A0A096NY16_PAPAN Loading...

Mitotic spindle assembly checkpoint protein MAD2B

AlphaFold DB (F7GZR5), UniProt , Accession A0A096NY16, Species PAPAN (Papio anubis, Olive baboon), Gene MAD2L2, Length 224 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	47.4	Very low	246 Å²	246	124.5 Å²	124.5	100%	1.212	63%	0.633	S	S	*	*				0	94.5	0	-73.8	-179.3	-169.3	0	0	107.6
2	T	37.5	Very low	50	Low	133 Å²	133	114.9 Å²	114.9	82%	0.816	59%	0.588	S	S	*	*			trans	-96.6	106.1	-178.2	6.9	0	0	0	0	108.2	L4	T2-L4 PolarHBondContact O-N 3.04Å
3	T	37	Very low	52.7	Low	133 Å²	133	112.5 Å²	112.5	82%	0.816	57%	0.573	S	S	*	*			trans	-66.3	94.4	169.3	28.1	0	0	0	0	108.7	T5	T3-T5 PolarHBondContact O-N 3.37Å; T3-T5 VanDerWaalsContact O-N 3.17Å
4	L	38.4	Very low	55.1	Low	136 Å²	136	108.4 Å²	108.4	71%	0.712	56%	0.556	S	S	*	*			trans	-55	114.7	164.7	-90.4	145.4	0	0	0	108	T2 D8	T2-L4 PolarHBondContact O-N 3.04Å; L4-D8 HydrophobicContact CD2-CB 4.34Å
5	T	43.1	Very low	57.3	Low	66 Å²	66	101.4 Å²	101.4	41%	0.405	52%	0.52	S	S	.	.			trans	-81.7	148.5	-179.4	67.3	0	0	0	0	109.5	T3 Q7 D8	T3-T5 PolarHBondContact O-N 3.37Å; T3-T5 VanDerWaalsContact O-N 3.17Å; T5-Q7 PolarHBondContact O-N 3.25Å; T5-D8 PolarHBondContact N-OD2 3.47Å; T5-D8 WeakPolarHBondContact O-CB 3.47Å; T5-D8 PolarHBondContact O-N 3.49Å; T5-D8 VanDerWaalsContact OG1-CG 3.32Å; T5-D8 PolarHBondContact OG1-OD2 3.48Å
6	R	40.2	Very low	59.4	Low	218 Å²	218	95.1 Å²	95.1	82%	0.823	49%	0.488	S	S	*	.	H	α-helix	trans	-54.1	-21	179.4	-170.3	176.8	175.7	179.3	-1.1	114
7	Q	49.3	Very low	61.3	Low	139 Å²	139	93.8 Å²	93.8	65%	0.65	48%	0.482	S	S	*	.	H	α-helix	trans	-75.4	-31.9	174.3	-70.9	-177.5	-18.1	0	0	113	T5 L9 F11	T5-Q7 PolarHBondContact O-N 3.25Å; Q7-L9 VanDerWaalsContact C-N 3.34Å; Q7-F11 PolarHBondContact O-N 3.26Å
8	D	50.9	Low	63.1	Low	41 Å²	41	90.6 Å²	90.6	22%	0.219	47%	0.468	C	S	.	.	H	α-helix	trans	-70.1	-34.3	177.7	-54.8	-47.8	0	0	0	110.9	L4 T5 F11 G12 L107	L4-D8 HydrophobicContact CD2-CB 4.34Å; T5-D8 PolarHBondContact N-OD2 3.47Å; T5-D8 WeakPolarHBondContact O-CB 3.47Å; T5-D8 PolarHBondContact O-N 3.49Å; T5-D8 VanDerWaalsContact OG1-CG 3.32Å; T5-D8 PolarHBondContact OG1-OD2 3.48Å; D8-F11 PolarHBondContact O-N 3.1Å; D8-G12 PolarHBondContact O-N 2.79Å; D8-L107 HydrophobicContact CB-CD1 3.97Å; D8-L107 WeakPolarHBondContact OD1-CD1 3.21Å
9	L	52	Low	64.7	Low	102 Å²	102	85.8 Å²	85.8	53%	0.534	44%	0.443	S	S	.	.	H	α-helix	trans	-64.7	-41.7	176.3	-75.1	165.7	0	0	0	112.7	Q7 F11 Q13	Q7-L9 VanDerWaalsContact C-N 3.34Å; L9-F11 VanDerWaalsContact C-N 3.27Å; L9-F11 PolarHBondContact O-N 3.04Å; L9-Q13 WeakPolarHBondContact O-CG 3.3Å; L9-Q13 PolarHBondContact O-N 2.7Å
10	N	69.9	Low	66.3	Low	96 Å²	96	82.4 Å²	82.4	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-30.4	176.8	-73.6	-4.9	0	0	0	111.9	V14	N10-V14 WeakPolarHBondContact O-CG2 3.47Å; N10-V14 PolarHBondContact O-N 3.31Å; N10-V14 VanDerWaalsContact O-N 3.16Å
11	F	72.2	Confident	67.7	Low	59 Å²	59	82.1 Å²	82.1	26%	0.259	42%	0.423	S	S	.	.	H	α-helix	trans	-73.6	-44	-176.5	-169	-89.7	0	0	0	112.5	Q7 D8 L9 Q13 V14 V15 L107 I209	Q7-F11 PolarHBondContact O-N 3.26Å; D8-F11 PolarHBondContact O-N 3.1Å; L9-F11 VanDerWaalsContact C-N 3.27Å; L9-F11 PolarHBondContact O-N 3.04Å; F11-Q13 PolarHBondContact O-N 3.37Å; F11-V14 PolarHBondContact O-N 2.64Å; F11-V15 HydrophobicContact CD1-CG2 4.03Å; F11-V15 HydrophobicContact CE1-CG2 3.44Å; F11-V15 VanDerWaalsContact CE1-CG2 3.44Å; F11-V15 HydrophobicContact CZ-CG2 3.8Å; F11-V15 PolarHBondContact O-N 3.21Å; F11-L107 HydrophobicContact CB-CD1 4.07Å; F11-L107 HydrophobicContact CD1-CD1 4.01Å; F11-L107 HydrophobicContact CD1-CD2 3.53Å; F11-L107 HydrophobicContact CD1-CG 4.15Å; F11-L107 HydrophobicContact CE1-CD2 3.72Å; F11-L107 HydrophobicContact CG-CD1 4.18Å; F11-L107 HydrophobicContact CG-CD2 4.01Å; F11-L107 HydrophobicContact CZ-CD2 4.38Å; F11-I209 HydrophobicContact CE1-CB 3.81Å; F11-I209 HydrophobicContact CE1-CG2 3.79Å; F11-I209 HydrophobicContact CE2-CG2 4.17Å; F11-I209 HydrophobicContact CZ-CB 3.54Å; F11-I209 HydrophobicContact CZ-CD1 3.85Å; F11-I209 HydrophobicContact CZ-CG1 4.3Å; F11-I209 HydrophobicContact CZ-CG2 3.22Å
12	G	77.8	Confident	70.9	Confident	10 Å²	10	70.4 Å²	70.4	10%	0.103	37%	0.365	C	S	.	.	H	α-helix	trans	-59.1	-37.1	174.3	0	0	0	0	0	112.5	D8 A16	D8-G12 PolarHBondContact O-N 2.79Å; G12-A16 VanDerWaalsContact O-CB 3.28Å; G12-A16 WeakPolarHBondContact O-CB 3.35Å; G12-A16 PolarHBondContact O-N 2.66Å
13	Q	85.4	Confident	73.8	Confident	84 Å²	84	64.1 Å²	64.1	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-63.2	-47.1	174.1	-71.2	177.4	-15	0	0	112.5	L9 F11 V15 A16 D17 E76	L9-Q13 WeakPolarHBondContact O-CG 3.3Å; L9-Q13 PolarHBondContact O-N 2.7Å; F11-Q13 PolarHBondContact O-N 3.37Å; Q13-V15 PolarHBondContact O-N 3.02Å; Q13-A16 PolarHBondContact O-N 3.38Å; Q13-D17 WeakPolarHBondContact O-CB 3.49Å; Q13-D17 PolarHBondContact O-N 3.17Å; Q13-E76 HydrophobicContact CG-CG 4.18Å
14	V	87.1	Confident	76.7	Confident	54 Å²	54	60.9 Å²	60.9	33%	0.327	30%	0.303	S	S	.	.	H	α-helix	trans	-61.7	-43.4	178.4	172.5	0	0	0	0	111.4	N10 F11 D17 V18 L129	N10-V14 WeakPolarHBondContact O-CG2 3.47Å; N10-V14 PolarHBondContact O-N 3.31Å; N10-V14 VanDerWaalsContact O-N 3.16Å; F11-V14 PolarHBondContact O-N 2.64Å; V14-D17 PolarHBondContact O-N 3.49Å; V14-V18 VanDerWaalsContact O-CG2 3.3Å; V14-V18 WeakPolarHBondContact O-CG2 3.46Å; V14-V18 PolarHBondContact O-N 3.43Å; V14-L129 HydrophobicContact CG1-CD1 4.04Å; V14-L129 HydrophobicContact CG1-CD2 3.74Å
15	V	87	Confident	79.6	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-41.9	177.2	177.4	0	0	0	0	111.1	F11 Q13 V18 L19 Q104 I209	F11-V15 HydrophobicContact CD1-CG2 4.03Å; F11-V15 HydrophobicContact CE1-CG2 3.44Å; F11-V15 VanDerWaalsContact CE1-CG2 3.44Å; F11-V15 HydrophobicContact CZ-CG2 3.8Å; F11-V15 PolarHBondContact O-N 3.21Å; Q13-V15 PolarHBondContact O-N 3.02Å; V15-V18 PolarHBondContact O-N 3.23Å; V15-L19 HydrophobicContact CG1-CD1 3.97Å; V15-L19 HydrophobicContact CG1-CG 4.4Å; V15-L19 WeakPolarHBondContact O-CB 3.48Å; V15-L19 WeakPolarHBondContact O-CG 3.44Å; V15-L19 PolarHBondContact O-N 2.7Å; V15-Q104 HydrophobicContact CG1-CG 4.42Å; V15-I209 HydrophobicContact CG2-CD1 4.05Å
16	A	91.6	Very high	82.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.8	-43	175.9	0	0	0	0	0	111.8	G12 Q13 L19 C20 K72 L75 E76	G12-A16 VanDerWaalsContact O-CB 3.28Å; G12-A16 WeakPolarHBondContact O-CB 3.35Å; G12-A16 PolarHBondContact O-N 2.66Å; Q13-A16 PolarHBondContact O-N 3.38Å; A16-L19 PolarHBondContact O-N 3.22Å; A16-C20 WeakPolarHBondContact O-CB 3.48Å; A16-C20 PolarHBondContact O-N 3.29Å; A16-C20 PolarHBondContact O-SG 2.61Å; A16-C20 VanDerWaalsContact O-SG 3.34Å; A16-K72 HydrophobicContact CB-CG 4.41Å; A16-L75 HydrophobicContact CB-CB 3.77Å; A16-E76 HydrophobicContact CB-CB 4.47Å; A16-E76 HydrophobicContact CB-CG 3.62Å
17	D	92.1	Very high	85	Confident	74 Å²	74	41.2 Å²	41.2	40%	0.396	21%	0.212	S	C	.	.	H	α-helix	trans	-61.5	-47.2	176.6	-78.7	-32.1	0	0	0	112.1	Q13 V14 L19 C20 E21 K72	Q13-D17 WeakPolarHBondContact O-CB 3.49Å; Q13-D17 PolarHBondContact O-N 3.17Å; V14-D17 PolarHBondContact O-N 3.49Å; D17-L19 VanDerWaalsContact C-N 3.32Å; D17-L19 PolarHBondContact O-N 2.8Å; D17-C20 PolarHBondContact O-N 3.47Å; D17-E21 PolarHBondContact O-N 3.39Å; D17-K72 WeakPolarHBondContact OD1-CE 3.26Å; D17-K72 IonicContact OD1-NZ 2.58Å; D17-K72 PolarHBondContact OD1-NZ 3.31Å; D17-K72 IonicContact OD2-NZ 3.86Å
18	V	92.5	Very high	87.3	Confident	36 Å²	36	34.7 Å²	34.7	22%	0.218	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-41.6	177.1	170.7	0	0	0	0	111.1	V14 V15 F22 L129 V132 L136	V14-V18 VanDerWaalsContact O-CG2 3.3Å; V14-V18 WeakPolarHBondContact O-CG2 3.46Å; V14-V18 PolarHBondContact O-N 3.43Å; V15-V18 PolarHBondContact O-N 3.23Å; V18-F22 VanDerWaalsContact O-CB 3.29Å; V18-F22 WeakPolarHBondContact O-CB 3.47Å; V18-F22 PolarHBondContact O-N 3.03Å; V18-L129 HydrophobicContact CG2-CD2 4.36Å; V18-V132 HydrophobicContact CG1-CG1 4.18Å; V18-L136 HydrophobicContact CG1-CD1 3.65Å
19	L	94.8	Very high	89.6	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-68.1	-42.3	177.2	-78.4	174.7	0	0	0	112.3	V15 A16 D17 F22 L23 L75 I102 L210 M212	V15-L19 HydrophobicContact CG1-CD1 3.97Å; V15-L19 HydrophobicContact CG1-CG 4.4Å; V15-L19 WeakPolarHBondContact O-CB 3.48Å; V15-L19 WeakPolarHBondContact O-CG 3.44Å; V15-L19 PolarHBondContact O-N 2.7Å; A16-L19 PolarHBondContact O-N 3.22Å; D17-L19 VanDerWaalsContact C-N 3.32Å; D17-L19 PolarHBondContact O-N 2.8Å; L19-F22 PolarHBondContact O-N 3.46Å; L19-L23 VanDerWaalsContact O-CB 3.31Å; L19-L23 WeakPolarHBondContact O-CB 3.42Å; L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 3.41Å; L19-L75 HydrophobicContact CB-CD1 4.09Å; L19-L75 HydrophobicContact CD1-CD2 4.02Å; L19-I102 HydrophobicContact CD1-CD1 4.49Å; L19-I102 HydrophobicContact CD1-CG2 4Å; L19-L210 HydrophobicContact CD1-CD1 4.03Å; L19-L210 HydrophobicContact CD2-CD1 4.11Å; L19-L210 HydrophobicContact CD2-CD2 3.7Å; L19-L210 HydrophobicContact CG-CD1 4.46Å; L19-L210 HydrophobicContact CG-CD2 4.31Å; L19-M212 HydrophobicContact CD2-SD 4.12Å
20	C	96.4	Very high	91.8	Very high	16 Å²	16	28.1 Å²	28.1	11%	0.108	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-45.9	176.7	-77	0	0	0	0	111.3	A16 D17 F22 L23 E24	A16-C20 WeakPolarHBondContact O-CB 3.48Å; A16-C20 PolarHBondContact O-N 3.29Å; A16-C20 PolarHBondContact O-SG 2.61Å; A16-C20 VanDerWaalsContact O-SG 3.34Å; D17-C20 PolarHBondContact O-N 3.47Å; C20-F22 VanDerWaalsContact C-N 3.31Å; C20-F22 PolarHBondContact O-N 3.05Å; C20-L23 PolarHBondContact O-N 2.83Å; C20-E24 WeakPolarHBondContact O-CB 3.43Å; C20-E24 PolarHBondContact O-N 3.12Å
21	E	96.1	Very high	93.1	Very high	77 Å²	77	23.5 Å²	23.5	36%	0.36	12%	0.123	S	C	.	.	H	α-helix	trans	-60.2	-43.6	175	-176	-178.8	-169.5	0	0	111.1	D17 E24 V25 K47	D17-E21 PolarHBondContact O-N 3.39Å; E21-E24 PolarHBondContact O-N 2.95Å; E21-V25 WeakPolarHBondContact O-CG2 3.37Å; E21-V25 PolarHBondContact O-N 3.35Å; E21-K47 IonicContact OE1-NZ 2.69Å; E21-K47 PolarHBondContact OE1-NZ 3.11Å
22	F	97.5	Very high	94.4	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64	-48	179	168.3	-102.6	0	0	0	112.5	V18 L19 C20 E24 V25 A26 Y48 F100 L136 F139 I140 M212	V18-F22 VanDerWaalsContact O-CB 3.29Å; V18-F22 WeakPolarHBondContact O-CB 3.47Å; V18-F22 PolarHBondContact O-N 3.03Å; L19-F22 PolarHBondContact O-N 3.46Å; C20-F22 VanDerWaalsContact C-N 3.31Å; C20-F22 PolarHBondContact O-N 3.05Å; F22-E24 VanDerWaalsContact C-N 3.29Å; F22-E24 PolarHBondContact O-N 3.41Å; F22-V25 PolarHBondContact O-N 2.97Å; F22-A26 HydrophobicContact CE1-CB 4.39Å; F22-A26 HydrophobicContact CE2-CB 4.49Å; F22-A26 HydrophobicContact CZ-CB 4.22Å; F22-A26 VanDerWaalsContact O-CB 3.29Å; F22-A26 WeakPolarHBondContact O-CB 3.37Å; F22-A26 PolarHBondContact O-N 3.09Å; F22-Y48 WeakPolarHBondContact CA-OH 3.31Å; F22-Y48 WeakPolarHBondContact CB-OH 3.27Å; F22-Y48 HydrophobicContact CD2-CE2 4.12Å; F22-Y48 PolarHBondContact N-OH 2.93Å; F22-F100 AromaticContact CE1-CD1 3.88Å; F22-F100 HydrophobicContact CE1-CD1 3.88Å; F22-F100 AromaticContact CE1-CE1 3.7Å; F22-F100 HydrophobicContact CE1-CE1 3.7Å; F22-F100 AromaticContact CZ-CE1 3.99Å; F22-F100 HydrophobicContact CZ-CE1 3.99Å; F22-L136 HydrophobicContact CB-CD1 4.13Å; F22-L136 HydrophobicContact CB-CD2 4.4Å; F22-L136 HydrophobicContact CD1-CD2 4.05Å; F22-L136 HydrophobicContact CD2-CB 3.9Å; F22-L136 HydrophobicContact CD2-CD1 4.37Å; F22-L136 HydrophobicContact CD2-CD2 3.79Å; F22-L136 HydrophobicContact CD2-CG 4.22Å; F22-L136 HydrophobicContact CE1-CD2 4.31Å; F22-L136 HydrophobicContact CE2-CB 4.21Å; F22-L136 HydrophobicContact CE2-CD2 4.04Å; F22-L136 HydrophobicContact CG-CD1 4.32Å; F22-L136 HydrophobicContact CG-CD2 3.78Å; F22-L136 HydrophobicContact CG-CG 4.45Å; F22-L136 HydrophobicContact CZ-CD2 4.3Å; F22-F139 HydrophobicContact CE2-CB 3.75Å; F22-F139 HydrophobicContact CE2-CG 4.4Å; F22-F139 HydrophobicContact CZ-CB 3.56Å; F22-F139 HydrophobicContact CZ-CD1 4.28Å; F22-F139 AromaticContact CZ-CG 3.94Å; F22-F139 HydrophobicContact CZ-CG 3.94Å; F22-I140 HydrophobicContact CD2-CD1 4.15Å; F22-I140 HydrophobicContact CE2-CD1 3.71Å; F22-I140 HydrophobicContact CE2-CG1 4.12Å; F22-M212 HydrophobicContact CD1-CE 4Å; F22-M212 HydrophobicContact CD1-SD 4.32Å; F22-M212 HydrophobicContact CE1-CE 3.37Å; F22-M212 HydrophobicContact CE1-SD 3.88Å; F22-M212 HydrophobicContact CZ-CE 3.72Å
23	L	98.2	Very high	95.3	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-62.4	-38.6	179.5	-73.2	169.5	0	0	0	110.7	L19 C20 V25 A26 V27 L68 L75 V83 F100	L19-L23 VanDerWaalsContact O-CB 3.31Å; L19-L23 WeakPolarHBondContact O-CB 3.42Å; L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 3.41Å; C20-L23 PolarHBondContact O-N 2.83Å; L23-V25 PolarHBondContact O-N 3.12Å; L23-A26 PolarHBondContact O-N 2.9Å; L23-V27 WeakPolarHBondContact O-CB 3.32Å; L23-V27 WeakPolarHBondContact O-CG2 3.5Å; L23-V27 PolarHBondContact O-N 3.32Å; L23-L68 HydrophobicContact CB-CD1 4.36Å; L23-L68 HydrophobicContact CB-CD2 3.75Å; L23-L68 HydrophobicContact CD1-CD2 4.17Å; L23-L75 HydrophobicContact CD1-CD1 4.5Å; L23-V83 HydrophobicContact CD1-CB 4.43Å; L23-V83 HydrophobicContact CD1-CG1 4.37Å; L23-V83 HydrophobicContact CD1-CG2 4.12Å; L23-V83 HydrophobicContact CD2-CB 4.42Å; L23-V83 HydrophobicContact CD2-CG1 4.35Å; L23-F100 HydrophobicContact CD2-CB 4.19Å; L23-F100 HydrophobicContact CD2-CD1 3.95Å; L23-F100 HydrophobicContact CD2-CD2 3.99Å; L23-F100 HydrophobicContact CD2-CE1 4.3Å; L23-F100 HydrophobicContact CD2-CE2 4.35Å; L23-F100 HydrophobicContact CD2-CG 3.77Å; L23-F100 HydrophobicContact CD2-CZ 4.49Å
24	E	98.3	Very high	95.9	Very high	66 Å²	66	21.4 Å²	21.4	31%	0.308	11%	0.109	S	C	.	.	H	α-helix	trans	-58	-51.3	174.5	-171.7	-171	169.5	0	0	111.1	C20 E21 F22 A26 V27 H28 I64 L68	C20-E24 WeakPolarHBondContact O-CB 3.43Å; C20-E24 PolarHBondContact O-N 3.12Å; E21-E24 PolarHBondContact O-N 2.95Å; F22-E24 VanDerWaalsContact C-N 3.29Å; F22-E24 PolarHBondContact O-N 3.41Å; E24-A26 VanDerWaalsContact C-N 3.33Å; E24-A26 PolarHBondContact O-N 2.92Å; E24-V27 PolarHBondContact O-N 3.29Å; E24-H28 PolarHBondContact O-N 3.44Å; E24-H28 VanDerWaalsContact O-N 3.11Å; E24-H28 PolarHBondContact O-ND1 3.09Å; E24-I64 HydrophobicContact CG-CG2 4.22Å; E24-L68 VanDerWaalsContact CA-CD1 3.42Å; E24-L68 HydrophobicContact CB-CD1 3.52Å; E24-L68 HydrophobicContact CG-CD1 4.2Å
25	V	98.3	Very high	96.4	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-41.1	179.3	176.7	0	0	0	0	111	E21 F22 L23 L29 K47 Y48 V52 M54 I140	E21-V25 WeakPolarHBondContact O-CG2 3.37Å; E21-V25 PolarHBondContact O-N 3.35Å; F22-V25 PolarHBondContact O-N 2.97Å; L23-V25 PolarHBondContact O-N 3.12Å; V25-L29 WeakPolarHBondContact O-CB 2.85Å; V25-L29 PolarHBondContact O-N 3.23Å; V25-K47 HydrophobicContact CG1-CB 4.16Å; V25-K47 HydrophobicContact CG1-CG 4.42Å; V25-K47 HydrophobicContact CG2-CB 4.25Å; V25-K47 HydrophobicContact CG2-CD 4.26Å; V25-K47 HydrophobicContact CG2-CG 3.86Å; V25-Y48 HydrophobicContact CB-CE2 4.46Å; V25-Y48 HydrophobicContact CG2-CE2 4.46Å; V25-V52 HydrophobicContact CG1-CB 4.09Å; V25-V52 HydrophobicContact CG1-CG1 3.75Å; V25-V52 HydrophobicContact CG1-CG2 4.27Å; V25-M54 HydrophobicContact CB-SD 4.44Å; V25-M54 HydrophobicContact CG1-SD 4.3Å; V25-M54 HydrophobicContact CG2-CE 4.33Å; V25-M54 HydrophobicContact CG2-SD 4.22Å; V25-I140 HydrophobicContact CG1-CD1 3.91Å
26	A	98.4	Very high	96.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.4	-43.5	-179.9	0	0	0	0	0	112	F22 L23 E24 L29 I30 F100 I140 I143	F22-A26 HydrophobicContact CE1-CB 4.39Å; F22-A26 HydrophobicContact CE2-CB 4.49Å; F22-A26 HydrophobicContact CZ-CB 4.22Å; F22-A26 VanDerWaalsContact O-CB 3.29Å; F22-A26 WeakPolarHBondContact O-CB 3.37Å; F22-A26 PolarHBondContact O-N 3.09Å; L23-A26 PolarHBondContact O-N 2.9Å; E24-A26 VanDerWaalsContact C-N 3.33Å; E24-A26 PolarHBondContact O-N 2.92Å; A26-L29 PolarHBondContact O-N 3.43Å; A26-I30 WeakPolarHBondContact O-CB 3.42Å; A26-I30 WeakPolarHBondContact O-CD1 3.38Å; A26-I30 WeakPolarHBondContact O-CG1 3.4Å; A26-I30 PolarHBondContact O-N 3.05Å; A26-F100 HydrophobicContact CB-CE1 4.05Å; A26-F100 HydrophobicContact CB-CZ 3.79Å; A26-I140 HydrophobicContact CB-CD1 4.34Å; A26-I143 HydrophobicContact CB-CD1 3.91Å
27	V	98.6	Very high	97.2	Very high	6 Å²	6	30.2 Å²	30.2	4%	0.036	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-51.3	176.3	171.4	0	0	0	0	109.9	L23 E24 L29 I30 L31 I64 V85 F159	L23-V27 WeakPolarHBondContact O-CB 3.32Å; L23-V27 WeakPolarHBondContact O-CG2 3.5Å; L23-V27 PolarHBondContact O-N 3.32Å; E24-V27 PolarHBondContact O-N 3.29Å; V27-L29 VanDerWaalsContact C-N 3.27Å; V27-L29 PolarHBondContact O-N 2.76Å; V27-I30 PolarHBondContact O-N 3.02Å; V27-L31 HydrophobicContact CG1-CD1 4.06Å; V27-L31 HydrophobicContact CG1-CG 4.37Å; V27-L31 VanDerWaalsContact O-CG 3.29Å; V27-L31 WeakPolarHBondContact O-CG 3.46Å; V27-L31 PolarHBondContact O-N 3.16Å; V27-I64 HydrophobicContact CB-CG2 4.41Å; V27-I64 HydrophobicContact CG1-CD1 3.9Å; V27-I64 HydrophobicContact CG1-CG1 4.03Å; V27-I64 HydrophobicContact CG1-CG2 4.17Å; V27-V85 HydrophobicContact CG2-CG2 3.73Å; V27-F159 HydrophobicContact CG1-CE2 4.28Å
