very low	150 Å²	150	127.7 Å²	127.7	92%	0.92	73%	0.728	S	S	*	*			trans	-153.1	91.8	137.9	36.9	0	0	0	0	108.9
236	G	41.6	Very low	49.8	Very low	54 Å²	54	134.8 Å²	134.8	56%	0.557	76%	0.759	S	S	*	*	S	Bend	trans	171.7	107.5	173.7	0	0	0	0	0	109	I238	G236-I238 PolarHBondContact O-N 2.89Å; G236-I238 VanDerWaalsContact O-N 3.12Å
237	A	47.7	Very low	50	Low	115 Å²	115	131.8 Å²	131.8	95%	0.95	76%	0.757	S	S	*	*			trans	-52.5	113.4	-173.7	0	0	0	0	0	111.7
238	I	48.8	Very low	50.3	Low	124 Å²	124	129.5 Å²	129.5	64%	0.636	75%	0.75	S	S	*	*			trans	-97.1	136.5	165.3	-59.2	175	0	0	0	106.3	G236	G236-I238 PolarHBondContact O-N 2.89Å; G236-I238 VanDerWaalsContact O-N 3.12Å
239	H	51.6	Low	50.6	Low	139 Å²	139	131.1 Å²	131.1	64%	0.644	76%	0.759	S	S	*	*			trans	-13	135.8	174.1	-144.4	-94.1	0	0	0	116.6	S241	H239-S241 PolarHBondContact ND1-OG 2.59Å; H239-S241 PolarHBondContact O-N 2.99Å
240	P	54.3	Low	51.1	Low	135 Å²	135	136 Å²	136	88%	0.877	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	18.6	-169.4	28.2	-35.6	0	0	0	116.4
241	S	56	Low	51.3	Low	96 Å²	96	139.7 Å²	139.7	67%	0.671	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.3	14.8	-173.3	65	0	0	0	0	114.6	H239	H239-S241 PolarHBondContact ND1-OG 2.59Å; H239-S241 PolarHBondContact O-N 2.99Å
242	M	53.1	Low	51.9	Low	143 Å²	143	138 Å²	138	70%	0.704	76%	0.758	S	S	*	*			trans	-131.3	90.7	178.9	-155.7	179.4	-68.8	0	0	110.7	I244	M242-I244 PolarHBondContact O-N 2.54Å
243	E	54.8	Low	52.2	Low	193 Å²	193	135.5 Å²	135.5	90%	0.902	74%	0.744	S	S	*	*			trans	-78.9	112.2	167.9	-69.6	-176.2	170.7	0	0	108.6	P245	E243-P245 WeakPolarHBondContact O-CD 3.29Å
244	I	60.9	Low	53.6	Low	134 Å²	134	130.4 Å²	130.4	69%	0.687	73%	0.732	S	S	*	*			trans	-74.2	123.7	169.6	-59	175.8	0	0	0	106.7	M242 L246	M242-I244 PolarHBondContact O-N 2.54Å; I244-L246 PolarHBondContact O-N 2.69Å
245	P	59.5	Low	55.6	Low	112 Å²	112	126.9 Å²	126.9	73%	0.727	71%	0.708	S	S	*	*			trans	-55.6	129.6	177	-24.3	33.3	0	0	0	111	E243 L247	E243-P245 WeakPolarHBondContact O-CD 3.29Å; P245-L247 PolarHBondContact O-N 2.87Å
246	L	53.3	Low	57.7	Low	173 Å²	173	121.9 Å²	121.9	91%	0.906	68%	0.677	S	S	*	*			trans	-63.4	107.7	172.5	-84	157.7	0	0	0	109	I244 I248	I244-L246 PolarHBondContact O-N 2.69Å; L246-I248 PolarHBondContact O-N 3.3Å
247	L	54.1	Low	60.1	Low	124 Å²	124	119.9 Å²	119.9	65%	0.649	66%	0.655	S	S	*	*			trans	-67	114	168.8	-90.3	151.5	0	0	0	108.4	P229 P245	P229-L247 HydrophobicContact CB-CD1 4.1Å; P229-L247 HydrophobicContact CG-CD1 4.39Å; P245-L247 PolarHBondContact O-N 2.87Å
248	I	54.2	Low	62.3	Low	151 Å²	151	118.9 Å²	118.9	77%	0.774	64%	0.636	S	S	*	*			trans	-59.4	127.4	170.4	-55.7	171.5	0	0	0	106.9	L246 K250	L246-I248 PolarHBondContact O-N 3.3Å; I248-K250 PolarHBondContact O-N 2.6Å; I248-K250 VanDerWaalsContact O-N 3.16Å
249	P	54.6	Low	64.3	Low	110 Å²	110	115.1 Å²	115.1	71%	0.714	63%	0.628	S	S	*	*			trans	-53.2	125.1	171.9	-22.7	32.5	0	0	0	108.7	E251	P249-E251 PolarHBondContact O-N 3.01Å
250	K	54.5	Low	66.4	Low	198 Å²	198	113 Å²	113	86%	0.861	62%	0.622	S	S	*	*			trans	-60.8	113.4	170.5	-80.9	-175.2	174.3	-179.2	0	107.4	I248 K252	I248-K250 PolarHBondContact O-N 2.6Å; I248-K250 VanDerWaalsContact O-N 3.16Å; K250-K252 PolarHBondContact O-N 3.25Å
251	E	52.8	Low	68.4	Low	190 Å²	190	106.8 Å²	106.8	89%	0.888	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-60.8	128	165.4	-74.3	-174.8	166.3	0	0	107.9	P249	P249-E251 PolarHBondContact O-N 3.01Å
252	K	57.2	Low	70.4	Confident	108 Å²	108	103.8 Å²	103.8	47%	0.47	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-76.6	130.6	-176.2	-71.9	165.9	164	-167.4	0	108.8	E214 D221 K250	E214-K252 WeakPolarHBondContact OE1-CE 3.43Å; E214-K252 IonicContact OE1-NZ 2.85Å; E214-K252 WeakPolarHBondContact OE2-CD 3.42Å; E214-K252 WeakPolarHBondContact OE2-CE 3.24Å; E214-K252 IonicContact OE2-NZ 2.63Å; E214-K252 PolarHBondContact OE2-NZ 3.46Å; D221-K252 IonicContact OD1-NZ 3.66Å; D221-K252 PolarHBondContact OD1-NZ 3.26Å; D221-K252 IonicContact OD2-NZ 3.36Å; D221-K252 PolarHBondContact OD2-NZ 3.22Å; K250-K252 PolarHBondContact O-N 3.25Å
253	P	58.9	Low	72.4	Confident	67 Å²	67	99.2 Å²	99.2	44%	0.435	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-67	147	178.6	27.2	-32.5	0	0	0	110.5
254	P	72.9	Confident	74.5	Confident	100 Å²	100	93.7 Å²	93.7	65%	0.649	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-60.6	158.3	174.9	26.9	-34.2	0	0	0	111	T256	P254-T256 PolarHBondContact O-N 2.99Å
255	I	82.3	Confident	76.3	Confident	48 Å²	48	87.4 Å²	87.4	25%	0.246	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-59.1	129.3	174.3	-165.9	168.8	0	0	0	110.2	I211 H212 A281 T285	I211-I255 HydrophobicContact CG2-CD1 3.74Å; I211-I255 HydrophobicContact CG2-CG1 3.52Å; H212-I255 CarbonylContact O-C 3.33Å; I255-A281 HydrophobicContact CD1-CB 4.08Å; I255-T285 HydrophobicContact CG2-CG2 4.42Å; I255-T285 WeakPolarHBondContact CG2-OG1 3.4Å
256	T	87.8	Confident	78.1	Confident	45 Å²	45	82.1 Å²	82.1	28%	0.276	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	155.2	-176.6	55.2	0	0	0	0	110.2	I211 H212 P254	I211-T256 WeakPolarHBondContact CA-O 3.49Å; H212-T256 PolarHBondContact N-O 3.39Å; H212-T256 PolarHBondContact O-N 3.06Å; H212-T256 VanDerWaalsContact O-O 3.11Å; H212-T256 PolarHBondContact O-OG1 3.29Å; P254-T256 PolarHBondContact O-N 2.99Å
257	V	92.3	Very high	80.3	Confident	13 Å²	13	73.9 Å²	73.9	8%	0.079	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.8	177.4	-178.5	0	0	0	0	108.9	A209 I211 V261 T285 L286 R289	A209-V257 HydrophobicContact CB-CG1 4.11Å; I211-V257 HydrophobicContact CG1-CG2 4.29Å; V257-V261 HydrophobicContact CG1-CG1 3.88Å; V257-V261 HydrophobicContact CG1-CG2 4.45Å; V257-T285 HydrophobicContact CG2-CG2 3.7Å; V257-L286 HydrophobicContact CG1-CD2 4.43Å; V257-L286 HydrophobicContact CG2-CD2 4.21Å; V257-R289 HydrophobicContact CB-CG 4.45Å; V257-R289 HydrophobicContact CG2-CG 4.21Å
258	V	93.6	Very high	82.4	Confident	93 Å²	93	68 Å²	68	56%	0.564	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	106.5	170.1	-177.2	0	0	0	0	108	A209 V210 H212	A209-V258 CarbonylContact C-O 3.58Å; A209-V258 VanDerWaalsContact CA-O 3.25Å; A209-V258 WeakPolarHBondContact CA-O 3.43Å; V210-V258 PolarHBondContact N-O 3.33Å; V210-V258 PolarHBondContact O-N 3.13Å; H212-V258 HydrophobicContact CB-CG2 4.49Å
259	G	92.4	Very high	84.4	Confident	45 Å²	45	60.8 Å²	60.8	46%	0.464	35%	0.349	S	S	.	.	S	Bend	trans	134.6	164	-176.3	0	0	0	0	0	112.1
260	D	94.6	Very high	86.4	Confident	95 Å²	95	56.2 Å²	56.2	51%	0.508	32%	0.318	S	S	.	.			trans	-90.5	119.4	176.4	177.7	31.2	0	0	0	110.9	G262 R264	D260-G262 PolarHBondContact OD1-N 3.23Å; D260-R264 IonicContact OD2-CZ 2.6Å; D260-R264 IonicContact OD2-NE 3.05Å; D260-R264 IonicContact OD2-NH2 3.31Å; D260-R264 PolarHBondContact OD2-NH2 3.09Å
261	V	96.7	Very high	88.3	Confident	4 Å²	4	47 Å²	47	2%	0.024	28%	0.278	C	S	.	.			trans	-124.3	-3.5	-178.9	-54.1	0	0	0	0	112.9	V185 A209 V257 G263 R264 L286 R289	V185-V261 HydrophobicContact CG1-CB 4.15Å; V185-V261 HydrophobicContact CG1-CG1 3.9Å; A209-V261 HydrophobicContact CB-CG1 3.68Å; V257-V261 HydrophobicContact CG1-CG1 3.88Å; V257-V261 HydrophobicContact CG1-CG2 4.45Å; V261-G263 PolarHBondContact O-N 2.92Å; V261-R264 PolarHBondContact O-N 2.93Å; V261-L286 HydrophobicContact CB-CD2 4.3Å; V261-L286 HydrophobicContact CG1-CD2 3.91Å; V261-L286 HydrophobicContact CG2-CD2 4.27Å; V261-R289 HydrophobicContact CG2-CB 3.43Å; V261-R289 VanDerWaalsContact CG2-CB 3.43Å; V261-R289 HydrophobicContact CG2-CG 4.45Å
262	G	96.8	Very high	90.4	Very high	34 Å²	34	38.5 Å²	38.5	35%	0.351	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	129.4	-173.1	0	0	0	0	0	112.1	D260 R264 R289	D260-G262 PolarHBondContact OD1-N 3.23Å; G262-R264 PolarHBondContact O-N 2.78Å; G262-R289 WeakPolarHBondContact CA-O 3.16Å
263	G	96.4	Very high	92.2	Very high	47 Å²	47	33.3 Å²	33.3	49%	0.485	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	15.6	-179.6	0	0	0	0	0	114.4	N183 V261 G290 Y292	N183-G263 PolarHBondContact ND2-O 2.92Å; V261-G263 PolarHBondContact O-N 2.92Å; G263-G290 PolarHBondContact N-O 3.21Å; G263-Y292 WeakPolarHBondContact O-CE1 3.47Å
264	R	97.8	Very high	93.8	Very high	77 Å²	77	31.8 Å²	31.8	29%	0.291	20%	0.204	S	C	.	.	S	Bend	trans	-116.9	163.4	-178	-62.7	-173.6	-162	-150.7	8.2	112	N183 V185 D260 V261 G262 A291 Y292	N183-R264 WeakPolarHBondContact O-CA 3.4Å; N183-R264 VanDerWaalsContact O-CB 3.24Å; N183-R264 WeakPolarHBondContact O-CB 3.24Å; V185-R264 HydrophobicContact CG1-CB 4.25Å; D260-R264 IonicContact OD2-CZ 2.6Å; D260-R264 IonicContact OD2-NE 3.05Å; D260-R264 IonicContact OD2-NH2 3.31Å; D260-R264 PolarHBondContact OD2-NH2 3.09Å; V261-R264 PolarHBondContact O-N 2.93Å; G262-R264 PolarHBondContact O-N 2.78Å; R264-A291 WeakPolarHBondContact O-CA 3.4Å; R264-Y292 VanDerWaalsContact O-CD1 3.3Å; R264-Y292 WeakPolarHBondContact O-CD1 3.31Å; R264-Y292 PolarHBondContact O-N 3.48Å
265	I	98.5	Very high	94.4	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.4	165.2	-56.5	179.5	0	0	0	107.6	I178 P179 N183 A184 V185 I267 Y292 K293 F295	I178-I265 HydrophobicContact CG2-CD1 4.13Å; P179-I265 WeakPolarHBondContact O-CD1 3.33Å; N183-I265 PolarHBondContact O-N 2.99Å; A184-I265 CarbonylContact C-O 3.58Å; A184-I265 WeakPolarHBondContact CA-O 3.47Å; A184-I265 HydrophobicContact CB-CB 3.84Å; A184-I265 HydrophobicContact CB-CG2 4.28Å; A184-I265 WeakPolarHBondContact CB-O 3.4Å; V185-I265 PolarHBondContact N-O 3.23Å; I265-I267 HydrophobicContact CG2-CG1 4.12Å; I265-Y292 WeakPolarHBondContact CD1-OH 3.28Å; I265-Y292 HydrophobicContact CG1-CE1 3.95Å; I265-Y292 HydrophobicContact CG1-CE2 4.01Å; I265-Y292 VanDerWaalsContact CG1-CZ 3.44Å; I265-Y292 WeakPolarHBondContact CG1-OH 3.47Å; I265-K293 HydrophobicContact CG1-CB 4.3Å; I265-K293 HydrophobicContact CG2-CB 4.12Å; I265-F295 HydrophobicContact CG2-CD2 3.51Å; I265-F295 HydrophobicContact CG2-CE2 3.6Å
266	A	98.4	Very high	94.9	Very high	0 Å²	0	28 Å²	28	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.8	173.1	0	0	0	0	0	110.1	V185 V187 L286 A291 K293 I294 F295	V185-A266 HydrophobicContact CG1-CB 4.46Å; V187-A266 HydrophobicContact CG2-CB 3.95Å; A266-L286 HydrophobicContact CB-CB 4.44Å; A266-L286 HydrophobicContact CB-CD1 3.88Å; A266-L286 HydrophobicContact CB-CD2 4.19Å; A266-L286 HydrophobicContact CB-CG 4.4Å; A266-A291 HydrophobicContact CB-CB 3.92Å; A266-K293 PolarHBondContact N-O 3.35Å; A266-I294 HydrophobicContact CB-CG1 4.39Å; A266-I294 CarbonylContact O-C 3.57Å; A266-I294 WeakPolarHBondContact O-CA 3.46Å; A266-F295 PolarHBondContact O-N 3.26Å
