A0A3Q0KN10_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession A0A3Q0KN10, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 291 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	45.7	Very low	73.2	Confident	238 Å²	238	105.6 Å²	105.6	100%	1.172	57%	0.574	S	S	*	*				0	106.7	0	-75.2	168.9	-165.9	0	0	107
2	T	56.1	Low	74.7	Confident	133 Å²	133	100.6 Å²	100.6	82%	0.816	54%	0.543	S	S	*	.			trans	-87.9	98.9	169.4	31	0	0	0	0	107.2	L4	T2-L4 PolarHBondContact O-N 3.16Å
3	E	56.1	Low	75.7	Confident	166 Å²	166	107.2 Å²	107.2	78%	0.776	57%	0.568	S	S	*	*			trans	-65.6	110.4	167.4	-66	-167.6	158.4	0	0	107.9	N5	E3-N5 PolarHBondContact O-N 3.13Å; E3-N5 VanDerWaalsContact O-N 3.13Å
4	L	63.6	Low	76.6	Confident	138 Å²	138	111.1 Å²	111.1	72%	0.723	59%	0.59	S	S	*	*			trans	-75	97.1	173.6	-87.4	118	0	0	0	108.4	T2 I6	T2-L4 PolarHBondContact O-N 3.16Å; L4-I6 HydrophobicContact CB-CD1 3.97Å; L4-I6 HydrophobicContact CB-CG1 3.96Å; L4-I6 HydrophobicContact CD2-CD1 4.11Å; L4-I6 HydrophobicContact CD2-CG1 4.29Å; L4-I6 PolarHBondContact O-N 3.2Å
5	N	66.6	Low	77.5	Confident	150 Å²	150	104.8 Å²	104.8	80%	0.802	56%	0.558	S	S	*	*			trans	-69.6	78.4	170.2	-71.4	-44.4	0	0	0	110.1	E3	E3-N5 PolarHBondContact O-N 3.13Å; E3-N5 VanDerWaalsContact O-N 3.13Å
6	I	75.3	Confident	77.9	Confident	109 Å²	109	110.1 Å²	110.1	56%	0.559	58%	0.575	S	S	*	*			trans	-94.3	115.8	179.1	-54.3	164.8	0	0	0	108.6	L4 F20	L4-I6 HydrophobicContact CB-CD1 3.97Å; L4-I6 HydrophobicContact CB-CG1 3.96Å; L4-I6 HydrophobicContact CD2-CD1 4.11Å; L4-I6 HydrophobicContact CD2-CG1 4.29Å; L4-I6 PolarHBondContact O-N 3.2Å; I6-F20 HydrophobicContact CG2-CD1 4.05Å; I6-F20 WeakPolarHBondContact O-CD1 3.16Å; I6-F20 WeakPolarHBondContact O-CE1 3.43Å
7	G	81.7	Confident	78.4	Confident	34 Å²	34	108.4 Å²	108.4	35%	0.351	56%	0.563	S	S	.	*	S	Bend	trans	114.8	172.3	178.5	0	0	0	0	0	112.9	D19	G7-D19 CarbonylContact C-O 3.56Å; G7-D19 VanDerWaalsContact CA-O 3.26Å; G7-D19 WeakPolarHBondContact CA-O 3.39Å
8	A	85.5	Confident	78.7	Confident	20 Å²	20	106.4 Å²	106.4	17%	0.165	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-134	145.6	176.4	0	0	0	0	0	110.7	D19 P22 I31	A8-D19 PolarHBondContact N-O 2.82Å; A8-D19 PolarHBondContact O-N 2.83Å; A8-P22 HydrophobicContact CB-CB 3.95Å; A8-P22 HydrophobicContact CB-CG 3.72Å; A8-I31 HydrophobicContact CB-CD1 3.86Å; A8-I31 HydrophobicContact CB-CG2 3.84Å
9	H	90.9	Very high	78.8	Confident	113 Å²	113	102.4 Å²	102.4	52%	0.523	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	147.9	175.2	-73.2	-70.7	0	0	0	111.4	K16 Q17	H9-K16 PolarHBondContact ND1-O 3.2Å; H9-Q17 WeakPolarHBondContact CA-O 3.3Å