28	H	98.6	Very high	97.4	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-56.2	-43.2	177.1	-77.6	98.5	0	0	0	112.6	E24 L31 Y32 F42 Q53 M54 S55 N61	E24-H28 PolarHBondContact O-N 3.44Å; E24-H28 VanDerWaalsContact O-N 3.11Å; E24-H28 PolarHBondContact O-ND1 3.09Å; H28-L31 PolarHBondContact O-N 2.81Å; H28-Y32 PolarHBondContact O-N 2.94Å; H28-Y32 VanDerWaalsContact O-N 3.09Å; H28-F42 WeakPolarHBondContact O-CE1 3.46Å; H28-Q53 WeakPolarHBondContact CB-O 3.46Å; H28-M54 HydrophobicContact CB-CE 4.23Å; H28-M54 HydrophobicContact CB-SD 3.94Å; H28-M54 WeakPolarHBondContact ND1-CE 3.49Å; H28-S55 PolarHBondContact CD2-N 3.25Å; H28-S55 VanDerWaalsContact CD2-N 3.27Å; H28-N61 PolarHBondContact NE2-OD1 3.08Å
29	L	98.3	Very high	97.6	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-68.2	-39.7	179.4	-173.8	63.8	0	0	0	112.1	V25 A26 V27 Y32 V33 Q53 I140 I143	V25-L29 WeakPolarHBondContact O-CB 2.85Å; V25-L29 PolarHBondContact O-N 3.23Å; A26-L29 PolarHBondContact O-N 3.43Å; V27-L29 VanDerWaalsContact C-N 3.27Å; V27-L29 PolarHBondContact O-N 2.76Å; L29-Y32 WeakPolarHBondContact O-CB 3.34Å; L29-Y32 PolarHBondContact O-N 2.86Å; L29-V33 HydrophobicContact CD1-CG1 4.14Å; L29-V33 HydrophobicContact CG-CG1 4.37Å; L29-V33 WeakPolarHBondContact O-CG1 3.39Å; L29-V33 WeakPolarHBondContact O-CG2 3.44Å; L29-V33 PolarHBondContact O-N 2.81Å; L29-Q53 HydrophobicContact CD1-CB 4.34Å; L29-Q53 HydrophobicContact CD1-CG 4.47Å; L29-I140 HydrophobicContact CD2-CG2 3.77Å; L29-I140 WeakPolarHBondContact CD2-O 3.36Å; L29-I143 HydrophobicContact CB-CG2 4.21Å; L29-I143 HydrophobicContact CD2-CB 3.87Å; L29-I143 HydrophobicContact CD2-CG2 3.74Å; L29-I143 HydrophobicContact CG-CB 4.41Å; L29-I143 HydrophobicContact CG-CG2 3.71Å
30	I	98.5	Very high	97.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.3	-49.3	174.1	-71.9	162.2	0	0	0	110.1	A26 V27 Y32 V33 R34 V85 I87 F98 F100 I143	A26-I30 WeakPolarHBondContact O-CB 3.42Å; A26-I30 WeakPolarHBondContact O-CD1 3.38Å; A26-I30 WeakPolarHBondContact O-CG1 3.4Å; A26-I30 PolarHBondContact O-N 3.05Å; V27-I30 PolarHBondContact O-N 3.02Å; I30-Y32 PolarHBondContact O-N 3.28Å; I30-V33 PolarHBondContact O-N 2.76Å; I30-R34 HydrophobicContact CG2-CG 4.21Å; I30-R34 WeakPolarHBondContact O-CB 3.35Å; I30-R34 WeakPolarHBondContact O-CG 3.46Å; I30-R34 PolarHBondContact O-N 2.78Å; I30-V85 HydrophobicContact CD1-CG2 4.28Å; I30-V85 HydrophobicContact CG2-CG1 4.32Å; I30-I87 HydrophobicContact CG2-CD1 4.42Å; I30-F98 HydrophobicContact CD1-CB 3.72Å; I30-F98 HydrophobicContact CD1-CD1 3.7Å; I30-F98 HydrophobicContact CD1-CD2 4.39Å; I30-F98 HydrophobicContact CD1-CE1 4.45Å; I30-F98 HydrophobicContact CD1-CG 3.68Å; I30-F98 HydrophobicContact CG1-CD1 3.83Å; I30-F98 HydrophobicContact CG1-CE1 4.08Å; I30-F98 HydrophobicContact CG1-CG 4.1Å; I30-F98 HydrophobicContact CG2-CD1 4.43Å; I30-F98 HydrophobicContact CG2-CD2 3.74Å; I30-F98 HydrophobicContact CG2-CE1 4.42Å; I30-F98 HydrophobicContact CG2-CE2 3.75Å; I30-F98 HydrophobicContact CG2-CG 4.11Å; I30-F98 HydrophobicContact CG2-CZ 4.11Å; I30-F100 HydrophobicContact CD1-CE2 3.99Å; I30-F100 HydrophobicContact CD1-CZ 3.86Å; I30-I143 HydrophobicContact CG1-CD1 4.42Å; I30-I143 HydrophobicContact CG1-CG2 3.79Å
31	L	98.4	Very high	97.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-33.5	179.7	-65.2	177.5	0	0	0	112.5	V27 H28 E35 V36 Y37 F42 L60 I64 F159	V27-L31 HydrophobicContact CG1-CD1 4.06Å; V27-L31 HydrophobicContact CG1-CG 4.37Å; V27-L31 VanDerWaalsContact O-CG 3.29Å; V27-L31 WeakPolarHBondContact O-CG 3.46Å; V27-L31 PolarHBondContact O-N 3.16Å; H28-L31 PolarHBondContact O-N 2.81Å; L31-E35 PolarHBondContact O-N 3.27Å; L31-V36 HydrophobicContact CD2-CB 3.84Å; L31-V36 HydrophobicContact CD2-CG1 3.91Å; L31-V36 HydrophobicContact CD2-CG2 4.01Å; L31-V36 PolarHBondContact O-N 3.09Å; L31-V36 VanDerWaalsContact O-N 3.08Å; L31-Y37 HydrophobicContact CB-CD2 4.25Å; L31-Y37 HydrophobicContact CD1-CD2 4.15Å; L31-Y37 HydrophobicContact CD1-CE2 4.03Å; L31-Y37 HydrophobicContact CD2-CD2 4.35Å; L31-Y37 HydrophobicContact CD2-CE2 4.22Å; L31-Y37 HydrophobicContact CG-CD2 4.48Å; L31-F42 HydrophobicContact CB-CE1 4.45Å; L31-F42 HydrophobicContact CB-CZ 3.98Å; L31-L60 HydrophobicContact CD1-CD1 4.14Å; L31-L60 HydrophobicContact CD1-CD2 4.35Å; L31-I64 HydrophobicContact CD1-CD1 3.94Å; L31-F159 HydrophobicContact CD1-CD1 4.32Å; L31-F159 HydrophobicContact CD1-CE1 3.9Å; L31-F159 HydrophobicContact CD1-CE2 4.37Å; L31-F159 HydrophobicContact CD1-CZ 3.92Å; L31-F159 HydrophobicContact CD2-CB 3.96Å; L31-F159 HydrophobicContact CD2-CD1 3.54Å; L31-F159 HydrophobicContact CD2-CD2 4.03Å; L31-F159 HydrophobicContact CD2-CE1 4Å; L31-F159 HydrophobicContact CD2-CE2 4.42Å; L31-F159 HydrophobicContact CD2-CG 3.56Å; L31-F159 HydrophobicContact CD2-CZ 4.41Å
32	Y	98.3	Very high	97.9	Very high	70 Å²	70	35.4 Å²	35.4	28%	0.275	20%	0.197	S	C	.	.	H	α-helix	trans	-71.4	-55.5	174.3	175	-94.2	0	0	0	112.5	H28 L29 I30 R34 E35 V39 F42 Q53	H28-Y32 PolarHBondContact O-N 2.94Å; H28-Y32 VanDerWaalsContact O-N 3.09Å; L29-Y32 WeakPolarHBondContact O-CB 3.34Å; L29-Y32 PolarHBondContact O-N 2.86Å; I30-Y32 PolarHBondContact O-N 3.28Å; Y32-R34 VanDerWaalsContact C-N 3.27Å; Y32-R34 PolarHBondContact O-N 2.91Å; Y32-E35 PolarHBondContact O-N 3.01Å; Y32-E35 VanDerWaalsContact O-N 3.16Å; Y32-V39 HydrophobicContact CD2-CG1 4.45Å; Y32-V39 HydrophobicContact CE2-CB 4.17Å; Y32-V39 HydrophobicContact CE2-CG1 3.93Å; Y32-F42 HydrophobicContact CD2-CB 3.73Å; Y32-F42 HydrophobicContact CD2-CD1 4.23Å; Y32-F42 AromaticContact CD2-CD2 3.73Å; Y32-F42 HydrophobicContact CD2-CD2 3.73Å; Y32-F42 HydrophobicContact CD2-CE2 4.36Å; Y32-F42 AromaticContact CD2-CG 3.65Å; Y32-F42 HydrophobicContact CD2-CG 3.65Å; Y32-F42 HydrophobicContact CE2-CB 4.22Å; Y32-F42 HydrophobicContact CG-CG 4.37Å; Y32-Q53 HydrophobicContact CD1-CB 3.89Å; Y32-Q53 HydrophobicContact CD1-CG 3.56Å; Y32-Q53 HydrophobicContact CD2-CB 3.8Å; Y32-Q53 HydrophobicContact CD2-CG 3.88Å; Y32-Q53 HydrophobicContact CE1-CB 4.37Å; Y32-Q53 HydrophobicContact CE1-CG 3.57Å; Y32-Q53 HydrophobicContact CE2-CB 4.28Å; Y32-Q53 HydrophobicContact CE2-CG 3.87Å; Y32-Q53 HydrophobicContact CG-CB 3.56Å; Y32-Q53 HydrophobicContact CG-CG 3.71Å; Y32-Q53 PolarHBondContact OH-NE2 3.3Å
33	V	97.6	Very high	97.9	Very high	24 Å²	24	40.1 Å²	40.1	15%	0.145	22%	0.219	C	C	.	.	H	α-helix	trans	-71.2	-22.9	-173.6	-59.3	0	0	0	0	113.1	L29 I30 I143	L29-V33 HydrophobicContact CD1-CG1 4.14Å; L29-V33 HydrophobicContact CG-CG1 4.37Å; L29-V33 WeakPolarHBondContact O-CG1 3.39Å; L29-V33 WeakPolarHBondContact O-CG2 3.44Å; L29-V33 PolarHBondContact O-N 2.81Å; I30-V33 PolarHBondContact O-N 2.76Å; V33-I143 HydrophobicContact CG2-CG2 4.16Å
34	R	97.6	Very high	97.9	Very high	14 Å²	14	47.1 Å²	47.1	5%	0.053	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	7	175.9	-54.7	-48.6	-65.8	151.9	0.5	113.1	I30 Y32 V36 I87 E96 F98 D151 N153	I30-R34 HydrophobicContact CG2-CG 4.21Å; I30-R34 WeakPolarHBondContact O-CB 3.35Å; I30-R34 WeakPolarHBondContact O-CG 3.46Å; I30-R34 PolarHBondContact O-N 2.78Å; Y32-R34 VanDerWaalsContact C-N 3.27Å; Y32-R34 PolarHBondContact O-N 2.91Å; R34-V36 HydrophobicContact CB-CG2 4.2Å; R34-V36 PolarHBondContact O-N 3.45Å; R34-V36 VanDerWaalsContact O-N 3.12Å; R34-I87 HydrophobicContact CB-CD1 3.64Å; R34-I87 HydrophobicContact CG-CD1 3.8Å; R34-E96 IonicContact CZ-OE1 2.93Å; R34-E96 IonicContact CZ-OE2 3.38Å; R34-E96 IonicContact NE-OE1 3.88Å; R34-E96 PolarHBondContact NE-OE1 3.18Å; R34-E96 IonicContact NE-OE2 3.77Å; R34-E96 PolarHBondContact NE-OE2 2.77Å; R34-E96 IonicContact NH2-OE1 2.87Å; R34-E96 PolarHBondContact NH2-OE1 3.46Å; R34-E96 IonicContact NH2-OE2 2.64Å; R34-E96 PolarHBondContact NH2-OE2 2.84Å; R34-F98 HydrophobicContact CG-CE2 3.95Å; R34-F98 HydrophobicContact CG-CZ 3.78Å; R34-D151 PolarHBondContact NH2-O 2.83Å; R34-N153 PolarHBondContact NH2-OD1 2.88Å
35	E	97.2	Very high	97.8	Very high	149 Å²	149	50.2 Å²	50.2	70%	0.696	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	33.1	174.7	-56	-175.2	123.1	0	0	113.8	L31 Y32 Y37	L31-E35 PolarHBondContact O-N 3.27Å; Y32-E35 PolarHBondContact O-N 3.01Å; Y32-E35 VanDerWaalsContact O-N 3.16Å; E35-Y37 PolarHBondContact O-N 2.95Å
36	V	97.9	Very high	97.7	Very high	16 Å²	16	57 Å²	57	10%	0.097	29%	0.288	C	S	.	.	S	Bend	trans	-67	-32.4	177.1	-177.6	0	0	0	0	110.4	L31 R34 I87 F159	L31-V36 HydrophobicContact CD2-CB 3.84Å; L31-V36 HydrophobicContact CD2-CG1 3.91Å; L31-V36 HydrophobicContact CD2-CG2 4.01Å; L31-V36 PolarHBondContact O-N 3.09Å; L31-V36 VanDerWaalsContact O-N 3.08Å; R34-V36 HydrophobicContact CB-CG2 4.2Å; R34-V36 PolarHBondContact O-N 3.45Å; R34-V36 VanDerWaalsContact O-N 3.12Å; V36-I87 HydrophobicContact CG2-CD1 3.95Å; V36-I87 HydrophobicContact CG2-CG1 4.37Å; V36-I87 HydrophobicContact CG2-CG2 4.31Å; V36-F159 HydrophobicContact CG1-CB 4.43Å; V36-F159 HydrophobicContact CG1-CD1 4.39Å
37	Y	97.9	Very high	97.5	Very high	78 Å²	78	60.5 Å²	60.5	31%	0.306	30%	0.303	S	S	.	.	S	Bend	trans	-124.9	153.7	172.2	-67.9	-82.5	0	0	0	111.2	L31 E35 V39 I41 L60 F159	L31-Y37 HydrophobicContact CB-CD2 4.25Å; L31-Y37 HydrophobicContact CD1-CD2 4.15Å; L31-Y37 HydrophobicContact CD1-CE2 4.03Å; L31-Y37 HydrophobicContact CD2-CD2 4.35Å; L31-Y37 HydrophobicContact CD2-CE2 4.22Å; L31-Y37 HydrophobicContact CG-CD2 4.48Å; E35-Y37 PolarHBondContact O-N 2.95Å; Y37-V39 PolarHBondContact O-N 2.82Å; Y37-I41 HydrophobicContact CD1-CD1 4.27Å; Y37-I41 HydrophobicContact CG-CD1 4.04Å; Y37-L60 HydrophobicContact CD1-CD2 4.39Å; Y37-L60 HydrophobicContact CD2-CD1 4.47Å; Y37-L60 HydrophobicContact CD2-CD2 3.71Å; Y37-L60 HydrophobicContact CE1-CD2 4.43Å; Y37-L60 HydrophobicContact CE2-CD1 3.69Å; Y37-L60 HydrophobicContact CE2-CD2 3.75Å; Y37-L60 HydrophobicContact CE2-CG 4.39Å; Y37-L60 HydrophobicContact CG-CD2 4.04Å; Y37-F159 AromaticContact CE2-CD1 3.84Å; Y37-F159 HydrophobicContact CE2-CD1 3.84Å; Y37-F159 AromaticContact CE2-CE1 3.68Å; Y37-F159 HydrophobicContact CE2-CE1 3.68Å; Y37-F159 WeakPolarHBondContact OH-CE1 3.32Å
38	P	97	Very high	97.2	Very high	93 Å²	93	61 Å²	61	60%	0.604	30%	0.304	S	S	*	.			trans	-59.1	137.2	179.6	-23.4	33.3	0	0	0	112.7	G40 I41	P38-G40 PolarHBondContact O-N 3.15Å; P38-I41 WeakPolarHBondContact O-CG1 3.26Å; P38-I41 PolarHBondContact O-N 3.06Å; P38-I41 VanDerWaalsContact O-N 3.09Å
39	V	96.1	Very high	96.9	Very high	84 Å²	84	65.5 Å²	65.5	51%	0.509	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-54.7	-24.9	179.8	-62.4	0	0	0	0	114.1	Y32 Y37 I41 F42	Y32-V39 HydrophobicContact CD2-CG1 4.45Å; Y32-V39 HydrophobicContact CE2-CB 4.17Å; Y32-V39 HydrophobicContact CE2-CG1 3.93Å; Y37-V39 PolarHBondContact O-N 2.82Å; V39-I41 PolarHBondContact O-N 2.85Å; V39-F42 PolarHBondContact O-N 2.89Å; V39-F42 VanDerWaalsContact O-N 3.1Å
40	G	97.1	Very high	96.8	Very high	74 Å²	74	65.9 Å²	65.9	76%	0.763	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-65.3	-18.5	179.8	0	0	0	0	0	115.1	P38	P38-G40 PolarHBondContact O-N 3.15Å
41	I	97.5	Very high	96.6	Very high	41 Å²	41	69.4 Å²	69.4	21%	0.21	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-87.9	-5.9	174.7	73.1	161.7	0	0	0	113	Y37 P38 V39 S55 C56 H57 L60	Y37-I41 HydrophobicContact CD1-CD1 4.27Å; Y37-I41 HydrophobicContact CG-CD1 4.04Å; P38-I41 WeakPolarHBondContact O-CG1 3.26Å; P38-I41 PolarHBondContact O-N 3.06Å; P38-I41 VanDerWaalsContact O-N 3.09Å; V39-I41 PolarHBondContact O-N 2.85Å; I41-S55 CarbonylContact O-C 3.54Å; I41-S55 WeakPolarHBondContact O-CA 3.46Å; I41-C56 PolarHBondContact O-N 3.3Å; I41-H57 HydrophobicContact CB-CB 4.47Å; I41-H57 HydrophobicContact CD1-CB 3.97Å; I41-L60 HydrophobicContact CD1-CD2 3.8Å
42	F	98.2	Very high	96.6	Very high	21 Å²	21	69.5 Å²	69.5	9%	0.092	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.5	-176.8	-66.2	-89.7	0	0	0	112	H28 L31 Y32 V39 Q53 M54	H28-F42 WeakPolarHBondContact O-CE1 3.46Å; L31-F42 HydrophobicContact CB-CE1 4.45Å; L31-F42 HydrophobicContact CB-CZ 3.98Å; Y32-F42 HydrophobicContact CD2-CB 3.73Å; Y32-F42 HydrophobicContact CD2-CD1 4.23Å; Y32-F42 AromaticContact CD2-CD2 3.73Å; Y32-F42 HydrophobicContact CD2-CD2 3.73Å; Y32-F42 HydrophobicContact CD2-CE2 4.36Å; Y32-F42 AromaticContact CD2-CG 3.65Å; Y32-F42 HydrophobicContact CD2-CG 3.65Å; Y32-F42 HydrophobicContact CE2-CB 4.22Å; Y32-F42 HydrophobicContact CG-CG 4.37Å; V39-F42 PolarHBondContact O-N 2.89Å; V39-F42 VanDerWaalsContact O-N 3.1Å; F42-Q53 HydrophobicContact CB-CB 4.27Å; F42-Q53 HydrophobicContact CD1-CB 4.32Å; F42-M54 CarbonylContact C-O 3.59Å; F42-M54 WeakPolarHBondContact CA-O 3.12Å
43	Q	97.9	Very high	96.6	Very high	98 Å²	98	67.8 Å²	67.8	46%	0.458	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.9	175.2	-173.1	-179.8	49.8	0	0	110.4	R45 M54 C56	Q43-R45 PolarHBondContact O-N 2.87Å; Q43-M54 PolarHBondContact N-O 3.38Å; Q43-M54 PolarHBondContact O-N 3.31Å; Q43-C56 VanDerWaalsContact CB-SG 3.59Å
44	K	97.4	Very high	96.6	Very high	149 Å²	149	67.2 Å²	67.2	65%	0.648	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	122	174.5	-171	175.2	-177.3	173.9	0	110	V52 Q53	K44-V52 CarbonylContact C-O 3.57Å; K44-V52 WeakPolarHBondContact CA-O 3.33Å; K44-Q53 VanDerWaalsContact N-OE1 3.15Å
45	R	96.8	Very high	96.6	Very high	131 Å²	131	66.6 Å²	66.6	49%	0.494	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	176.9	174.6	-65.1	-166.9	177.5	-176.9	-1.1	110.2	Q43 P51 V52 M54	Q43-R45 PolarHBondContact O-N 2.87Å; R45-P51 WeakPolarHBondContact O-CA 3.22Å; R45-V52 HydrophobicContact CB-CG2 4.07Å; R45-V52 PolarHBondContact N-O 3.35Å; R45-V52 PolarHBondContact O-N 3.05Å; R45-M54 HydrophobicContact CB-CG 4.1Å; R45-M54 HydrophobicContact CG-CB 4.37Å; R45-M54 HydrophobicContact CG-CG 4.19Å
46	K	96.2	Very high	96.6	Very high	144 Å²	144	62.6 Å²	62.6	63%	0.626	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.3	176.1	-171.4	175.4	176.4	-178.9	0	109.1	N49 V50	K46-N49 WeakPolarHBondContact CE-OD1 3.5Å; K46-N49 PolarHBondContact NZ-OD1 3.38Å; K46-V50 WeakPolarHBondContact CA-O 3.38Å
47	K	93.5	Very high	96.6	Very high	72 Å²	72	65.4 Å²	65.4	31%	0.313	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	143.6	175	-76.5	-71.1	-164.2	168.2	0	108.2	E21 V25 N49 V50 V52	E21-K47 IonicContact OE1-NZ 2.69Å; E21-K47 PolarHBondContact OE1-NZ 3.11Å; V25-K47 HydrophobicContact CG1-CB 4.16Å; V25-K47 HydrophobicContact CG1-CG 4.42Å; V25-K47 HydrophobicContact CG2-CB 4.25Å; V25-K47 HydrophobicContact CG2-CD 4.26Å; V25-K47 HydrophobicContact CG2-CG 3.86Å; K47-N49 PolarHBondContact O-N 3.06Å; K47-N49 VanDerWaalsContact O-N 3.1Å; K47-V50 PolarHBondContact N-O 2.97Å; K47-V50 WeakPolarHBondContact O-CG2 3.35Å; K47-V50 PolarHBondContact O-N 2.77Å; K47-V52 HydrophobicContact CB-CG1 4.09Å; K47-V52 HydrophobicContact CB-CG2 3.82Å; K47-V52 HydrophobicContact CG-CG2 3.84Å
48	Y	92.9	Very high	96.6	Very high	16 Å²	16	66.4 Å²	66.4	6%	0.063	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	36.3	-176.4	-50.6	-61.6	0	0	0	113.1	F22 V25 V50 E133 L136 R137 I140	F22-Y48 WeakPolarHBondContact CA-OH 3.31Å; F22-Y48 WeakPolarHBondContact CB-OH 3.27Å; F22-Y48 HydrophobicContact CD2-CE2 4.12Å; F22-Y48 PolarHBondContact N-OH 2.93Å; V25-Y48 HydrophobicContact CB-CE2 4.46Å; V25-Y48 HydrophobicContact CG2-CE2 4.46Å; Y48-V50 PolarHBondContact O-N 3.42Å; Y48-V50 VanDerWaalsContact O-N 3.09Å; Y48-E133 WeakPolarHBondContact CA-OE1 3.46Å; Y48-E133 HydrophobicContact CD1-CG 3.36Å; Y48-E133 HydrophobicContact CE1-CG 3.94Å; Y48-E133 HydrophobicContact CG-CG 4.42Å; Y48-L136 HydrophobicContact CE1-CD1 4.45Å; Y48-R137 WeakPolarHBondContact O-CD 3.31Å; Y48-R137 WeakPolarHBondContact O-CG 3.36Å; Y48-R137 PolarHBondContact O-NE 2.71Å; Y48-R137 PolarHBondContact O-NH2 3.42Å; Y48-I140 HydrophobicContact CD2-CG1 3.94Å; Y48-I140 HydrophobicContact CE2-CG1 4.44Å
49	N	93.1	Very high	96.6	Very high	97 Å²	97	69.1 Å²	69.1	52%	0.519	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	17.9	-173.6	-158.9	40.6	0	0	0	116.2	K46 K47	K46-N49 WeakPolarHBondContact CE-OD1 3.5Å; K46-N49 PolarHBondContact NZ-OD1 3.38Å; K47-N49 PolarHBondContact O-N 3.06Å; K47-N49 VanDerWaalsContact O-N 3.1Å
50	V	95.2	Very high	96.7	Very high	12 Å²	12	65.5 Å²	65.5	7%	0.073	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153.9	176.3	-68.7	0	0	0	0	111.1	K46 K47 Y48 V52 R137 I140 L141	K46-V50 WeakPolarHBondContact CA-O 3.38Å; K47-V50 PolarHBondContact N-O 2.97Å; K47-V50 WeakPolarHBondContact O-CG2 3.35Å; K47-V50 PolarHBondContact O-N 2.77Å; Y48-V50 PolarHBondContact O-N 3.42Å; Y48-V50 VanDerWaalsContact O-N 3.09Å; V50-V52 HydrophobicContact CG2-CG1 4.5Å; V50-R137 HydrophobicContact CB-CG 4.39Å; V50-R137 HydrophobicContact CG1-CG 3.43Å; V50-R137 VanDerWaalsContact CG1-CG 3.43Å; V50-R137 HydrophobicContact CG2-CG 4.05Å; V50-I140 HydrophobicContact CG2-CB 4.14Å; V50-I140 HydrophobicContact CG2-CG2 3.64Å; V50-L141 HydrophobicContact CB-CD2 4.24Å; V50-L141 HydrophobicContact CG1-CD1 4.32Å; V50-L141 HydrophobicContact CG1-CD2 3.84Å; V50-L141 HydrophobicContact CG1-CG 4.1Å