267	I	98.6	Very high	95	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	100.6	176.6	-53.8	175.9	0	0	0	108.2	I174 I178 A184 V185 I186 V187 I265 V269 F295 M297	I174-I267 HydrophobicContact CD1-CD1 4.47Å; I174-I267 HydrophobicContact CD1-CG2 4.26Å; I174-I267 HydrophobicContact CG1-CD1 4.42Å; I174-I267 HydrophobicContact CG2-CD1 3.89Å; I178-I267 HydrophobicContact CD1-CD1 3.94Å; I178-I267 HydrophobicContact CD1-CG1 4.45Å; A184-I267 HydrophobicContact CB-CD1 3.72Å; A184-I267 HydrophobicContact CB-CG1 4.11Å; V185-I267 PolarHBondContact O-N 2.91Å; I186-I267 CarbonylContact C-O 3.54Å; I186-I267 HydrophobicContact CD1-CB 3.97Å; I186-I267 HydrophobicContact CD1-CD1 4.17Å; I186-I267 HydrophobicContact CD1-CG2 4.39Å; V187-I267 PolarHBondContact N-O 3.35Å; I265-I267 HydrophobicContact CG2-CG1 4.12Å; I267-V269 HydrophobicContact CG2-CG2 4.27Å; I267-F295 CarbonylContact C-O 3.53Å; I267-F295 HydrophobicContact CG1-CB 4.29Å; I267-F295 HydrophobicContact CG2-CB 4.28Å; I267-M297 HydrophobicContact CG2-CE 4.39Å; I267-M297 HydrophobicContact CG2-CG 3.6Å
268	I	98.3	Very high	94.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	128.1	175.3	-54.7	175.9	0	0	0	108.7	V187 K189 F279 A282 L286 I294 F295 V296 M297	V187-I268 HydrophobicContact CB-CG1 4.14Å; V187-I268 HydrophobicContact CG1-CG1 4.39Å; V187-I268 CarbonylContact O-C 3.58Å; V187-I268 VanDerWaalsContact O-CA 3.31Å; V187-I268 WeakPolarHBondContact O-CA 3.3Å; K189-I268 HydrophobicContact CB-CG2 4.11Å; I268-F279 HydrophobicContact CG2-CD1 4.17Å; I268-F279 HydrophobicContact CG2-CE1 4.22Å; I268-A282 HydrophobicContact CD1-CB 3.99Å; I268-L286 HydrophobicContact CD1-CD1 3.76Å; I268-L286 HydrophobicContact CG1-CD1 3.83Å; I268-I294 HydrophobicContact CD1-CG2 4.19Å; I268-F295 PolarHBondContact N-O 3.07Å; I268-V296 HydrophobicContact CB-CG2 4.27Å; I268-V296 HydrophobicContact CD1-CG2 4.22Å; I268-V296 CarbonylContact O-C 3.52Å; I268-V296 WeakPolarHBondContact O-CA 3.4Å; I268-M297 PolarHBondContact O-N 2.93Å
269	V	97.3	Very high	94.9	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.2	178.7	-178	0	0	0	0	110.4	I186 V187 R196 F200 I267 M297	I186-V269 HydrophobicContact CG2-CB 4.4Å; I186-V269 HydrophobicContact CG2-CG2 3.71Å; V187-V269 PolarHBondContact O-N 3.23Å; R196-V269 HydrophobicContact CG-CG1 3.9Å; F200-V269 HydrophobicContact CB-CG2 4.43Å; F200-V269 HydrophobicContact CD1-CG1 4.28Å; F200-V269 HydrophobicContact CD1-CG2 3.96Å; F200-V269 HydrophobicContact CD2-CG1 3.88Å; F200-V269 HydrophobicContact CE1-CG1 4.22Å; F200-V269 HydrophobicContact CE1-CG2 4.37Å; F200-V269 HydrophobicContact CE2-CG1 3.8Å; F200-V269 HydrophobicContact CG-CG1 4.11Å; F200-V269 HydrophobicContact CG-CG2 4.14Å; F200-V269 HydrophobicContact CZ-CG1 3.98Å; I267-V269 HydrophobicContact CG2-CG2 4.27Å; V269-M297 WeakPolarHBondContact CA-O 3.17Å; V269-M297 HydrophobicContact CG2-CB 4.27Å
270	D	95.6	Very high	95	Very high	14 Å²	14	24.9 Å²	24.9	8%	0.075	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	177.1	173.3	-137.7	-43.7	0	0	0	111.5	K189 R196 F279 M297 A298	K189-D270 VanDerWaalsContact CE-OD2 3.31Å; K189-D270 WeakPolarHBondContact CE-OD2 3.45Å; R196-D270 VanDerWaalsContact NH1-C 3.29Å; R196-D270 IonicContact NH1-OD1 2.86Å; R196-D270 PolarHBondContact NH1-OD1 2.77Å; D270-F279 HydrophobicContact CB-CE1 3.95Å; D270-F279 HydrophobicContact CB-CZ 3.8Å; D270-M297 PolarHBondContact N-O 2.87Å; D270-A298 VanDerWaalsContact O-CA 3.29Å; D270-A298 WeakPolarHBondContact O-CA 3.34Å
271	D	95.3	Very high	95	Very high	4 Å²	4	21.7 Å²	21.7	2%	0.021	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	-38.7	177	48.7	-62.3	0	0	0	111.1	H149 R196 T299 H300	H149-D271 WeakPolarHBondContact CA-OD2 3.39Å; H149-D271 IonicContact CE1-OD2 3.88Å; H149-D271 IonicContact CG-OD2 3.52Å; H149-D271 IonicContact ND1-OD1 2.85Å; H149-D271 IonicContact ND1-OD2 2.78Å; H149-D271 PolarHBondContact ND1-OD2 3.49Å; R196-D271 IonicContact CZ-OD1 3.76Å; R196-D271 IonicContact NH1-OD1 3.48Å; R196-D271 PolarHBondContact NH1-OD1 3Å; R196-D271 IonicContact NH2-OD1 2.89Å; R196-D271 PolarHBondContact NH2-OD1 3.15Å; R196-D271 IonicContact NH2-OD2 3.59Å; D271-T299 PolarHBondContact O-N 2.85Å; D271-T299 VanDerWaalsContact O-N 3.09Å; D271-H300 PolarHBondContact O-CD2 2.9Å; D271-H300 PolarHBondContact O-N 3.28Å
272	I	96	Very high	94.8	Very high	11 Å²	11	21.5 Å²	21.5	6%	0.056	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.5	-174.4	-60.5	161.2	0	0	0	108	Y111 K116 H149 D274 H300 L302	Y111-I272 HydrophobicContact CE2-CD1 3.93Å; Y111-I272 HydrophobicContact CE2-CG1 4.26Å; K116-I272 HydrophobicContact CD-CD1 4.22Å; K116-I272 HydrophobicContact CG-CD1 3.85Å; H149-I272 HydrophobicContact CB-CD1 4.23Å; I272-D274 HydrophobicContact CG2-CB 4Å; I272-H300 WeakPolarHBondContact CA-O 3.31Å; I272-H300 HydrophobicContact CB-CB 4.4Å; I272-H300 HydrophobicContact CG1-CB 3.9Å; I272-H300 HydrophobicContact CG2-CB 4.48Å; I272-L302 HydrophobicContact CG2-CD1 3.79Å
273	I	95.3	Very high	94.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116.7	161.9	-174.5	172.9	0	0	0	107.9	V276 F279 V296 A298 H300 L302 L303 I311 V319 V321	I273-V276 HydrophobicContact CD1-CG1 3.98Å; I273-V276 HydrophobicContact CG1-CG1 3.85Å; I273-F279 HydrophobicContact CB-CE2 4.28Å; I273-F279 HydrophobicContact CB-CZ 4.21Å; I273-F279 HydrophobicContact CD1-CG 4.49Å; I273-F279 HydrophobicContact CG1-CD2 4.14Å; I273-F279 HydrophobicContact CG1-CE2 3.98Å; I273-F279 HydrophobicContact CG1-CZ 4.29Å; I273-V296 HydrophobicContact CD1-CG1 4.22Å; I273-A298 HydrophobicContact CB-CB 4.21Å; I273-A298 HydrophobicContact CG2-CB 4.01Å; I273-H300 PolarHBondContact N-O 2.97Å; I273-L302 WeakPolarHBondContact O-CA 3.33Å; I273-L302 WeakPolarHBondContact O-CB 3.48Å; I273-L302 PolarHBondContact O-N 3.47Å; I273-L303 HydrophobicContact CD1-CD2 3.93Å; I273-L303 HydrophobicContact CG1-CD2 4.01Å; I273-L303 HydrophobicContact CG2-CD2 3.92Å; I273-L303 HydrophobicContact CG2-CG 4.21Å; I273-L303 PolarHBondContact O-N 3.12Å; I273-I311 HydrophobicContact CD1-CD1 4.15Å; I273-V319 HydrophobicContact CD1-CG1 3.91Å; I273-V321 HydrophobicContact CG2-CG1 3.54Å
274	D	92.1	Very high	94.8	Very high	35 Å²	35	21 Å²	21	19%	0.187	11%	0.11	C	C	.	.	S	Bend	trans	-131.4	-81.7	-174.8	-177.3	21.7	0	0	0	109.3	I272 L302 S304	I272-D274 HydrophobicContact CG2-CB 4Å; D274-L302 HydrophobicContact CB-CB 3.73Å; D274-L302 HydrophobicContact CB-CD2 4.26Å; D274-L302 WeakPolarHBondContact OD1-CB 3.34Å; D274-S304 PolarHBondContact O-N 3.41Å; D274-S304 WeakPolarHBondContact OD1-CB 3.49Å; D274-S304 PolarHBondContact OD1-OG 2.73Å
275	D	85.9	Confident	94.7	Very high	67 Å²	67	17.9 Å²	17.9	36%	0.358	10%	0.099	S	C	.	.			trans	-76.1	131.4	160	-174.1	-6.4	0	0	0	109	D277	D275-D277 PolarHBondContact OD1-N 2.96Å; D275-D277 VanDerWaalsContact OD1-N 3.09Å
276	V	92.5	Very high	94.6	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.012	10%	0.099	C	C	.	.			trans	-104.9	-8.2	-171.8	-61.7	0	0	0	0	113.3	I273 S278 F279 V280 A307 F310 I311	I273-V276 HydrophobicContact CD1-CG1 3.98Å; I273-V276 HydrophobicContact CG1-CG1 3.85Å; V276-S278 VanDerWaalsContact C-N 3.27Å; V276-S278 PolarHBondContact O-N 3.19Å; V276-F279 CarbonylContact O-C 3.57Å; V276-F279 WeakPolarHBondContact O-CA 3.49Å; V276-F279 WeakPolarHBondContact O-CB 3.47Å; V276-F279 PolarHBondContact O-N 3.49Å; V276-V280 WeakPolarHBondContact O-CG2 3.42Å; V276-V280 PolarHBondContact O-N 3.48Å; V276-A307 HydrophobicContact CB-CB 4.41Å; V276-A307 HydrophobicContact CG1-CB 3.53Å; V276-A307 HydrophobicContact CG2-CB 3.96Å; V276-F310 HydrophobicContact CG2-CB 3.64Å; V276-F310 HydrophobicContact CG2-CD2 3.92Å; V276-F310 HydrophobicContact CG2-CG 4.28Å; V276-I311 HydrophobicContact CB-CG1 4.42Å; V276-I311 HydrophobicContact CG1-CD1 3.95Å; V276-I311 HydrophobicContact CG1-CG1 4.09Å
277	D	90.3	Very high	94.5	Very high	84 Å²	84	23.3 Å²	23.3	45%	0.449	12%	0.123	S	C	.	.	H	α-helix	trans	-56.3	-43.9	-174.9	-75	-13	0	0	0	111.8	D275 F279 V280 A281	D275-D277 PolarHBondContact OD1-N 2.96Å; D275-D277 VanDerWaalsContact OD1-N 3.09Å; D277-F279 VanDerWaalsContact C-N 3.33Å; D277-F279 PolarHBondContact O-N 3.4Å; D277-V280 PolarHBondContact O-N 2.86Å; D277-A281 WeakPolarHBondContact O-CB 3.29Å; D277-A281 PolarHBondContact O-N 2.88Å
278	S	89.6	Confident	94.4	Very high	10 Å²	10	31 Å²	31	7%	0.07	16%	0.158	C	C	.	.	H	α-helix	trans	-67.8	-29.6	176.3	62.8	0	0	0	0	113.7	K189 V276 A282	K189-S278 PolarHBondContact NZ-OG 3.3Å; V276-S278 VanDerWaalsContact C-N 3.27Å; V276-S278 PolarHBondContact O-N 3.19Å; S278-A282 WeakPolarHBondContact O-CB 3.43Å; S278-A282 PolarHBondContact O-N 2.89Å; S278-A282 VanDerWaalsContact O-N 3.1Å
279	F	94.6	Very high	94.2	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-74.3	-38.7	174.4	-71.8	-92.1	0	0	0	111.4	K189 I268 D270 I273 V276 D277 A282 A283 V296 I316	K189-F279 HydrophobicContact CD-CD1 3.82Å; K189-F279 HydrophobicContact CD-CD2 3.74Å; K189-F279 HydrophobicContact CD-CE1 3.72Å; K189-F279 HydrophobicContact CD-CE2 3.64Å; K189-F279 HydrophobicContact CD-CG 3.84Å; K189-F279 HydrophobicContact CD-CZ 3.63Å; I268-F279 HydrophobicContact CG2-CD1 4.17Å; I268-F279 HydrophobicContact CG2-CE1 4.22Å; D270-F279 HydrophobicContact CB-CE1 3.95Å; D270-F279 HydrophobicContact CB-CZ 3.8Å; I273-F279 HydrophobicContact CB-CE2 4.28Å; I273-F279 HydrophobicContact CB-CZ 4.21Å; I273-F279 HydrophobicContact CD1-CG 4.49Å; I273-F279 HydrophobicContact CG1-CD2 4.14Å; I273-F279 HydrophobicContact CG1-CE2 3.98Å; I273-F279 HydrophobicContact CG1-CZ 4.29Å; V276-F279 CarbonylContact O-C 3.57Å; V276-F279 WeakPolarHBondContact O-CA 3.49Å; V276-F279 WeakPolarHBondContact O-CB 3.47Å; V276-F279 PolarHBondContact O-N 3.49Å; D277-F279 VanDerWaalsContact C-N 3.33Å; D277-F279 PolarHBondContact O-N 3.4Å; F279-A282 WeakPolarHBondContact O-CB 3.4Å; F279-A282 PolarHBondContact O-N 2.92Å; F279-A283 WeakPolarHBondContact O-CB 3.27Å; F279-A283 PolarHBondContact O-N 3.11Å; F279-V296 HydrophobicContact CD1-CG1 3.63Å; F279-V296 HydrophobicContact CD1-CG2 4.28Å; F279-V296 HydrophobicContact CE1-CG1 3.69Å; F279-I316 HydrophobicContact CB-CD1 4.43Å
280	V	95.4	Very high	94.2	Very high	31 Å²	31	39.2 Å²	39.2	19%	0.188	20%	0.201	C	C	.	.	H	α-helix	trans	-65.9	-48.5	175.6	173.4	0	0	0	0	110.4	V276 D277 A282 A283 E284 F310 I316	V276-V280 WeakPolarHBondContact O-CG2 3.42Å; V276-V280 PolarHBondContact O-N 3.48Å; D277-V280 PolarHBondContact O-N 2.86Å; V280-A282 VanDerWaalsContact C-N 3.28Å; V280-A282 PolarHBondContact O-N 3.29Å; V280-A283 WeakPolarHBondContact O-CB 3.4Å; V280-A283 PolarHBondContact O-N 3.18Å; V280-E284 PolarHBondContact O-N 2.78Å; V280-F310 HydrophobicContact CG2-CB 4.45Å; V280-I316 HydrophobicContact CG2-CD1 4.48Å