10	C	92	Very high	79	Confident	10 Å²	10	104.4 Å²	104.4	7%	0.068	54%	0.537	C	S	.	.			trans	-60.6	136.6	170.3	-170.8	0	0	0	0	110.8	Q12 C15 Q17 C33 H36	C10-Q12 PolarHBondContact O-N 3.36Å; C10-C15 HydrophobicContact CB-CB 3.85Å; C10-C15 WeakPolarHBondContact CB-SG 3.47Å; C10-Q17 PolarHBondContact N-O 2.89Å; C10-Q17 VanDerWaalsContact N-O 3.08Å; C10-C33 HydrophobicContact CB-CB 4.22Å; C10-C33 PolarHBondContact SG-N 3.41Å; C10-H36 PolarHBondContact SG-ND1 3.18Å
11	S	92.2	Very high	79.3	Confident	51 Å²	51	105.6 Å²	105.6	36%	0.357	54%	0.544	S	S	.	.	S	Bend	trans	-82.8	6.3	179.4	-52.3	0	0	0	0	113.5	I31	S11-I31 VanDerWaalsContact CB-O 3.23Å; S11-I31 WeakPolarHBondContact CB-O 2.92Å; S11-I31 PolarHBondContact N-O 3.31Å; S11-I31 PolarHBondContact OG-N 3.18Å; S11-I31 PolarHBondContact OG-O 3.13Å
12	Q	90.7	Very high	81	Confident	45 Å²	45	96.8 Å²	96.8	21%	0.21	50%	0.504	C	S	.	.	S	Bend	trans	-80	131.7	171.9	-83.4	-63.4	-58	0	0	110.2	C10 D14 C15 F32 H36 H42	C10-Q12 PolarHBondContact O-N 3.36Å; Q12-D14 VanDerWaalsContact C-N 3.26Å; Q12-D14 PolarHBondContact O-N 2.8Å; Q12-C15 HydrophobicContact CB-CB 3.72Å; Q12-C15 PolarHBondContact O-N 2.96Å; Q12-F32 HydrophobicContact CG-CD1 4.01Å; Q12-F32 HydrophobicContact CG-CE1 4.05Å; Q12-H36 HydrophobicContact CG-CB 3.81Å; Q12-H42 HydrophobicContact CG-CB 3.92Å; Q12-H42 VanDerWaalsContact NE2-CA 3.25Å; Q12-H42 PolarHBondContact NE2-O 3.27Å
13	E	87.3	Confident	82.5	Confident	186 Å²	186	93.4 Å²	93.4	87%	0.869	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-37.5	-171.4	-60.7	-171.6	165.1	0	0	113.1
14	D	89.5	Confident	84.1	Confident	162 Å²	162	90.9 Å²	90.9	87%	0.866	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-1.7	-180	-63.2	-37.2	0	0	0	113.5	Q12	Q12-D14 VanDerWaalsContact C-N 3.26Å; Q12-D14 PolarHBondContact O-N 2.8Å
15	C	89.2	Confident	85.3	Confident	17 Å²	17	84.7 Å²	84.7	12%	0.115	44%	0.437	C	S	.	.			trans	-110.3	105.7	-173.6	-168.2	0	0	0	0	112.1	C10 Q12 Q17 H36	C10-C15 HydrophobicContact CB-CB 3.85Å; C10-C15 WeakPolarHBondContact CB-SG 3.47Å; Q12-C15 HydrophobicContact CB-CB 3.72Å; Q12-C15 PolarHBondContact O-N 2.96Å; C15-Q17 VanDerWaalsContact C-N 3.32Å; C15-H36 VanDerWaalsContact SG-CE1 3.53Å; C15-H36 PolarHBondContact SG-ND1 3.18Å; C15-H36 VanDerWaalsContact SG-ND1 3.42Å
16	K	84.7	Confident	86.1	Confident	189 Å²	189	84.7 Å²	84.7	82%	0.822	43%	0.432	S	S	*	.			trans	-93.3	14.8	175.8	-62	-177.9	-179.5	179.4	0	113.7	H9 L18	H9-K16 PolarHBondContact ND1-O 3.2Å; K16-L18 PolarHBondContact O-N 3.48Å
17	Q	85.7	Confident	86.6	Confident	81 Å²	81	82.9 Å²	82.9	38%	0.379	42%	0.421	S	S	.	.			trans	-67.7	127.2	-177.2	-172.6	175	-17.9	0	0	110.2	H9 C10 C15 C33	H9-Q17 WeakPolarHBondContact CA-O 3.3Å; C10-Q17 PolarHBondContact N-O 2.89Å; C10-Q17 VanDerWaalsContact N-O 3.08Å; C15-Q17 VanDerWaalsContact C-N 3.32Å; Q17-C33 HydrophobicContact CB-CB 4.32Å; Q17-C33 HydrophobicContact CG-CB 4.21Å; Q17-C33 PolarHBondContact OE1-SG 3.43Å