51	P	95.8	Very high	96.7	Very high	74 Å²	74	64 Å²	64	48%	0.481	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	135.8	174.8	28.8	-34.2	0	0	0	110.4	R45	R45-P51 WeakPolarHBondContact O-CA 3.22Å
52	V	97.1	Very high	96.7	Very high	2 Å²	2	66.5 Å²	66.5	1%	0.012	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	162.2	175.4	-61.5	0	0	0	0	109.9	V25 K44 R45 K47 V50 M54 I140	V25-V52 HydrophobicContact CG1-CB 4.09Å; V25-V52 HydrophobicContact CG1-CG1 3.75Å; V25-V52 HydrophobicContact CG1-CG2 4.27Å; K44-V52 CarbonylContact C-O 3.57Å; K44-V52 WeakPolarHBondContact CA-O 3.33Å; R45-V52 HydrophobicContact CB-CG2 4.07Å; R45-V52 PolarHBondContact N-O 3.35Å; R45-V52 PolarHBondContact O-N 3.05Å; K47-V52 HydrophobicContact CB-CG1 4.09Å; K47-V52 HydrophobicContact CB-CG2 3.82Å; K47-V52 HydrophobicContact CG-CG2 3.84Å; V50-V52 HydrophobicContact CG2-CG1 4.5Å; V52-M54 HydrophobicContact CG2-CG 4.06Å; V52-M54 HydrophobicContact CG2-SD 4.18Å; V52-I140 HydrophobicContact CG1-CG2 3.52Å
53	Q	97.9	Very high	96.7	Very high	35 Å²	35	69.2 Å²	69.2	16%	0.164	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.5	176.2	-62.5	-72.6	9	0	0	108.1	H28 L29 Y32 F42 K44	H28-Q53 WeakPolarHBondContact CB-O 3.46Å; L29-Q53 HydrophobicContact CD1-CB 4.34Å; L29-Q53 HydrophobicContact CD1-CG 4.47Å; Y32-Q53 HydrophobicContact CD1-CB 3.89Å; Y32-Q53 HydrophobicContact CD1-CG 3.56Å; Y32-Q53 HydrophobicContact CD2-CB 3.8Å; Y32-Q53 HydrophobicContact CD2-CG 3.88Å; Y32-Q53 HydrophobicContact CE1-CB 4.37Å; Y32-Q53 HydrophobicContact CE1-CG 3.57Å; Y32-Q53 HydrophobicContact CE2-CB 4.28Å; Y32-Q53 HydrophobicContact CE2-CG 3.87Å; Y32-Q53 HydrophobicContact CG-CB 3.56Å; Y32-Q53 HydrophobicContact CG-CG 3.71Å; Y32-Q53 PolarHBondContact OH-NE2 3.3Å; F42-Q53 HydrophobicContact CB-CB 4.27Å; F42-Q53 HydrophobicContact CD1-CB 4.32Å; K44-Q53 VanDerWaalsContact N-OE1 3.15Å
54	M	98	Very high	96.7	Very high	11 Å²	11	64.7 Å²	64.7	5%	0.054	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.5	-178.2	-59.6	-62.1	-64.2	0	0	109	V25 H28 F42 Q43 R45 V52	V25-M54 HydrophobicContact CB-SD 4.44Å; V25-M54 HydrophobicContact CG1-SD 4.3Å; V25-M54 HydrophobicContact CG2-CE 4.33Å; V25-M54 HydrophobicContact CG2-SD 4.22Å; H28-M54 HydrophobicContact CB-CE 4.23Å; H28-M54 HydrophobicContact CB-SD 3.94Å; H28-M54 WeakPolarHBondContact ND1-CE 3.49Å; F42-M54 CarbonylContact C-O 3.59Å; F42-M54 WeakPolarHBondContact CA-O 3.12Å; Q43-M54 PolarHBondContact N-O 3.38Å; Q43-M54 PolarHBondContact O-N 3.31Å; R45-M54 HydrophobicContact CB-CG 4.1Å; R45-M54 HydrophobicContact CG-CB 4.37Å; R45-M54 HydrophobicContact CG-CG 4.19Å; V52-M54 HydrophobicContact CG2-CG 4.06Å; V52-M54 HydrophobicContact CG2-SD 4.18Å
55	S	98.1	Very high	96.6	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.014	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	145.3	178	160.9	0	0	0	0	110.6	H28 I41 H57 N61	H28-S55 PolarHBondContact CD2-N 3.25Å; H28-S55 VanDerWaalsContact CD2-N 3.27Å; I41-S55 CarbonylContact O-C 3.54Å; I41-S55 WeakPolarHBondContact O-CA 3.46Å; S55-H57 PolarHBondContact OG-N 2.98Å; S55-N61 WeakPolarHBondContact CB-OD1 3.34Å; S55-N61 PolarHBondContact O-ND2 2.92Å; S55-N61 PolarHBondContact O-OD1 3.33Å; S55-N61 PolarHBondContact OG-OD1 2.65Å
56	C	97.1	Very high	96.6	Very high	64 Å²	64	58.1 Å²	58.1	43%	0.432	29%	0.293	S	S	.	.			trans	-105.5	0.9	169.3	-65.7	0	0	0	0	112.2	I41 Q43 P58	I41-C56 PolarHBondContact O-N 3.3Å; Q43-C56 VanDerWaalsContact CB-SG 3.59Å; C56-P58 WeakPolarHBondContact O-CD 3.5Å
57	H	97.9	Very high	96.6	Very high	75 Å²	75	51.5 Å²	51.5	35%	0.347	27%	0.265	S	S	.	.			trans	-77.4	115	178.6	-169.8	-89.7	0	0	0	110.7	I41 S55 E59 L60 N61	I41-H57 HydrophobicContact CB-CB 4.47Å; I41-H57 HydrophobicContact CD1-CB 3.97Å; S55-H57 PolarHBondContact OG-N 2.98Å; H57-E59 IonicContact CE1-OE2 3.54Å; H57-E59 PolarHBondContact O-N 3.16Å; H57-L60 HydrophobicContact CB-CB 4.05Å; H57-L60 PolarHBondContact ND1-N 3.34Å; H57-L60 PolarHBondContact O-N 3.08Å; H57-N61 PolarHBondContact O-N 2.86Å; H57-N61 PolarHBondContact O-OD1 3.01Å; H57-N61 VanDerWaalsContact O-OD1 3.14Å
58	P	97.6	Very high	96.7	Very high	99 Å²	99	48.7 Å²	48.7	64%	0.643	25%	0.253	S	S	*	.	H	α-helix	trans	-57.7	-44.7	-171.2	-26.8	35.7	0	0	0	114	C56 L60 N61 Q62	C56-P58 WeakPolarHBondContact O-CD 3.5Å; P58-L60 VanDerWaalsContact C-N 3.35Å; P58-L60 PolarHBondContact O-N 3.17Å; P58-N61 PolarHBondContact O-N 3.04Å; P58-Q62 WeakPolarHBondContact O-CB 3.43Å; P58-Q62 PolarHBondContact O-N 3.17Å
59	E	97.6	Very high	96.7	Very high	151 Å²	151	52.7 Å²	52.7	71%	0.706	27%	0.272	S	S	*	.	H	α-helix	trans	-70.5	-32.4	-176.8	-56.3	178.4	168.7	0	0	112.4	H57 Y63	H57-E59 IonicContact CE1-OE2 3.54Å; H57-E59 PolarHBondContact O-N 3.16Å; E59-Y63 WeakPolarHBondContact O-CB 3.48Å; E59-Y63 PolarHBondContact O-N 2.89Å
60	L	97.8	Very high	96.7	Very high	7 Å²	7	48.1 Å²	48.1	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-70.8	-44.4	177.1	176	57.7	0	0	0	109.8	L31 Y37 I41 H57 P58 Q62 Y63 I64 F159	L31-L60 HydrophobicContact CD1-CD1 4.14Å; L31-L60 HydrophobicContact CD1-CD2 4.35Å; Y37-L60 HydrophobicContact CD1-CD2 4.39Å; Y37-L60 HydrophobicContact CD2-CD1 4.47Å; Y37-L60 HydrophobicContact CD2-CD2 3.71Å; Y37-L60 HydrophobicContact CE1-CD2 4.43Å; Y37-L60 HydrophobicContact CE2-CD1 3.69Å; Y37-L60 HydrophobicContact CE2-CD2 3.75Å; Y37-L60 HydrophobicContact CE2-CG 4.39Å; Y37-L60 HydrophobicContact CG-CD2 4.04Å; I41-L60 HydrophobicContact CD1-CD2 3.8Å; H57-L60 HydrophobicContact CB-CB 4.05Å; H57-L60 PolarHBondContact ND1-N 3.34Å; H57-L60 PolarHBondContact O-N 3.08Å; P58-L60 VanDerWaalsContact C-N 3.35Å; P58-L60 PolarHBondContact O-N 3.17Å; L60-Q62 VanDerWaalsContact C-N 3.31Å; L60-Q62 PolarHBondContact O-N 2.85Å; L60-Y63 PolarHBondContact O-N 2.93Å; L60-I64 HydrophobicContact CD1-CD1 3.9Å; L60-I64 HydrophobicContact CD1-CG1 4.27Å; L60-I64 HydrophobicContact CG-CD1 3.99Å; L60-I64 WeakPolarHBondContact O-CG1 3.29Å; L60-I64 PolarHBondContact O-N 3.3Å; L60-F159 HydrophobicContact CD1-CE1 3.75Å; L60-F159 HydrophobicContact CD1-CZ 3.95Å
61	N	97.6	Very high	96.6	Very high	44 Å²	44	47.5 Å²	47.5	24%	0.235	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-43.4	177.9	-64.6	6.2	0	0	0	110.6	H28 S55 H57 P58 I64 Q65	H28-N61 PolarHBondContact NE2-OD1 3.08Å; S55-N61 WeakPolarHBondContact CB-OD1 3.34Å; S55-N61 PolarHBondContact O-ND2 2.92Å; S55-N61 PolarHBondContact O-OD1 3.33Å; S55-N61 PolarHBondContact OG-OD1 2.65Å; H57-N61 PolarHBondContact O-N 2.86Å; H57-N61 PolarHBondContact O-OD1 3.01Å; H57-N61 VanDerWaalsContact O-OD1 3.14Å; P58-N61 PolarHBondContact O-N 3.04Å; N61-I64 PolarHBondContact O-N 3.11Å; N61-Q65 VanDerWaalsContact O-CB 3.25Å; N61-Q65 WeakPolarHBondContact O-CB 3.15Å; N61-Q65 PolarHBondContact O-N 3.32Å
62	Q	97.3	Very high	96.5	Very high	92 Å²	92	46.7 Å²	46.7	43%	0.43	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-46.3	176.6	-170.5	61.6	53.2	0	0	111.4	P58 L60 I64 Q65 D66	P58-Q62 WeakPolarHBondContact O-CB 3.43Å; P58-Q62 PolarHBondContact O-N 3.17Å; L60-Q62 VanDerWaalsContact C-N 3.31Å; L60-Q62 PolarHBondContact O-N 2.85Å; Q62-I64 PolarHBondContact O-N 2.95Å; Q62-Q65 PolarHBondContact O-N 3.27Å; Q62-D66 WeakPolarHBondContact CG-OD2 3.49Å; Q62-D66 PolarHBondContact NE2-OD1 2.74Å; Q62-D66 PolarHBondContact NE2-OD2 2.87Å; Q62-D66 WeakPolarHBondContact O-CB 3.47Å; Q62-D66 VanDerWaalsContact O-CG 3.26Å; Q62-D66 PolarHBondContact O-N 3.28Å
63	Y	97.9	Very high	96.2	Very high	78 Å²	78	47.9 Å²	47.9	31%	0.306	24%	0.241	S	C	.	.	H	α-helix	trans	-57.9	-47	176.9	175.8	-92	0	0	0	112.6	E59 L60 Q65 T67 F159 F182	E59-Y63 WeakPolarHBondContact O-CB 3.48Å; E59-Y63 PolarHBondContact O-N 2.89Å; L60-Y63 PolarHBondContact O-N 2.93Å; Y63-Q65 VanDerWaalsContact C-N 3.35Å; Y63-T67 WeakPolarHBondContact O-CB 3.5Å; Y63-T67 PolarHBondContact O-N 3.29Å; Y63-T67 PolarHBondContact O-OG1 3.03Å; Y63-F159 HydrophobicContact CD1-CE2 4.37Å; Y63-F159 AromaticContact CD1-CZ 3.76Å; Y63-F159 HydrophobicContact CD1-CZ 3.76Å; Y63-F159 HydrophobicContact CE1-CE1 4.44Å; Y63-F159 AromaticContact CE1-CE2 3.86Å; Y63-F159 HydrophobicContact CE1-CE2 3.86Å; Y63-F159 AromaticContact CE1-CZ 3.62Å; Y63-F159 HydrophobicContact CE1-CZ 3.62Å; Y63-F182 AromaticContact CD2-CE2 3.71Å; Y63-F182 HydrophobicContact CD2-CE2 3.71Å; Y63-F182 HydrophobicContact CD2-CZ 4.07Å; Y63-F182 AromaticContact CE2-CE2 3.82Å; Y63-F182 HydrophobicContact CE2-CE2 3.82Å; Y63-F182 AromaticContact CE2-CZ 3.83Å; Y63-F182 HydrophobicContact CE2-CZ 3.83Å
64	I	97.8	Very high	95.8	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-64.7	-42.8	178.6	-64.6	165.6	0	0	0	110.2	E24 V27 L31 L60 N61 Q62 T67 L68 F159	E24-I64 HydrophobicContact CG-CG2 4.22Å; V27-I64 HydrophobicContact CB-CG2 4.41Å; V27-I64 HydrophobicContact CG1-CD1 3.9Å; V27-I64 HydrophobicContact CG1-CG1 4.03Å; V27-I64 HydrophobicContact CG1-CG2 4.17Å; L31-I64 HydrophobicContact CD1-CD1 3.94Å; L60-I64 HydrophobicContact CD1-CD1 3.9Å; L60-I64 HydrophobicContact CD1-CG1 4.27Å; L60-I64 HydrophobicContact CG-CD1 3.99Å; L60-I64 WeakPolarHBondContact O-CG1 3.29Å; L60-I64 PolarHBondContact O-N 3.3Å; N61-I64 PolarHBondContact O-N 3.11Å; Q62-I64 PolarHBondContact O-N 2.95Å; I64-T67 PolarHBondContact O-N 3.45Å; I64-L68 HydrophobicContact CG2-CD1 3.98Å; I64-L68 WeakPolarHBondContact O-CG 3.07Å; I64-L68 PolarHBondContact O-N 3.1Å; I64-F159 HydrophobicContact CG1-CZ 4.2Å
65	Q	96.6	Very high	95.5	Very high	108 Å²	108	45.7 Å²	45.7	51%	0.505	23%	0.23	S	C	.	.	H	α-helix	trans	-63.9	-46.3	179.3	-174.6	176.3	-11.5	0	0	111.8	N61 Q62 Y63 L68 H69	N61-Q65 VanDerWaalsContact O-CB 3.25Å; N61-Q65 WeakPolarHBondContact O-CB 3.15Å; N61-Q65 PolarHBondContact O-N 3.32Å; Q62-Q65 PolarHBondContact O-N 3.27Å; Y63-Q65 VanDerWaalsContact C-N 3.35Å; Q65-L68 PolarHBondContact O-N 3.22Å; Q65-H69 VanDerWaalsContact O-CB 3.29Å; Q65-H69 WeakPolarHBondContact O-CB 3.34Å; Q65-H69 PolarHBondContact O-N 3.36Å
66	D	96	Very high	95.1	Very high	34 Å²	34	48.7 Å²	48.7	18%	0.182	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-42.1	178.6	-70.7	-22.9	0	0	0	111.2	Q62 L68 H69 C70 I179 F182	Q62-D66 WeakPolarHBondContact CG-OD2 3.49Å; Q62-D66 PolarHBondContact NE2-OD1 2.74Å; Q62-D66 PolarHBondContact NE2-OD2 2.87Å; Q62-D66 WeakPolarHBondContact O-CB 3.47Å; Q62-D66 VanDerWaalsContact O-CG 3.26Å; Q62-D66 PolarHBondContact O-N 3.28Å; D66-L68 PolarHBondContact O-N 3.31Å; D66-H69 PolarHBondContact O-N 3.45Å; D66-C70 PolarHBondContact O-N 2.85Å; D66-C70 PolarHBondContact O-SG 3.14Å; D66-I179 HydrophobicContact CB-CD1 3.68Å; D66-F182 HydrophobicContact CB-CD2 4.03Å; D66-F182 HydrophobicContact CB-CE2 4.17Å; D66-F182 HydrophobicContact CB-CG 4.22Å; D66-F182 HydrophobicContact CB-CZ 4.48Å
67	T	96.1	Very high	94.7	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-55.5	-52.2	173.4	-58	0	0	0	0	110.8	Y63 I64 H69 C70 V71 V161 F182 W184	Y63-T67 WeakPolarHBondContact O-CB 3.5Å; Y63-T67 PolarHBondContact O-N 3.29Å; Y63-T67 PolarHBondContact O-OG1 3.03Å; I64-T67 PolarHBondContact O-N 3.45Å; T67-H69 VanDerWaalsContact C-N 3.34Å; T67-H69 PolarHBondContact O-N 2.89Å; T67-C70 WeakPolarHBondContact O-CB 3.37Å; T67-C70 PolarHBondContact O-N 2.78Å; T67-V71 VanDerWaalsContact O-CG2 3.32Å; T67-V71 WeakPolarHBondContact O-CG2 3.34Å; T67-V71 PolarHBondContact O-N 2.87Å; T67-V71 VanDerWaalsContact O-N 3.11Å; T67-V161 HydrophobicContact CG2-CB 3.89Å; T67-V161 HydrophobicContact CG2-CG1 3.98Å; T67-V161 HydrophobicContact CG2-CG2 4.12Å; T67-F182 VanDerWaalsContact OG1-CZ 3.31Å; T67-F182 WeakPolarHBondContact OG1-CZ 3.49Å; T67-W184 HydrophobicContact CG2-CH2 3.84Å; T67-W184 HydrophobicContact CG2-CZ2 3.78Å
68	L	95.6	Very high	94.3	Very high	13 Å²	13	50 Å²	50	7%	0.068	24%	0.244	C	C	.	.	H	α-helix	trans	-71.7	-28.7	-177.9	-66.9	173.8	0	0	0	112.9	L23 E24 I64 Q65 D66 C70 V71 K72	L23-L68 HydrophobicContact CB-CD1 4.36Å; L23-L68 HydrophobicContact CB-CD2 3.75Å; L23-L68 HydrophobicContact CD1-CD2 4.17Å; E24-L68 VanDerWaalsContact CA-CD1 3.42Å; E24-L68 HydrophobicContact CB-CD1 3.52Å; E24-L68 HydrophobicContact CG-CD1 4.2Å; I64-L68 HydrophobicContact CG2-CD1 3.98Å; I64-L68 WeakPolarHBondContact O-CG 3.07Å; I64-L68 PolarHBondContact O-N 3.1Å; Q65-L68 PolarHBondContact O-N 3.22Å; D66-L68 PolarHBondContact O-N 3.31Å; L68-C70 VanDerWaalsContact C-N 3.34Å; L68-V71 PolarHBondContact O-N 3.27Å; L68-K72 PolarHBondContact O-N 2.97Å
69	H	93.7	Very high	94	Very high	101 Å²	101	46.1 Å²	46.1	47%	0.468	22%	0.218	S	C	.	.	H	α-helix	trans	-64.1	-40.8	173.3	-166.3	76.4	0	0	0	111.4	Q65 D66 T67 P73 I179	Q65-H69 VanDerWaalsContact O-CB 3.29Å; Q65-H69 WeakPolarHBondContact O-CB 3.34Å; Q65-H69 PolarHBondContact O-N 3.36Å; D66-H69 PolarHBondContact O-N 3.45Å; T67-H69 VanDerWaalsContact C-N 3.34Å; T67-H69 PolarHBondContact O-N 2.89Å; H69-P73 WeakPolarHBondContact O-CD 3.42Å; H69-I179 HydrophobicContact CB-CD1 4.23Å
70	C	92.4	Very high	93.8	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.6	-34.7	172	-73.9	0	0	0	0	113.1	D66 T67 L68 P73 I176 W184	D66-C70 PolarHBondContact O-N 2.85Å; D66-C70 PolarHBondContact O-SG 3.14Å; T67-C70 WeakPolarHBondContact O-CB 3.37Å; T67-C70 PolarHBondContact O-N 2.78Å; L68-C70 VanDerWaalsContact C-N 3.34Å; C70-P73 WeakPolarHBondContact O-CD 3.47Å; C70-P73 WeakPolarHBondContact O-CG 3.23Å; C70-I176 HydrophobicContact CB-CG1 3.98Å; C70-I176 WeakPolarHBondContact CB-O 3.37Å; C70-I176 PolarHBondContact SG-O 2.87Å; C70-W184 HydrophobicContact CB-CZ2 4.01Å; C70-W184 PolarHBondContact SG-NE1 3.35Å; C70-W184 VanDerWaalsContact SG-NE1 3.4Å
71	V	93.3	Very high	93.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-74.1	-33	179.3	174.5	0	0	0	0	112.5	T67 L68 L74 L75 V80 V83 V163 W184	T67-V71 VanDerWaalsContact O-CG2 3.32Å; T67-V71 WeakPolarHBondContact O-CG2 3.34Å; T67-V71 PolarHBondContact O-N 2.87Å; T67-V71 VanDerWaalsContact O-N 3.11Å; L68-V71 PolarHBondContact O-N 3.27Å; V71-L74 WeakPolarHBondContact O-CB 3.38Å; V71-L74 PolarHBondContact O-N 2.83Å; V71-L75 HydrophobicContact CG1-CD1 3.8Å; V71-L75 HydrophobicContact CG1-CG 3.93Å; V71-L75 PolarHBondContact O-N 2.84Å; V71-V80 HydrophobicContact CG1-CG2 4.45Å; V71-V83 HydrophobicContact CG1-CG2 4.29Å; V71-V163 HydrophobicContact CG2-CG2 3.66Å; V71-W184 HydrophobicContact CG2-CH2 4.08Å; V71-W184 HydrophobicContact CG2-CZ2 4.14Å
72	K	92.8	Very high	93.6	Very high	56 Å²	56	41.9 Å²	41.9	24%	0.243	20%	0.196	C	C	.	.	H	α-helix	trans	-48.5	-53.7	-178.2	-176.3	173.6	168.6	173.1	0	114.8	A16 D17 L68 L74 L75 E76	A16-K72 HydrophobicContact CB-CG 4.41Å; D17-K72 WeakPolarHBondContact OD1-CE 3.26Å; D17-K72 IonicContact OD1-NZ 2.58Å; D17-K72 PolarHBondContact OD1-NZ 3.31Å; D17-K72 IonicContact OD2-NZ 3.86Å; L68-K72 PolarHBondContact O-N 2.97Å; K72-L74 PolarHBondContact O-N 3.43Å; K72-L75 WeakPolarHBondContact O-CB 3.36Å; K72-L75 PolarHBondContact O-N 2.96Å; K72-E76 WeakPolarHBondContact CE-OE1 3.23Å; K72-E76 HydrophobicContact CG-CG 4.49Å; K72-E76 WeakPolarHBondContact O-CG 3.48Å; K72-E76 PolarHBondContact O-N 3.02Å
73	P	91.3	Very high	93.7	Very high	27 Å²	27	37.6 Å²	37.6	18%	0.175	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-24.3	-179.1	26.1	-37.4	0	0	0	113.8	H69 C70 K77 V178	H69-P73 WeakPolarHBondContact O-CD 3.42Å; C70-P73 WeakPolarHBondContact O-CD 3.47Å; C70-P73 WeakPolarHBondContact O-CG 3.23Å; P73-K77 WeakPolarHBondContact O-CG 3.4Å; P73-K77 PolarHBondContact O-N 3.2Å; P73-V178 HydrophobicContact CG-CG2 3.92Å
74	L	90.2	Very high	93.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-75.4	-38.7	173.3	-63.7	165.6	0	0	0	110.9	V71 K72 K77 N78 D79 V80 V163 T165 N172 K175 I176	V71-L74 WeakPolarHBondContact O-CB 3.38Å; V71-L74 PolarHBondContact O-N 2.83Å; K72-L74 PolarHBondContact O-N 3.43Å; L74-K77 PolarHBondContact O-N 2.86Å; L74-N78 PolarHBondContact O-N 2.83Å; L74-N78 VanDerWaalsContact O-N 3.16Å; L74-D79 HydrophobicContact CB-CB 4.36Å; L74-D79 HydrophobicContact CD2-CB 4.05Å; L74-D79 PolarHBondContact O-N 3.03Å; L74-V80 HydrophobicContact CB-CG2 3.42Å; L74-V80 VanDerWaalsContact CB-CG2 3.42Å; L74-V163 HydrophobicContact CD1-CG1 4.42Å; L74-T165 HydrophobicContact CD1-CG2 4.46Å; L74-N172 HydrophobicContact CD2-CB 3.82Å; L74-K175 HydrophobicContact CD2-CB 4.24Å; L74-K175 HydrophobicContact CD2-CD 4.39Å; L74-I176 HydrophobicContact CD1-CB 3.92Å; L74-I176 HydrophobicContact CD1-CD1 3.54Å; L74-I176 HydrophobicContact CD1-CG1 3.66Å
75	L	91.3	Very high	93.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.1	-41.1	173.7	-72.2	171	0	0	0	111.7	A16 L19 L23 V71 K72 K77 N78 V80 I102 Q104	A16-L75 HydrophobicContact CB-CB 3.77Å; L19-L75 HydrophobicContact CB-CD1 4.09Å; L19-L75 HydrophobicContact CD1-CD2 4.02Å; L23-L75 HydrophobicContact CD1-CD1 4.5Å; V71-L75 HydrophobicContact CG1-CD1 3.8Å; V71-L75 HydrophobicContact CG1-CG 3.93Å; V71-L75 PolarHBondContact O-N 2.84Å; K72-L75 WeakPolarHBondContact O-CB 3.36Å; K72-L75 PolarHBondContact O-N 2.96Å; L75-K77 PolarHBondContact O-N 3.45Å; L75-N78 PolarHBondContact O-N 3.41Å; L75-V80 HydrophobicContact CD2-CB 3.86Å; L75-V80 HydrophobicContact CD2-CG1 4.25Å; L75-V80 HydrophobicContact CD2-CG2 3.95Å; L75-V80 HydrophobicContact CG-CG2 4.08Å; L75-I102 HydrophobicContact CD2-CD1 4.13Å; L75-Q104 PolarHBondContact O-NE2 2.91Å