281	A	92.8	Very high	94.3	Very high	28 Å²	28	38.8 Å²	38.8	23%	0.231	20%	0.199	C	C	.	.	H	α-helix	trans	-59.4	-40.1	176.1	0	0	0	0	0	112.2	A215 I255 D277 T285	A215-A281 HydrophobicContact CB-CB 3.72Å; I255-A281 HydrophobicContact CD1-CB 4.08Å; D277-A281 WeakPolarHBondContact O-CB 3.29Å; D277-A281 PolarHBondContact O-N 2.88Å; A281-T285 WeakPolarHBondContact O-CB 3.38Å; A281-T285 PolarHBondContact O-N 3.07Å; A281-T285 PolarHBondContact O-OG1 2.84Å
282	A	94.3	Very high	94.4	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-45.9	172.7	0	0	0	0	0	112.1	I211 I268 S278 F279 V280 T285 L286	I211-A282 HydrophobicContact CD1-CB 3.26Å; I268-A282 HydrophobicContact CD1-CB 3.99Å; S278-A282 WeakPolarHBondContact O-CB 3.43Å; S278-A282 PolarHBondContact O-N 2.89Å; S278-A282 VanDerWaalsContact O-N 3.1Å; F279-A282 WeakPolarHBondContact O-CB 3.4Å; F279-A282 PolarHBondContact O-N 2.92Å; V280-A282 VanDerWaalsContact C-N 3.28Å; V280-A282 PolarHBondContact O-N 3.29Å; A282-T285 PolarHBondContact O-N 2.94Å; A282-L286 WeakPolarHBondContact O-CD1 3.5Å; A282-L286 WeakPolarHBondContact O-CG 3.38Å; A282-L286 PolarHBondContact O-N 3.45Å
283	A	96.6	Very high	94.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-47	178.8	0	0	0	0	0	112.2	F279 V280 T285 L286 K287 I294 A315 I316	F279-A283 WeakPolarHBondContact O-CB 3.27Å; F279-A283 PolarHBondContact O-N 3.11Å; V280-A283 WeakPolarHBondContact O-CB 3.4Å; V280-A283 PolarHBondContact O-N 3.18Å; A283-T285 VanDerWaalsContact C-N 3.34Å; A283-T285 PolarHBondContact O-N 2.91Å; A283-L286 PolarHBondContact O-N 2.94Å; A283-K287 WeakPolarHBondContact O-CB 3.32Å; A283-K287 PolarHBondContact O-N 3.09Å; A283-I294 HydrophobicContact CB-CD1 4.01Å; A283-I294 HydrophobicContact CB-CG2 3.98Å; A283-I294 WeakPolarHBondContact O-CD1 3.22Å; A283-A315 HydrophobicContact CB-CB 4.29Å; A283-I316 HydrophobicContact CB-CD1 4.33Å; A283-I316 HydrophobicContact CB-CG1 3.52Å
284	E	95.6	Very high	94.6	Very high	72 Å²	72	47.1 Å²	47.1	34%	0.336	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-44	177.1	-63.1	-52.1	145.2	0	0	111.5	V280 L286 K287 E288 A315	V280-E284 PolarHBondContact O-N 2.78Å; E284-L286 VanDerWaalsContact C-N 3.31Å; E284-L286 PolarHBondContact O-N 3.06Å; E284-K287 WeakPolarHBondContact O-CB 3.41Å; E284-K287 PolarHBondContact O-N 2.6Å; E284-K287 VanDerWaalsContact O-N 3.15Å; E284-E288 WeakPolarHBondContact O-CG 3.36Å; E284-E288 PolarHBondContact O-N 3.25Å; E284-A315 WeakPolarHBondContact OE1-CB 2.96Å; E284-A315 PolarHBondContact OE1-N 3.13Å
285	T	95	Very high	94.9	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-38.9	177.8	-49.2	0	0	0	0	111.9	I255 V257 A281 A282 A283 R289	I255-T285 HydrophobicContact CG2-CG2 4.42Å; I255-T285 WeakPolarHBondContact CG2-OG1 3.4Å; V257-T285 HydrophobicContact CG2-CG2 3.7Å; A281-T285 WeakPolarHBondContact O-CB 3.38Å; A281-T285 PolarHBondContact O-N 3.07Å; A281-T285 PolarHBondContact O-OG1 2.84Å; A282-T285 PolarHBondContact O-N 2.94Å; A283-T285 VanDerWaalsContact C-N 3.34Å; A283-T285 PolarHBondContact O-N 2.91Å; T285-R289 WeakPolarHBondContact O-CB 3.43Å; T285-R289 WeakPolarHBondContact O-CG 3.13Å; T285-R289 PolarHBondContact O-N 3.15Å; T285-R289 VanDerWaalsContact O-N 3.15Å
286	L	96.8	Very high	95.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-40.3	176.3	-71.2	165	0	0	0	111.5	V187 I211 V257 V261 A266 I268 A282 A283 E284 R289 G290 A291 I294	V187-L286 HydrophobicContact CG1-CD1 4.22Å; V187-L286 HydrophobicContact CG1-CD2 4.13Å; V187-L286 HydrophobicContact CG2-CD1 4.32Å; V187-L286 HydrophobicContact CG2-CD2 3.98Å; I211-L286 HydrophobicContact CD1-CD1 4.34Å; I211-L286 HydrophobicContact CD1-CG 4.32Å; V257-L286 HydrophobicContact CG1-CD2 4.43Å; V257-L286 HydrophobicContact CG2-CD2 4.21Å; V261-L286 HydrophobicContact CB-CD2 4.3Å; V261-L286 HydrophobicContact CG1-CD2 3.91Å; V261-L286 HydrophobicContact CG2-CD2 4.27Å; A266-L286 HydrophobicContact CB-CB 4.44Å; A266-L286 HydrophobicContact CB-CD1 3.88Å; A266-L286 HydrophobicContact CB-CD2 4.19Å; A266-L286 HydrophobicContact CB-CG 4.4Å; I268-L286 HydrophobicContact CD1-CD1 3.76Å; I268-L286 HydrophobicContact CG1-CD1 3.83Å; A282-L286 WeakPolarHBondContact O-CD1 3.5Å; A282-L286 WeakPolarHBondContact O-CG 3.38Å; A282-L286 PolarHBondContact O-N 3.45Å; A283-L286 PolarHBondContact O-N 2.94Å; E284-L286 VanDerWaalsContact C-N 3.31Å; E284-L286 PolarHBondContact O-N 3.06Å; L286-R289 CarbonylContact O-C 3.55Å; L286-R289 PolarHBondContact O-N 2.93Å; L286-G290 PolarHBondContact O-N 2.84Å; L286-A291 HydrophobicContact CB-CB 4.12Å; L286-A291 VanDerWaalsContact O-CB 3.26Å; L286-A291 WeakPolarHBondContact O-CB 3.24Å; L286-A291 PolarHBondContact O-N 2.99Å; L286-I294 HydrophobicContact CB-CD1 4.19Å; L286-I294 HydrophobicContact CB-CG1 4.43Å
287	K	96.8	Very high	95.8	Very high	117 Å²	117	42.6 Å²	42.6	51%	0.509	21%	0.208	S	C	.	.	H	α-helix	trans	-65.5	-43.8	177.5	-170.6	167.5	178.3	178.4	0	112	A283 E284 R289 G290 I294 A315	A283-K287 WeakPolarHBondContact O-CB 3.32Å; A283-K287 PolarHBondContact O-N 3.09Å; E284-K287 WeakPolarHBondContact O-CB 3.41Å; E284-K287 PolarHBondContact O-N 2.6Å; E284-K287 VanDerWaalsContact O-N 3.15Å; K287-R289 PolarHBondContact O-N 3.21Å; K287-G290 PolarHBondContact O-N 3.04Å; K287-I294 HydrophobicContact CB-CD1 4.08Å; K287-A315 HydrophobicContact CD-CB 3.59Å
288	E	95.6	Very high	96.2	Very high	160 Å²	160	38.6 Å²	38.6	75%	0.748	19%	0.187	S	C	*	.	H	α-helix	trans	-59.2	-32.8	173.1	-73	176.9	177.9	0	0	112.5	E284 G290	E284-E288 WeakPolarHBondContact O-CG 3.36Å; E284-E288 PolarHBondContact O-N 3.25Å; E288-G290 PolarHBondContact O-N 3.34Å
289	R	95.6	Very high	96.5	Very high	138 Å²	138	38.4 Å²	38.4	52%	0.521	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	4.8	175.7	-67.6	-79.3	-176.8	153	1	113.6	V257 V261 G262 T285 L286 K287	V257-R289 HydrophobicContact CB-CG 4.45Å; V257-R289 HydrophobicContact CG2-CG 4.21Å; V261-R289 HydrophobicContact CG2-CB 3.43Å; V261-R289 VanDerWaalsContact CG2-CB 3.43Å; V261-R289 HydrophobicContact CG2-CG 4.45Å; G262-R289 WeakPolarHBondContact CA-O 3.16Å; T285-R289 WeakPolarHBondContact O-CB 3.43Å; T285-R289 WeakPolarHBondContact O-CG 3.13Å; T285-R289 PolarHBondContact O-N 3.15Å; T285-R289 VanDerWaalsContact O-N 3.15Å; L286-R289 CarbonylContact O-C 3.55Å; L286-R289 PolarHBondContact O-N 2.93Å; K287-R289 PolarHBondContact O-N 3.21Å
290	G	96.3	Very high	96.7	Very high	37 Å²	37	38.3 Å²	38.3	38%	0.381	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	14.7	172.5	0	0	0	0	0	115.4	G263 L286 K287 E288 Y292	G263-G290 PolarHBondContact N-O 3.21Å; L286-G290 PolarHBondContact O-N 2.84Å; K287-G290 PolarHBondContact O-N 3.04Å; E288-G290 PolarHBondContact O-N 3.34Å; G290-Y292 PolarHBondContact O-N 2.95Å
291	A	98	Very high	96.7	Very high	5 Å²	5	36.9 Å²	36.9	4%	0.041	18%	0.176	C	C	.	.			trans	-67.3	128.1	166.6	0	0	0	0	0	109.3	R264 A266 L286	R264-A291 WeakPolarHBondContact O-CA 3.4Å; A266-A291 HydrophobicContact CB-CB 3.92Å; L286-A291 HydrophobicContact CB-CB 4.12Å; L286-A291 VanDerWaalsContact O-CB 3.26Å; L286-A291 WeakPolarHBondContact O-CB 3.24Å; L286-A291 PolarHBondContact O-N 2.99Å
292	Y	96.9	Very high	96.8	Very high	112 Å²	112	36.5 Å²	36.5	44%	0.439	17%	0.17	S	C	.	.	S	Bend	trans	-96.8	-14.8	-173.8	72.3	-90.9	0	0	0	113.7	G263 R264 I265 G290	G263-Y292 WeakPolarHBondContact O-CE1 3.47Å; R264-Y292 VanDerWaalsContact O-CD1 3.3Å; R264-Y292 WeakPolarHBondContact O-CD1 3.31Å; R264-Y292 PolarHBondContact O-N 3.48Å; I265-Y292 WeakPolarHBondContact CD1-OH 3.28Å; I265-Y292 HydrophobicContact CG1-CE1 3.95Å; I265-Y292 HydrophobicContact CG1-CE2 4.01Å; I265-Y292 VanDerWaalsContact CG1-CZ 3.44Å; I265-Y292 WeakPolarHBondContact CG1-OH 3.47Å; G290-Y292 PolarHBondContact O-N 2.95Å
293	K	98.1	Very high	96.7	Very high	74 Å²	74	36.5 Å²	36.5	32%	0.322	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	144	169.3	-78.8	-166.9	175.6	-171.2	0	110.8	I265 A266 F295 D317	I265-K293 HydrophobicContact CG1-CB 4.3Å; I265-K293 HydrophobicContact CG2-CB 4.12Å; A266-K293 PolarHBondContact N-O 3.35Å; K293-F295 HydrophobicContact CB-CE2 3.99Å; K293-F295 HydrophobicContact CD-CE2 4.13Å; K293-F295 HydrophobicContact CD-CZ 4.41Å; K293-D317 WeakPolarHBondContact CA-OD2 3.43Å
294	I	98.4	Very high	96.3	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.015	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	117.3	-176.4	-60.5	162.1	0	0	0	109.7	A266 I268 A283 L286 K287 A315 I316 D317	A266-I294 HydrophobicContact CB-CG1 4.39Å; A266-I294 CarbonylContact O-C 3.57Å; A266-I294 WeakPolarHBondContact O-CA 3.46Å; I268-I294 HydrophobicContact CD1-CG2 4.19Å; A283-I294 HydrophobicContact CB-CD1 4.01Å; A283-I294 HydrophobicContact CB-CG2 3.98Å; A283-I294 WeakPolarHBondContact O-CD1 3.22Å; L286-I294 HydrophobicContact CB-CD1 4.19Å; L286-I294 HydrophobicContact CB-CG1 4.43Å; K287-I294 HydrophobicContact CB-CD1 4.08Å; I294-A315 HydrophobicContact CD1-CB 4.2Å; I294-I316 HydrophobicContact CG2-CG1 4.39Å; I294-D317 PolarHBondContact N-OD2 3.34Å; I294-D317 WeakPolarHBondContact O-CB 3.43Å; I294-D317 PolarHBondContact O-N 3.03Å
295	F	98.7	Very high	96	Very high	10 Å²	10	40.3 Å²	40.3	4%	0.044	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	145.5	174	-66.6	-100.9	0	0	0	109.6	I178 I265 A266 I267 I268 K293 M297 E318	I178-F295 HydrophobicContact CD1-CB 4.3Å; I178-F295 HydrophobicContact CD1-CD1 3.57Å; I178-F295 HydrophobicContact CD1-CD2 4.13Å; I178-F295 HydrophobicContact CD1-CE1 3.86Å; I178-F295 HydrophobicContact CD1-CE2 4.37Å; I178-F295 HydrophobicContact CD1-CG 3.74Å; I178-F295 HydrophobicContact CD1-CZ 4.25Å; I178-F295 HydrophobicContact CG1-CD1 4.03Å; I178-F295 HydrophobicContact CG1-CE1 3.8Å; I178-F295 HydrophobicContact CG1-CZ 4.12Å; I178-F295 HydrophobicContact CG2-CE2 4.02Å; I178-F295 HydrophobicContact CG2-CZ 4.02Å; I265-F295 HydrophobicContact CG2-CD2 3.51Å; I265-F295 HydrophobicContact CG2-CE2 3.6Å; A266-F295 PolarHBondContact O-N 3.26Å; I267-F295 CarbonylContact C-O 3.53Å; I267-F295 HydrophobicContact CG1-CB 4.29Å; I267-F295 HydrophobicContact CG2-CB 4.28Å; I268-F295 PolarHBondContact N-O 3.07Å; K293-F295 HydrophobicContact CB-CE2 3.99Å; K293-F295 HydrophobicContact CD-CE2 4.13Å; K293-F295 HydrophobicContact CD-CZ 4.41Å; F295-M297 HydrophobicContact CB-CE 4.27Å; F295-M297 HydrophobicContact CD1-CE 4.44Å; F295-E318 CarbonylContact C-O 3.56Å; F295-E318 WeakPolarHBondContact CA-O 3.3Å; F295-E318 HydrophobicContact CD1-CB 3.65Å; F295-E318 HydrophobicContact CD1-CG 4.4Å; F295-E318 HydrophobicContact CE1-CB 3.77Å; F295-E318 HydrophobicContact CE1-CG 4.47Å