18	L	84.4	Confident	86.9	Confident	73 Å²	73	82.2 Å²	82.2	38%	0.382	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.9	168.7	-170.2	134.4	0	0	0	107.9	K16 F20	K16-L18 PolarHBondContact O-N 3.48Å; L18-F20 HydrophobicContact CD2-CD1 4.17Å; L18-F20 HydrophobicContact CD2-CE1 3.71Å; L18-F20 HydrophobicContact CD2-CE2 4.33Å; L18-F20 HydrophobicContact CD2-CZ 3.8Å
19	D	81.2	Confident	87	Confident	31 Å²	31	87.3 Å²	87.3	17%	0.166	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.1	177.4	-149.2	-34.9	0	0	0	109.4	G7 A8 L21	G7-D19 CarbonylContact C-O 3.56Å; G7-D19 VanDerWaalsContact CA-O 3.26Å; G7-D19 WeakPolarHBondContact CA-O 3.39Å; A8-D19 PolarHBondContact N-O 2.82Å; A8-D19 PolarHBondContact O-N 2.83Å; D19-L21 PolarHBondContact OD1-N 3.35Å
20	F	82.4	Confident	87	Confident	141 Å²	141	86.4 Å²	86.4	62%	0.618	43%	0.427	S	S	*	.	S	Bend	trans	-80.4	-12.5	177.4	-62.1	-75	0	0	0	111.6	I6 L18 P22	I6-F20 HydrophobicContact CG2-CD1 4.05Å; I6-F20 WeakPolarHBondContact O-CD1 3.16Å; I6-F20 WeakPolarHBondContact O-CE1 3.43Å; L18-F20 HydrophobicContact CD2-CD1 4.17Å; L18-F20 HydrophobicContact CD2-CE1 3.71Å; L18-F20 HydrophobicContact CD2-CE2 4.33Å; L18-F20 HydrophobicContact CD2-CZ 3.8Å; F20-P22 WeakPolarHBondContact O-CD 3.22Å
21	L	84	Confident	86.9	Confident	131 Å²	131	88 Å²	88	69%	0.686	43%	0.434	S	S	*	.	S	Bend	trans	-115.8	90.5	169.4	-83.3	75	0	0	0	109.5	D19 I23	D19-L21 PolarHBondContact OD1-N 3.35Å; L21-I23 PolarHBondContact O-N 3.36Å; L21-I23 VanDerWaalsContact O-N 3.17Å
22	P	81.3	Confident	86.9	Confident	52 Å²	52	85.6 Å²	85.6	34%	0.338	42%	0.417	S	S	.	.			trans	-60.3	116.8	177.2	-23.1	34.3	0	0	0	111.6	A8 F20 H24 I31	A8-P22 HydrophobicContact CB-CB 3.95Å; A8-P22 HydrophobicContact CB-CG 3.72Å; F20-P22 WeakPolarHBondContact O-CD 3.22Å; P22-H24 PolarHBondContact O-ND1 2.87Å; P22-I31 HydrophobicContact CB-CD1 4.16Å; P22-I31 HydrophobicContact CB-CG1 4.37Å; P22-I31 HydrophobicContact CB-CG2 3.73Å
23	I	89	Confident	86.8	Confident	62 Å²	62	83.4 Å²	83.4	32%	0.318	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.1	175.2	-51.5	171.1	0	0	0	108.5	L21 I31 F32 K34	L21-I23 PolarHBondContact O-N 3.36Å; L21-I23 VanDerWaalsContact O-N 3.17Å; I23-I31 CarbonylContact O-C 3.59Å; I23-I31 WeakPolarHBondContact O-CA 3.49Å; I23-F32 WeakPolarHBondContact CB-O 3.39Å; I23-F32 PolarHBondContact N-O 3.17Å; I23-F32 PolarHBondContact O-N 3.16Å; I23-K34 HydrophobicContact CD1-CB 4.4Å
24	H	89.8	Confident	86.9	Confident	114 Å²	114	82.7 Å²	82.7	53%	0.528	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	132.7	178.7	-59.2	79.1	0	0	0	109.6	P22	P22-H24 PolarHBondContact O-ND1 2.87Å
25	C	88.4	Confident	86.9	Confident	7 Å²	7	80.5 Å²	80.5	5%	0.047	39%	0.388	C	S	.	.			trans	-75.8	122.4	169.5	176.3	0	0	0	0	109.7	H27 C28 D29 R30 F32 H42	C25-H27 PolarHBondContact O-N 3.01Å; C25-H27 PolarHBondContact SG-N 3.4Å; C25-C28 PolarHBondContact O-N 2.81Å; C25-D29 VanDerWaalsContact O-CA 3.27Å; C25-D29 WeakPolarHBondContact O-CA 3.15Å; C25-D29 PolarHBondContact O-N 3.32Å; C25-R30 PolarHBondContact N-O 3.39Å; C25-F32 HydrophobicContact CB-CD2 3.98Å; C25-F32 HydrophobicContact CB-CE2 3.73Å; C25-H42 PolarHBondContact SG-CE1 2.82Å