76	E	90.3	Very high	93.8	Very high	65 Å²	65	28.8 Å²	28.8	30%	0.304	14%	0.138	S	C	.	.	H	α-helix	trans	-58.6	-34.2	176.9	-70.9	179.6	-178.9	0	0	112.6	Q13 A16 K72	Q13-E76 HydrophobicContact CG-CG 4.18Å; A16-E76 HydrophobicContact CB-CB 4.47Å; A16-E76 HydrophobicContact CB-CG 3.62Å; K72-E76 WeakPolarHBondContact CE-OE1 3.23Å; K72-E76 HydrophobicContact CG-CG 4.49Å; K72-E76 WeakPolarHBondContact O-CG 3.48Å; K72-E76 PolarHBondContact O-N 3.02Å
77	K	87.3	Confident	93.9	Very high	119 Å²	119	27.1 Å²	27.1	52%	0.517	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1	178.4	-67.1	176.2	-175.9	172.1	0	113.5	P73 L74 L75 D79 K175	P73-K77 WeakPolarHBondContact O-CG 3.4Å; P73-K77 PolarHBondContact O-N 3.2Å; L74-K77 PolarHBondContact O-N 2.86Å; L75-K77 PolarHBondContact O-N 3.45Å; K77-D79 HydrophobicContact CB-CB 4.45Å; K77-D79 WeakPolarHBondContact CB-OD2 3.46Å; K77-D79 PolarHBondContact O-N 3.5Å; K77-K175 HydrophobicContact CD-CD 4.32Å
78	N	89.2	Confident	93.9	Very high	48 Å²	48	27.6 Å²	27.6	26%	0.257	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	30.1	-171.3	-168.1	26.3	0	0	0	113	L74 L75 V80 Q104 R166	L74-N78 PolarHBondContact O-N 2.83Å; L74-N78 VanDerWaalsContact O-N 3.16Å; L75-N78 PolarHBondContact O-N 3.41Å; N78-V80 VanDerWaalsContact C-N 3.3Å; N78-Q104 HydrophobicContact CB-CB 4.49Å; N78-Q104 PolarHBondContact ND2-O 3.34Å; N78-Q104 VanDerWaalsContact ND2-O 3.11Å; N78-Q104 WeakPolarHBondContact OD1-CB 3.45Å; N78-R166 WeakPolarHBondContact O-CD 3.47Å; N78-R166 PolarHBondContact O-NE 3.3Å; N78-R166 PolarHBondContact OD1-NE 3.45Å; N78-R166 PolarHBondContact OD1-NH2 3.49Å
79	D	91.1	Very high	93.8	Very high	18 Å²	18	27.1 Å²	27.1	10%	0.096	13%	0.128	C	C	.	.			trans	-82	-8.1	179.4	-76.9	-25.1	0	0	0	112.1	L74 K77 T165 R166 N172 K175	L74-D79 HydrophobicContact CB-CB 4.36Å; L74-D79 HydrophobicContact CD2-CB 4.05Å; L74-D79 PolarHBondContact O-N 3.03Å; K77-D79 HydrophobicContact CB-CB 4.45Å; K77-D79 WeakPolarHBondContact CB-OD2 3.46Å; K77-D79 PolarHBondContact O-N 3.5Å; D79-T165 CarbonylContact O-C 3.53Å; D79-T165 WeakPolarHBondContact O-CA 3.47Å; D79-T165 WeakPolarHBondContact O-CB 3.38Å; D79-R166 PolarHBondContact O-N 2.92Å; D79-N172 PolarHBondContact OD2-OD1 2.93Å; D79-K175 IonicContact OD2-NZ 2.78Å; D79-K175 PolarHBondContact OD2-NZ 3.33Å
80	V	93.9	Very high	93.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130	179.2	-176.2	0	0	0	0	111.2	V71 L74 L75 N78 V83 V163 R166	V71-V80 HydrophobicContact CG1-CG2 4.45Å; L74-V80 HydrophobicContact CB-CG2 3.42Å; L74-V80 VanDerWaalsContact CB-CG2 3.42Å; L75-V80 HydrophobicContact CD2-CB 3.86Å; L75-V80 HydrophobicContact CD2-CG1 4.25Å; L75-V80 HydrophobicContact CD2-CG2 3.95Å; L75-V80 HydrophobicContact CG-CG2 4.08Å; N78-V80 VanDerWaalsContact C-N 3.3Å; V80-V83 HydrophobicContact CG1-CG2 3.79Å; V80-V163 HydrophobicContact CG1-CG1 4.06Å; V80-V163 HydrophobicContact CG2-CG1 4.16Å; V80-R166 PolarHBondContact O-NE 3.4Å; V80-R166 PolarHBondContact O-NH2 3.05Å
81	E	95.2	Very high	93.8	Very high	74 Å²	74	32.7 Å²	32.7	35%	0.346	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-46.6	170.3	-169	-176.2	163.8	0	0	111.5	I102 H164 R166	E81-I102 PolarHBondContact O-N 3.38Å; E81-H164 PolarHBondContact N-O 2.82Å; E81-R166 HydrophobicContact CB-CG 4.1Å
82	K	97.5	Very high	93.7	Very high	38 Å²	38	38.9 Å²	38.9	17%	0.165	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139.1	-179	-45.9	-174.9	179.2	-160.4	0	111.2	V84 V99 F100 E101 V163 H164 Y215	K82-V84 HydrophobicContact CB-CG2 4.16Å; K82-V99 HydrophobicContact CB-CG1 4.28Å; K82-V99 HydrophobicContact CD-CG1 3.93Å; K82-V99 HydrophobicContact CG-CG1 4.44Å; K82-F100 VanDerWaalsContact CA-O 3.28Å; K82-F100 WeakPolarHBondContact CA-O 3.29Å; K82-E101 WeakPolarHBondContact CE-OE1 3.35Å; K82-E101 HydrophobicContact CG-CB 4.44Å; K82-E101 HydrophobicContact CG-CG 4.34Å; K82-E101 IonicContact NZ-OE1 3.02Å; K82-E101 PolarHBondContact NZ-OE1 2.97Å; K82-V163 WeakPolarHBondContact O-CA 3.33Å; K82-H164 HydrophobicContact CB-CB 3.91Å; K82-H164 HydrophobicContact CG-CB 4.22Å; K82-H164 PolarHBondContact N-O 3.06Å; K82-H164 PolarHBondContact O-N 2.99Å; K82-Y215 PolarHBondContact NZ-OH 2.78Å
83	V	98	Very high	93.7	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.018	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.1	162.7	-178.7	0	0	0	0	106.7	L23 V71 V80 F100 I102 V161	L23-V83 HydrophobicContact CD1-CB 4.43Å; L23-V83 HydrophobicContact CD1-CG1 4.37Å; L23-V83 HydrophobicContact CD1-CG2 4.12Å; L23-V83 HydrophobicContact CD2-CB 4.42Å; L23-V83 HydrophobicContact CD2-CG1 4.35Å; V71-V83 HydrophobicContact CG1-CG2 4.29Å; V80-V83 HydrophobicContact CG1-CG2 3.79Å; V83-F100 HydrophobicContact CB-CB 4.4Å; V83-F100 PolarHBondContact N-O 3.46Å; V83-F100 WeakPolarHBondContact O-CA 3.4Å; V83-F100 WeakPolarHBondContact O-CB 3.14Å; V83-F100 WeakPolarHBondContact O-CD2 3.11Å; V83-F100 PolarHBondContact O-N 3.32Å; V83-I102 HydrophobicContact CG2-CD1 4.1Å; V83-V161 HydrophobicContact CG1-CG1 4.02Å
84	V	98.4	Very high	93.9	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	122.8	-172.2	-170.7	0	0	0	0	109.8	K82 V86 K97 F98 V99 V161 L162	K82-V84 HydrophobicContact CB-CG2 4.16Å; V84-V86 HydrophobicContact CB-CG2 4.48Å; V84-V86 HydrophobicContact CG1-CG2 3.84Å; V84-K97 HydrophobicContact CG1-CB 3.7Å; V84-K97 HydrophobicContact CG1-CD 4.15Å; V84-K97 HydrophobicContact CG1-CG 4.3Å; V84-F98 WeakPolarHBondContact CA-O 3.48Å; V84-V99 HydrophobicContact CG1-CG2 3.91Å; V84-V99 HydrophobicContact CG2-CG1 4.15Å; V84-V99 HydrophobicContact CG2-CG2 4.22Å; V84-V161 CarbonylContact O-C 3.6Å; V84-V161 VanDerWaalsContact O-CA 3.31Å; V84-V161 WeakPolarHBondContact O-CA 3.43Å; V84-L162 HydrophobicContact CB-CB 4.19Å; V84-L162 PolarHBondContact N-O 2.87Å; V84-L162 PolarHBondContact O-N 3.47Å
85	V	98.5	Very high	94.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	110.1	168.3	-174.6	0	0	0	0	107.4	V27 I30 K97 F98 F100 F159	V27-V85 HydrophobicContact CG2-CG2 3.73Å; I30-V85 HydrophobicContact CD1-CG2 4.28Å; I30-V85 HydrophobicContact CG2-CG1 4.32Å; V85-K97 CarbonylContact O-C 3.57Å; V85-K97 WeakPolarHBondContact O-CA 3.35Å; V85-F98 HydrophobicContact CB-CB 4.22Å; V85-F98 PolarHBondContact N-O 2.9Å; V85-F98 PolarHBondContact O-N 3.47Å; V85-F100 HydrophobicContact CG2-CE2 4.2Å; V85-F159 HydrophobicContact CG1-CD2 4.13Å
86	V	98.1	Very high	94.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	124.5	-179.5	-176.8	0	0	0	0	108.4	V84 L88 P94 K97 F159 T160 L162	V84-V86 HydrophobicContact CB-CG2 4.48Å; V84-V86 HydrophobicContact CG1-CG2 3.84Å; V86-L88 HydrophobicContact CG1-CD2 3.72Å; V86-L88 HydrophobicContact CG1-CG 4.31Å; V86-P94 HydrophobicContact CG1-CB 4.01Å; V86-P94 HydrophobicContact CG1-CG 4.2Å; V86-K97 HydrophobicContact CG1-CG 4.22Å; V86-K97 HydrophobicContact CG2-CD 4.21Å; V86-K97 HydrophobicContact CG2-CG 4.09Å; V86-F159 CarbonylContact O-C 3.54Å; V86-F159 WeakPolarHBondContact O-CA 3.38Å; V86-F159 WeakPolarHBondContact O-CB 3.47Å; V86-T160 HydrophobicContact CB-CG2 3.87Å; V86-T160 HydrophobicContact CG1-CG2 4.44Å; V86-T160 HydrophobicContact CG2-CG2 4.46Å; V86-T160 PolarHBondContact N-O 2.89Å; V86-T160 PolarHBondContact O-N 2.93Å; V86-L162 HydrophobicContact CG2-CD1 3.6Å; V86-L162 HydrophobicContact CG2-CG 3.77Å
87	I	97.7	Very high	94.8	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.9	170.2	-56.5	-175.4	0	0	0	107.6	I30 R34 V36 V95 E96 F98 C157 T158	I30-I87 HydrophobicContact CG2-CD1 4.42Å; R34-I87 HydrophobicContact CB-CD1 3.64Å; R34-I87 HydrophobicContact CG-CD1 3.8Å; V36-I87 HydrophobicContact CG2-CD1 3.95Å; V36-I87 HydrophobicContact CG2-CG1 4.37Å; V36-I87 HydrophobicContact CG2-CG2 4.31Å; I87-V95 HydrophobicContact CB-CG2 3.89Å; I87-V95 HydrophobicContact CG2-CG2 3.59Å; I87-V95 VanDerWaalsContact O-CG2 3.27Å; I87-V95 WeakPolarHBondContact O-CG2 3.17Å; I87-V95 PolarHBondContact O-N 3.48Å; I87-E96 HydrophobicContact CB-CB 4.23Å; I87-E96 HydrophobicContact CD1-CB 4.42Å; I87-E96 WeakPolarHBondContact CD1-OE2 3.4Å; I87-E96 HydrophobicContact CG1-CB 4.48Å; I87-E96 PolarHBondContact N-O 2.69Å; I87-F98 HydrophobicContact CD1-CE2 3.98Å; I87-C157 HydrophobicContact CG2-CB 3.73Å; I87-T158 WeakPolarHBondContact CA-O 3.5Å
88	L	96	Very high	95.3	Very high	13 Å²	13	33.3 Å²	33.3	7%	0.068	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	142.3	-177.3	-58.4	172.3	0	0	0	109.6	V86 R93 P94 C157 T158 T160	V86-L88 HydrophobicContact CG1-CD2 3.72Å; V86-L88 HydrophobicContact CG1-CG 4.31Å; L88-R93 WeakPolarHBondContact CA-O 3.47Å; L88-P94 HydrophobicContact CD2-CB 4.46Å; L88-P94 HydrophobicContact CD2-CG 4.01Å; L88-C157 CarbonylContact O-C 3.53Å; L88-C157 WeakPolarHBondContact O-CA 3.29Å; L88-C157 WeakPolarHBondContact O-CB 3.47Å; L88-C157 PolarHBondContact O-SG 3.03Å; L88-C157 VanDerWaalsContact O-SG 3.34Å; L88-T158 PolarHBondContact N-O 3.32Å; L88-T158 PolarHBondContact O-N 2.81Å; L88-T160 HydrophobicContact CD1-CG2 4.06Å
89	D	94.2	Very high	95.8	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.016	14%	0.139	C	C	.	.			trans	-75.7	178.8	167.9	61.4	29.7	0	0	0	112.1	E91 H92 R93 V95 R219	D89-E91 PolarHBondContact O-N 3.41Å; D89-E91 WeakPolarHBondContact OD1-CA 3.36Å; D89-E91 WeakPolarHBondContact OD1-CB 3.47Å; D89-E91 PolarHBondContact OD1-N 3.32Å; D89-H92 WeakPolarHBondContact O-CA 3.37Å; D89-H92 PolarHBondContact O-N 2.84Å; D89-H92 PolarHBondContact OD1-N 3.19Å; D89-R93 PolarHBondContact N-O 3.44Å; D89-R93 WeakPolarHBondContact OD1-CB 3.43Å; D89-R93 PolarHBondContact OD1-N 2.84Å; D89-R93 IonicContact OD1-NE 3.39Å; D89-R93 IonicContact OD2-CZ 2.77Å; D89-R93 IonicContact OD2-NE 3.73Å; D89-R93 PolarHBondContact OD2-NE 3.47Å; D89-R93 IonicContact OD2-NH2 3.66Å; D89-V95 HydrophobicContact CB-CG1 3.81Å; D89-R219 IonicContact OD2-CZ 2.7Å; D89-R219 IonicContact OD2-NH1 3.34Å; D89-R219 PolarHBondContact OD2-NH1 3.47Å; D89-R219 IonicContact OD2-NH2 2.66Å; D89-R219 PolarHBondContact OD2-NH2 2.89Å
90	K	93.5	Very high	96.1	Very high	124 Å²	124	30.3 Å²	30.3	54%	0.539	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.1	178.2	68	-169.5	174.5	-169.4	0	113.8	H92	K90-H92 VanDerWaalsContact C-N 3.33Å
91	E	91.6	Very high	96.3	Very high	94 Å²	94	32.6 Å²	32.6	44%	0.439	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	13.2	172.4	-64.7	83	-158.6	0	0	112.6	D89 R93	D89-E91 PolarHBondContact O-N 3.41Å; D89-E91 WeakPolarHBondContact OD1-CA 3.36Å; D89-E91 WeakPolarHBondContact OD1-CB 3.47Å; D89-E91 PolarHBondContact OD1-N 3.32Å; E91-R93 HydrophobicContact CB-CG 4.37Å; E91-R93 PolarHBondContact O-N 3.26Å; E91-R93 IonicContact OE2-CZ 3.38Å; E91-R93 IonicContact OE2-NH2 2.61Å; E91-R93 PolarHBondContact OE2-NH2 2.81Å
92	H	91.8	Very high	96.3	Very high	131 Å²	131	29 Å²	29	61%	0.606	13%	0.129	S	C	*	.	S	Bend	trans	60.1	28.8	-177.8	-60.9	-80.9	0	0	0	114.2	D89 K90	D89-H92 WeakPolarHBondContact O-CA 3.37Å; D89-H92 PolarHBondContact O-N 2.84Å; D89-H92 PolarHBondContact OD1-N 3.19Å; K90-H92 VanDerWaalsContact C-N 3.33Å
93	R	92.5	Very high	96.1	Very high	129 Å²	129	30 Å²	30	49%	0.487	14%	0.138	S	C	.	.			trans	-98.4	137.7	176.2	-61	173.5	-68.1	-173	-6.5	110.9	L88 D89 E91 V95	L88-R93 WeakPolarHBondContact CA-O 3.47Å; D89-R93 PolarHBondContact N-O 3.44Å; D89-R93 WeakPolarHBondContact OD1-CB 3.43Å; D89-R93 PolarHBondContact OD1-N 2.84Å; D89-R93 IonicContact OD1-NE 3.39Å; D89-R93 IonicContact OD2-CZ 2.77Å; D89-R93 IonicContact OD2-NE 3.73Å; D89-R93 PolarHBondContact OD2-NE 3.47Å; D89-R93 IonicContact OD2-NH2 3.66Å; E91-R93 HydrophobicContact CB-CG 4.37Å; E91-R93 PolarHBondContact O-N 3.26Å; E91-R93 IonicContact OE2-CZ 3.38Å; E91-R93 IonicContact OE2-NH2 2.61Å; E91-R93 PolarHBondContact OE2-NH2 2.81Å; R93-V95 PolarHBondContact O-N 3.5Å
94	P	95.3	Very high	95.6	Very high	6 Å²	6	31 Å²	31	4%	0.039	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	127.6	174	-26.4	35.5	0	0	0	112.4	V86 L88 M194 R219	V86-P94 HydrophobicContact CG1-CB 4.01Å; V86-P94 HydrophobicContact CG1-CG 4.2Å; L88-P94 HydrophobicContact CD2-CB 4.46Å; L88-P94 HydrophobicContact CD2-CG 4.01Å; P94-M194 HydrophobicContact CB-CB 4.46Å; P94-M194 HydrophobicContact CB-SD 4.25Å; P94-R219 PolarHBondContact O-NH1 3.2Å
95	V	95.6	Very high	94.7	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-37.1	172.6	-66.5	0	0	0	0	112.2	I87 D89 R93 P154 R219	I87-V95 HydrophobicContact CB-CG2 3.89Å; I87-V95 HydrophobicContact CG2-CG2 3.59Å; I87-V95 VanDerWaalsContact O-CG2 3.27Å; I87-V95 WeakPolarHBondContact O-CG2 3.17Å; I87-V95 PolarHBondContact O-N 3.48Å; D89-V95 HydrophobicContact CB-CG1 3.81Å; R93-V95 PolarHBondContact O-N 3.5Å; V95-P154 HydrophobicContact CG1-CG 4.4Å; V95-R219 WeakPolarHBondContact O-CB 3.26Å; V95-R219 PolarHBondContact O-N 3.41Å
96	E	97.3	Very high	93.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	147.5	178.6	-62.5	-174.2	146	0	0	109.9	R34 I87 F98 N153 V216 E217 K222	R34-E96 IonicContact CZ-OE1 2.93Å; R34-E96 IonicContact CZ-OE2 3.38Å; R34-E96 IonicContact NE-OE1 3.88Å; R34-E96 PolarHBondContact NE-OE1 3.18Å; R34-E96 IonicContact NE-OE2 3.77Å; R34-E96 PolarHBondContact NE-OE2 2.77Å; R34-E96 IonicContact NH2-OE1 2.87Å; R34-E96 PolarHBondContact NH2-OE1 3.46Å; R34-E96 IonicContact NH2-OE2 2.64Å; R34-E96 PolarHBondContact NH2-OE2 2.84Å; I87-E96 HydrophobicContact CB-CB 4.23Å; I87-E96 HydrophobicContact CD1-CB 4.42Å; I87-E96 WeakPolarHBondContact CD1-OE2 3.4Å; I87-E96 HydrophobicContact CG1-CB 4.48Å; I87-E96 PolarHBondContact N-O 2.69Å; E96-F98 HydrophobicContact CB-CE2 4.35Å; E96-N153 WeakPolarHBondContact CG-OD1 3.08Å; E96-N153 PolarHBondContact OE1-OD1 2.96Å; E96-N153 PolarHBondContact OE2-ND2 2.91Å; E96-N153 PolarHBondContact OE2-OD1 3.11Å; E96-V216 HydrophobicContact CB-CG1 4.4Å; E96-E217 CarbonylContact C-O 3.53Å; E96-E217 VanDerWaalsContact CA-O 3.31Å; E96-E217 WeakPolarHBondContact CA-O 3.39Å; E96-K222 IonicContact OE1-NZ 3.72Å; E96-K222 PolarHBondContact OE1-NZ 3.44Å
97	K	98.2	Very high	91.6	Very high	14 Å²	14	38.9 Å²	38.9	6%	0.061	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	118.9	170.1	-56	-170.4	-159.7	147.8	0	110.5	V84 V85 V86 V99 V192 M194 V216 E217	V84-K97 HydrophobicContact CG1-CB 3.7Å; V84-K97 HydrophobicContact CG1-CD 4.15Å; V84-K97 HydrophobicContact CG1-CG 4.3Å; V85-K97 CarbonylContact O-C 3.57Å; V85-K97 WeakPolarHBondContact O-CA 3.35Å; V86-K97 HydrophobicContact CG1-CG 4.22Å; V86-K97 HydrophobicContact CG2-CD 4.21Å; V86-K97 HydrophobicContact CG2-CG 4.09Å; K97-V99 HydrophobicContact CB-CG2 4.18Å; K97-V99 PolarHBondContact O-N 3.39Å; K97-V192 WeakPolarHBondContact CE-O 3.39Å; K97-V192 PolarHBondContact NZ-O 3.04Å; K97-M194 HydrophobicContact CG-CE 4.21Å; K97-V216 CarbonylContact O-C 3.6Å; K97-V216 VanDerWaalsContact O-CA 3.23Å; K97-V216 WeakPolarHBondContact O-CA 3.49Å; K97-E217 HydrophobicContact CB-CB 4.13Å; K97-E217 WeakPolarHBondContact CD-OE2 3.49Å; K97-E217 PolarHBondContact N-O 3.26Å; K97-E217 IonicContact NZ-OE2 3.06Å; K97-E217 PolarHBondContact NZ-OE2 2.86Å; K97-E217 PolarHBondContact O-N 3.01Å
98	F	98.6	Very high	89.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	102.7	170.6	-69.6	-103.3	0	0	0	108.3	I30 R34 V84 V85 I87 E96 F100 L150 L202 L214 V216	I30-F98 HydrophobicContact CD1-CB 3.72Å; I30-F98 HydrophobicContact CD1-CD1 3.7Å; I30-F98 HydrophobicContact CD1-CD2 4.39Å; I30-F98 HydrophobicContact CD1-CE1 4.45Å; I30-F98 HydrophobicContact CD1-CG 3.68Å; I30-F98 HydrophobicContact CG1-CD1 3.83Å; I30-F98 HydrophobicContact CG1-CE1 4.08Å; I30-F98 HydrophobicContact CG1-CG 4.1Å; I30-F98 HydrophobicContact CG2-CD1 4.43Å; I30-F98 HydrophobicContact CG2-CD2 3.74Å; I30-F98 HydrophobicContact CG2-CE1 4.42Å; I30-F98 HydrophobicContact CG2-CE2 3.75Å; I30-F98 HydrophobicContact CG2-CG 4.11Å; I30-F98 HydrophobicContact CG2-CZ 4.11Å; R34-F98 HydrophobicContact CG-CE2 3.95Å; R34-F98 HydrophobicContact CG-CZ 3.78Å; V84-F98 WeakPolarHBondContact CA-O 3.48Å; V85-F98 HydrophobicContact CB-CB 4.22Å; V85-F98 PolarHBondContact N-O 2.9Å; V85-F98 PolarHBondContact O-N 3.47Å; I87-F98 HydrophobicContact CD1-CE2 3.98Å; E96-F98 HydrophobicContact CB-CE2 4.35Å; F98-F100 HydrophobicContact CB-CE2 4.28Å; F98-L150 HydrophobicContact CE1-CD1 4.24Å; F98-L150 HydrophobicContact CZ-CD1 3.7Å; F98-L202 HydrophobicContact CD1-CD1 4.4Å; F98-L202 HydrophobicContact CE1-CD1 4.26Å; F98-L214 HydrophobicContact CB-CD1 4.38Å; F98-V216 HydrophobicContact CD1-CG2 3.6Å; F98-V216 HydrophobicContact CE1-CG2 3.53Å; F98-V216 HydrophobicContact CE2-CG1 4.47Å; F98-V216 HydrophobicContact CG-CG2 4.16Å; F98-V216 HydrophobicContact CZ-CG2 4.02Å