296	V	98.5	Very high	95.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.1	168.8	-178.3	0	0	0	0	109	I268 I273 F279 I316 E318 V319 V320	I268-V296 HydrophobicContact CB-CG2 4.27Å; I268-V296 HydrophobicContact CD1-CG2 4.22Å; I268-V296 CarbonylContact O-C 3.52Å; I268-V296 WeakPolarHBondContact O-CA 3.4Å; I273-V296 HydrophobicContact CD1-CG1 4.22Å; F279-V296 HydrophobicContact CD1-CG1 3.63Å; F279-V296 HydrophobicContact CD1-CG2 4.28Å; F279-V296 HydrophobicContact CE1-CG1 3.69Å; V296-I316 HydrophobicContact CG2-CD1 3.97Å; V296-I316 HydrophobicContact CG2-CG1 4.23Å; V296-I316 HydrophobicContact CG2-CG2 3.92Å; V296-E318 PolarHBondContact N-O 2.95Å; V296-V319 HydrophobicContact CB-CG1 4.46Å; V296-V319 HydrophobicContact CB-CG2 4.18Å; V296-V319 HydrophobicContact CG2-CG2 4.48Å; V296-V319 CarbonylContact O-C 3.57Å; V296-V319 WeakPolarHBondContact O-CA 3.43Å; V296-V320 PolarHBondContact O-N 2.96Å
297	M	98.1	Very high	95.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.2	178.4	-61.6	-79.9	163.4	0	0	108.4	Y173 I174 I178 I267 I268 V269 D270 F295 V320	Y173-M297 HydrophobicContact CD1-CE 3.96Å; Y173-M297 HydrophobicContact CD1-SD 4.48Å; Y173-M297 HydrophobicContact CE1-CE 4.23Å; I174-M297 HydrophobicContact CD1-CG 4.36Å; I174-M297 HydrophobicContact CD1-SD 4.43Å; I174-M297 HydrophobicContact CG1-CE 3.79Å; I174-M297 HydrophobicContact CG1-SD 4.13Å; I178-M297 HydrophobicContact CD1-CE 3.53Å; I267-M297 HydrophobicContact CG2-CE 4.39Å; I267-M297 HydrophobicContact CG2-CG 3.6Å; I268-M297 PolarHBondContact O-N 2.93Å; V269-M297 WeakPolarHBondContact CA-O 3.17Å; V269-M297 HydrophobicContact CG2-CB 4.27Å; D270-M297 PolarHBondContact N-O 2.87Å; F295-M297 HydrophobicContact CB-CE 4.27Å; F295-M297 HydrophobicContact CD1-CE 4.44Å; M297-V320 WeakPolarHBondContact CA-O 3.42Å; M297-V320 HydrophobicContact CE-CB 3.97Å; M297-V320 HydrophobicContact CE-CG2 3.56Å; M297-V320 HydrophobicContact SD-CB 3.51Å; M297-V320 VanDerWaalsContact SD-CB 3.51Å; M297-V320 HydrophobicContact SD-CG1 3.93Å; M297-V320 HydrophobicContact SD-CG2 3.84Å
298	A	97.8	Very high	95.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	149.3	173	0	0	0	0	0	112.3	D270 I273 V320 V321	D270-A298 VanDerWaalsContact O-CA 3.29Å; D270-A298 WeakPolarHBondContact O-CA 3.34Å; I273-A298 HydrophobicContact CB-CB 4.21Å; I273-A298 HydrophobicContact CG2-CB 4.01Å; A298-V320 PolarHBondContact N-O 3.45Å; A298-V321 HydrophobicContact CB-CG1 4.3Å; A298-V321 VanDerWaalsContact O-CA 3.27Å; A298-V321 WeakPolarHBondContact O-CA 3.46Å
299	T	97.6	Very high	95.5	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	-47.2	175.3	-57.7	0	0	0	0	110.6	M146 D147 A166 D271 T322 T324	M146-T299 HydrophobicContact CE-CG2 3.54Å; M146-T299 HydrophobicContact CG-CG2 4.34Å; D147-T299 HydrophobicContact CB-CG2 3.87Å; D147-T299 WeakPolarHBondContact OD2-CG2 3.34Å; D147-T299 PolarHBondContact OD2-OG1 2.91Å; A166-T299 HydrophobicContact CB-CG2 3.54Å; D271-T299 PolarHBondContact O-N 2.85Å; D271-T299 VanDerWaalsContact O-N 3.09Å; T299-T322 HydrophobicContact CG2-CG2 4.24Å; T299-T322 WeakPolarHBondContact O-CB 3.45Å; T299-T322 PolarHBondContact O-N 3.35Å; T299-T322 PolarHBondContact O-OG1 3.19Å; T299-T324 HydrophobicContact CG2-CG2 4.21Å; T299-T324 PolarHBondContact O-OG1 3.07Å
300	H	97.6	Very high	95.6	Very high	3 Å²	3	33 Å²	33	1%	0.014	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	110	-172.6	-52.8	-60.2	0	0	0	111.5	P110 Y111 M146 D147 D271 I272 I273 L302 T324 I325	P110-H300 PolarHBondContact O-CE1 2.87Å; Y111-H300 HydrophobicContact CD2-CB 4.03Å; Y111-H300 AromaticContact CD2-CD2 3.85Å; Y111-H300 AromaticContact CD2-CG 3.62Å; Y111-H300 AromaticContact CD2-ND1 3.82Å; M146-H300 PolarHBondContact O-CE1 3.38Å; M146-H300 PolarHBondContact O-NE2 2.99Å; M146-H300 VanDerWaalsContact O-NE2 3.11Å; D147-H300 PolarHBondContact O-NE2 3.38Å; D271-H300 PolarHBondContact O-CD2 2.9Å; D271-H300 PolarHBondContact O-N 3.28Å; I272-H300 WeakPolarHBondContact CA-O 3.31Å; I272-H300 HydrophobicContact CB-CB 4.4Å; I272-H300 HydrophobicContact CG1-CB 3.9Å; I272-H300 HydrophobicContact CG2-CB 4.48Å; I273-H300 PolarHBondContact N-O 2.97Å; H300-L302 HydrophobicContact CB-CD1 4.38Å; H300-L302 PolarHBondContact O-N 3.13Å; H300-T324 PolarHBondContact ND1-OG1 3.47Å; H300-T324 VanDerWaalsContact ND1-OG1 3.09Å; H300-I325 HydrophobicContact CB-CD1 3.98Å
301	G	96.4	Very high	95.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	81.6	170.1	0	0	0	0	0	111.7	I325	G301-I325 WeakPolarHBondContact O-CG2 3.23Å
302	L	94.1	Very high	95.6	Very high	20 Å²	20	34.8 Å²	34.8	11%	0.105	17%	0.173	C	C	.	.			trans	-68	-49.9	168.1	-97.6	84.3	0	0	0	109.6	N79 Y111 I272 I273 D274 H300 S304 I325	N79-L302 PolarHBondContact ND2-O 3.2Å; N79-L302 PolarHBondContact OD1-O 2.99Å; N79-L302 VanDerWaalsContact OD1-O 3.09Å; Y111-L302 HydrophobicContact CD1-CD1 4.31Å; Y111-L302 HydrophobicContact CD2-CD1 4.25Å; Y111-L302 HydrophobicContact CE1-CD1 3.8Å; Y111-L302 HydrophobicContact CE1-CD2 4.47Å; Y111-L302 HydrophobicContact CE2-CD1 3.77Å; Y111-L302 HydrophobicContact CG-CD1 4.5Å; I272-L302 HydrophobicContact CG2-CD1 3.79Å; I273-L302 WeakPolarHBondContact O-CA 3.33Å; I273-L302 WeakPolarHBondContact O-CB 3.48Å; I273-L302 PolarHBondContact O-N 3.47Å; D274-L302 HydrophobicContact CB-CB 3.73Å; D274-L302 HydrophobicContact CB-CD2 4.26Å; D274-L302 WeakPolarHBondContact OD1-CB 3.34Å; H300-L302 HydrophobicContact CB-CD1 4.38Å; H300-L302 PolarHBondContact O-N 3.13Å; L302-S304 VanDerWaalsContact C-N 3.32Å; L302-S304 PolarHBondContact O-N 3.43Å; L302-I325 HydrophobicContact CB-CD1 4.5Å; L302-I325 HydrophobicContact CD1-CD1 3.09Å; L302-I325 HydrophobicContact CG-CD1 3.77Å
303	L	93.3	Very high	95.6	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.181	C	C	.	.			trans	47.9	53.9	172.9	-58.6	164.7	0	0	0	112.3	I273 A307 I311 H327 Q330 I337	I273-L303 HydrophobicContact CD1-CD2 3.93Å; I273-L303 HydrophobicContact CG1-CD2 4.01Å; I273-L303 HydrophobicContact CG2-CD2 3.92Å; I273-L303 HydrophobicContact CG2-CG 4.21Å; I273-L303 PolarHBondContact O-N 3.12Å; L303-A307 HydrophobicContact CB-CB 4.31Å; L303-I311 HydrophobicContact CD2-CD1 3.55Å; L303-H327 HydrophobicContact CD1-CB 4.29Å; L303-Q330 HydrophobicContact CB-CG 3.91Å; L303-Q330 HydrophobicContact CD1-CB 4.22Å; L303-Q330 HydrophobicContact CD1-CG 4.39Å; L303-I337 HydrophobicContact CD1-CD1 3.98Å; L303-I337 HydrophobicContact CD1-CG2 4.33Å
304	S	88.1	Confident	95.5	Very high	37 Å²	37	32.8 Å²	32.8	26%	0.259	17%	0.17	S	C	.	.			trans	-80	161.1	-174.2	62.3	0	0	0	0	112	D274 L302 D306 A307	D274-S304 PolarHBondContact O-N 3.41Å; D274-S304 WeakPolarHBondContact OD1-CB 3.49Å; D274-S304 PolarHBondContact OD1-OG 2.73Å; L302-S304 VanDerWaalsContact C-N 3.32Å; L302-S304 PolarHBondContact O-N 3.43Å; S304-D306 PolarHBondContact O-N 3.18Å; S304-A307 WeakPolarHBondContact O-CB 3.38Å; S304-A307 PolarHBondContact O-N 2.79Å
305	S	87.7	Confident	95.5	Very high	114 Å²	114	33.2 Å²	33.2	80%	0.797	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	-132.1	177.5	-47.1	0	0	0	0	112.7	A307	S305-A307 PolarHBondContact O-N 3.25Å
306	D	90.8	Very high	95.4	Very high	94 Å²	94	32.8 Å²	32.8	50%	0.503	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	14.3	-178.5	-70.2	-31	0	0	0	113.8	S304 P308 R309 F310	S304-D306 PolarHBondContact O-N 3.18Å; D306-P308 VanDerWaalsContact C-CD 3.46Å; D306-R309 WeakPolarHBondContact O-CB 3.47Å; D306-R309 PolarHBondContact O-N 2.94Å; D306-F310 HydrophobicContact CB-CD2 4.2Å; D306-F310 HydrophobicContact CB-CE2 3.87Å; D306-F310 HydrophobicContact CB-CZ 4.31Å; D306-F310 PolarHBondContact O-N 2.82Å; D306-F310 VanDerWaalsContact O-N 3.15Å
307	A	93.6	Very high	95.4	Very high	3 Å²	3	36.2 Å²	36.2	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-48.8	-45.9	-177.5	0	0	0	0	0	114.5	V276 L303 S304 S305 R309 F310 I311	V276-A307 HydrophobicContact CB-CB 4.41Å; V276-A307 HydrophobicContact CG1-CB 3.53Å; V276-A307 HydrophobicContact CG2-CB 3.96Å; L303-A307 HydrophobicContact CB-CB 4.31Å; S304-A307 WeakPolarHBondContact O-CB 3.38Å; S304-A307 PolarHBondContact O-N 2.79Å; S305-A307 PolarHBondContact O-N 3.25Å; A307-R309 VanDerWaalsContact C-N 3.3Å; A307-R309 PolarHBondContact O-N 2.96Å; A307-F310 PolarHBondContact O-N 3.05Å; A307-I311 WeakPolarHBondContact O-CD1 3.43Å; A307-I311 VanDerWaalsContact O-CG1 3.29Å; A307-I311 WeakPolarHBondContact O-CG1 3.48Å; A307-I311 PolarHBondContact O-N 3.14Å
308	P	95.4	Very high	95.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.8	-37.6	178.6	-24.3	36.1	0	0	0	113.2	D306 I311 E312 Q330 Q333 C334 I337	D306-P308 VanDerWaalsContact C-CD 3.46Å; P308-I311 PolarHBondContact O-N 2.78Å; P308-E312 PolarHBondContact O-N 2.82Å; P308-Q330 HydrophobicContact CG-CB 3.69Å; P308-Q330 HydrophobicContact CG-CG 3.6Å; P308-Q333 HydrophobicContact CB-CB 3.88Å; P308-C334 HydrophobicContact CB-CB 3.81Å; P308-C334 WeakPolarHBondContact O-CB 3.26Å; P308-I337 HydrophobicContact CB-CD1 4.37Å
309	R	95.6	Very high	95.5	Very high	106 Å²	106	38 Å²	38	40%	0.4	20%	0.199	S	C	.	.	H	α-helix	trans	-67	-45.8	179.4	-175	179.3	67.8	78.9	0.2	111	D306 A307 I311 E312 E313	D306-R309 WeakPolarHBondContact O-CB 3.47Å; D306-R309 PolarHBondContact O-N 2.94Å; A307-R309 VanDerWaalsContact C-N 3.3Å; A307-R309 PolarHBondContact O-N 2.96Å; R309-I311 VanDerWaalsContact C-N 3.34Å; R309-I311 PolarHBondContact O-N 3.06Å; R309-E312 PolarHBondContact O-N 2.77Å; R309-E313 VanDerWaalsContact CG-OE1 3.23Å; R309-E313 WeakPolarHBondContact CG-OE1 3.39Å; R309-E313 IonicContact CZ-OE1 2.72Å; R309-E313 VanDerWaalsContact NH1-CD 3.29Å; R309-E313 IonicContact NH1-OE1 3.87Å; R309-E313 PolarHBondContact NH1-OE1 2.73Å; R309-E313 IonicContact NH1-OE2 3.61Å; R309-E313 PolarHBondContact NH1-OE2 2.69Å; R309-E313 WeakPolarHBondContact O-CG 3.22Å; R309-E313 PolarHBondContact O-N 2.98Å
310	F	96	Very high	95.5	Very high	69 Å²	69	37.8 Å²	37.8	30%	0.303	20%	0.198	S	C	.	.	H	α-helix	trans	-65.2	-36.5	177.7	-66.8	-43.5	0	0	0	112.6	V276 V280 D306 A307 S314	V276-F310 HydrophobicContact CG2-CB 3.64Å; V276-F310 HydrophobicContact CG2-CD2 3.92Å; V276-F310 HydrophobicContact CG2-CG 4.28Å; V280-F310 HydrophobicContact CG2-CB 4.45Å; D306-F310 HydrophobicContact CB-CD2 4.2Å; D306-F310 HydrophobicContact CB-CE2 3.87Å; D306-F310 HydrophobicContact CB-CZ 4.31Å; D306-F310 PolarHBondContact O-N 2.82Å; D306-F310 VanDerWaalsContact O-N 3.15Å; A307-F310 PolarHBondContact O-N 3.05Å; F310-S314 WeakPolarHBondContact O-CB 3.03Å; F310-S314 PolarHBondContact O-N 3.19Å; F310-S314 VanDerWaalsContact O-N 3.07Å; F310-S314 PolarHBondContact O-OG 3.27Å
311	I	97.4	Very high	95.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.6	-45.7	172.6	-69.2	163	0	0	0	110.5	I273 V276 L303 A307 P308 R309 E313 S314 V319 K336	I273-I311 HydrophobicContact CD1-CD1 4.15Å; V276-I311 HydrophobicContact CB-CG1 4.42Å; V276-I311 HydrophobicContact CG1-CD1 3.95Å; V276-I311 HydrophobicContact CG1-CG1 4.09Å; L303-I311 HydrophobicContact CD2-CD1 3.55Å; A307-I311 WeakPolarHBondContact O-CD1 3.43Å; A307-I311 VanDerWaalsContact O-CG1 3.29Å; A307-I311 WeakPolarHBondContact O-CG1 3.48Å; A307-I311 PolarHBondContact O-N 3.14Å; P308-I311 PolarHBondContact O-N 2.78Å; R309-I311 VanDerWaalsContact C-N 3.34Å; R309-I311 PolarHBondContact O-N 3.06Å; I311-E313 PolarHBondContact O-N 3.2Å; I311-S314 PolarHBondContact O-N 3.47Å; I311-S314 PolarHBondContact O-OG 3.22Å; I311-V319 HydrophobicContact CD1-CG2 4.13Å; I311-V319 HydrophobicContact CG1-CG2 4.29Å; I311-V319 HydrophobicContact CG2-CG2 3.51Å; I311-K336 HydrophobicContact CG2-CB 4.35Å; I311-K336 HydrophobicContact CG2-CD 4.27Å; I311-K336 PolarHBondContact O-NZ 2.84Å
312	E	96.8	Very high	95.7	Very high	80 Å²	80	37.6 Å²	37.6	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-61.3	-44.4	-179.8	-169.2	62.4	-161.8	0	0	112.2	P308 R309 S314 C334 P335 K336	P308-E312 PolarHBondContact O-N 2.82Å; R309-E312 PolarHBondContact O-N 2.77Å; E312-S314 VanDerWaalsContact C-N 3.31Å; E312-S314 PolarHBondContact O-N 2.87Å; E312-C334 PolarHBondContact OE2-SG 3.31Å; E312-P335 WeakPolarHBondContact OE2-CD 3.48Å; E312-K336 WeakPolarHBondContact O-CE 3.39Å; E312-K336 PolarHBondContact O-NZ 3.49Å
313	E	96.9	Very high	95.8	Very high	128 Å²	128	37.4 Å²	37.4	60%	0.598	20%	0.196	S	C	*	.	H	α-helix	trans	-74.5	-17.3	-179.4	-68.6	170.2	-166.8	0	0	113.6	R309 I311	R309-E313 VanDerWaalsContact CG-OE1 3.23Å; R309-E313 WeakPolarHBondContact CG-OE1 3.39Å; R309-E313 IonicContact CZ-OE1 2.72Å; R309-E313 VanDerWaalsContact NH1-CD 3.29Å; R309-E313 IonicContact NH1-OE1 3.87Å; R309-E313 PolarHBondContact NH1-OE1 2.73Å; R309-E313 IonicContact NH1-OE2 3.61Å; R309-E313 PolarHBondContact NH1-OE2 2.69Å; R309-E313 WeakPolarHBondContact O-CG 3.22Å; R309-E313 PolarHBondContact O-N 2.98Å; I311-E313 PolarHBondContact O-N 3.2Å
314	S	97.3	Very high	95.9	Very high	15 Å²	15	37.4 Å²	37.4	11%	0.105	20%	0.196	C	C	.	.	S	Bend	trans	-83.4	170.1	-175.3	73.7	0	0	0	0	115.3	F310 I311 E312 I316 K336	F310-S314 WeakPolarHBondContact O-CB 3.03Å; F310-S314 PolarHBondContact O-N 3.19Å; F310-S314 VanDerWaalsContact O-N 3.07Å; F310-S314 PolarHBondContact O-OG 3.27Å; I311-S314 PolarHBondContact O-N 3.47Å; I311-S314 PolarHBondContact O-OG 3.22Å; E312-S314 VanDerWaalsContact C-N 3.31Å; E312-S314 PolarHBondContact O-N 2.87Å; S314-I316 PolarHBondContact O-N 3.33Å; S314-I316 WeakPolarHBondContact OG-CB 3.47Å; S314-I316 WeakPolarHBondContact OG-CG1 3.45Å; S314-I316 PolarHBondContact OG-N 2.74Å; S314-K336 PolarHBondContact O-NZ 2.88Å
315	A	97.3	Very high	96.3	Very high	12 Å²	12	35.6 Å²	35.6	10%	0.099	18%	0.184	C	C	.	.	S	Bend	trans	-64.1	-5.3	168.2	0	0	0	0	0	116.3	A283 E284 K287 I294 D317	A283-A315 HydrophobicContact CB-CB 4.29Å; E284-A315 WeakPolarHBondContact OE1-CB 2.96Å; E284-A315 PolarHBondContact OE1-N 3.13Å; K287-A315 HydrophobicContact CD-CB 3.59Å; I294-A315 HydrophobicContact CD1-CB 4.2Å; A315-D317 PolarHBondContact O-N 2.66Å
316	I	98.4	Very high	96.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	15%	0.153	C	C	.	.			trans	-69.2	130.3	177.8	-59.3	166.1	0	0	0	109.2	F279 V280 A283 I294 V296 S314 V319 K336	F279-I316 HydrophobicContact CB-CD1 4.43Å; V280-I316 HydrophobicContact CG2-CD1 4.48Å; A283-I316 HydrophobicContact CB-CD1 4.33Å; A283-I316 HydrophobicContact CB-CG1 3.52Å; I294-I316 HydrophobicContact CG2-CG1 4.39Å; V296-I316 HydrophobicContact CG2-CD1 3.97Å; V296-I316 HydrophobicContact CG2-CG1 4.23Å; V296-I316 HydrophobicContact CG2-CG2 3.92Å; S314-I316 PolarHBondContact O-N 3.33Å; S314-I316 WeakPolarHBondContact OG-CB 3.47Å; S314-I316 WeakPolarHBondContact OG-CG1 3.45Å; S314-I316 PolarHBondContact OG-N 2.74Å; I316-V319 HydrophobicContact CG2-CG2 3.7Å; I316-K336 VanDerWaalsContact O-CD 3.29Å; I316-K336 WeakPolarHBondContact O-CD 3.21Å; I316-K336 WeakPolarHBondContact O-CE 3.1Å; I316-K336 PolarHBondContact O-NZ 3.39Å
317	D	98.4	Very high	96.8	Very high	72 Å²	72	26.9 Å²	26.9	39%	0.385	13%	0.129	S	C	.	.			trans	-84	-42.1	177.5	-66.3	-82.1	0	0	0	111.7	K293 I294 A315 K336	K293-D317 WeakPolarHBondContact CA-OD2 3.43Å; I294-D317 PolarHBondContact N-OD2 3.34Å; I294-D317 WeakPolarHBondContact O-CB 3.43Å; I294-D317 PolarHBondContact O-N 3.03Å; A315-D317 PolarHBondContact O-N 2.66Å; D317-K336 WeakPolarHBondContact O-CG 3.31Å
318	E	98.5	Very high	96.6	Very high	38 Å²	38	31.2 Å²	31.2	18%	0.178	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	139.4	-176.5	-167	172	104.8	0	0	111.9	Y173 F295 V296 V320 K336 K338	Y173-E318 WeakPolarHBondContact CE1-OE1 3.46Å; Y173-E318 PolarHBondContact OH-OE1 3.36Å; F295-E318 CarbonylContact C-O 3.56Å; F295-E318 WeakPolarHBondContact CA-O 3.3Å; F295-E318 HydrophobicContact CD1-CB 3.65Å; F295-E318 HydrophobicContact CD1-CG 4.4Å; F295-E318 HydrophobicContact CE1-CB 3.77Å; F295-E318 HydrophobicContact CE1-CG 4.47Å; V296-E318 PolarHBondContact N-O 2.95Å; E318-V320 HydrophobicContact CG-CG2 4.11Å; E318-V320 WeakPolarHBondContact OE1-CG2 3.29Å; E318-K336 WeakPolarHBondContact CG-O 3.43Å; E318-K338 HydrophobicContact CG-CG 3.71Å
319	V	98.6	Very high	96.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	116	175.1	177.6	0	0	0	0	108.5	I273 V296 I311 I316 V321 K336 I337 K338	I273-V319 HydrophobicContact CD1-CG1 3.91Å; V296-V319 HydrophobicContact CB-CG1 4.46Å; V296-V319 HydrophobicContact CB-CG2 4.18Å; V296-V319 HydrophobicContact CG2-CG2 4.48Å; V296-V319 CarbonylContact O-C 3.57Å; V296-V319 WeakPolarHBondContact O-CA 3.43Å; I311-V319 HydrophobicContact CD1-CG2 4.13Å; I311-V319 HydrophobicContact CG1-CG2 4.29Å; I311-V319 HydrophobicContact CG2-CG2 3.51Å; I316-V319 HydrophobicContact CG2-CG2 3.7Å; V319-V321 HydrophobicContact CG1-CG1 4.15Å; V319-K336 PolarHBondContact N-O 3.15Å; V319-I337 HydrophobicContact CB-CG1 4.38Å; V319-I337 CarbonylContact O-C 3.58Å; V319-I337 VanDerWaalsContact O-CA 3.3Å; V319-I337 WeakPolarHBondContact O-CA 3.22Å; V319-K338 PolarHBondContact O-N 3.09Å
320	V	98.6	Very high	96.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116.3	-177.8	-173.7	0	0	0	0	108.9	L170 Y173 V296 M297 A298 E318 K338 V340	L170-V320 HydrophobicContact CD2-CG1 4.2Å; Y173-V320 HydrophobicContact CD1-CG1 3.95Å; Y173-V320 HydrophobicContact CD1-CG2 3.99Å; Y173-V320 HydrophobicContact CD2-CG1 4.22Å; Y173-V320 HydrophobicContact CE1-CB 4.32Å; Y173-V320 HydrophobicContact CE1-CG1 3.98Å; Y173-V320 HydrophobicContact CE1-CG2 3.39Å; Y173-V320 HydrophobicContact CE2-CG1 4.22Å; Y173-V320 HydrophobicContact CG-CG1 4.07Å; V296-V320 PolarHBondContact O-N 2.96Å; M297-V320 WeakPolarHBondContact CA-O 3.42Å; M297-V320 HydrophobicContact CE-CB 3.97Å; M297-V320 HydrophobicContact CE-CG2 3.56Å; M297-V320 HydrophobicContact SD-CB 3.51Å; M297-V320 VanDerWaalsContact SD-CB 3.51Å; M297-V320 HydrophobicContact SD-CG1 3.93Å; M297-V320 HydrophobicContact SD-CG2 3.84Å; A298-V320 PolarHBondContact N-O 3.45Å; E318-V320 HydrophobicContact CG-CG2 4.11Å; E318-V320 WeakPolarHBondContact OE1-CG2 3.29Å; V320-K338 WeakPolarHBondContact CA-O 3.48Å; V320-K338 HydrophobicContact CG2-CB 4.34Å; V320-V340 HydrophobicContact CG1-CG2 3.63Å
321	V	98.3	Very high	96.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	160.7	178.4	-67	0	0	0	0	111.4	I273 A298 V319 H327 I337 K338 T339 V340	I273-V321 HydrophobicContact CG2-CG1 3.54Å; A298-V321 HydrophobicContact CB-CG1 4.3Å; A298-V321 VanDerWaalsContact O-CA 3.27Å; A298-V321 WeakPolarHBondContact O-CA 3.46Å; V319-V321 HydrophobicContact CG1-CG1 4.15Å; V321-H327 WeakPolarHBondContact CG2-NE2 3.17Å; V321-I337 HydrophobicContact CG2-CG2 4.08Å; V321-K338 PolarHBondContact N-O 2.98Å; V321-T339 CarbonylContact O-C 3.6Å; V321-T339 VanDerWaalsContact O-CA 3.22Å; V321-T339 WeakPolarHBondContact O-CA 3.42Å; V321-V340 PolarHBondContact O-N 3.26Å
322	T	98.3	Very high	96	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	163	172.5	77.4	0	0	0	0	112	M146 A166 L170 T299 T324 H327 V340 I342	M146-T322 HydrophobicContact CE-CG2 4.45Å; A166-T322 HydrophobicContact CB-CG2 3.79Å; L170-T322 HydrophobicContact CD2-CG2 4.29Å; T299-T322 HydrophobicContact CG2-CG2 4.24Å; T299-T322 WeakPolarHBondContact O-CB 3.45Å; T299-T322 PolarHBondContact O-N 3.35Å; T299-T322 PolarHBondContact O-OG1 3.19Å; T322-T324 PolarHBondContact O-N 3.3Å; T322-T324 VanDerWaalsContact O-N 3.11Å; T322-T324 WeakPolarHBondContact OG1-CG2 3.44Å; T322-T324 PolarHBondContact OG1-N 3.22Å; T322-T324 PolarHBondContact OG1-OG1 2.78Å; T322-H327 PolarHBondContact O-CE1 3.05Å; T322-H327 VanDerWaalsContact O-CE1 3.26Å; T322-V340 VanDerWaalsContact CA-O 3.26Å; T322-V340 WeakPolarHBondContact CA-O 3.22Å; T322-I342 HydrophobicContact CG2-CG2 3.79Å
323	N	96.6	Very high	95.9	Very high	16 Å²	16	40.2 Å²	40.2	9%	0.086	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-77.5	24.3	172.2	66	-15.7	0	0	0	114.9	I325 T339 V340 D341 I342	N323-I325 PolarHBondContact O-N 3.46Å; N323-T339 HydrophobicContact CB-CG2 3.72Å; N323-V340 PolarHBondContact N-O 3.17Å; N323-V340 VanDerWaalsContact N-O 3.08Å; N323-V340 PolarHBondContact OD1-O 3.4Å; N323-D341 PolarHBondContact ND2-OD1 3.21Å; N323-I342 VanDerWaalsContact OD1-CD1 3.27Å; N323-I342 WeakPolarHBondContact OD1-CD1 3.37Å; N323-I342 WeakPolarHBondContact OD1-CG1 3.41Å; N323-I342 PolarHBondContact OD1-N 3.15Å
324	T	96.7	Very high	95.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-33	169.7	47.1	0	0	0	0	113.6	P110 M146 T299 H300 T322 I342	P110-T324 HydrophobicContact CB-CG2 3.71Å; M146-T324 HydrophobicContact CE-CG2 3Å; T299-T324 HydrophobicContact CG2-CG2 4.21Å; T299-T324 PolarHBondContact O-OG1 3.07Å; H300-T324 PolarHBondContact ND1-OG1 3.47Å; H300-T324 VanDerWaalsContact ND1-OG1 3.09Å; T322-T324 PolarHBondContact O-N 3.3Å; T322-T324 VanDerWaalsContact O-N 3.11Å; T322-T324 WeakPolarHBondContact OG1-CG2 3.44Å; T322-T324 PolarHBondContact OG1-N 3.22Å; T322-T324 PolarHBondContact OG1-OG1 2.78Å; T324-I342 HydrophobicContact CG2-CD1 4.32Å; T324-I342 HydrophobicContact CG2-CG1 4.18Å
325	I	95.7	Very high	95.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-125	131.5	179.7	-65.7	174.1	0	0	0	106.8	V77 Y111 H300 G301 L302 N323 H327	V77-I325 WeakPolarHBondContact O-CG2 3.14Å; Y111-I325 HydrophobicContact CD1-CD1 3.76Å; Y111-I325 HydrophobicContact CD1-CG1 4.19Å; Y111-I325 HydrophobicContact CD2-CD1 4.16Å; Y111-I325 HydrophobicContact CE1-CD1 4.3Å; Y111-I325 HydrophobicContact CG-CD1 3.67Å; Y111-I325 HydrophobicContact CG-CG1 4.05Å; H300-I325 HydrophobicContact CB-CD1 3.98Å; G301-I325 WeakPolarHBondContact O-CG2 3.23Å; L302-I325 HydrophobicContact CB-CD1 4.5Å; L302-I325 HydrophobicContact CD1-CD1 3.09Å; L302-I325 HydrophobicContact CG-CD1 3.77Å; N323-I325 PolarHBondContact O-N 3.46Å; I325-H327 PolarHBondContact O-CE1 2.53Å; I325-H327 PolarHBondContact O-N 2.75Å; I325-H327 PolarHBondContact O-ND1 3.35Å