99	V	98.6	Very high	86.9	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.2	-174	-176.7	0	0	0	0	109.7	K82 V84 K97 L214 Y215 E217	K82-V99 HydrophobicContact CB-CG1 4.28Å; K82-V99 HydrophobicContact CD-CG1 3.93Å; K82-V99 HydrophobicContact CG-CG1 4.44Å; V84-V99 HydrophobicContact CG1-CG2 3.91Å; V84-V99 HydrophobicContact CG2-CG1 4.15Å; V84-V99 HydrophobicContact CG2-CG2 4.22Å; K97-V99 HydrophobicContact CB-CG2 4.18Å; K97-V99 PolarHBondContact O-N 3.39Å; V99-L214 WeakPolarHBondContact O-CA 3.34Å; V99-Y215 HydrophobicContact CB-CD1 4.33Å; V99-Y215 HydrophobicContact CB-CD2 4.03Å; V99-Y215 HydrophobicContact CB-CE1 3.94Å; V99-Y215 HydrophobicContact CB-CE2 3.62Å; V99-Y215 HydrophobicContact CB-CG 4.38Å; V99-Y215 HydrophobicContact CG1-CE1 3.75Å; V99-Y215 HydrophobicContact CG1-CE2 4.01Å; V99-Y215 VanDerWaalsContact CG1-CZ 3.44Å; V99-Y215 WeakPolarHBondContact CG1-OH 3.49Å; V99-Y215 HydrophobicContact CG2-CD2 4.24Å; V99-Y215 HydrophobicContact CG2-CE2 3.67Å; V99-Y215 PolarHBondContact N-O 3.42Å; V99-Y215 PolarHBondContact O-N 2.82Å; V99-E217 HydrophobicContact CG2-CG 4.12Å
100	F	98.5	Very high	84.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	95.4	169	-59.8	-94.5	0	0	0	108.5	F22 L23 A26 I30 K82 V83 V85 F98 M212 Q213 L214	F22-F100 AromaticContact CE1-CD1 3.88Å; F22-F100 HydrophobicContact CE1-CD1 3.88Å; F22-F100 AromaticContact CE1-CE1 3.7Å; F22-F100 HydrophobicContact CE1-CE1 3.7Å; F22-F100 AromaticContact CZ-CE1 3.99Å; F22-F100 HydrophobicContact CZ-CE1 3.99Å; L23-F100 HydrophobicContact CD2-CB 4.19Å; L23-F100 HydrophobicContact CD2-CD1 3.95Å; L23-F100 HydrophobicContact CD2-CD2 3.99Å; L23-F100 HydrophobicContact CD2-CE1 4.3Å; L23-F100 HydrophobicContact CD2-CE2 4.35Å; L23-F100 HydrophobicContact CD2-CG 3.77Å; L23-F100 HydrophobicContact CD2-CZ 4.49Å; A26-F100 HydrophobicContact CB-CE1 4.05Å; A26-F100 HydrophobicContact CB-CZ 3.79Å; I30-F100 HydrophobicContact CD1-CE2 3.99Å; I30-F100 HydrophobicContact CD1-CZ 3.86Å; K82-F100 VanDerWaalsContact CA-O 3.28Å; K82-F100 WeakPolarHBondContact CA-O 3.29Å; V83-F100 HydrophobicContact CB-CB 4.4Å; V83-F100 PolarHBondContact N-O 3.46Å; V83-F100 WeakPolarHBondContact O-CA 3.4Å; V83-F100 WeakPolarHBondContact O-CB 3.14Å; V83-F100 WeakPolarHBondContact O-CD2 3.11Å; V83-F100 PolarHBondContact O-N 3.32Å; V85-F100 HydrophobicContact CG2-CE2 4.2Å; F98-F100 HydrophobicContact CB-CE2 4.28Å; F100-M212 HydrophobicContact CD1-SD 4.36Å; F100-Q213 CarbonylContact C-O 3.5Å; F100-Q213 WeakPolarHBondContact CA-O 3.36Å; F100-L214 HydrophobicContact CD1-CD1 3.92Å; F100-L214 HydrophobicContact CD2-CD1 4.26Å; F100-L214 HydrophobicContact CE1-CD1 3.71Å; F100-L214 HydrophobicContact CE1-CD2 4.07Å; F100-L214 HydrophobicContact CE1-CG 4.34Å; F100-L214 HydrophobicContact CE2-CD1 4.06Å; F100-L214 HydrophobicContact CG-CD1 4.19Å; F100-L214 HydrophobicContact CZ-CD1 3.78Å; F100-L214 HydrophobicContact CZ-CD2 4.43Å
101	E	97.9	Very high	82.2	Confident	48 Å²	48	52.9 Å²	52.9	22%	0.224	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	119.2	175.1	-174.8	171.6	-122.7	0	0	109.5	K82 M212 Q213 Y215	K82-E101 WeakPolarHBondContact CE-OE1 3.35Å; K82-E101 HydrophobicContact CG-CB 4.44Å; K82-E101 HydrophobicContact CG-CG 4.34Å; K82-E101 IonicContact NZ-OE1 3.02Å; K82-E101 PolarHBondContact NZ-OE1 2.97Å; E101-M212 CarbonylContact O-C 3.41Å; E101-M212 VanDerWaalsContact O-CA 3.25Å; E101-M212 WeakPolarHBondContact O-CA 3.38Å; E101-Q213 HydrophobicContact CB-CB 4.36Å; E101-Q213 PolarHBondContact N-O 3.16Å; E101-Q213 PolarHBondContact O-N 3.01Å; E101-Y215 HydrophobicContact CB-CE1 4.38Å
102	I	95.4	Very high	79.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131.9	-168.6	-60.2	169.6	0	0	0	109.1	L19 L75 E81 V83 Q104 R166 L210 M212	L19-I102 HydrophobicContact CD1-CD1 4.49Å; L19-I102 HydrophobicContact CD1-CG2 4Å; L75-I102 HydrophobicContact CD2-CD1 4.13Å; E81-I102 PolarHBondContact O-N 3.38Å; V83-I102 HydrophobicContact CG2-CD1 4.1Å; I102-Q104 HydrophobicContact CG2-CG 4.41Å; I102-R166 PolarHBondContact O-NH2 3.06Å; I102-L210 HydrophobicContact CG2-CD1 3.97Å; I102-M212 HydrophobicContact CG1-CG 4.31Å; I102-M212 HydrophobicContact CG1-SD 4.38Å
103	T	92.6	Very high	77.2	Confident	59 Å²	59	55.8 Å²	55.8	36%	0.362	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	117	172.3	-64.3	0	0	0	0	109.8	P105 K211	T103-P105 WeakPolarHBondContact O-CD 3.38Å; T103-K211 PolarHBondContact N-O 3.3Å; T103-K211 PolarHBondContact O-N 2.72Å
104	Q	86.6	Confident	74.6	Confident	22 Å²	22	53 Å²	53	10%	0.103	28%	0.283	C	S	.	.			trans	-97.8	105.5	172.8	-52.4	178.2	35.9	0	0	108.4	V15 L75 N78 I102	V15-Q104 HydrophobicContact CG1-CG 4.42Å; L75-Q104 PolarHBondContact O-NE2 2.91Å; N78-Q104 HydrophobicContact CB-CB 4.49Å; N78-Q104 PolarHBondContact ND2-O 3.34Å; N78-Q104 VanDerWaalsContact ND2-O 3.11Å; N78-Q104 WeakPolarHBondContact OD1-CB 3.45Å; I102-Q104 HydrophobicContact CG2-CG 4.41Å
105	P	80.6	Confident	72.1	Confident	27 Å²	27	59.5 Å²	59.5	18%	0.175	33%	0.326	C	S	.	.			trans	-64.5	144.5	177.8	26.8	-33.9	0	0	0	110.9	T103 L107 D208	T103-P105 WeakPolarHBondContact O-CD 3.38Å; P105-L107 PolarHBondContact O-N 3.1Å; P105-D208 WeakPolarHBondContact CG-O 3.21Å
106	P	70.5	Confident	69.8	Low	97 Å²	97	63 Å²	63	63%	0.63	36%	0.355	S	S	*	.			trans	-63	131.6	177.8	22.9	-30.4	0	0	0	110.7	L108 S109	P106-L108 PolarHBondContact O-N 2.88Å; P106-S109 PolarHBondContact O-N 2.93Å; P106-S109 PolarHBondContact O-OG 2.82Å
107	L	60.3	Low	67.2	Low	47 Å²	47	69 Å²	69	25%	0.246	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-22.1	-175.9	-76.5	172.2	0	0	0	115.3	D8 F11 P105 S109 I110	D8-L107 HydrophobicContact CB-CD1 3.97Å; D8-L107 WeakPolarHBondContact OD1-CD1 3.21Å; F11-L107 HydrophobicContact CB-CD1 4.07Å; F11-L107 HydrophobicContact CD1-CD1 4.01Å; F11-L107 HydrophobicContact CD1-CD2 3.53Å; F11-L107 HydrophobicContact CD1-CG 4.15Å; F11-L107 HydrophobicContact CE1-CD2 3.72Å; F11-L107 HydrophobicContact CG-CD1 4.18Å; F11-L107 HydrophobicContact CG-CD2 4.01Å; F11-L107 HydrophobicContact CZ-CD2 4.38Å; P105-L107 PolarHBondContact O-N 3.1Å; L107-S109 PolarHBondContact O-N 2.96Å; L107-I110 HydrophobicContact CD2-CD1 3.65Å; L107-I110 WeakPolarHBondContact O-CB 3.34Å; L107-I110 PolarHBondContact O-N 2.64Å; L107-I110 VanDerWaalsContact O-N 3.1Å
108	L	50.2	Low	64.8	Low	135 Å²	135	79.7 Å²	79.7	71%	0.707	43%	0.434	S	S	*	.	H	α-helix	trans	-55.1	-32.4	172.7	-79.9	159.5	0	0	0	112	P106 I110 R111	P106-L108 PolarHBondContact O-N 2.88Å; L108-I110 PolarHBondContact O-N 2.76Å; L108-R111 PolarHBondContact O-N 3.39Å; L108-R111 VanDerWaalsContact O-N 3.15Å
109	S	44.6	Very low	62.1	Low	46 Å²	46	84.8 Å²	84.8	32%	0.322	47%	0.467	S	S	.	.	H	α-helix	trans	-65	-19.4	178.5	52.2	0	0	0	0	115.2	P106 L107	P106-S109 PolarHBondContact O-N 2.93Å; P106-S109 PolarHBondContact O-OG 2.82Å; L107-S109 PolarHBondContact O-N 2.96Å
110	I	48.2	Very low	59.4	Low	70 Å²	70	92.6 Å²	92.6	36%	0.359	51%	0.508	S	S	.	.	H	α-helix	trans	-82.7	-25.4	177.5	-49.3	-177.9	0	0	0	111.1	L107 L108 D208 I209	L107-I110 HydrophobicContact CD2-CD1 3.65Å; L107-I110 WeakPolarHBondContact O-CB 3.34Å; L107-I110 PolarHBondContact O-N 2.64Å; L107-I110 VanDerWaalsContact O-N 3.1Å; L108-I110 PolarHBondContact O-N 2.76Å; I110-D208 HydrophobicContact CD1-CB 4.25Å; I110-D208 HydrophobicContact CG1-CB 4.24Å; I110-I209 HydrophobicContact CD1-CG2 3.69Å
111	R	41	Very low	56.7	Low	183 Å²	183	98 Å²	98	69%	0.691	55%	0.553	S	S	*	*	H	α-helix	trans	-91.7	-17	-174.3	-62.3	-152.9	-157.7	-106.1	8.2	115.3	L108	L108-R111 PolarHBondContact O-N 3.39Å; L108-R111 VanDerWaalsContact O-N 3.15Å
112	W	38.5	Very low	54	Low	205 Å²	205	98.8 Å²	98.8	78%	0.777	57%	0.574	S	S	*	*	S	Bend	trans	-102.2	-9.4	-176.7	74.8	-95.2	0	0	0	114.8	A114	W112-A114 VanDerWaalsContact C-N 3.35Å; W112-A114 PolarHBondContact O-N 3.39Å
113	A	40.8	Very low	51.7	Low	80 Å²	80	103.3 Å²	103.3	66%	0.661	61%	0.605	S	S	*	*	S	Bend	trans	-82.3	3.3	-174.6	0	0	0	0	0	115.6
114	A	37.9	Very low	50.1	Low	70 Å²	70	104.7 Å²	104.7	58%	0.579	62%	0.617	S	S	*	*			trans	-150.7	123.9	176.3	0	0	0	0	0	114.3	W112 A116	W112-A114 VanDerWaalsContact C-N 3.35Å; W112-A114 PolarHBondContact O-N 3.39Å; A114-A116 HydrophobicContact CB-CB 4.4Å; A114-A116 PolarHBondContact O-N 3.48Å
115	P	42.6	Very low	48.8	Very low	143 Å²	143	106.8 Å²	106.8	93%	0.929	63%	0.634	S	S	*	*			trans	-85.1	82.5	151.7	33	-24	0	0	0	107.9
116	A	47.2	Very low	48.2	Very low	74 Å²	74	110.7 Å²	110.7	61%	0.612	65%	0.654	S	S	*	*			trans	-143.2	146.1	173.3	0	0	0	0	0	110.7	A114	A114-A116 HydrophobicContact CB-CB 4.4Å; A114-A116 PolarHBondContact O-N 3.48Å
117	P	42.9	Very low	48.4	Very low	126 Å²	126	109.9 Å²	109.9	82%	0.818	65%	0.65	S	S	*	*			trans	-65.9	140.1	-165	26.8	-32.8	0	0	0	111.5
118	R	47.7	Very low	49	Very low	238 Å²	238	109.5 Å²	109.5	90%	0.898	65%	0.648	S	S	*	*			trans	-44.8	123.8	179.8	-59.2	173.7	-178.7	178.7	-0.7	111.3
119	P	40.9	Very low	50.4	Low	108 Å²	108	105.7 Å²	105.7	70%	0.701	63%	0.628	S	S	*	*			trans	-75.7	141.6	157.3	18.4	-6.6	0	0	0	108.6	A121	P119-A121 PolarHBondContact O-N 3.09Å
120	L	42.4	Very low	52.3	Low	167 Å²	167	106 Å²	106	87%	0.874	63%	0.63	S	S	*	*			trans	-46.9	130.3	173.8	-70.6	146.5	0	0	0	110.2	G122	L120-G122 PolarHBondContact O-N 3.01Å
121	A	42.4	Very low	54.1	Low	114 Å²	114	106.8 Å²	106.8	94%	0.942	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	108.6	180	0	0	0	0	0	110	P119	P119-A121 PolarHBondContact O-N 3.09Å
122	G	41.7	Very low	56.4	Low	64 Å²	64	98.1 Å²	98.1	66%	0.66	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.5	-15.6	173.7	0	0	0	0	0	117.1	L120	L120-G122 PolarHBondContact O-N 3.01Å
123	S	46	Very low	58.8	Low	95 Å²	95	92.1 Å²	92.1	66%	0.664	58%	0.58	S	S	*	*	S	Bend	trans	-120.9	-1.7	-168.5	-168	0	0	0	0	116.5
124	S	59.4	Low	61.2	Low	88 Å²	88	93.5 Å²	93.5	62%	0.615	57%	0.573	S	S	*	*	H	α-helix	trans	-93.8	-32.2	-170.4	57.6	0	0	0	0	115	L128	S124-L128 WeakPolarHBondContact O-CB 3.39Å; S124-L128 PolarHBondContact O-N 3.43Å
125	S	60.1	Low	63.9	Low	65 Å²	65	92.1 Å²	92.1	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-69.6	-45.2	-179.8	49.3	0	0	0	0	111.9	S127 L128 L129	S125-S127 PolarHBondContact O-N 2.94Å; S125-L128 PolarHBondContact O-N 2.87Å; S125-L128 VanDerWaalsContact O-N 3.09Å; S125-L129 WeakPolarHBondContact O-CG 3.33Å; S125-L129 PolarHBondContact O-N 3.44Å
126	D	66.3	Low	66.5	Low	110 Å²	110	85.3 Å²	85.3	59%	0.588	51%	0.511	S	S	*	.	H	α-helix	trans	-69.6	-36.6	-174.5	-63.6	0	0	0	0	111.5	L128 S130	D126-L128 VanDerWaalsContact C-N 3.27Å; D126-L128 PolarHBondContact O-N 2.83Å; D126-S130 WeakPolarHBondContact O-CB 3.37Å; D126-S130 PolarHBondContact O-N 3.2Å; D126-S130 PolarHBondContact O-OG 3.09Å
127	S	74.4	Confident	68.8	Low	79 Å²	79	84.8 Å²	84.8	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-64.9	-32.8	172.1	-176.2	0	0	0	0	112.3	S125 S130 H131	S125-S127 PolarHBondContact O-N 2.94Å; S127-S130 WeakPolarHBondContact CA-OG 3Å; S127-S130 PolarHBondContact O-OG 3.22Å; S127-H131 WeakPolarHBondContact O-CB 3.25Å; S127-H131 PolarHBondContact O-N 3.28Å
128	L	74.9	Confident	71.4	Confident	40 Å²	40	80.1 Å²	80.1	21%	0.209	47%	0.465	C	S	.	.	H	α-helix	trans	-80.3	-40	-179	-177.2	145.2	0	0	0	111.4	S124 S125 D126 H131 V132 D208 I209	S124-L128 WeakPolarHBondContact O-CB 3.39Å; S124-L128 PolarHBondContact O-N 3.43Å; S125-L128 PolarHBondContact O-N 2.87Å; S125-L128 VanDerWaalsContact O-N 3.09Å; D126-L128 VanDerWaalsContact C-N 3.27Å; D126-L128 PolarHBondContact O-N 2.83Å; L128-H131 WeakPolarHBondContact O-CB 3.44Å; L128-H131 PolarHBondContact O-N 3.46Å; L128-V132 PolarHBondContact O-N 3.3Å; L128-D208 HydrophobicContact CD1-CB 4.41Å; L128-I209 HydrophobicContact CD1-CG2 4.08Å; L128-I209 HydrophobicContact CD2-CB 4.35Å; L128-I209 HydrophobicContact CD2-CD1 3.28Å; L128-I209 HydrophobicContact CD2-CG1 3.69Å; L128-I209 HydrophobicContact CD2-CG2 3.78Å
129	L	79.1	Confident	73.8	Confident	54 Å²	54	68.8 Å²	68.8	28%	0.283	42%	0.423	S	S	.	.	H	α-helix	trans	-65.5	-42.4	174.9	-68.4	175.7	0	0	0	111.6	V14 V18 S125 H131 V132 E133	V14-L129 HydrophobicContact CG1-CD1 4.04Å; V14-L129 HydrophobicContact CG1-CD2 3.74Å; V18-L129 HydrophobicContact CG2-CD2 4.36Å; S125-L129 WeakPolarHBondContact O-CG 3.33Å; S125-L129 PolarHBondContact O-N 3.44Å; L129-H131 VanDerWaalsContact C-N 3.3Å; L129-H131 PolarHBondContact O-N 3Å; L129-V132 PolarHBondContact O-N 3.32Å; L129-E133 WeakPolarHBondContact O-CB 3.49Å; L129-E133 PolarHBondContact O-N 2.93Å
130	S	84.9	Confident	76.5	Confident	52 Å²	52	63.6 Å²	63.6	36%	0.364	39%	0.389	S	S	.	.	H	α-helix	trans	-63.7	-34.6	173.5	55.9	0	0	0	0	112.5	D126 S127 E133 Q134	D126-S130 WeakPolarHBondContact O-CB 3.37Å; D126-S130 PolarHBondContact O-N 3.2Å; D126-S130 PolarHBondContact O-OG 3.09Å; S127-S130 WeakPolarHBondContact CA-OG 3Å; S127-S130 PolarHBondContact O-OG 3.22Å; S130-E133 WeakPolarHBondContact O-CB 3.44Å; S130-E133 PolarHBondContact O-N 3.3Å; S130-Q134 WeakPolarHBondContact O-CG 3.28Å; S130-Q134 PolarHBondContact O-N 3.44Å
131	H	85.9	Confident	79.1	Confident	87 Å²	87	59.7 Å²	59.7	40%	0.403	37%	0.369	S	S	.	.	H	α-helix	trans	-65.2	-44.6	172	-174.9	59.7	0	0	0	112	S127 L128 L129 E133 Q134 L135	S127-H131 WeakPolarHBondContact O-CB 3.25Å; S127-H131 PolarHBondContact O-N 3.28Å; L128-H131 WeakPolarHBondContact O-CB 3.44Å; L128-H131 PolarHBondContact O-N 3.46Å; L129-H131 VanDerWaalsContact C-N 3.3Å; L129-H131 PolarHBondContact O-N 3Å; H131-E133 VanDerWaalsContact C-N 3.32Å; H131-E133 PolarHBondContact O-N 2.85Å; H131-Q134 WeakPolarHBondContact O-CB 3.43Å; H131-Q134 PolarHBondContact O-N 3.01Å; H131-L135 WeakPolarHBondContact O-CG 3.46Å; H131-L135 PolarHBondContact O-N 3.43Å
132	V	88.4	Confident	81.7	Confident	2 Å²	2	59 Å²	59	1%	0.012	35%	0.345	C	S	.	.	H	α-helix	trans	-61.1	-41.7	174.1	167.8	0	0	0	0	111.2	V18 L128 L129 Q134 L135 L136 M205 I209 L210	V18-V132 HydrophobicContact CG1-CG1 4.18Å; L128-V132 PolarHBondContact O-N 3.3Å; L129-V132 PolarHBondContact O-N 3.32Å; V132-Q134 VanDerWaalsContact C-N 3.29Å; V132-Q134 PolarHBondContact O-N 2.8Å; V132-L135 WeakPolarHBondContact O-CA 3.48Å; V132-L135 WeakPolarHBondContact O-CB 3.41Å; V132-L135 PolarHBondContact O-N 3.41Å; V132-L136 HydrophobicContact CG1-CD1 3.82Å; V132-L136 HydrophobicContact CG1-CG 4.06Å; V132-L136 VanDerWaalsContact O-CG 3.29Å; V132-L136 WeakPolarHBondContact O-CG 3.25Å; V132-L136 PolarHBondContact O-N 3.35Å; V132-M205 HydrophobicContact CG1-CE 4.26Å; V132-I209 HydrophobicContact CG2-CD1 3.88Å; V132-I209 HydrophobicContact CG2-CG1 4.01Å; V132-L210 HydrophobicContact CG1-CD2 4.44Å
133	E	89.9	Confident	84.4	Confident	78 Å²	78	56 Å²	56	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-55.6	-44	174.6	-162.1	-163.2	149.6	0	0	112.1	Y48 L129 S130 H131 L135 L136 R137	Y48-E133 WeakPolarHBondContact CA-OE1 3.46Å; Y48-E133 HydrophobicContact CD1-CG 3.36Å; Y48-E133 HydrophobicContact CE1-CG 3.94Å; Y48-E133 HydrophobicContact CG-CG 4.42Å; L129-E133 WeakPolarHBondContact O-CB 3.49Å; L129-E133 PolarHBondContact O-N 2.93Å; S130-E133 WeakPolarHBondContact O-CB 3.44Å; S130-E133 PolarHBondContact O-N 3.3Å; H131-E133 VanDerWaalsContact C-N 3.32Å; H131-E133 PolarHBondContact O-N 2.85Å; E133-L135 VanDerWaalsContact C-N 3.34Å; E133-L135 PolarHBondContact O-N 2.82Å; E133-L136 PolarHBondContact O-N 2.96Å; E133-R137 PolarHBondContact O-N 3.01Å
134	Q	90.8	Very high	86.8	Confident	110 Å²	110	53.5 Å²	53.5	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-36.6	175.2	-69.9	171.3	-21.2	0	0	112.5	S130 H131 V132 R137	S130-Q134 WeakPolarHBondContact O-CG 3.28Å; S130-Q134 PolarHBondContact O-N 3.44Å; H131-Q134 WeakPolarHBondContact O-CB 3.43Å; H131-Q134 PolarHBondContact O-N 3.01Å; V132-Q134 VanDerWaalsContact C-N 3.29Å; V132-Q134 PolarHBondContact O-N 2.8Å; Q134-R137 WeakPolarHBondContact O-CB 3.43Å
135	L	94.1	Very high	88.6	Confident	40 Å²	40	53.3 Å²	53.3	21%	0.209	29%	0.291	C	S	.	.	H	α-helix	trans	-68.9	-43.6	175.6	-66.4	175	0	0	0	111.2	H131 V132 E133 R137 A138 F139 M205	H131-L135 WeakPolarHBondContact O-CG 3.46Å; H131-L135 PolarHBondContact O-N 3.43Å; V132-L135 WeakPolarHBondContact O-CA 3.48Å; V132-L135 WeakPolarHBondContact O-CB 3.41Å; V132-L135 PolarHBondContact O-N 3.41Å; E133-L135 VanDerWaalsContact C-N 3.34Å; E133-L135 PolarHBondContact O-N 2.82Å; L135-R137 VanDerWaalsContact C-N 3.31Å; L135-R137 PolarHBondContact O-N 3.47Å; L135-A138 WeakPolarHBondContact O-CB 3.3Å; L135-A138 PolarHBondContact O-N 3.03Å; L135-A138 VanDerWaalsContact O-N 3.08Å; L135-F139 WeakPolarHBondContact O-CD2 3.44Å; L135-M205 HydrophobicContact CB-CB 4.24Å; L135-M205 HydrophobicContact CB-CE 3.65Å; L135-M205 HydrophobicContact CB-SD 3.86Å; L135-M205 HydrophobicContact CD1-CB 4.39Å; L135-M205 HydrophobicContact CD1-CE 3.7Å; L135-M205 HydrophobicContact CG-CE 4.34Å