326	P	94.4	Very high	95.8	Very high	23 Å²	23	38.7 Å²	38.7	15%	0.149	20%	0.198	C	C	.	.			trans	-69	122.9	176.1	-13	27.5	0	0	0	110.8	V77	V77-P326 WeakPolarHBondContact O-CD 3.26Å
327	H	93.4	Very high	95.8	Very high	2 Å²	2	39 Å²	39	1%	0.009	20%	0.199	C	C	.	.			trans	-137.5	31.8	-175.8	54.6	-92	0	0	0	113.1	L303 V321 T322 I325 L329 Q330 K331 T339	L303-H327 HydrophobicContact CD1-CB 4.29Å; V321-H327 WeakPolarHBondContact CG2-NE2 3.17Å; T322-H327 PolarHBondContact O-CE1 3.05Å; T322-H327 VanDerWaalsContact O-CE1 3.26Å; I325-H327 PolarHBondContact O-CE1 2.53Å; I325-H327 PolarHBondContact O-N 2.75Å; I325-H327 PolarHBondContact O-ND1 3.35Å; H327-L329 VanDerWaalsContact C-N 3.31Å; H327-L329 PolarHBondContact O-N 3.07Å; H327-Q330 VanDerWaalsContact C-OE1 3.3Å; H327-Q330 HydrophobicContact CB-CB 4.23Å; H327-Q330 HydrophobicContact CB-CG 4.42Å; H327-Q330 WeakPolarHBondContact O-CB 3.25Å; H327-Q330 PolarHBondContact O-N 3.47Å; H327-Q330 PolarHBondContact O-OE1 3.15Å; H327-K331 PolarHBondContact O-N 3.17Å; H327-K331 VanDerWaalsContact O-N 3.09Å; H327-T339 PolarHBondContact NE2-OG1 3.28Å
328	E	90.6	Very high	95.8	Very high	94 Å²	94	39.6 Å²	39.6	44%	0.439	20%	0.198	S	C	.	.	H	α-helix	trans	-64.5	-32.9	-178.3	-61.6	-56	151.2	0	0	112.9	K331 L332	E328-K331 PolarHBondContact O-N 3.44Å; E328-K331 IonicContact OE1-NZ 2.78Å; E328-K331 PolarHBondContact OE1-NZ 2.96Å; E328-K331 IonicContact OE2-NZ 3.61Å; E328-K331 PolarHBondContact OE2-NZ 2.86Å; E328-L332 WeakPolarHBondContact O-CG 3.33Å; E328-L332 PolarHBondContact O-N 2.78Å; E328-L332 VanDerWaalsContact O-N 3.14Å
329	L	91.3	Very high	95.8	Very high	91 Å²	91	39.8 Å²	39.8	48%	0.476	20%	0.202	S	C	.	.	H	α-helix	trans	-66.4	-40.7	175	-66.8	179.9	0	0	0	111.6	I80 H327 K331 L332 Q333	I80-L329 HydrophobicContact CD1-CD1 3.59Å; I80-L329 HydrophobicContact CD1-CG 4.4Å; I80-L329 HydrophobicContact CG1-CD1 3.92Å; H327-L329 VanDerWaalsContact C-N 3.31Å; H327-L329 PolarHBondContact O-N 3.07Å; L329-K331 VanDerWaalsContact C-N 3.34Å; L329-K331 PolarHBondContact O-N 3.34Å; L329-L332 PolarHBondContact O-N 2.83Å; L329-Q333 WeakPolarHBondContact O-CG 3.46Å; L329-Q333 PolarHBondContact O-N 3.01Å
330	Q	93.2	Very high	95.8	Very high	20 Å²	20	40.6 Å²	40.6	9%	0.093	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-41	177.8	-69.3	74.5	2.3	0	0	110.9	N79 L303 P308 H327 L332 Q333 C334 I337	N79-Q330 PolarHBondContact ND2-NE2 3.33Å; L303-Q330 HydrophobicContact CB-CG 3.91Å; L303-Q330 HydrophobicContact CD1-CB 4.22Å; L303-Q330 HydrophobicContact CD1-CG 4.39Å; P308-Q330 HydrophobicContact CG-CB 3.69Å; P308-Q330 HydrophobicContact CG-CG 3.6Å; H327-Q330 VanDerWaalsContact C-OE1 3.3Å; H327-Q330 HydrophobicContact CB-CB 4.23Å; H327-Q330 HydrophobicContact CB-CG 4.42Å; H327-Q330 WeakPolarHBondContact O-CB 3.25Å; H327-Q330 PolarHBondContact O-N 3.47Å; H327-Q330 PolarHBondContact O-OE1 3.15Å; Q330-L332 VanDerWaalsContact C-N 3.33Å; Q330-L332 PolarHBondContact O-N 3.28Å; Q330-Q333 WeakPolarHBondContact O-CB 3.3Å; Q330-Q333 PolarHBondContact O-N 2.99Å; Q330-Q333 VanDerWaalsContact O-N 3.12Å; Q330-C334 PolarHBondContact O-N 3.4Å; Q330-I337 HydrophobicContact CB-CD1 4.1Å
331	K	93.3	Very high	95.7	Very high	60 Å²	60	42.7 Å²	42.7	26%	0.261	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-34.5	175.7	-73	163.8	68.5	-169.2	0	113.4	H327 E328 L329 Q333 C334 I337 T339	H327-K331 PolarHBondContact O-N 3.17Å; H327-K331 VanDerWaalsContact O-N 3.09Å; E328-K331 PolarHBondContact O-N 3.44Å; E328-K331 IonicContact OE1-NZ 2.78Å; E328-K331 PolarHBondContact OE1-NZ 2.96Å; E328-K331 IonicContact OE2-NZ 3.61Å; E328-K331 PolarHBondContact OE2-NZ 2.86Å; L329-K331 VanDerWaalsContact C-N 3.34Å; L329-K331 PolarHBondContact O-N 3.34Å; K331-Q333 VanDerWaalsContact C-N 3.25Å; K331-Q333 PolarHBondContact O-N 3.42Å; K331-C334 CarbonylContact O-C 3.59Å; K331-I337 HydrophobicContact CG-CB 4.02Å; K331-I337 HydrophobicContact CG-CG2 3.72Å; K331-T339 VanDerWaalsContact CD-OG1 3.24Å; K331-T339 WeakPolarHBondContact CD-OG1 3.42Å; K331-T339 VanDerWaalsContact CE-OG1 3.28Å; K331-T339 WeakPolarHBondContact CE-OG1 3.45Å; K331-T339 PolarHBondContact NZ-OG1 3.31Å
332	L	93.3	Very high	95.6	Very high	146 Å²	146	42.7 Å²	42.7	76%	0.764	22%	0.218	S	C	*	.	H	α-helix	trans	-66.7	-31.3	173.6	-71.2	171.2	0	0	0	111.7	E328 L329 Q330	E328-L332 WeakPolarHBondContact O-CG 3.33Å; E328-L332 PolarHBondContact O-N 2.78Å; E328-L332 VanDerWaalsContact O-N 3.14Å; L329-L332 PolarHBondContact O-N 2.83Å; Q330-L332 VanDerWaalsContact C-N 3.33Å; Q330-L332 PolarHBondContact O-N 3.28Å
333	Q	94.2	Very high	95.5	Very high	127 Å²	127	42.7 Å²	42.7	59%	0.593	22%	0.218	S	C	*	.	H	α-helix	trans	-81.3	-30.7	177.9	-68.8	172.9	-10.7	0	0	113.2	P308 L329 Q330 K331	P308-Q333 HydrophobicContact CB-CB 3.88Å; L329-Q333 WeakPolarHBondContact O-CG 3.46Å; L329-Q333 PolarHBondContact O-N 3.01Å; Q330-Q333 WeakPolarHBondContact O-CB 3.3Å; Q330-Q333 PolarHBondContact O-N 2.99Å; Q330-Q333 VanDerWaalsContact O-N 3.12Å; K331-Q333 VanDerWaalsContact C-N 3.25Å; K331-Q333 PolarHBondContact O-N 3.42Å
334	C	96.5	Very high	95.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.			trans	-137.3	104.4	-176.9	179.7	0	0	0	0	111.1	P308 E312 Q330 K331 K336 I337	P308-C334 HydrophobicContact CB-CB 3.81Å; P308-C334 WeakPolarHBondContact O-CB 3.26Å; E312-C334 PolarHBondContact OE2-SG 3.31Å; Q330-C334 PolarHBondContact O-N 3.4Å; K331-C334 CarbonylContact O-C 3.59Å; C334-K336 PolarHBondContact O-N 3.38Å; C334-I337 HydrophobicContact CB-CD1 3.79Å; C334-I337 HydrophobicContact CB-CG1 4.11Å; C334-I337 PolarHBondContact O-N 3.47Å; C334-I337 VanDerWaalsContact O-N 3.15Å
335	P	96.8	Very high	95.3	Very high	83 Å²	83	46.9 Å²	46.9	54%	0.539	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-14.4	-179.1	28.1	-36.3	0	0	0	114.1	E312 I337 K338	E312-P335 WeakPolarHBondContact OE2-CD 3.48Å; P335-I337 PolarHBondContact O-N 3.09Å; P335-K338 PolarHBondContact O-NZ 3.23Å
336	K	97.9	Very high	95.3	Very high	40 Å²	40	46.9 Å²	46.9	17%	0.174	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.1	172	-58.3	179.8	-179.2	-179.1	0	112.7	I311 E312 S314 I316 D317 E318 V319 C334 K338	I311-K336 HydrophobicContact CG2-CB 4.35Å; I311-K336 HydrophobicContact CG2-CD 4.27Å; I311-K336 PolarHBondContact O-NZ 2.84Å; E312-K336 WeakPolarHBondContact O-CE 3.39Å; E312-K336 PolarHBondContact O-NZ 3.49Å; S314-K336 PolarHBondContact O-NZ 2.88Å; I316-K336 VanDerWaalsContact O-CD 3.29Å; I316-K336 WeakPolarHBondContact O-CD 3.21Å; I316-K336 WeakPolarHBondContact O-CE 3.1Å; I316-K336 PolarHBondContact O-NZ 3.39Å; D317-K336 WeakPolarHBondContact O-CG 3.31Å; E318-K336 WeakPolarHBondContact CG-O 3.43Å; V319-K336 PolarHBondContact N-O 3.15Å; C334-K336 PolarHBondContact O-N 3.38Å; K336-K338 PolarHBondContact O-N 3.2Å
337	I	98.2	Very high	95.4	Very high	6 Å²	6	46.1 Å²	46.1	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	117.3	179.2	-58.2	168.3	0	0	0	110	L303 P308 V319 V321 Q330 K331 C334 P335	L303-I337 HydrophobicContact CD1-CD1 3.98Å; L303-I337 HydrophobicContact CD1-CG2 4.33Å; P308-I337 HydrophobicContact CB-CD1 4.37Å; V319-I337 HydrophobicContact CB-CG1 4.38Å; V319-I337 CarbonylContact O-C 3.58Å; V319-I337 VanDerWaalsContact O-CA 3.3Å; V319-I337 WeakPolarHBondContact O-CA 3.22Å; V321-I337 HydrophobicContact CG2-CG2 4.08Å; Q330-I337 HydrophobicContact CB-CD1 4.1Å; K331-I337 HydrophobicContact CG-CB 4.02Å; K331-I337 HydrophobicContact CG-CG2 3.72Å; C334-I337 HydrophobicContact CB-CD1 3.79Å; C334-I337 HydrophobicContact CB-CG1 4.11Å; C334-I337 PolarHBondContact O-N 3.47Å; C334-I337 VanDerWaalsContact O-N 3.15Å; P335-I337 PolarHBondContact O-N 3.09Å
338	K	98.1	Very high	95.5	Very high	86 Å²	86	48.1 Å²	48.1	37%	0.374	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	146.1	174	-57	-58.7	-175.2	-165.7	0	110.6	Y173 E318 V319 V320 V321 P335 K336	Y173-K338 WeakPolarHBondContact OH-CG 3.47Å; E318-K338 HydrophobicContact CG-CG 3.71Å; V319-K338 PolarHBondContact O-N 3.09Å; V320-K338 WeakPolarHBondContact CA-O 3.48Å; V320-K338 HydrophobicContact CG2-CB 4.34Å; V321-K338 PolarHBondContact N-O 2.98Å; P335-K338 PolarHBondContact O-NZ 3.23Å; K336-K338 PolarHBondContact O-N 3.2Å
339	T	97.8	Very high	95.8	Very high	42 Å²	42	43.7 Å²	43.7	26%	0.258	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.1	-176.5	-46.2	0	0	0	0	111.4	V321 N323 H327 K331	V321-T339 CarbonylContact O-C 3.6Å; V321-T339 VanDerWaalsContact O-CA 3.22Å; V321-T339 WeakPolarHBondContact O-CA 3.42Å; N323-T339 HydrophobicContact CB-CG2 3.72Å; H327-T339 PolarHBondContact NE2-OG1 3.28Å; K331-T339 VanDerWaalsContact CD-OG1 3.24Å; K331-T339 WeakPolarHBondContact CD-OG1 3.42Å; K331-T339 VanDerWaalsContact CE-OG1 3.28Å; K331-T339 WeakPolarHBondContact CE-OG1 3.45Å; K331-T339 PolarHBondContact NZ-OG1 3.31Å
340	V	97.8	Very high	96.1	Very high	17 Å²	17	39.3 Å²	39.3	10%	0.103	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.6	169.7	179.5	0	0	0	0	109.7	F169 L170 Y173 V320 V321 T322 N323	F169-V340 HydrophobicContact CB-CG1 3.79Å; L170-V340 HydrophobicContact CD2-CG2 4.2Å; Y173-V340 HydrophobicContact CD2-CG2 3.71Å; Y173-V340 HydrophobicContact CE2-CG2 4.35Å; Y173-V340 HydrophobicContact CG-CG2 4.18Å; V320-V340 HydrophobicContact CG1-CG2 3.63Å; V321-V340 PolarHBondContact O-N 3.26Å; T322-V340 VanDerWaalsContact CA-O 3.26Å; T322-V340 WeakPolarHBondContact CA-O 3.22Å; N323-V340 PolarHBondContact N-O 3.17Å; N323-V340 VanDerWaalsContact N-O 3.08Å; N323-V340 PolarHBondContact OD1-O 3.4Å
341	D	96.6	Very high	96.2	Very high	43 Å²	43	41.2 Å²	41.2	23%	0.23	21%	0.206	C	C	.	.			trans	-80.3	121.7	179.7	178.8	39.9	0	0	0	111.7	R36 R40 N323 S343	R36-D341 IonicContact NH1-OD1 3.78Å; R40-D341 IonicContact CZ-OD2 2.77Å; R40-D341 IonicContact NE-OD2 2.75Å; R40-D341 IonicContact NH2-OD2 3.83Å; R40-D341 PolarHBondContact NH2-OD2 3.15Å; N323-D341 PolarHBondContact ND2-OD1 3.21Å; D341-S343 VanDerWaalsContact OD1-CB 3.3Å; D341-S343 WeakPolarHBondContact OD1-CB 3.11Å; D341-S343 PolarHBondContact OD1-N 3.22Å; D341-S343 VanDerWaalsContact OD1-N 3.12Å; D341-S343 PolarHBondContact OD1-OG 3.42Å; D341-S343 PolarHBondContact OD2-OG 2.95Å
342	I	96.4	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.			trans	-110.1	9.9	177.7	53.7	61.9	0	0	0	113	L33 M146 T322 N323 T324 M344 I345 L346	L33-I342 HydrophobicContact CD1-CD1 3.88Å; L33-I342 HydrophobicContact CD2-CD1 4.11Å; M146-I342 HydrophobicContact CE-CB 3.99Å; M146-I342 HydrophobicContact CE-CD1 4.27Å; M146-I342 HydrophobicContact CE-CG1 3.59Å; M146-I342 HydrophobicContact CE-CG2 3.98Å; M146-I342 HydrophobicContact SD-CB 4.26Å; M146-I342 HydrophobicContact SD-CG1 4.43Å; M146-I342 HydrophobicContact SD-CG2 4.26Å; T322-I342 HydrophobicContact CG2-CG2 3.79Å; N323-I342 VanDerWaalsContact OD1-CD1 3.27Å; N323-I342 WeakPolarHBondContact OD1-CD1 3.37Å; N323-I342 WeakPolarHBondContact OD1-CG1 3.41Å; N323-I342 PolarHBondContact OD1-N 3.15Å; T324-I342 HydrophobicContact CG2-CD1 4.32Å; T324-I342 HydrophobicContact CG2-CG1 4.18Å; I342-M344 PolarHBondContact O-N 2.95Å; I342-I345 HydrophobicContact CB-CG2 3.95Å; I342-I345 WeakPolarHBondContact O-CG2 3.43Å; I342-I345 PolarHBondContact O-N 2.92Å; I342-L346 HydrophobicContact CD1-CD1 3.5Å; I342-L346 VanDerWaalsContact CD1-CD1 3.5Å; I342-L346 HydrophobicContact CD1-CG 4.21Å; I342-L346 PolarHBondContact O-N 2.97Å
343	S	96.3	Very high	96.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.1	-30	177.2	61	0	0	0	0	112.5	R40 D341 L346 S347	R40-S343 PolarHBondContact NE-OG 3.24Å; D341-S343 VanDerWaalsContact OD1-CB 3.3Å; D341-S343 WeakPolarHBondContact OD1-CB 3.11Å; D341-S343 PolarHBondContact OD1-N 3.22Å; D341-S343 VanDerWaalsContact OD1-N 3.12Å; D341-S343 PolarHBondContact OD1-OG 3.42Å; D341-S343 PolarHBondContact OD2-OG 2.95Å; S343-L346 PolarHBondContact O-N 3.45Å; S343-S347 WeakPolarHBondContact O-CB 3.46Å; S343-S347 PolarHBondContact O-N 3.33Å; S343-S347 PolarHBondContact O-OG 2.85Å; S343-S347 VanDerWaalsContact O-OG 3.06Å
344	M	93.9	Very high	96.4	Very high	95 Å²	95	30 Å²	30	47%	0.468	15%	0.15	S	C	.	.	H	α-helix	trans	-60.2	-53.1	176.5	-176.6	66.3	87.9	0	0	112.3	R40 I342 L346 S347 E348	R40-M344 VanDerWaalsContact NH1-CE 3.33Å; I342-M344 PolarHBondContact O-N 2.95Å; M344-L346 VanDerWaalsContact C-N 3.31Å; M344-L346 PolarHBondContact O-N 3.1Å; M344-S347 WeakPolarHBondContact CA-OG 3.4Å; M344-S347 PolarHBondContact O-N 3.06Å; M344-S347 PolarHBondContact O-OG 2.85Å; M344-E348 WeakPolarHBondContact O-CB 3.39Å; M344-E348 PolarHBondContact O-N 3.27Å
345	I	95.4	Very high	96.2	Very high	10 Å²	10	32.9 Å²	32.9	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-65.5	-36.6	-178.1	-171.8	173.3	0	0	0	111.4	M146 L164 R165 F169 I342 E348 A349 L362	M146-I345 HydrophobicContact SD-CG2 4.32Å; L164-I345 HydrophobicContact CB-CD1 4.19Å; L164-I345 HydrophobicContact CD1-CG1 4.27Å; R165-I345 WeakPolarHBondContact O-CD1 3.19Å; F169-I345 HydrophobicContact CE2-CB 3.78Å; F169-I345 HydrophobicContact CE2-CD1 4.11Å; F169-I345 HydrophobicContact CE2-CG1 4.44Å; F169-I345 HydrophobicContact CE2-CG2 3.97Å; F169-I345 HydrophobicContact CZ-CB 3.92Å; F169-I345 HydrophobicContact CZ-CG2 4.25Å; I342-I345 HydrophobicContact CB-CG2 3.95Å; I342-I345 WeakPolarHBondContact O-CG2 3.43Å; I342-I345 PolarHBondContact O-N 2.92Å; I345-E348 PolarHBondContact O-N 3.29Å; I345-A349 WeakPolarHBondContact O-CB 3.47Å; I345-A349 PolarHBondContact O-N 3.37Å; I345-L362 HydrophobicContact CG1-CD1 4.48Å; I345-L362 HydrophobicContact CG1-CD2 4.28Å
346	L	96.9	Very high	96	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.7	-43.7	175.5	-68	175.5	0	0	0	112.1	L33 I37 V108 P110 I144 L164 I342 S343 M344 E348 A349 I350	L33-L346 HydrophobicContact CD1-CD1 4.29Å; L33-L346 HydrophobicContact CD2-CD1 3.89Å; L33-L346 HydrophobicContact CG-CD1 4.35Å; I37-L346 HydrophobicContact CD1-CB 3.7Å; I37-L346 HydrophobicContact CD1-CD1 3.77Å; I37-L346 HydrophobicContact CD1-CG 4.4Å; I37-L346 HydrophobicContact CG1-CB 4.12Å; V108-L346 HydrophobicContact CG1-CD2 4.09Å; P110-L346 HydrophobicContact CB-CD1 4.21Å; P110-L346 HydrophobicContact CG-CD1 3.8Å; I144-L346 HydrophobicContact CG2-CD2 4.15Å; L164-L346 HydrophobicContact CD1-CD2 3.82Å; I342-L346 HydrophobicContact CD1-CD1 3.5Å; I342-L346 VanDerWaalsContact CD1-CD1 3.5Å; I342-L346 HydrophobicContact CD1-CG 4.21Å; I342-L346 PolarHBondContact O-N 2.97Å; S343-L346 PolarHBondContact O-N 3.45Å; M344-L346 VanDerWaalsContact C-N 3.31Å; M344-L346 PolarHBondContact O-N 3.1Å; L346-E348 VanDerWaalsContact C-N 3.33Å; L346-E348 PolarHBondContact O-N 2.91Å; L346-A349 PolarHBondContact O-N 2.85Å; L346-I350 WeakPolarHBondContact O-CG1 3.46Å; L346-I350 PolarHBondContact O-N 2.82Å
347	S	96.1	Very high	95.8	Very high	6 Å²	6	34 Å²	34	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-42.9	175.1	58.2	0	0	0	0	111.6	L41 S343 M344 A349 I350 R351	L41-S347 WeakPolarHBondContact CD2-O 3.41Å; S343-S347 WeakPolarHBondContact O-CB 3.46Å; S343-S347 PolarHBondContact O-N 3.33Å; S343-S347 PolarHBondContact O-OG 2.85Å; S343-S347 VanDerWaalsContact O-OG 3.06Å; M344-S347 WeakPolarHBondContact CA-OG 3.4Å; M344-S347 PolarHBondContact O-N 3.06Å; M344-S347 PolarHBondContact O-OG 2.85Å; S347-A349 VanDerWaalsContact C-N 3.35Å; S347-A349 PolarHBondContact O-N 3.44Å; S347-I350 PolarHBondContact O-N 2.89Å; S347-R351 WeakPolarHBondContact O-CB 3.46Å; S347-R351 PolarHBondContact O-N 2.9Å
348	E	95.4	Very high	95.4	Very high	45 Å²	45	37.1 Å²	37.1	21%	0.21	21%	0.205	C	C	.	.	H	α-helix	trans	-67.6	-36.2	179.8	-176.8	59	-168.6	0	0	112	M344 I345 L346 R351 R352 L362	M344-E348 WeakPolarHBondContact O-CB 3.39Å; M344-E348 PolarHBondContact O-N 3.27Å; I345-E348 PolarHBondContact O-N 3.29Å; L346-E348 VanDerWaalsContact C-N 3.33Å; L346-E348 PolarHBondContact O-N 2.91Å; E348-R351 PolarHBondContact O-N 3.35Å; E348-R351 IonicContact OE1-CZ 2.99Å; E348-R351 IonicContact OE1-NE 2.59Å; E348-R351 IonicContact OE1-NH2 3.48Å; E348-R351 PolarHBondContact OE1-NH2 3.22Å; E348-R351 IonicContact OE2-CZ 2.68Å; E348-R351 IonicContact OE2-NE 3.84Å; E348-R351 PolarHBondContact OE2-NE 3.3Å; E348-R351 IonicContact OE2-NH2 2.72Å; E348-R352 WeakPolarHBondContact O-CB 3.5Å; E348-R352 VanDerWaalsContact O-CG 3.29Å; E348-R352 WeakPolarHBondContact O-CG 3.33Å; E348-R352 PolarHBondContact O-N 2.86Å; E348-R352 IonicContact OE1-CZ 3.84Å; E348-R352 IonicContact OE1-NE 3.16Å; E348-R352 PolarHBondContact OE1-NE 3.09Å; E348-R352 IonicContact OE1-NH2 3.76Å; E348-R352 PolarHBondContact OE1-NH2 3.29Å; E348-L362 HydrophobicContact CB-CD2 4.39Å; E348-L362 HydrophobicContact CG-CD1 4.48Å; E348-L362 HydrophobicContact CG-CD2 3.86Å
349	A	96.7	Very high	95	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-48.7	172.4	0	0	0	0	0	112	I144 L164 I345 L346 S347 R351 R352 I353 M359 L362	I144-A349 HydrophobicContact CD1-CB 4.14Å; I144-A349 HydrophobicContact CG2-CB 4.2Å; L164-A349 HydrophobicContact CD1-CB 3.81Å; L164-A349 HydrophobicContact CD2-CB 4.31Å; I345-A349 WeakPolarHBondContact O-CB 3.47Å; I345-A349 PolarHBondContact O-N 3.37Å; L346-A349 PolarHBondContact O-N 2.85Å; S347-A349 VanDerWaalsContact C-N 3.35Å; S347-A349 PolarHBondContact O-N 3.44Å; A349-R351 VanDerWaalsContact C-N 3.34Å; A349-R351 PolarHBondContact O-N 3.27Å; A349-R352 PolarHBondContact O-N 3.42Å; A349-I353 WeakPolarHBondContact O-CG1 3.25Å; A349-I353 PolarHBondContact O-N 2.86Å; A349-M359 HydrophobicContact CB-CE 3.65Å; A349-M359 HydrophobicContact CB-SD 4.46Å; A349-L362 HydrophobicContact CB-CD1 4.03Å
350	I	96.6	Very high	94.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.2	-47.9	176.3	-68.2	166.5	0	0	0	110.5	L19 I37 L41 F72 V108 I144 L346 S347 R352 I353 H354	L19-I350 HydrophobicContact CD1-CG2 4.44Å; I37-I350 HydrophobicContact CG2-CD1 3.55Å; L41-I350 HydrophobicContact CD1-CB 4.18Å; L41-I350 HydrophobicContact CD1-CD1 4.42Å; L41-I350 HydrophobicContact CD1-CG2 3.76Å; F72-I350 HydrophobicContact CD1-CB 4.2Å; F72-I350 HydrophobicContact CD1-CD1 4.49Å; F72-I350 HydrophobicContact CD1-CG1 3.76Å; F72-I350 HydrophobicContact CD1-CG2 3.78Å; F72-I350 HydrophobicContact CD2-CG2 4.15Å; F72-I350 HydrophobicContact CE1-CB 4.15Å; F72-I350 HydrophobicContact CE1-CG1 4.09Å; F72-I350 HydrophobicContact CE1-CG2 3.8Å; F72-I350 HydrophobicContact CE2-CG2 4.18Å; F72-I350 HydrophobicContact CG-CG1 4.46Å; F72-I350 HydrophobicContact CG-CG2 3.95Å; F72-I350 HydrophobicContact CZ-CG2 4Å; V108-I350 HydrophobicContact CG2-CD1 4.08Å; V108-I350 HydrophobicContact CG2-CG1 4.14Å; I144-I350 HydrophobicContact CD1-CG1 3.89Å; L346-I350 WeakPolarHBondContact O-CG1 3.46Å; L346-I350 PolarHBondContact O-N 2.82Å; S347-I350 PolarHBondContact O-N 2.89Å; I350-R352 VanDerWaalsContact C-N 3.32Å; I350-R352 PolarHBondContact O-N 2.96Å; I350-I353 PolarHBondContact O-N 2.89Å; I350-H354 VanDerWaalsContact O-CB 3.3Å; I350-H354 WeakPolarHBondContact O-CB 3.42Å; I350-H354 PolarHBondContact O-N 3.35Å
351	R	95.4	Very high	93.3	Very high	60 Å²	60	42 Å²	42	23%	0.226	23%	0.228	C	C	.	.	H	α-helix	trans	-58.6	-43.2	179.5	-165.2	-165	67	67.3	5.2	111.6	M12 L41 S347 E348 A349 N355 E357	M12-R351 HydrophobicContact SD-CG 3.88Å; L41-R351 HydrophobicContact CD2-CB 3.97Å; L41-R351 HydrophobicContact CD2-CG 4.44Å; S347-R351 WeakPolarHBondContact O-CB 3.46Å; S347-R351 PolarHBondContact O-N 2.9Å; E348-R351 PolarHBondContact O-N 3.35Å; E348-R351 IonicContact OE1-CZ 2.99Å; E348-R351 IonicContact OE1-NE 2.59Å; E348-R351 IonicContact OE1-NH2 3.48Å; E348-R351 PolarHBondContact OE1-NH2 3.22Å; E348-R351 IonicContact OE2-CZ 2.68Å; E348-R351 IonicContact OE2-NE 3.84Å; E348-R351 PolarHBondContact OE2-NE 3.3Å; E348-R351 IonicContact OE2-NH2 2.72Å; A349-R351 VanDerWaalsContact C-N 3.34Å; A349-R351 PolarHBondContact O-N 3.27Å; R351-N355 WeakPolarHBondContact O-CB 3.38Å; R351-N355 PolarHBondContact O-N 3.29Å; R351-N355 VanDerWaalsContact O-N 3.15Å; R351-N355 PolarHBondContact O-ND2 3.18Å; R351-E357 IonicContact CZ-OE1 2.91Å; R351-E357 IonicContact CZ-OE2 3.99Å; R351-E357 VanDerWaalsContact NH1-CD 3.28Å; R351-E357 IonicContact NH1-OE1 2.78Å; R351-E357 PolarHBondContact NH1-OE1 3.35Å; R351-E357 IonicContact NH1-OE2 3.07Å; R351-E357 PolarHBondContact NH1-OE2 2.73Å; R351-E357 VanDerWaalsContact NH1-OE2 3.13Å; R351-E357 IonicContact NH2-OE1 3.42Å; R351-E357 IonicContact NH2-OE2 2.64Å; R351-E357 PolarHBondContact NH2-OE2 3Å
352	R	95.1	Very high	92.6	Very high	34 Å²	34	41.2 Å²	41.2	13%	0.128	22%	0.224	C	C	.	.	H	α-helix	trans	-68.2	-47.8	-179.9	-75.4	175.5	-177.8	-80.8	-16.3	112.2	E348 A349 I350 H354 N355 G356 E357 S358 M359	E348-R352 WeakPolarHBondContact O-CB 3.5Å; E348-R352 VanDerWaalsContact O-CG 3.29Å; E348-R352 WeakPolarHBondContact O-CG 3.33Å; E348-R352 PolarHBondContact O-N 2.86Å; E348-R352 IonicContact OE1-CZ 3.84Å; E348-R352 IonicContact OE1-NE 3.16Å; E348-R352 PolarHBondContact OE1-NE 3.09Å; E348-R352 IonicContact OE1-NH2 3.76Å; E348-R352 PolarHBondContact OE1-NH2 3.29Å; A349-R352 PolarHBondContact O-N 3.42Å; I350-R352 VanDerWaalsContact C-N 3.32Å; I350-R352 PolarHBondContact O-N 2.96Å; R352-H354 VanDerWaalsContact C-N 3.33Å; R352-H354 PolarHBondContact O-N 2.74Å; R352-N355 CarbonylContact O-C 3.56Å; R352-N355 PolarHBondContact O-N 3.2Å; R352-G356 PolarHBondContact O-N 3.15Å; R352-E357 HydrophobicContact CB-CB 4.09Å; R352-E357 HydrophobicContact CG-CB 4.05Å; R352-E357 PolarHBondContact O-N 2.83Å; R352-S358 WeakPolarHBondContact CD-O 3.28Å; R352-S358 PolarHBondContact NH1-O 3.22Å; R352-M359 HydrophobicContact CB-SD 3.66Å; R352-M359 HydrophobicContact CG-SD 4.4Å