136	L	96.2	Very high	90.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-36.5	177	-67.7	175	0	0	0	112.1	V18 F22 Y48 V132 E133 A138 F139 I140 M205 M212	V18-L136 HydrophobicContact CG1-CD1 3.65Å; F22-L136 HydrophobicContact CB-CD1 4.13Å; F22-L136 HydrophobicContact CB-CD2 4.4Å; F22-L136 HydrophobicContact CD1-CD2 4.05Å; F22-L136 HydrophobicContact CD2-CB 3.9Å; F22-L136 HydrophobicContact CD2-CD1 4.37Å; F22-L136 HydrophobicContact CD2-CD2 3.79Å; F22-L136 HydrophobicContact CD2-CG 4.22Å; F22-L136 HydrophobicContact CE1-CD2 4.31Å; F22-L136 HydrophobicContact CE2-CB 4.21Å; F22-L136 HydrophobicContact CE2-CD2 4.04Å; F22-L136 HydrophobicContact CG-CD1 4.32Å; F22-L136 HydrophobicContact CG-CD2 3.78Å; F22-L136 HydrophobicContact CG-CG 4.45Å; F22-L136 HydrophobicContact CZ-CD2 4.3Å; Y48-L136 HydrophobicContact CE1-CD1 4.45Å; V132-L136 HydrophobicContact CG1-CD1 3.82Å; V132-L136 HydrophobicContact CG1-CG 4.06Å; V132-L136 VanDerWaalsContact O-CG 3.29Å; V132-L136 WeakPolarHBondContact O-CG 3.25Å; V132-L136 PolarHBondContact O-N 3.35Å; E133-L136 PolarHBondContact O-N 2.96Å; L136-A138 PolarHBondContact O-N 3.42Å; L136-A138 VanDerWaalsContact O-N 3.16Å; L136-F139 WeakPolarHBondContact O-CB 3.29Å; L136-F139 PolarHBondContact O-N 2.98Å; L136-I140 PolarHBondContact O-N 2.82Å; L136-M205 HydrophobicContact CD2-SD 3.92Å; L136-M212 HydrophobicContact CD2-CE 3.52Å
137	R	96.5	Very high	91.5	Very high	64 Å²	64	49.1 Å²	49.1	24%	0.242	26%	0.263	C	S	.	.	H	α-helix	trans	-51.3	-38.9	171.7	-176.8	-173.7	-61.4	162.6	5.4	112.5	Y48 V50 E133 Q134 L135 F139 I140 L141	Y48-R137 WeakPolarHBondContact O-CD 3.31Å; Y48-R137 WeakPolarHBondContact O-CG 3.36Å; Y48-R137 PolarHBondContact O-NE 2.71Å; Y48-R137 PolarHBondContact O-NH2 3.42Å; V50-R137 HydrophobicContact CB-CG 4.39Å; V50-R137 HydrophobicContact CG1-CG 3.43Å; V50-R137 VanDerWaalsContact CG1-CG 3.43Å; V50-R137 HydrophobicContact CG2-CG 4.05Å; E133-R137 PolarHBondContact O-N 3.01Å; Q134-R137 WeakPolarHBondContact O-CB 3.43Å; L135-R137 VanDerWaalsContact C-N 3.31Å; L135-R137 PolarHBondContact O-N 3.47Å; R137-F139 VanDerWaalsContact C-N 3.27Å; R137-F139 PolarHBondContact O-N 3.23Å; R137-I140 PolarHBondContact O-N 3.02Å; R137-L141 HydrophobicContact CG-CD1 4.26Å; R137-L141 WeakPolarHBondContact O-CG 3.31Å; R137-L141 PolarHBondContact O-N 3.48Å
138	A	96.6	Very high	92.4	Very high	27 Å²	27	49.5 Å²	49.5	22%	0.223	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-30.1	-179.7	0	0	0	0	0	112.6	L135 L136 K142 K203	L135-A138 WeakPolarHBondContact O-CB 3.3Å; L135-A138 PolarHBondContact O-N 3.03Å; L135-A138 VanDerWaalsContact O-N 3.08Å; L136-A138 PolarHBondContact O-N 3.42Å; L136-A138 VanDerWaalsContact O-N 3.16Å; A138-K142 WeakPolarHBondContact O-CB 3.35Å; A138-K142 VanDerWaalsContact O-CG 3.26Å; A138-K142 WeakPolarHBondContact O-CG 3.4Å; A138-K142 PolarHBondContact O-N 2.86Å; A138-K142 VanDerWaalsContact O-N 3.11Å; A138-K203 HydrophobicContact CB-CD 4.16Å; A138-K203 HydrophobicContact CB-CG 4.36Å
139	F	98.1	Very high	93.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-47.3	173.7	-70.3	-103.2	0	0	0	110.8	F22 L135 L136 R137 L141 K142 I143 K203 M205 M212 L214	F22-F139 HydrophobicContact CE2-CB 3.75Å; F22-F139 HydrophobicContact CE2-CG 4.4Å; F22-F139 HydrophobicContact CZ-CB 3.56Å; F22-F139 HydrophobicContact CZ-CD1 4.28Å; F22-F139 AromaticContact CZ-CG 3.94Å; F22-F139 HydrophobicContact CZ-CG 3.94Å; L135-F139 WeakPolarHBondContact O-CD2 3.44Å; L136-F139 WeakPolarHBondContact O-CB 3.29Å; L136-F139 PolarHBondContact O-N 2.98Å; R137-F139 VanDerWaalsContact C-N 3.27Å; R137-F139 PolarHBondContact O-N 3.23Å; F139-L141 VanDerWaalsContact C-N 3.3Å; F139-L141 PolarHBondContact O-N 3.13Å; F139-K142 PolarHBondContact O-N 2.87Å; F139-I143 WeakPolarHBondContact O-CG1 3.32Å; F139-I143 PolarHBondContact O-N 3.12Å; F139-K203 HydrophobicContact CD1-CB 3.79Å; F139-K203 HydrophobicContact CD1-CG 4.13Å; F139-K203 HydrophobicContact CD2-CB 4.4Å; F139-K203 HydrophobicContact CD2-CG 3.84Å; F139-K203 HydrophobicContact CE1-CB 3.77Å; F139-K203 HydrophobicContact CE1-CG 4.01Å; F139-K203 WeakPolarHBondContact CE1-O 3.2Å; F139-K203 HydrophobicContact CE2-CB 4.37Å; F139-K203 HydrophobicContact CE2-CG 3.69Å; F139-K203 HydrophobicContact CG-CB 4.1Å; F139-K203 HydrophobicContact CG-CG 4.04Å; F139-K203 HydrophobicContact CZ-CB 4.06Å; F139-K203 HydrophobicContact CZ-CG 3.78Å; F139-M205 HydrophobicContact CD2-SD 4.31Å; F139-M205 HydrophobicContact CE2-CB 3.78Å; F139-M205 HydrophobicContact CE2-CG 3.55Å; F139-M205 HydrophobicContact CE2-SD 3.47Å; F139-M205 WeakPolarHBondContact CE2-SD 3.31Å; F139-M205 HydrophobicContact CZ-CB 4.06Å; F139-M205 HydrophobicContact CZ-CG 3.66Å; F139-M205 HydrophobicContact CZ-SD 4.06Å; F139-M212 HydrophobicContact CD1-CE 3.88Å; F139-M212 HydrophobicContact CD2-CE 4.03Å; F139-M212 HydrophobicContact CE1-CE 3.69Å; F139-M212 HydrophobicContact CE1-CG 4.37Å; F139-M212 HydrophobicContact CE2-CE 3.86Å; F139-M212 HydrophobicContact CG-CE 4.06Å; F139-M212 HydrophobicContact CZ-CB 4.39Å; F139-M212 HydrophobicContact CZ-CE 3.7Å; F139-M212 HydrophobicContact CZ-CG 4.46Å; F139-L214 HydrophobicContact CD1-CB 3.5Å; F139-L214 VanDerWaalsContact CD1-CB 3.5Å; F139-L214 HydrophobicContact CD1-CD2 3.93Å; F139-L214 HydrophobicContact CD1-CG 4.38Å; F139-L214 HydrophobicContact CE1-CB 3.56Å
140	I	98.1	Very high	94.1	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.8	-43.9	178.1	-60.8	-52.6	0	0	0	111.5	F22 V25 A26 L29 Y48 V50 V52 L136 R137 K142 I143 S144	F22-I140 HydrophobicContact CD2-CD1 4.15Å; F22-I140 HydrophobicContact CE2-CD1 3.71Å; F22-I140 HydrophobicContact CE2-CG1 4.12Å; V25-I140 HydrophobicContact CG1-CD1 3.91Å; A26-I140 HydrophobicContact CB-CD1 4.34Å; L29-I140 HydrophobicContact CD2-CG2 3.77Å; L29-I140 WeakPolarHBondContact CD2-O 3.36Å; Y48-I140 HydrophobicContact CD2-CG1 3.94Å; Y48-I140 HydrophobicContact CE2-CG1 4.44Å; V50-I140 HydrophobicContact CG2-CB 4.14Å; V50-I140 HydrophobicContact CG2-CG2 3.64Å; V52-I140 HydrophobicContact CG1-CG2 3.52Å; L136-I140 PolarHBondContact O-N 2.82Å; R137-I140 PolarHBondContact O-N 3.02Å; I140-K142 VanDerWaalsContact C-N 3.33Å; I140-K142 PolarHBondContact O-N 2.77Å; I140-I143 PolarHBondContact O-N 2.74Å; I140-S144 WeakPolarHBondContact O-CB 3.45Å; I140-S144 PolarHBondContact O-N 2.85Å; I140-S144 PolarHBondContact O-OG 3Å
141	L	97.5	Very high	94.5	Very high	85 Å²	85	50.3 Å²	50.3	45%	0.445	28%	0.275	S	S	.	.	H	α-helix	trans	-63.6	-37.9	175.6	-70	173.9	0	0	0	112.4	V50 R137 F139 S144 V145	V50-L141 HydrophobicContact CB-CD2 4.24Å; V50-L141 HydrophobicContact CG1-CD1 4.32Å; V50-L141 HydrophobicContact CG1-CD2 3.84Å; V50-L141 HydrophobicContact CG1-CG 4.1Å; R137-L141 HydrophobicContact CG-CD1 4.26Å; R137-L141 WeakPolarHBondContact O-CG 3.31Å; R137-L141 PolarHBondContact O-N 3.48Å; F139-L141 VanDerWaalsContact C-N 3.3Å; F139-L141 PolarHBondContact O-N 3.13Å; L141-S144 PolarHBondContact O-N 3.13Å; L141-V145 WeakPolarHBondContact O-CG2 3.36Å
142	K	97.8	Very high	94.9	Very high	100 Å²	100	53.7 Å²	53.7	44%	0.435	29%	0.29	S	S	.	.	H	α-helix	trans	-70.7	-37.1	177.4	-76	-71.2	-175	-177.9	0	112.9	A138 F139 I140 S144 V145 C146 L202 K203	A138-K142 WeakPolarHBondContact O-CB 3.35Å; A138-K142 VanDerWaalsContact O-CG 3.26Å; A138-K142 WeakPolarHBondContact O-CG 3.4Å; A138-K142 PolarHBondContact O-N 2.86Å; A138-K142 VanDerWaalsContact O-N 3.11Å; F139-K142 PolarHBondContact O-N 2.87Å; I140-K142 VanDerWaalsContact C-N 3.33Å; I140-K142 PolarHBondContact O-N 2.77Å; K142-S144 VanDerWaalsContact C-N 3.32Å; K142-V145 PolarHBondContact O-N 2.85Å; K142-C146 PolarHBondContact O-N 3.21Å; K142-L202 HydrophobicContact CB-CB 4.35Å; K142-L202 WeakPolarHBondContact CD-O 3.34Å; K142-L202 WeakPolarHBondContact CG-O 3.13Å; K142-K203 HydrophobicContact CG-CB 4.27Å
143	I	97.9	Very high	95.2	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.3	-39.1	172.8	-63.8	166.3	0	0	0	110.1	A26 L29 I30 V33 F139 I140 V145 C146 L214	A26-I143 HydrophobicContact CB-CD1 3.91Å; L29-I143 HydrophobicContact CB-CG2 4.21Å; L29-I143 HydrophobicContact CD2-CB 3.87Å; L29-I143 HydrophobicContact CD2-CG2 3.74Å; L29-I143 HydrophobicContact CG-CB 4.41Å; L29-I143 HydrophobicContact CG-CG2 3.71Å; I30-I143 HydrophobicContact CG1-CD1 4.42Å; I30-I143 HydrophobicContact CG1-CG2 3.79Å; V33-I143 HydrophobicContact CG2-CG2 4.16Å; F139-I143 WeakPolarHBondContact O-CG1 3.32Å; F139-I143 PolarHBondContact O-N 3.12Å; I140-I143 PolarHBondContact O-N 2.74Å; I143-V145 PolarHBondContact O-N 3.06Å; I143-C146 PolarHBondContact O-N 3.02Å; I143-C146 PolarHBondContact O-SG 3.34Å; I143-L214 HydrophobicContact CD1-CD2 3.82Å; I143-L214 HydrophobicContact CG1-CD2 3.66Å
144	S	96.8	Very high	95.4	Very high	43 Å²	43	52.2 Å²	52.2	30%	0.301	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.5	-179.1	-61.6	0	0	0	0	114.5	I140 L141 K142	I140-S144 WeakPolarHBondContact O-CB 3.45Å; I140-S144 PolarHBondContact O-N 2.85Å; I140-S144 PolarHBondContact O-OG 3Å; L141-S144 PolarHBondContact O-N 3.13Å; K142-S144 VanDerWaalsContact C-N 3.32Å
145	V	95.6	Very high	95.5	Very high	83 Å²	83	52 Å²	52	50%	0.503	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	15.1	-178.2	-56.3	0	0	0	0	112.1	L141 K142 I143 D147 A148	L141-V145 WeakPolarHBondContact O-CG2 3.36Å; K142-V145 PolarHBondContact O-N 2.85Å; I143-V145 PolarHBondContact O-N 3.06Å; V145-D147 VanDerWaalsContact C-N 3.26Å; V145-D147 VanDerWaalsContact C-OD1 3.25Å; V145-D147 WeakPolarHBondContact CA-OD1 3.37Å; V145-D147 PolarHBondContact O-N 3.44Å; V145-A148 PolarHBondContact O-N 2.94Å
146	C	95.1	Very high	95.5	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.007	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-74.6	-19.6	-178.5	70.4	0	0	0	0	112.6	K142 I143 A148 V149 L150 L202	K142-C146 PolarHBondContact O-N 3.21Å; I143-C146 PolarHBondContact O-N 3.02Å; I143-C146 PolarHBondContact O-SG 3.34Å; C146-A148 PolarHBondContact O-N 3.25Å; C146-V149 HydrophobicContact CB-CG2 4.47Å; C146-V149 WeakPolarHBondContact O-CG2 3.32Å; C146-V149 PolarHBondContact O-N 3.43Å; C146-L150 HydrophobicContact CB-CD1 4.03Å; C146-L150 WeakPolarHBondContact O-CB 3.36Å; C146-L150 VanDerWaalsContact O-CG 3.26Å; C146-L150 WeakPolarHBondContact O-CG 3.37Å; C146-L150 PolarHBondContact O-N 3.39Å; C146-L202 HydrophobicContact CB-CD1 4.11Å; C146-L202 HydrophobicContact CB-CD2 4.03Å
147	D	93.3	Very high	95.6	Very high	87 Å²	87	53.6 Å²	53.6	47%	0.465	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-55.9	-32.3	172.2	66	-33.3	0	0	0	113	V145 V149	V145-D147 VanDerWaalsContact C-N 3.26Å; V145-D147 VanDerWaalsContact C-OD1 3.25Å; V145-D147 WeakPolarHBondContact CA-OD1 3.37Å; V145-D147 PolarHBondContact O-N 3.44Å; D147-V149 VanDerWaalsContact C-N 3.26Å; D147-V149 PolarHBondContact O-N 2.58Å
148	A	93	Very high	95.6	Very high	87 Å²	87	53.4 Å²	53.4	72%	0.719	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-72.6	-15.2	177.5	0	0	0	0	0	114.3	V145 C146	V145-A148 PolarHBondContact O-N 2.94Å; C146-A148 PolarHBondContact O-N 3.25Å
149	V	94.3	Very high	95.7	Very high	75 Å²	75	53 Å²	53	46%	0.455	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-12.7	-178.8	-59.3	0	0	0	0	113.6	C146 D147 R198 I200 L202	C146-V149 HydrophobicContact CB-CG2 4.47Å; C146-V149 WeakPolarHBondContact O-CG2 3.32Å; C146-V149 PolarHBondContact O-N 3.43Å; D147-V149 VanDerWaalsContact C-N 3.26Å; D147-V149 PolarHBondContact O-N 2.58Å; V149-R198 PolarHBondContact O-NH2 2.85Å; V149-I200 HydrophobicContact CG2-CG2 4.17Å; V149-L202 HydrophobicContact CG2-CD2 4.29Å
150	L	94.8	Very high	95.7	Very high	8 Å²	8	54.8 Å²	54.8	4%	0.042	33%	0.327	C	S	.	.	S	Bend	trans	-103.6	142	178.7	-62.1	175.1	0	0	0	110.2	F98 C146 I200 V216 E218	F98-L150 HydrophobicContact CE1-CD1 4.24Å; F98-L150 HydrophobicContact CZ-CD1 3.7Å; C146-L150 HydrophobicContact CB-CD1 4.03Å; C146-L150 WeakPolarHBondContact O-CB 3.36Å; C146-L150 VanDerWaalsContact O-CG 3.26Å; C146-L150 WeakPolarHBondContact O-CG 3.37Å; C146-L150 PolarHBondContact O-N 3.39Å; L150-I200 HydrophobicContact CD2-CD1 3.47Å; L150-I200 VanDerWaalsContact CD2-CD1 3.47Å; L150-V216 HydrophobicContact CD1-CG1 4.38Å; L150-V216 HydrophobicContact CD1-CG2 4.31Å; L150-V216 HydrophobicContact CD2-CB 3.97Å; L150-V216 HydrophobicContact CD2-CG1 3.75Å; L150-V216 HydrophobicContact CD2-CG2 4.27Å; L150-E218 WeakPolarHBondContact CA-OE1 3.39Å
151	D	94.4	Very high	95.7	Very high	80 Å²	80	55.4 Å²	55.4	43%	0.428	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-69.3	152.9	174.2	-65.6	-30.6	0	0	0	110.4	R34 N153 E218 K222	R34-D151 PolarHBondContact NH2-O 2.83Å; D151-N153 PolarHBondContact O-N 3.23Å; D151-E218 PolarHBondContact N-OE1 3.04Å; D151-K222 HydrophobicContact CB-CD 4.37Å; D151-K222 PolarHBondContact O-NZ 2.96Å
152	H	93.6	Very high	95.6	Very high	157 Å²	157	52.2 Å²	52.2	73%	0.727	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-60.4	138.9	177.8	-68.9	-66.8	0	0	0	112	K222	H152-K222 WeakPolarHBondContact O-CD 3.49Å
153	N	94.9	Very high	95.5	Very high	30 Å²	30	48.8 Å²	48.8	16%	0.16	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-78.1	151	175	-72.7	-20.9	0	0	0	110.8	R34 E96 D151 K222	R34-N153 PolarHBondContact NH2-OD1 2.88Å; E96-N153 WeakPolarHBondContact CG-OD1 3.08Å; E96-N153 PolarHBondContact OE1-OD1 2.96Å; E96-N153 PolarHBondContact OE2-ND2 2.91Å; E96-N153 PolarHBondContact OE2-OD1 3.11Å; D151-N153 PolarHBondContact O-N 3.23Å; N153-K222 PolarHBondContact OD1-NZ 3.01Å
154	P	94.1	Very high	95.3	Very high	20 Å²	20	52.2 Å²	52.2	13%	0.13	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-58.2	153.7	169.5	-21.7	33.4	0	0	0	111.7	V95 C157 K222	V95-P154 HydrophobicContact CG1-CG 4.4Å; P154-C157 PolarHBondContact O-SG 3.31Å; P154-K222 HydrophobicContact CG-CB 4.42Å; P154-K222 WeakPolarHBondContact CG-O 3.43Å
155	P	93.3	Very high	95.1	Very high	106 Å²	106	51.6 Å²	51.6	69%	0.688	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	150.9	174.2	29.6	-35	0	0	0	111.2
156	G	94	Very high	94.6	Very high	58 Å²	58	52.2 Å²	52.2	60%	0.598	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	25.4	177	0	0	0	0	0	114
157	C	97	Very high	94	Very high	14 Å²	14	56.6 Å²	56.6	10%	0.095	33%	0.326	C	S	.	.			trans	-65.3	149.5	173.2	-80.9	0	0	0	0	112.5	I87 L88 P154	I87-C157 HydrophobicContact CG2-CB 3.73Å; L88-C157 CarbonylContact O-C 3.53Å; L88-C157 WeakPolarHBondContact O-CA 3.29Å; L88-C157 WeakPolarHBondContact O-CB 3.47Å; L88-C157 PolarHBondContact O-SG 3.03Å; L88-C157 VanDerWaalsContact O-SG 3.34Å; P154-C157 PolarHBondContact O-SG 3.31Å
158	T	97.6	Very high	93.1	Very high	60 Å²	60	55.5 Å²	55.5	37%	0.368	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	-180	170.5	60.3	0	0	0	0	109.4	I87 L88	I87-T158 WeakPolarHBondContact CA-O 3.5Å; L88-T158 PolarHBondContact N-O 3.32Å; L88-T158 PolarHBondContact O-N 2.81Å
159	F	98.4	Very high	91.8	Very high	19 Å²	19	53.3 Å²	53.3	8%	0.083	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	157.3	175.7	85.4	-73.7	0	0	0	112.6	V27 L31 V36 Y37 L60 Y63 I64 V85 V86 V161	V27-F159 HydrophobicContact CG1-CE2 4.28Å; L31-F159 HydrophobicContact CD1-CD1 4.32Å; L31-F159 HydrophobicContact CD1-CE1 3.9Å; L31-F159 HydrophobicContact CD1-CE2 4.37Å; L31-F159 HydrophobicContact CD1-CZ 3.92Å; L31-F159 HydrophobicContact CD2-CB 3.96Å; L31-F159 HydrophobicContact CD2-CD1 3.54Å; L31-F159 HydrophobicContact CD2-CD2 4.03Å; L31-F159 HydrophobicContact CD2-CE1 4Å; L31-F159 HydrophobicContact CD2-CE2 4.42Å; L31-F159 HydrophobicContact CD2-CG 3.56Å; L31-F159 HydrophobicContact CD2-CZ 4.41Å; V36-F159 HydrophobicContact CG1-CB 4.43Å; V36-F159 HydrophobicContact CG1-CD1 4.39Å; Y37-F159 AromaticContact CE2-CD1 3.84Å; Y37-F159 HydrophobicContact CE2-CD1 3.84Å; Y37-F159 AromaticContact CE2-CE1 3.68Å; Y37-F159 HydrophobicContact CE2-CE1 3.68Å; Y37-F159 WeakPolarHBondContact OH-CE1 3.32Å; L60-F159 HydrophobicContact CD1-CE1 3.75Å; L60-F159 HydrophobicContact CD1-CZ 3.95Å; Y63-F159 HydrophobicContact CD1-CE2 4.37Å; Y63-F159 AromaticContact CD1-CZ 3.76Å; Y63-F159 HydrophobicContact CD1-CZ 3.76Å; Y63-F159 HydrophobicContact CE1-CE1 4.44Å; Y63-F159 AromaticContact CE1-CE2 3.86Å; Y63-F159 HydrophobicContact CE1-CE2 3.86Å; Y63-F159 AromaticContact CE1-CZ 3.62Å; Y63-F159 HydrophobicContact CE1-CZ 3.62Å; I64-F159 HydrophobicContact CG1-CZ 4.2Å; V85-F159 HydrophobicContact CG1-CD2 4.13Å; V86-F159 CarbonylContact O-C 3.54Å; V86-F159 WeakPolarHBondContact O-CA 3.38Å; V86-F159 WeakPolarHBondContact O-CB 3.47Å; F159-V161 HydrophobicContact CD2-CG2 4.44Å; F159-V161 HydrophobicContact CE2-CG2 4.21Å
160	T	97.5	Very high	90.4	Very high	37 Å²	37	54.3 Å²	54.3	23%	0.227	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	165.5	168	-171.5	0	0	0	0	109.8	V86 L88	V86-T160 HydrophobicContact CB-CG2 3.87Å; V86-T160 HydrophobicContact CG1-CG2 4.44Å; V86-T160 HydrophobicContact CG2-CG2 4.46Å; V86-T160 PolarHBondContact N-O 2.89Å; V86-T160 PolarHBondContact O-N 2.93Å; L88-T160 HydrophobicContact CD1-CG2 4.06Å
161	V	97.8	Very high	89	Confident	14 Å²	14	62.1 Å²	62.1	9%	0.085	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.6	178	179.8	0	0	0	0	110	T67 V83 V84 F159	T67-V161 HydrophobicContact CG2-CB 3.89Å; T67-V161 HydrophobicContact CG2-CG1 3.98Å; T67-V161 HydrophobicContact CG2-CG2 4.12Å; V83-V161 HydrophobicContact CG1-CG1 4.02Å; V84-V161 CarbonylContact O-C 3.6Å; V84-V161 VanDerWaalsContact O-CA 3.31Å; V84-V161 WeakPolarHBondContact O-CA 3.43Å; F159-V161 HydrophobicContact CD2-CG2 4.44Å; F159-V161 HydrophobicContact CE2-CG2 4.21Å
162	L	96.4	Very high	87.8	Confident	17 Å²	17	58.5 Å²	58.5	9%	0.089	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	144.1	172.8	-53.3	177.8	0	0	0	110.3	V84 V86 A187 V192	V84-L162 HydrophobicContact CB-CB 4.19Å; V84-L162 PolarHBondContact N-O 2.87Å; V84-L162 PolarHBondContact O-N 3.47Å; V86-L162 HydrophobicContact CG2-CD1 3.6Å; V86-L162 HydrophobicContact CG2-CG 3.77Å; L162-A187 HydrophobicContact CD2-CB 4.04Å; L162-V192 HydrophobicContact CD1-CG2 4.16Å
163	V	95.6	Very high	86.8	Confident	29 Å²	29	53.7 Å²	53.7	18%	0.176	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	113.6	177.3	-177.3	0	0	0	0	108.1	V71 L74 V80 K82 T165 W184	V71-V163 HydrophobicContact CG2-CG2 3.66Å; L74-V163 HydrophobicContact CD1-CG1 4.42Å; V80-V163 HydrophobicContact CG1-CG1 4.06Å; V80-V163 HydrophobicContact CG2-CG1 4.16Å; K82-V163 WeakPolarHBondContact O-CA 3.33Å; V163-T165 HydrophobicContact CG1-CG2 4.33Å; V163-W184 HydrophobicContact CB-CZ3 4.29Å; V163-W184 HydrophobicContact CG2-CH2 3.58Å; V163-W184 HydrophobicContact CG2-CZ3 3.62Å
164	H	93.8	Very high	85.4	Confident	72 Å²	72	60.6 Å²	60.6	33%	0.333	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	118.1	172.6	-68.4	-119.8	0	0	0	108	E81 K82	E81-H164 PolarHBondContact N-O 2.82Å; K82-H164 HydrophobicContact CB-CB 3.91Å; K82-H164 HydrophobicContact CG-CB 4.22Å; K82-H164 PolarHBondContact N-O 3.06Å; K82-H164 PolarHBondContact O-N 2.99Å
165	T	91.9	Very high	84.1	Confident	29 Å²	29	62.6 Å²	62.6	18%	0.178	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	147.6	177.3	58.7	0	0	0	0	111.8	L74 D79 V163 E167 N172	L74-T165 HydrophobicContact CD1-CG2 4.46Å; D79-T165 CarbonylContact O-C 3.53Å; D79-T165 WeakPolarHBondContact O-CA 3.47Å; D79-T165 WeakPolarHBondContact O-CB 3.38Å; V163-T165 HydrophobicContact CG1-CG2 4.33Å; T165-E167 VanDerWaalsContact C-N 3.34Å; T165-E167 PolarHBondContact O-N 3.29Å; T165-E167 PolarHBondContact OG1-O 2.8Å; T165-N172 WeakPolarHBondContact CB-ND2 3.29Å; T165-N172 HydrophobicContact CG2-CB 4.13Å; T165-N172 PolarHBondContact OG1-ND2 3.29Å
166	R	86.8	Confident	83.2	Confident	97 Å²	97	58.2 Å²	58.2	37%	0.366	31%	0.314	S	S	.	.	S	Bend	trans	-67.4	-33.7	179.1	-61.8	-171.7	-169.4	-72.1	-10.2	113.1	N78 D79 V80 E81 I102	N78-R166 WeakPolarHBondContact O-CD 3.47Å; N78-R166 PolarHBondContact O-NE 3.3Å; N78-R166 PolarHBondContact OD1-NE 3.45Å; N78-R166 PolarHBondContact OD1-NH2 3.49Å; D79-R166 PolarHBondContact O-N 2.92Å; V80-R166 PolarHBondContact O-NE 3.4Å; V80-R166 PolarHBondContact O-NH2 3.05Å; E81-R166 HydrophobicContact CB-CG 4.1Å; I102-R166 PolarHBondContact O-NH2 3.06Å
167	E	82.1	Confident	82.3	Confident	92 Å²	92	60.1 Å²	60.1	43%	0.43	31%	0.307	S	S	.	.	S	Bend	trans	-100.5	164.6	173.1	-65.7	-165.9	177	0	0	110.9	T165 A169	T165-E167 VanDerWaalsContact C-N 3.34Å; T165-E167 PolarHBondContact O-N 3.29Å; T165-E167 PolarHBondContact OG1-O 2.8Å; E167-A169 PolarHBondContact O-N 3.38Å
168	A	74.4	Confident	81.2	Confident	64 Å²	64	63 Å²	63	53%	0.529	32%	0.324	S	S	.	.			trans	-51.2	128.8	176.3	0	0	0	0	0	111.7	T170 R171	A168-T170 PolarHBondContact O-N 3.24Å; A168-R171 PolarHBondContact O-N 3.1Å
169	A	65.9	Low	80.2	Confident	42 Å²	42	61.9 Å²	61.9	35%	0.347	32%	0.316	S	S	.	.	H	α-helix	trans	-56.4	-27.8	-172.7	0	0	0	0	0	113.7	E167 R171 N172 M173 L186	E167-A169 PolarHBondContact O-N 3.38Å; A169-R171 VanDerWaalsContact C-N 3.27Å; A169-R171 PolarHBondContact O-N 2.69Å; A169-N172 CarbonylContact O-C 3.54Å; A169-N172 PolarHBondContact O-N 3.11Å; A169-M173 PolarHBondContact O-N 3.36Å; A169-L186 HydrophobicContact CB-CD2 3.32Å
170	T	64.3	Low	78.8	Confident	96 Å²	96	70.3 Å²	70.3	59%	0.589	35%	0.352	S	S	*	.	H	α-helix	trans	-58	-34.5	176.6	50.6	0	0	0	0	113.6	A168 N172	A168-T170 PolarHBondContact O-N 3.24Å; T170-N172 VanDerWaalsContact C-N 3.33Å
171	R	64.6	Low	78.1	Confident	171 Å²	171	75.5 Å²	75.5	65%	0.645	38%	0.379	S	S	*	.	H	α-helix	trans	-77.3	-22.7	176.7	-67	-175.3	175.2	-149.2	-3.5	113.3	A168 A169	A168-R171 PolarHBondContact O-N 3.1Å; A169-R171 VanDerWaalsContact C-N 3.27Å; A169-R171 PolarHBondContact O-N 2.69Å
172	N	70.9	Confident	77.6	Confident	4 Å²	4	76.7 Å²	76.7	2%	0.021	38%	0.383	C	S	.	.	H	α-helix	trans	-98.6	-13.2	-176.8	-67.9	-34.2	0	0	0	112.2	L74 D79 T165 A169 T170 E174 K175 I176	L74-N172 HydrophobicContact CD2-CB 3.82Å; D79-N172 PolarHBondContact OD2-OD1 2.93Å; T165-N172 WeakPolarHBondContact CB-ND2 3.29Å; T165-N172 HydrophobicContact CG2-CB 4.13Å; T165-N172 PolarHBondContact OG1-ND2 3.29Å; A169-N172 CarbonylContact O-C 3.54Å; A169-N172 PolarHBondContact O-N 3.11Å; T170-N172 VanDerWaalsContact C-N 3.33Å; N172-E174 PolarHBondContact O-N 2.78Å; N172-K175 WeakPolarHBondContact O-CA 3.5Å; N172-K175 WeakPolarHBondContact O-CB 3.34Å; N172-K175 PolarHBondContact O-N 3.5Å; N172-K175 WeakPolarHBondContact OD1-CD 3.35Å; N172-K175 WeakPolarHBondContact OD1-CE 3.13Å; N172-K175 PolarHBondContact OD1-NZ 3.49Å; N172-I176 PolarHBondContact O-N 3.07Å
173	M	71.1	Confident	77.3	Confident	56 Å²	56	80.5 Å²	80.5	28%	0.276	41%	0.409	S	S	.	.	H	α-helix	trans	-62.1	-42	179.4	-152.3	169.7	-163.1	0	0	112.1	A169 K175 I176 Q177 W184 L186	A169-M173 PolarHBondContact O-N 3.36Å; M173-K175 VanDerWaalsContact C-N 3.27Å; M173-K175 PolarHBondContact O-N 2.79Å; M173-I176 WeakPolarHBondContact O-CG2 3.28Å; M173-Q177 WeakPolarHBondContact O-CB 3.46Å; M173-Q177 VanDerWaalsContact O-CG 3.26Å; M173-Q177 WeakPolarHBondContact O-CG 3.11Å; M173-Q177 PolarHBondContact O-N 3.41Å; M173-W184 VanDerWaalsContact CE-O 3.28Å; M173-W184 WeakPolarHBondContact CE-O 3.43Å; M173-L186 HydrophobicContact CE-CG 4.23Å
174	E	66.7	Low	77.1	Confident	176 Å²	176	80.8 Å²	80.8	82%	0.822	41%	0.406	S	S	*	.	H	α-helix	trans	-66.7	-30.4	173.3	-65.9	178.7	178.3	0	0	112.3	N172	N172-E174 PolarHBondContact O-N 2.78Å
175	K	66.6	Low	76.9	Confident	61 Å²	61	83.4 Å²	83.4	27%	0.265	42%	0.422	S	S	.	.	H	α-helix	trans	-79.2	-33.4	-178.2	-57.8	177.4	-169.9	162.9	0	112.6	L74 K77 D79 N172 M173 V178	L74-K175 HydrophobicContact CD2-CB 4.24Å; L74-K175 HydrophobicContact CD2-CD 4.39Å; K77-K175 HydrophobicContact CD-CD 4.32Å; D79-K175 IonicContact OD2-NZ 2.78Å; D79-K175 PolarHBondContact OD2-NZ 3.33Å; N172-K175 WeakPolarHBondContact O-CA 3.5Å; N172-K175 WeakPolarHBondContact O-CB 3.34Å; N172-K175 PolarHBondContact O-N 3.5Å; N172-K175 WeakPolarHBondContact OD1-CD 3.35Å; N172-K175 WeakPolarHBondContact OD1-CE 3.13Å; N172-K175 PolarHBondContact OD1-NZ 3.49Å; M173-K175 VanDerWaalsContact C-N 3.27Å; M173-K175 PolarHBondContact O-N 2.79Å; K175-V178 VanDerWaalsContact O-CG2 3.28Å; K175-V178 WeakPolarHBondContact O-CG2 3.42Å
176	I	74	Confident	76.8	Confident	14 Å²	14	86.3 Å²	86.3	7%	0.072	44%	0.436	C	S	.	.	H	α-helix	trans	-84.6	-24.7	-177.7	-157.4	173.9	0	0	0	111.8	C70 L74 N172 M173 V178 W184	C70-I176 HydrophobicContact CB-CG1 3.98Å; C70-I176 WeakPolarHBondContact CB-O 3.37Å; C70-I176 PolarHBondContact SG-O 2.87Å; L74-I176 HydrophobicContact CD1-CB 3.92Å; L74-I176 HydrophobicContact CD1-CD1 3.54Å; L74-I176 HydrophobicContact CD1-CG1 3.66Å; N172-I176 PolarHBondContact O-N 3.07Å; M173-I176 WeakPolarHBondContact O-CG2 3.28Å; I176-V178 PolarHBondContact O-N 3.37Å; I176-W184 HydrophobicContact CB-CG 4.49Å; I176-W184 HydrophobicContact CD1-CB 4.48Å; I176-W184 HydrophobicContact CD1-CD2 3.36Å; I176-W184 HydrophobicContact CD1-CE3 3.54Å; I176-W184 HydrophobicContact CD1-CG 3.81Å; I176-W184 HydrophobicContact CD1-CH2 4.14Å; I176-W184 HydrophobicContact CD1-CZ2 3.99Å; I176-W184 HydrophobicContact CD1-CZ3 3.93Å; I176-W184 HydrophobicContact CG1-CD2 3.87Å; I176-W184 HydrophobicContact CG1-CG 3.9Å; I176-W184 HydrophobicContact CG1-CZ2 4.43Å; I176-W184 HydrophobicContact CG2-CB 3.7Å; I176-W184 HydrophobicContact CG2-CG 3.85Å
177	Q	75.6	Confident	77	Confident	98 Å²	98	84.1 Å²	84.1	46%	0.458	44%	0.439	S	S	.	.			trans	-76.4	59	173.9	-71.5	-173.7	17.5	0	0	112	M173 W184	M173-Q177 WeakPolarHBondContact O-CB 3.46Å; M173-Q177 VanDerWaalsContact O-CG 3.26Å; M173-Q177 WeakPolarHBondContact O-CG 3.11Å; M173-Q177 PolarHBondContact O-N 3.41Å; Q177-W184 PolarHBondContact NE2-O 3.21Å
178	V	74.4	Confident	77.2	Confident	74 Å²	74	85 Å²	85	45%	0.448	45%	0.446	S	S	.	.			trans	-77.3	-37.1	177.8	-174.5	0	0	0	0	111.2	P73 K175 I176	P73-V178 HydrophobicContact CG-CG2 3.92Å; K175-V178 VanDerWaalsContact O-CG2 3.28Å; K175-V178 WeakPolarHBondContact O-CG2 3.42Å; I176-V178 PolarHBondContact O-N 3.37Å
179	I	75.8	Confident	77.8	Confident	38 Å²	38	90.2 Å²	90.2	20%	0.195	46%	0.459	C	S	.	.	S	Bend	trans	-100.6	116.5	-177	-59.9	171.5	0	0	0	108.2	D66 H69 D181 F182	D66-I179 HydrophobicContact CB-CD1 3.68Å; H69-I179 HydrophobicContact CB-CD1 4.23Å; I179-D181 VanDerWaalsContact C-N 3.25Å; I179-D181 PolarHBondContact O-N 3.02Å; I179-F182 HydrophobicContact CB-CB 3.81Å; I179-F182 HydrophobicContact CG2-CB 3.6Å; I179-F182 PolarHBondContact O-N 3.24Å; I179-F182 VanDerWaalsContact O-N 3.08Å
180	K	69.1	Low	78.5	Confident	195 Å²	195	96 Å²	96	85%	0.848	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-36.6	-173.8	-173.9	-178.5	174.6	-171.6	0	113.4
181	D	81.6	Confident	79.3	Confident	147 Å²	147	93.9 Å²	93.9	79%	0.786	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	14.2	-177.4	-55.9	-47.1	0	0	0	112.7	I179	I179-D181 VanDerWaalsContact C-N 3.25Å; I179-D181 PolarHBondContact O-N 3.02Å
182	F	87.6	Confident	80.2	Confident	39 Å²	39	88.2 Å²	88.2	17%	0.171	45%	0.449	C	S	.	.	S	Bend	trans	-131.9	72.2	177.7	-163.4	-92.8	0	0	0	110.5	Y63 D66 T67 I179 W184	Y63-F182 AromaticContact CD2-CE2 3.71Å; Y63-F182 HydrophobicContact CD2-CE2 3.71Å; Y63-F182 HydrophobicContact CD2-CZ 4.07Å; Y63-F182 AromaticContact CE2-CE2 3.82Å; Y63-F182 HydrophobicContact CE2-CE2 3.82Å; Y63-F182 AromaticContact CE2-CZ 3.83Å; Y63-F182 HydrophobicContact CE2-CZ 3.83Å; D66-F182 HydrophobicContact CB-CD2 4.03Å; D66-F182 HydrophobicContact CB-CE2 4.17Å; D66-F182 HydrophobicContact CB-CG 4.22Å; D66-F182 HydrophobicContact CB-CZ 4.48Å; T67-F182 VanDerWaalsContact OG1-CZ 3.31Å; T67-F182 WeakPolarHBondContact OG1-CZ 3.49Å; I179-F182 HydrophobicContact CB-CB 3.81Å; I179-F182 HydrophobicContact CG2-CB 3.6Å; I179-F182 PolarHBondContact O-N 3.24Å; I179-F182 VanDerWaalsContact O-N 3.08Å; F182-W184 AromaticContact CD1-NE1 3.7Å; F182-W184 HydrophobicContact CE1-CZ2 4.36Å; F182-W184 AromaticContact CE1-NE1 3.7Å
183	P	90.3	Very high	81.1	Confident	96 Å²	96	94 Å²	94	62%	0.623	48%	0.475	S	S	*	.			trans	-73.8	136.5	-175.2	30.1	-34.4	0	0	0	111.6
184	W	90.8	Very high	82	Confident	35 Å²	35	92 Å²	92	13%	0.133	47%	0.465	C	S	.	.			trans	-94.5	140.2	168.1	-72.8	73	0	0	0	110.4	T67 C70 V71 V163 M173 I176 Q177 F182	T67-W184 HydrophobicContact CG2-CH2 3.84Å; T67-W184 HydrophobicContact CG2-CZ2 3.78Å; C70-W184 HydrophobicContact CB-CZ2 4.01Å; C70-W184 PolarHBondContact SG-NE1 3.35Å; C70-W184 VanDerWaalsContact SG-NE1 3.4Å; V71-W184 HydrophobicContact CG2-CH2 4.08Å; V71-W184 HydrophobicContact CG2-CZ2 4.14Å; V163-W184 HydrophobicContact CB-CZ3 4.29Å; V163-W184 HydrophobicContact CG2-CH2 3.58Å; V163-W184 HydrophobicContact CG2-CZ3 3.62Å; M173-W184 VanDerWaalsContact CE-O 3.28Å; M173-W184 WeakPolarHBondContact CE-O 3.43Å; I176-W184 HydrophobicContact CB-CG 4.49Å; I176-W184 HydrophobicContact CD1-CB 4.48Å; I176-W184 HydrophobicContact CD1-CD2 3.36Å; I176-W184 HydrophobicContact CD1-CE3 3.54Å; I176-W184 HydrophobicContact CD1-CG 3.81Å; I176-W184 HydrophobicContact CD1-CH2 4.14Å; I176-W184 HydrophobicContact CD1-CZ2 3.99Å; I176-W184 HydrophobicContact CD1-CZ3 3.93Å; I176-W184 HydrophobicContact CG1-CD2 3.87Å; I176-W184 HydrophobicContact CG1-CG 3.9Å; I176-W184 HydrophobicContact CG1-CZ2 4.43Å; I176-W184 HydrophobicContact CG2-CB 3.7Å; I176-W184 HydrophobicContact CG2-CG 3.85Å; Q177-W184 PolarHBondContact NE2-O 3.21Å; F182-W184 AromaticContact CD1-NE1 3.7Å; F182-W184 HydrophobicContact CE1-CZ2 4.36Å; F182-W184 AromaticContact CE1-NE1 3.7Å
185	I	90.6	Very high	82.7	Confident	128 Å²	128	90.3 Å²	90.3	66%	0.656	46%	0.457	S	S	*	.			trans	-114.8	163.2	175.1	63.4	170.7	0	0	0	110.5
186	L	89.7	Confident	83.6	Confident	89 Å²	89	92.7 Å²	92.7	47%	0.466	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-72.3	132.7	167	-61.8	178.5	0	0	0	108.1	A169 M173	A169-L186 HydrophobicContact CB-CD2 3.32Å; M173-L186 HydrophobicContact CE-CG 4.23Å
187	A	90.3	Very high	84.5	Confident	52 Å²	52	94.5 Å²	94.5	43%	0.43	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-69	135.4	178.7	0	0	0	0	0	110.3	L162 D191 V192	L162-A187 HydrophobicContact CD2-CB 4.04Å; A187-D191 HydrophobicContact CB-CB 4.41Å; A187-V192 HydrophobicContact CB-CG2 3.74Å
188	D	87.9	Confident	85.4	Confident	110 Å²	110	95.4 Å²	95.4	59%	0.588	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-81.4	163.8	174.9	-73.2	-39.4	0	0	0	110.3	Q190 D191 V192	D188-Q190 PolarHBondContact O-N 3.3Å; D188-Q190 VanDerWaalsContact O-N 3.12Å; D188-D191 PolarHBondContact N-OD2 3.48Å; D188-D191 VanDerWaalsContact N-OD2 3.13Å; D188-D191 PolarHBondContact O-N 3.44Å; D188-D191 VanDerWaalsContact O-N 3.09Å; D188-V192 PolarHBondContact O-N 2.95Å
189	E	85.4	Confident	86.5	Confident	173 Å²	173	97.3 Å²	97.3	81%	0.808	49%	0.492	S	S	*	.	H	α-helix	trans	-56.9	-30.5	178	-70.8	-173.3	170.9	0	0	112.4	D191 V192 H193	E189-D191 VanDerWaalsContact C-N 3.34Å; E189-D191 PolarHBondContact O-N 3.34Å; E189-V192 PolarHBondContact O-N 3.27Å; E189-H193 WeakPolarHBondContact O-CA 3.44Å; E189-H193 WeakPolarHBondContact O-CB 3.28Å; E189-H193 PolarHBondContact O-N 3.07Å
190	Q	82.3	Confident	87.5	Confident	165 Å²	165	96.5 Å²	96.5	77%	0.771	49%	0.488	S	S	*	.	H	α-helix	trans	-68.4	-32.2	-179.9	-62.1	-179.2	20.7	0	0	112.8	D188	D188-Q190 PolarHBondContact O-N 3.3Å; D188-Q190 VanDerWaalsContact O-N 3.12Å
191	D	80.4	Confident	88.8	Confident	50 Å²	50	92.3 Å²	92.3	27%	0.267	48%	0.48	S	S	.	.	H	α-helix	trans	-75.6	-31	178.8	-57.8	-47.9	0	0	0	111.7	A187 D188 E189	A187-D191 HydrophobicContact CB-CB 4.41Å; D188-D191 PolarHBondContact N-OD2 3.48Å; D188-D191 VanDerWaalsContact N-OD2 3.13Å; D188-D191 PolarHBondContact O-N 3.44Å; D188-D191 VanDerWaalsContact O-N 3.09Å; E189-D191 VanDerWaalsContact C-N 3.34Å; E189-D191 PolarHBondContact O-N 3.34Å
192	V	84.3	Confident	89.6	Confident	52 Å²	52	86 Å²	86	32%	0.315	45%	0.447	S	S	.	.	H	α-helix	trans	-98.1	-34.7	-173	-173.4	0	0	0	0	111.9	K97 L162 A187 D188 E189 M194	K97-V192 WeakPolarHBondContact CE-O 3.39Å; K97-V192 PolarHBondContact NZ-O 3.04Å; L162-V192 HydrophobicContact CD1-CG2 4.16Å; A187-V192 HydrophobicContact CB-CG2 3.74Å; D188-V192 PolarHBondContact O-N 2.95Å; E189-V192 PolarHBondContact O-N 3.27Å; V192-M194 PolarHBondContact O-N 3.35Å
193	H	89.3	Confident	90.1	Very high	125 Å²	125	87.7 Å²	87.7	58%	0.579	45%	0.454	S	S	*	.			trans	-73	123.7	-173.3	-174.4	75.7	0	0	0	110.9	E189	E189-H193 WeakPolarHBondContact O-CA 3.44Å; E189-H193 WeakPolarHBondContact O-CB 3.28Å; E189-H193 PolarHBondContact O-N 3.07Å
194	M	88.6	Confident	90.4	Very high	14 Å²	14	86.5 Å²	86.5	7%	0.069	45%	0.445	C	S	.	.			trans	-122.4	125.4	167.9	-172.3	154.7	66	0	0	108.5	P94 K97 V192 D196 P197 E217 R219	P94-M194 HydrophobicContact CB-CB 4.46Å; P94-M194 HydrophobicContact CB-SD 4.25Å; K97-M194 HydrophobicContact CG-CE 4.21Å; V192-M194 PolarHBondContact O-N 3.35Å; M194-D196 PolarHBondContact O-N 3.2Å; M194-P197 HydrophobicContact CE-CB 3.5Å; M194-P197 VanDerWaalsContact CE-CB 3.5Å; M194-P197 HydrophobicContact CG-CB 4.27Å; M194-E217 HydrophobicContact CE-CB 3.14Å; M194-E217 HydrophobicContact CE-CG 4.43Å; M194-E217 VanDerWaalsContact CE-O 3.23Å; M194-E217 WeakPolarHBondContact CE-O 3.32Å; M194-R219 HydrophobicContact CG-CB 4.28Å; M194-R219 HydrophobicContact SD-CB 4.02Å
195	H	81.4	Confident	90.5	Very high	141 Å²	141	85.2 Å²	85.2	65%	0.653	44%	0.44	S	S	*	.	S	Bend	trans	-75.7	123	-177.8	-173.4	-74	0	0	0	110.5
196	D	86.7	Confident	90.5	Very high	112 Å²	112	83.4 Å²	83.4	60%	0.599	44%	0.436	S	S	*	.	S	Bend	trans	47.4	64	175.6	-165	31.3	0	0	0	114.1	M194	M194-D196 PolarHBondContact O-N 3.2Å
197	P	92.6	Very high	90.3	Very high	51 Å²	51	79.9 Å²	79.9	33%	0.331	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	132.1	-174.7	31.9	-34.3	0	0	0	112.2	M194 E217 E218	M194-P197 HydrophobicContact CE-CB 3.5Å; M194-P197 VanDerWaalsContact CE-CB 3.5Å; M194-P197 HydrophobicContact CG-CB 4.27Å; P197-E217 HydrophobicContact CB-CB 4.11Å; P197-E218 CarbonylContact C-O 3.57Å; P197-E218 WeakPolarHBondContact CA-O 3.41Å
198	R	95	Very high	89.8	Confident	117 Å²	117	82.3 Å²	82.3	44%	0.442	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	126	166	-174	173.4	74	159.4	5.4	109.4	V149 I200 E218	V149-R198 PolarHBondContact O-NH2 2.85Å; R198-I200 HydrophobicContact CG-CG1 4.2Å; R198-E218 HydrophobicContact CB-CB 4.49Å; R198-E218 IonicContact CZ-OE2 3.19Å; R198-E218 PolarHBondContact N-O 3.06Å; R198-E218 IonicContact NE-OE2 3.04Å; R198-E218 PolarHBondContact NE-OE2 3.43Å; R198-E218 IonicContact NH2-OE2 2.82Å; R198-E218 PolarHBondContact NH2-OE2 3.46Å; R198-E218 PolarHBondContact O-N 3.05Å
199	L	96.3	Very high	89.6	Confident	114 Å²	114	77.5 Å²	77.5	60%	0.597	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.3	177.1	-76.1	169.1	0	0	0	111.4	Y215 E217	L199-Y215 HydrophobicContact CD2-CD2 3.57Å; L199-Y215 HydrophobicContact CD2-CE2 3.63Å; L199-E217 HydrophobicContact CD2-CG 3.75Å