353	I	95.2	Very high	91.6	Very high	38 Å²	38	44.5 Å²	44.5	20%	0.195	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-45.8	178.6	-68.3	170	0	0	0	110.5	F72 I144 D162 A349 I350 N355 G356 M359	F72-I353 HydrophobicContact CE1-CB 4.43Å; F72-I353 HydrophobicContact CE1-CG2 4.24Å; F72-I353 HydrophobicContact CZ-CB 4.44Å; F72-I353 HydrophobicContact CZ-CG2 4.13Å; I144-I353 HydrophobicContact CD1-CD1 3.43Å; I144-I353 VanDerWaalsContact CD1-CD1 3.43Å; I144-I353 HydrophobicContact CG1-CD1 3.57Å; D162-I353 VanDerWaalsContact OD2-CD1 3.29Å; D162-I353 WeakPolarHBondContact OD2-CD1 3.3Å; A349-I353 WeakPolarHBondContact O-CG1 3.25Å; A349-I353 PolarHBondContact O-N 2.86Å; I350-I353 PolarHBondContact O-N 2.89Å; I353-N355 VanDerWaalsContact C-N 3.32Å; I353-N355 PolarHBondContact O-N 2.87Å; I353-G356 PolarHBondContact O-N 3.45Å; I353-M359 HydrophobicContact CG1-SD 4.35Å
354	H	94.8	Very high	90.1	Very high	24 Å²	24	53.4 Å²	53.4	11%	0.111	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-39.4	178.6	-176.6	65.3	0	0	0	112.9	T15 G17 L19 F72 I350 R352	T15-H354 PolarHBondContact OG1-NE2 2.68Å; G17-H354 PolarHBondContact O-CE1 3.07Å; L19-H354 HydrophobicContact CD1-CB 4.46Å; F72-H354 HydrophobicContact CE2-CB 4.36Å; F72-H354 HydrophobicContact CZ-CB 4.23Å; I350-H354 VanDerWaalsContact O-CB 3.3Å; I350-H354 WeakPolarHBondContact O-CB 3.42Å; I350-H354 PolarHBondContact O-N 3.35Å; R352-H354 VanDerWaalsContact C-N 3.33Å; R352-H354 PolarHBondContact O-N 2.74Å
355	N	93.7	Very high	88.4	Confident	62 Å²	62	55.4 Å²	55.4	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-88.7	-0.1	-179.6	-68.6	-55.4	0	0	0	114.1	R351 R352 I353 E357	R351-N355 WeakPolarHBondContact O-CB 3.38Å; R351-N355 PolarHBondContact O-N 3.29Å; R351-N355 VanDerWaalsContact O-N 3.15Å; R351-N355 PolarHBondContact O-ND2 3.18Å; R352-N355 CarbonylContact O-C 3.56Å; R352-N355 PolarHBondContact O-N 3.2Å; I353-N355 VanDerWaalsContact C-N 3.32Å; I353-N355 PolarHBondContact O-N 2.87Å; N355-E357 HydrophobicContact CB-CG 3.93Å; N355-E357 PolarHBondContact O-N 3.19Å
356	G	92.3	Very high	86.7	Confident	71 Å²	71	56.6 Å²	56.6	73%	0.732	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	26.5	-174.9	0	0	0	0	0	113.7	R352 I353	R352-G356 PolarHBondContact O-N 3.15Å; I353-G356 PolarHBondContact O-N 3.45Å
357	E	92.8	Very high	84.8	Confident	76 Å²	76	58 Å²	58	36%	0.355	31%	0.305	S	S	.	.			trans	-83.8	155.3	178.6	-65	176.5	-161	0	0	111.7	R351 R352 N355 M359	R351-E357 IonicContact CZ-OE1 2.91Å; R351-E357 IonicContact CZ-OE2 3.99Å; R351-E357 VanDerWaalsContact NH1-CD 3.28Å; R351-E357 IonicContact NH1-OE1 2.78Å; R351-E357 PolarHBondContact NH1-OE1 3.35Å; R351-E357 IonicContact NH1-OE2 3.07Å; R351-E357 PolarHBondContact NH1-OE2 2.73Å; R351-E357 VanDerWaalsContact NH1-OE2 3.13Å; R351-E357 IonicContact NH2-OE1 3.42Å; R351-E357 IonicContact NH2-OE2 2.64Å; R351-E357 PolarHBondContact NH2-OE2 3Å; R352-E357 HydrophobicContact CB-CB 4.09Å; R352-E357 HydrophobicContact CG-CB 4.05Å; R352-E357 PolarHBondContact O-N 2.83Å; N355-E357 HydrophobicContact CB-CG 3.93Å; N355-E357 PolarHBondContact O-N 3.19Å; E357-M359 PolarHBondContact O-N 2.72Å
358	S	91	Very high	82.8	Confident	70 Å²	70	63.8 Å²	63.8	49%	0.49	34%	0.34	S	S	.	.			trans	-66.6	134.6	177	172.7	0	0	0	0	112.2	R352 S360	R352-S358 WeakPolarHBondContact CD-O 3.28Å; R352-S358 PolarHBondContact NH1-O 3.22Å; S358-S360 VanDerWaalsContact C-N 3.31Å; S358-S360 WeakPolarHBondContact OG-CB 3.01Å; S358-S360 PolarHBondContact OG-N 3.39Å; S358-S360 PolarHBondContact OG-OG 2.6Å
359	M	89.9	Confident	80.8	Confident	23 Å²	23	64.6 Å²	64.6	11%	0.113	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.6	172.2	-69.6	-65.8	-81.4	0	0	113.4	D162 L164 A349 R352 I353 E357 Y361 L362 F363	D162-M359 HydrophobicContact CB-CE 4.13Å; L164-M359 HydrophobicContact CD2-CE 3.78Å; A349-M359 HydrophobicContact CB-CE 3.65Å; A349-M359 HydrophobicContact CB-SD 4.46Å; R352-M359 HydrophobicContact CB-SD 3.66Å; R352-M359 HydrophobicContact CG-SD 4.4Å; I353-M359 HydrophobicContact CG1-SD 4.35Å; E357-M359 PolarHBondContact O-N 2.72Å; M359-Y361 PolarHBondContact O-N 2.63Å; M359-L362 HydrophobicContact CE-CD1 3.67Å; M359-L362 WeakPolarHBondContact O-CB 3.45Å; M359-L362 PolarHBondContact O-N 3.08Å; M359-L362 HydrophobicContact SD-CD1 3.99Å; M359-F363 HydrophobicContact CB-CD2 4.34Å; M359-F363 HydrophobicContact CB-CE2 4.05Å; M359-F363 VanDerWaalsContact O-CD2 3.32Å; M359-F363 WeakPolarHBondContact O-CD2 3.13Å
360	S	82.3	Confident	78.8	Confident	74 Å²	74	65.3 Å²	65.3	52%	0.517	35%	0.35	S	S	.	.	H	α-helix	trans	-55.9	-26.9	-172.3	-54.5	0	0	0	0	114.3	S358 L362 F363 R364	S358-S360 VanDerWaalsContact C-N 3.31Å; S358-S360 WeakPolarHBondContact OG-CB 3.01Å; S358-S360 PolarHBondContact OG-N 3.39Å; S358-S360 PolarHBondContact OG-OG 2.6Å; S360-L362 VanDerWaalsContact C-N 3.34Å; S360-F363 CarbonylContact O-C 3.57Å; S360-F363 PolarHBondContact O-N 2.77Å; S360-F363 VanDerWaalsContact O-N 3.12Å; S360-R364 PolarHBondContact O-N 3.18Å
361	Y	77.6	Confident	77.9	Confident	150 Å²	150	68.6 Å²	68.6	59%	0.588	37%	0.367	S	S	*	.	H	α-helix	trans	-64.2	-38.5	176.5	-172.2	-96.3	0	0	0	112.4	M359 F363 R364	M359-Y361 PolarHBondContact O-N 2.63Å; Y361-F363 PolarHBondContact O-N 2.93Å; Y361-R364 PolarHBondContact O-N 2.91Å
362	L	81.3	Confident	77	Confident	27 Å²	27	69.1 Å²	69.1	14%	0.141	37%	0.374	C	S	.	.	H	α-helix	trans	-67.6	-18.4	175.9	-61.8	-178.2	0	0	0	111.8	L164 I345 E348 A349 M359 S360 I366	L164-L362 HydrophobicContact CD2-CD1 4.15Å; I345-L362 HydrophobicContact CG1-CD1 4.48Å; I345-L362 HydrophobicContact CG1-CD2 4.28Å; E348-L362 HydrophobicContact CB-CD2 4.39Å; E348-L362 HydrophobicContact CG-CD1 4.48Å; E348-L362 HydrophobicContact CG-CD2 3.86Å; A349-L362 HydrophobicContact CB-CD1 4.03Å; M359-L362 HydrophobicContact CE-CD1 3.67Å; M359-L362 WeakPolarHBondContact O-CB 3.45Å; M359-L362 PolarHBondContact O-N 3.08Å; M359-L362 HydrophobicContact SD-CD1 3.99Å; S360-L362 VanDerWaalsContact C-N 3.34Å; L362-I366 VanDerWaalsContact O-CD1 3.31Å; L362-I366 WeakPolarHBondContact O-CD1 3.49Å
363	F	75.1	Confident	76	Confident	69 Å²	69	71 Å²	71	30%	0.303	39%	0.388	S	S	.	.	H	α-helix	trans	-105	-3.1	-179.6	-62.2	-84.4	0	0	0	115.7	N163 L164 M359 S360 Y361 N365 I366	N163-F363 VanDerWaalsContact O-CE1 3.29Å; N163-F363 WeakPolarHBondContact O-CE1 3.49Å; L164-F363 HydrophobicContact CD2-CE2 4.38Å; L164-F363 HydrophobicContact CD2-CZ 4.01Å; M359-F363 HydrophobicContact CB-CD2 4.34Å; M359-F363 HydrophobicContact CB-CE2 4.05Å; M359-F363 VanDerWaalsContact O-CD2 3.32Å; M359-F363 WeakPolarHBondContact O-CD2 3.13Å; S360-F363 CarbonylContact O-C 3.57Å; S360-F363 PolarHBondContact O-N 2.77Å; S360-F363 VanDerWaalsContact O-N 3.12Å; Y361-F363 PolarHBondContact O-N 2.93Å; F363-N365 VanDerWaalsContact C-N 3.28Å; F363-N365 PolarHBondContact O-N 3.36Å; F363-N365 VanDerWaalsContact O-N 3.16Å; F363-I366 HydrophobicContact CB-CD1 4.23Å; F363-I366 HydrophobicContact CD1-CD1 3.65Å; F363-I366 HydrophobicContact CE1-CD1 4.39Å; F363-I366 HydrophobicContact CG-CD1 4.24Å; F363-I366 PolarHBondContact O-N 2.85Å
364	R	64.4	Low	74.9	Confident	187 Å²	187	72.9 Å²	72.9	71%	0.706	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.6	-169.1	-104.9	-178.9	177.3	175.6	-1.3	115.2	S360 Y361	S360-R364 PolarHBondContact O-N 3.18Å; Y361-R364 PolarHBondContact O-N 2.91Å
365	N	57.8	Low	73.6	Confident	137 Å²	137	76 Å²	76	73%	0.733	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	22	-174.7	-63.2	-20.3	0	0	0	112.7	F363	F363-N365 VanDerWaalsContact C-N 3.28Å; F363-N365 PolarHBondContact O-N 3.36Å; F363-N365 VanDerWaalsContact O-N 3.16Å
366	I	61.3	Low	72.3	Confident	36 Å²	36	76.9 Å²	76.9	19%	0.185	42%	0.423	C	S	.	.			trans	-101.9	131	-176.2	-62.5	174.2	0	0	0	109.2	R165 L362 F363 D370	R165-I366 HydrophobicContact CB-CD1 3.7Å; R165-I366 HydrophobicContact CB-CG1 4.27Å; R165-I366 HydrophobicContact CG-CD1 3.47Å; R165-I366 VanDerWaalsContact CG-CD1 3.47Å; R165-I366 HydrophobicContact CG-CG1 4.13Å; R165-I366 HydrophobicContact CG-CG2 3.72Å; L362-I366 VanDerWaalsContact O-CD1 3.31Å; L362-I366 WeakPolarHBondContact O-CD1 3.49Å; F363-I366 HydrophobicContact CB-CD1 4.23Å; F363-I366 HydrophobicContact CD1-CD1 3.65Å; F363-I366 HydrophobicContact CE1-CD1 4.39Å; F363-I366 HydrophobicContact CG-CD1 4.24Å; F363-I366 PolarHBondContact O-N 2.85Å; I366-D370 HydrophobicContact CG2-CB 3.83Å
367	G	55.3	Low	70.9	Confident	29 Å²	29	77.4 Å²	77.4	30%	0.299	40%	0.401	S	S	.	.			trans	-71.6	156.5	177.2	0	0	0	0	0	112.2	D369 D370	G367-D369 PolarHBondContact O-N 3.01Å; G367-D370 PolarHBondContact O-N 3.16Å
368	V	55	Low	69.2	Low	128 Å²	128	77.5 Å²	77.5	78%	0.776	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.5	177.9	179	0	0	0	0	112.1	K151	K151-V368 PolarHBondContact NZ-O 3.2Å; K151-V368 VanDerWaalsContact NZ-O 3.07Å
369	D	52.6	Low	67.4	Low	62 Å²	62	78.1 Å²	78.1	33%	0.332	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	6.8	-175.6	-67.6	-54.7	0	0	0	114.6	G367	G367-D369 PolarHBondContact O-N 3.01Å
370	D	56.1	Low	65.3	Low	15 Å²	15	83.1 Å²	83.1	8%	0.08	42%	0.424	C	S	.	.			trans	-58.9	0	167.1	-97.5	-9	0	0	0	112.7	R165 S167 S199 R203 I366 G367	R165-D370 PolarHBondContact NH1-O 3.05Å; R165-D370 PolarHBondContact NH1-OXT 2.75Å; R165-D370 PolarHBondContact NH2-O 3.46Å; S167-D370 PolarHBondContact OG-OD2 3.31Å; S199-D370 VanDerWaalsContact CB-OD1 3.23Å; S199-D370 WeakPolarHBondContact CB-OD1 3.45Å; S199-D370 VanDerWaalsContact OG-CG 3.26Å; S199-D370 PolarHBondContact OG-OD1 3.28Å; R203-D370 IonicContact CZ-OD1 2.66Å; R203-D370 IonicContact CZ-OD2 3.56Å; R203-D370 IonicContact NH1-OD1 3.76Å; R203-D370 IonicContact NH1-OD2 3.59Å; R203-D370 PolarHBondContact NH1-OD2 3.12Å; R203-D370 IonicContact NH2-OD1 2.96Å; R203-D370 PolarHBondContact NH2-OD1 3.12Å; R203-D370 IonicContact NH2-OD2 3.03Å; R203-D370 PolarHBondContact NH2-OD2 3.4Å; I366-D370 HydrophobicContact CG2-CB 3.83Å; G367-D370 PolarHBondContact O-N 3.16Å

Retrieved 370 of 370 residues in 194.4 ms (Link to these results)

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