200	I	97.2	Very high	89.7	Confident	21 Å²	21	69.3 Å²	69.3	11%	0.108	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	99.7	-176	-56.6	166.3	0	0	0	108.9	V149 L150 R198 L202 Y215 V216 E218	V149-I200 HydrophobicContact CG2-CG2 4.17Å; L150-I200 HydrophobicContact CD2-CD1 3.47Å; L150-I200 VanDerWaalsContact CD2-CD1 3.47Å; R198-I200 HydrophobicContact CG-CG1 4.2Å; I200-L202 HydrophobicContact CG2-CD2 4.49Å; I200-L202 PolarHBondContact O-N 3.2Å; I200-Y215 CarbonylContact O-C 3.57Å; I200-Y215 WeakPolarHBondContact O-CA 3.17Å; I200-V216 HydrophobicContact CB-CB 4.4Å; I200-V216 PolarHBondContact N-O 3.16Å; I200-V216 PolarHBondContact O-N 2.86Å; I200-E218 HydrophobicContact CD1-CB 4.01Å; I200-E218 VanDerWaalsContact CD1-OE2 3.3Å; I200-E218 WeakPolarHBondContact CD1-OE2 3.44Å
201	P	97.4	Very high	90.2	Very high	107 Å²	107	66.1 Å²	66.1	70%	0.695	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	129.2	179.5	28	-32.8	0	0	0	110.9
202	L	97.1	Very high	91	Very high	16 Å²	16	63.8 Å²	63.8	8%	0.084	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-51.6	176.3	-63.9	-174.9	0	0	0	111.6	F98 K142 C146 V149 I200 L214 V216	F98-L202 HydrophobicContact CD1-CD1 4.4Å; F98-L202 HydrophobicContact CE1-CD1 4.26Å; K142-L202 HydrophobicContact CB-CB 4.35Å; K142-L202 WeakPolarHBondContact CD-O 3.34Å; K142-L202 WeakPolarHBondContact CG-O 3.13Å; C146-L202 HydrophobicContact CB-CD1 4.11Å; C146-L202 HydrophobicContact CB-CD2 4.03Å; V149-L202 HydrophobicContact CG2-CD2 4.29Å; I200-L202 HydrophobicContact CG2-CD2 4.49Å; I200-L202 PolarHBondContact O-N 3.2Å; L202-L214 HydrophobicContact CB-CD2 4.22Å; L202-L214 HydrophobicContact CB-CG 4.1Å; L202-L214 HydrophobicContact CD1-CD2 3.95Å; L202-L214 HydrophobicContact CD1-CG 4.06Å; L202-L214 PolarHBondContact N-O 3.08Å; L202-V216 HydrophobicContact CD1-CG2 3.7Å; L202-V216 HydrophobicContact CG-CG2 4.08Å
203	K	97.8	Very high	91.7	Very high	74 Å²	74	65.5 Å²	65.5	32%	0.322	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	146.2	-178.4	-168.8	62.1	-169.1	173.6	0	113.1	A138 F139 K142 L214	A138-K203 HydrophobicContact CB-CD 4.16Å; A138-K203 HydrophobicContact CB-CG 4.36Å; F139-K203 HydrophobicContact CD1-CB 3.79Å; F139-K203 HydrophobicContact CD1-CG 4.13Å; F139-K203 HydrophobicContact CD2-CB 4.4Å; F139-K203 HydrophobicContact CD2-CG 3.84Å; F139-K203 HydrophobicContact CE1-CB 3.77Å; F139-K203 HydrophobicContact CE1-CG 4.01Å; F139-K203 WeakPolarHBondContact CE1-O 3.2Å; F139-K203 HydrophobicContact CE2-CB 4.37Å; F139-K203 HydrophobicContact CE2-CG 3.69Å; F139-K203 HydrophobicContact CG-CB 4.1Å; F139-K203 HydrophobicContact CG-CG 4.04Å; F139-K203 HydrophobicContact CZ-CB 4.06Å; F139-K203 HydrophobicContact CZ-CG 3.78Å; K142-K203 HydrophobicContact CG-CB 4.27Å; K203-L214 PolarHBondContact N-O 3.23Å; K203-L214 PolarHBondContact O-N 3.46Å
204	T	97.1	Very high	92.1	Very high	70 Å²	70	59.6 Å²	59.6	43%	0.429	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.3	169.3	-56.8	0	0	0	0	109.4	M212 Q213	T204-M212 WeakPolarHBondContact CA-O 3.28Å; T204-Q213 HydrophobicContact CG2-CG 3.82Å
205	M	93.1	Very high	92.6	Very high	8 Å²	8	60.5 Å²	60.5	4%	0.039	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	151.6	168.7	66.5	-180	-84.6	0	0	111.3	V132 L135 L136 F139 L210 K211 M212	V132-M205 HydrophobicContact CG1-CE 4.26Å; L135-M205 HydrophobicContact CB-CB 4.24Å; L135-M205 HydrophobicContact CB-CE 3.65Å; L135-M205 HydrophobicContact CB-SD 3.86Å; L135-M205 HydrophobicContact CD1-CB 4.39Å; L135-M205 HydrophobicContact CD1-CE 3.7Å; L135-M205 HydrophobicContact CG-CE 4.34Å; L136-M205 HydrophobicContact CD2-SD 3.92Å; F139-M205 HydrophobicContact CD2-SD 4.31Å; F139-M205 HydrophobicContact CE2-CB 3.78Å; F139-M205 HydrophobicContact CE2-CG 3.55Å; F139-M205 HydrophobicContact CE2-SD 3.47Å; F139-M205 WeakPolarHBondContact CE2-SD 3.31Å; F139-M205 HydrophobicContact CZ-CB 4.06Å; F139-M205 HydrophobicContact CZ-CG 3.66Å; F139-M205 HydrophobicContact CZ-SD 4.06Å; M205-L210 HydrophobicContact CE-CB 4.5Å; M205-L210 HydrophobicContact CE-CD2 3.97Å; M205-L210 HydrophobicContact CE-CG 4.27Å; M205-L210 HydrophobicContact SD-CD2 4.46Å; M205-K211 WeakPolarHBondContact O-CA 3.33Å; M205-M212 HydrophobicContact CG-CB 3.93Å; M205-M212 PolarHBondContact N-O 3.38Å; M205-M212 PolarHBondContact O-N 2.85Å; M205-M212 VanDerWaalsContact O-N 3.1Å; M205-M212 HydrophobicContact SD-CB 4.35Å; M205-M212 HydrophobicContact SD-CE 4.11Å
206	T	90.2	Very high	93.4	Very high	91 Å²	91	53.8 Å²	53.8	56%	0.558	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	127.8	171.1	-70.2	0	0	0	0	107.6	K211	T206-K211 HydrophobicContact CG2-CD 4.2Å; T206-K211 HydrophobicContact CG2-CG 3.97Å
207	S	85.4	Confident	93.9	Very high	15 Å²	15	50.2 Å²	50.2	11%	0.105	26%	0.26	C	S	.	.			trans	-135.5	173.3	171.6	68.4	0	0	0	0	108.7	I209 L210	S207-I209 PolarHBondContact O-N 3.2Å; S207-I209 VanDerWaalsContact O-N 3.13Å; S207-I209 PolarHBondContact OG-N 2.92Å; S207-L210 PolarHBondContact N-O 3.15Å; S207-L210 PolarHBondContact OG-N 2.91Å; S207-L210 PolarHBondContact OG-O 3.3Å
208	D	81.3	Confident	94	Very high	103 Å²	103	47.8 Å²	47.8	55%	0.551	24%	0.244	S	C	*	.	S	Bend	trans	-62	-20.4	178.8	-60.9	-26.5	0	0	0	113.1	P105 I110 L128	P105-D208 WeakPolarHBondContact CG-O 3.21Å; I110-D208 HydrophobicContact CD1-CB 4.25Å; I110-D208 HydrophobicContact CG1-CB 4.24Å; L128-D208 HydrophobicContact CD1-CB 4.41Å
209	I	81.8	Confident	93.9	Very high	8 Å²	8	44 Å²	44	4%	0.041	23%	0.23	C	C	.	.	S	Bend	trans	-121.1	-20	-168.6	65.7	155.4	0	0	0	113.3	F11 V15 I110 L128 V132 S207	F11-I209 HydrophobicContact CE1-CB 3.81Å; F11-I209 HydrophobicContact CE1-CG2 3.79Å; F11-I209 HydrophobicContact CE2-CG2 4.17Å; F11-I209 HydrophobicContact CZ-CB 3.54Å; F11-I209 HydrophobicContact CZ-CD1 3.85Å; F11-I209 HydrophobicContact CZ-CG1 4.3Å; F11-I209 HydrophobicContact CZ-CG2 3.22Å; V15-I209 HydrophobicContact CG2-CD1 4.05Å; I110-I209 HydrophobicContact CD1-CG2 3.69Å; L128-I209 HydrophobicContact CD1-CG2 4.08Å; L128-I209 HydrophobicContact CD2-CB 4.35Å; L128-I209 HydrophobicContact CD2-CD1 3.28Å; L128-I209 HydrophobicContact CD2-CG1 3.69Å; L128-I209 HydrophobicContact CD2-CG2 3.78Å; V132-I209 HydrophobicContact CG2-CD1 3.88Å; V132-I209 HydrophobicContact CG2-CG1 4.01Å; S207-I209 PolarHBondContact O-N 3.2Å; S207-I209 VanDerWaalsContact O-N 3.13Å; S207-I209 PolarHBondContact OG-N 2.92Å
210	L	88.4	Confident	93.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	22%	0.217	C	C	.	.			trans	-151	124.5	-174.5	178.9	63.5	0	0	0	109.9	L19 I102 V132 M205 S207 M212	L19-L210 HydrophobicContact CD1-CD1 4.03Å; L19-L210 HydrophobicContact CD2-CD1 4.11Å; L19-L210 HydrophobicContact CD2-CD2 3.7Å; L19-L210 HydrophobicContact CG-CD1 4.46Å; L19-L210 HydrophobicContact CG-CD2 4.31Å; I102-L210 HydrophobicContact CG2-CD1 3.97Å; V132-L210 HydrophobicContact CG1-CD2 4.44Å; M205-L210 HydrophobicContact CE-CB 4.5Å; M205-L210 HydrophobicContact CE-CD2 3.97Å; M205-L210 HydrophobicContact CE-CG 4.27Å; M205-L210 HydrophobicContact SD-CD2 4.46Å; S207-L210 PolarHBondContact N-O 3.15Å; S207-L210 PolarHBondContact OG-N 2.91Å; S207-L210 PolarHBondContact OG-O 3.3Å; L210-M212 HydrophobicContact CG-CB 4.46Å
211	K	93.4	Very high	92.5	Very high	98 Å²	98	46.8 Å²	46.8	43%	0.426	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.8	161.3	-61.3	-177	-178.5	-178.6	0	107.5	T103 M205 T206	T103-K211 PolarHBondContact N-O 3.3Å; T103-K211 PolarHBondContact O-N 2.72Å; M205-K211 WeakPolarHBondContact O-CA 3.33Å; T206-K211 HydrophobicContact CG2-CD 4.2Å; T206-K211 HydrophobicContact CG2-CG 3.97Å
212	M	96.9	Very high	91.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138.3	179.3	-172.4	172.7	67.7	0	0	110.6	L19 F22 F100 E101 I102 L136 F139 T204 M205 L210	L19-M212 HydrophobicContact CD2-SD 4.12Å; F22-M212 HydrophobicContact CD1-CE 4Å; F22-M212 HydrophobicContact CD1-SD 4.32Å; F22-M212 HydrophobicContact CE1-CE 3.37Å; F22-M212 HydrophobicContact CE1-SD 3.88Å; F22-M212 HydrophobicContact CZ-CE 3.72Å; F100-M212 HydrophobicContact CD1-SD 4.36Å; E101-M212 CarbonylContact O-C 3.41Å; E101-M212 VanDerWaalsContact O-CA 3.25Å; E101-M212 WeakPolarHBondContact O-CA 3.38Å; I102-M212 HydrophobicContact CG1-CG 4.31Å; I102-M212 HydrophobicContact CG1-SD 4.38Å; L136-M212 HydrophobicContact CD2-CE 3.52Å; F139-M212 HydrophobicContact CD1-CE 3.88Å; F139-M212 HydrophobicContact CD2-CE 4.03Å; F139-M212 HydrophobicContact CE1-CE 3.69Å; F139-M212 HydrophobicContact CE1-CG 4.37Å; F139-M212 HydrophobicContact CE2-CE 3.86Å; F139-M212 HydrophobicContact CG-CE 4.06Å; F139-M212 HydrophobicContact CZ-CB 4.39Å; F139-M212 HydrophobicContact CZ-CE 3.7Å; F139-M212 HydrophobicContact CZ-CG 4.46Å; T204-M212 WeakPolarHBondContact CA-O 3.28Å; M205-M212 HydrophobicContact CG-CB 3.93Å; M205-M212 PolarHBondContact N-O 3.38Å; M205-M212 PolarHBondContact O-N 2.85Å; M205-M212 VanDerWaalsContact O-N 3.1Å; M205-M212 HydrophobicContact SD-CB 4.35Å; M205-M212 HydrophobicContact SD-CE 4.11Å; L210-M212 HydrophobicContact CG-CB 4.46Å
213	Q	97.9	Very high	90.1	Very high	87 Å²	87	44.7 Å²	44.7	41%	0.407	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.6	170.5	-51.1	-163	6.9	0	0	109.6	F100 E101 T204	F100-Q213 CarbonylContact C-O 3.5Å; F100-Q213 WeakPolarHBondContact CA-O 3.36Å; E101-Q213 HydrophobicContact CB-CB 4.36Å; E101-Q213 PolarHBondContact N-O 3.16Å; E101-Q213 PolarHBondContact O-N 3.01Å; T204-Q213 HydrophobicContact CG2-CG 3.82Å
214	L	98.5	Very high	87.5	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.6	170.7	175.2	62	0	0	0	108.2	F98 V99 F100 F139 I143 L202 K203	F98-L214 HydrophobicContact CB-CD1 4.38Å; V99-L214 WeakPolarHBondContact O-CA 3.34Å; F100-L214 HydrophobicContact CD1-CD1 3.92Å; F100-L214 HydrophobicContact CD2-CD1 4.26Å; F100-L214 HydrophobicContact CE1-CD1 3.71Å; F100-L214 HydrophobicContact CE1-CD2 4.07Å; F100-L214 HydrophobicContact CE1-CG 4.34Å; F100-L214 HydrophobicContact CE2-CD1 4.06Å; F100-L214 HydrophobicContact CG-CD1 4.19Å; F100-L214 HydrophobicContact CZ-CD1 3.78Å; F100-L214 HydrophobicContact CZ-CD2 4.43Å; F139-L214 HydrophobicContact CD1-CB 3.5Å; F139-L214 VanDerWaalsContact CD1-CB 3.5Å; F139-L214 HydrophobicContact CD1-CD2 3.93Å; F139-L214 HydrophobicContact CD1-CG 4.38Å; F139-L214 HydrophobicContact CE1-CB 3.56Å; I143-L214 HydrophobicContact CD1-CD2 3.82Å; I143-L214 HydrophobicContact CG1-CD2 3.66Å; L202-L214 HydrophobicContact CB-CD2 4.22Å; L202-L214 HydrophobicContact CB-CG 4.1Å; L202-L214 HydrophobicContact CD1-CD2 3.95Å; L202-L214 HydrophobicContact CD1-CG 4.06Å; L202-L214 PolarHBondContact N-O 3.08Å; K203-L214 PolarHBondContact N-O 3.23Å; K203-L214 PolarHBondContact O-N 3.46Å
215	Y	98.4	Very high	87	Confident	33 Å²	33	47.9 Å²	47.9	13%	0.129	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	158.2	172	61.7	-92.4	0	0	0	109.7	K82 V99 E101 L199 I200 E217	K82-Y215 PolarHBondContact NZ-OH 2.78Å; V99-Y215 HydrophobicContact CB-CD1 4.33Å; V99-Y215 HydrophobicContact CB-CD2 4.03Å; V99-Y215 HydrophobicContact CB-CE1 3.94Å; V99-Y215 HydrophobicContact CB-CE2 3.62Å; V99-Y215 HydrophobicContact CB-CG 4.38Å; V99-Y215 HydrophobicContact CG1-CE1 3.75Å; V99-Y215 HydrophobicContact CG1-CE2 4.01Å; V99-Y215 VanDerWaalsContact CG1-CZ 3.44Å; V99-Y215 WeakPolarHBondContact CG1-OH 3.49Å; V99-Y215 HydrophobicContact CG2-CD2 4.24Å; V99-Y215 HydrophobicContact CG2-CE2 3.67Å; V99-Y215 PolarHBondContact N-O 3.42Å; V99-Y215 PolarHBondContact O-N 2.82Å; E101-Y215 HydrophobicContact CB-CE1 4.38Å; L199-Y215 HydrophobicContact CD2-CD2 3.57Å; L199-Y215 HydrophobicContact CD2-CE2 3.63Å; I200-Y215 CarbonylContact O-C 3.57Å; I200-Y215 WeakPolarHBondContact O-CA 3.17Å; Y215-E217 HydrophobicContact CD2-CG 4.19Å; Y215-E217 HydrophobicContact CE2-CG 3.83Å
216	V	98.3	Very high	86.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.3	174.8	-174.5	0	0	0	0	108.5	E96 K97 F98 L150 I200 L202	E96-V216 HydrophobicContact CB-CG1 4.4Å; K97-V216 CarbonylContact O-C 3.6Å; K97-V216 VanDerWaalsContact O-CA 3.23Å; K97-V216 WeakPolarHBondContact O-CA 3.49Å; F98-V216 HydrophobicContact CD1-CG2 3.6Å; F98-V216 HydrophobicContact CE1-CG2 3.53Å; F98-V216 HydrophobicContact CE2-CG1 4.47Å; F98-V216 HydrophobicContact CG-CG2 4.16Å; F98-V216 HydrophobicContact CZ-CG2 4.02Å; L150-V216 HydrophobicContact CD1-CG1 4.38Å; L150-V216 HydrophobicContact CD1-CG2 4.31Å; L150-V216 HydrophobicContact CD2-CB 3.97Å; L150-V216 HydrophobicContact CD2-CG1 3.75Å; L150-V216 HydrophobicContact CD2-CG2 4.27Å; I200-V216 HydrophobicContact CB-CB 4.4Å; I200-V216 PolarHBondContact N-O 3.16Å; I200-V216 PolarHBondContact O-N 2.86Å; L202-V216 HydrophobicContact CD1-CG2 3.7Å; L202-V216 HydrophobicContact CG-CG2 4.08Å
217	E	97.4	Very high	86.5	Confident	37 Å²	37	47.7 Å²	47.7	17%	0.173	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.8	160.7	-53.8	-178.2	173	0	0	106.9	E96 K97 V99 M194 P197 L199 Y215	E96-E217 CarbonylContact C-O 3.53Å; E96-E217 VanDerWaalsContact CA-O 3.31Å; E96-E217 WeakPolarHBondContact CA-O 3.39Å; K97-E217 HydrophobicContact CB-CB 4.13Å; K97-E217 WeakPolarHBondContact CD-OE2 3.49Å; K97-E217 PolarHBondContact N-O 3.26Å; K97-E217 IonicContact NZ-OE2 3.06Å; K97-E217 PolarHBondContact NZ-OE2 2.86Å; K97-E217 PolarHBondContact O-N 3.01Å; V99-E217 HydrophobicContact CG2-CG 4.12Å; M194-E217 HydrophobicContact CE-CB 3.14Å; M194-E217 HydrophobicContact CE-CG 4.43Å; M194-E217 VanDerWaalsContact CE-O 3.23Å; M194-E217 WeakPolarHBondContact CE-O 3.32Å; P197-E217 HydrophobicContact CB-CB 4.11Å; L199-E217 HydrophobicContact CD2-CG 3.75Å; Y215-E217 HydrophobicContact CD2-CG 4.19Å; Y215-E217 HydrophobicContact CE2-CG 3.83Å
218	E	95.6	Very high	86.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.7	-176.3	-174.7	-179.1	-126.3	0	0	110.9	L150 D151 P197 R198 I200 A220 K222	L150-E218 WeakPolarHBondContact CA-OE1 3.39Å; D151-E218 PolarHBondContact N-OE1 3.04Å; P197-E218 CarbonylContact C-O 3.57Å; P197-E218 WeakPolarHBondContact CA-O 3.41Å; R198-E218 HydrophobicContact CB-CB 4.49Å; R198-E218 IonicContact CZ-OE2 3.19Å; R198-E218 PolarHBondContact N-O 3.06Å; R198-E218 IonicContact NE-OE2 3.04Å; R198-E218 PolarHBondContact NE-OE2 3.43Å; R198-E218 IonicContact NH2-OE2 2.82Å; R198-E218 PolarHBondContact NH2-OE2 3.46Å; R198-E218 PolarHBondContact O-N 3.05Å; I200-E218 HydrophobicContact CD1-CB 4.01Å; I200-E218 VanDerWaalsContact CD1-OE2 3.3Å; I200-E218 WeakPolarHBondContact CD1-OE2 3.44Å; E218-A220 PolarHBondContact O-N 2.67Å; E218-K222 WeakPolarHBondContact OE1-CE 3.49Å; E218-K222 IonicContact OE1-NZ 3.4Å; E218-K222 PolarHBondContact OE1-NZ 2.86Å
219	R	92.6	Very high	86.8	Confident	36 Å²	36	46.3 Å²	46.3	14%	0.136	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	122.8	175.2	-171.9	166.8	77.5	-161.7	9.9	109.7	D89 P94 V95 M194 H221 K222	D89-R219 IonicContact OD2-CZ 2.7Å; D89-R219 IonicContact OD2-NH1 3.34Å; D89-R219 PolarHBondContact OD2-NH1 3.47Å; D89-R219 IonicContact OD2-NH2 2.66Å; D89-R219 PolarHBondContact OD2-NH2 2.89Å; P94-R219 PolarHBondContact O-NH1 3.2Å; V95-R219 WeakPolarHBondContact O-CB 3.26Å; V95-R219 PolarHBondContact O-N 3.41Å; M194-R219 HydrophobicContact CG-CB 4.28Å; M194-R219 HydrophobicContact SD-CB 4.02Å; R219-H221 PolarHBondContact NE-O 3Å; R219-H221 VanDerWaalsContact NE-O 3.15Å; R219-H221 PolarHBondContact O-N 3.03Å; R219-K222 HydrophobicContact CB-CG 4.49Å
220	A	83.4	Confident	87.2	Confident	39 Å²	39	48.8 Å²	48.8	32%	0.322	28%	0.277	S	S	.	.	S	Bend	trans	-54.1	-29.5	-175.7	0	0	0	0	0	114.4	E218	E218-A220 PolarHBondContact O-N 2.67Å
221	H	81.4	Confident	87.1	Confident	156 Å²	156	52.1 Å²	52.1	72%	0.722	30%	0.296	S	S	*	.			trans	-130.4	104.2	175.5	-58.5	83.3	0	0	0	109.7	R219 G223	R219-H221 PolarHBondContact NE-O 3Å; R219-H221 VanDerWaalsContact NE-O 3.15Å; R219-H221 PolarHBondContact O-N 3.03Å; H221-G223 PolarHBondContact O-N 3.17Å
222	K	78.5	Confident	86.6	Confident	21 Å²	21	48.6 Å²	48.6	9%	0.091	29%	0.286	C	S	.	.			trans	-88.4	33.2	174.3	-60.2	-176.2	-168.5	166.3	0	112.8	E96 D151 H152 N153 P154 E218 R219	E96-K222 IonicContact OE1-NZ 3.72Å; E96-K222 PolarHBondContact OE1-NZ 3.44Å; D151-K222 HydrophobicContact CB-CD 4.37Å; D151-K222 PolarHBondContact O-NZ 2.96Å; H152-K222 WeakPolarHBondContact O-CD 3.49Å; N153-K222 PolarHBondContact OD1-NZ 3.01Å; P154-K222 HydrophobicContact CG-CB 4.42Å; P154-K222 WeakPolarHBondContact CG-O 3.43Å; E218-K222 WeakPolarHBondContact OE1-CE 3.49Å; E218-K222 IonicContact OE1-NZ 3.4Å; E218-K222 PolarHBondContact OE1-NZ 2.86Å; R219-K222 HydrophobicContact CB-CG 4.49Å
223	G	64	Low	85.8	Confident	57 Å²	57	52.6 Å²	52.6	59%	0.588	31%	0.31	S	S	*	.			trans	-40.6	145.8	-165.6	0	0	0	0	0	116.4	H221	H221-G223 PolarHBondContact O-N 3.17Å
224	S	43.1	Very low	84.7	Confident	163 Å²	163	49.5 Å²	49.5	100%	1.14	30%	0.301	S	S	*	.			trans	-65	0	176.8	75.6	0	0	0	0	113

Retrieved 224 of 224 residues in 124.9 ms (Link to these results)

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