26	E	83.4	Confident	86.9	Confident	150 Å²	150	81.8 Å²	81.8	70%	0.701	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-12.4	179.3	-59.3	-178.2	173.3	0	0	114.7
27	H	84.7	Confident	87.1	Confident	71 Å²	71	74.7 Å²	74.7	33%	0.329	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-44.7	-178.6	-62	-68.3	0	0	0	112.9	C25 I39 I46	C25-H27 PolarHBondContact O-N 3.01Å; C25-H27 PolarHBondContact SG-N 3.4Å; H27-I39 WeakPolarHBondContact CD2-CD1 3.46Å; H27-I39 VanDerWaalsContact NE2-CD1 3.26Å; H27-I39 WeakPolarHBondContact NE2-CD1 3.48Å; H27-I46 HydrophobicContact CB-CB 4.26Å; H27-I46 HydrophobicContact CB-CG2 4.35Å; H27-I46 WeakPolarHBondContact O-CD1 3.49Å
28	C	89.4	Confident	87.2	Confident	20 Å²	20	72 Å²	72	14%	0.135	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	1.3	-176.2	70.9	0	0	0	0	114.5	C25 R30 P45 I46	C25-C28 PolarHBondContact O-N 2.81Å; C28-R30 PolarHBondContact O-N 2.81Å; C28-P45 HydrophobicContact CB-CG 4.04Å; C28-I46 HydrophobicContact CB-CD1 4.03Å
29	D	87.9	Confident	87.2	Confident	127 Å²	127	70.5 Å²	70.5	68%	0.679	35%	0.349	S	S	*	.			trans	54.5	14	179.9	-66.4	-34.7	0	0	0	115.3	C25	C25-D29 VanDerWaalsContact O-CA 3.27Å; C25-D29 WeakPolarHBondContact O-CA 3.15Å; C25-D29 PolarHBondContact O-N 3.32Å
30	R	89.8	Confident	87.3	Confident	95 Å²	95	72.7 Å²	72.7	36%	0.358	36%	0.364	S	S	.	.			trans	-85.1	152.1	175	-68.3	-174.3	-66.6	174.1	6.5	111.2	C25 C28 F32	C25-R30 PolarHBondContact N-O 3.39Å; C28-R30 PolarHBondContact O-N 2.81Å; R30-F32 HydrophobicContact CB-CE2 3.62Å; R30-F32 HydrophobicContact CB-CZ 3.59Å; R30-F32 WeakPolarHBondContact O-CD2 3.5Å; R30-F32 WeakPolarHBondContact O-CE2 3.45Å
31	I	90.6	Very high	87.5	Confident	42 Å²	42	67.7 Å²	67.7	22%	0.215	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	133.2	-178.4	-63.8	168.9	0	0	0	109.8	A8 S11 P22 I23	A8-I31 HydrophobicContact CB-CD1 3.86Å; A8-I31 HydrophobicContact CB-CG2 3.84Å; S11-I31 VanDerWaalsContact CB-O 3.23Å; S11-I31 WeakPolarHBondContact CB-O 2.92Å; S11-I31 PolarHBondContact N-O 3.31Å; S11-I31 PolarHBondContact OG-N 3.18Å; S11-I31 PolarHBondContact OG-O 3.13Å; P22-I31 HydrophobicContact CB-CD1 4.16Å; P22-I31 HydrophobicContact CB-CG1 4.37Å; P22-I31 HydrophobicContact CB-CG2 3.73Å; I23-I31 CarbonylContact O-C 3.59Å; I23-I31 WeakPolarHBondContact O-CA 3.49Å
32	F	91.5	Very high	87.7	Confident	1 Å²	1	61.6 Å²	61.6	0%	0.004	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.1	177.9	-59.9	-74.8	0	0	0	111.1	Q12 I23 C25 R30 H36 H42	Q12-F32 HydrophobicContact CG-CD1 4.01Å; Q12-F32 HydrophobicContact CG-CE1 4.05Å; I23-F32 WeakPolarHBondContact CB-O 3.39Å; I23-F32 PolarHBondContact N-O 3.17Å; I23-F32 PolarHBondContact O-N 3.16Å; C25-F32 HydrophobicContact CB-CD2 3.98Å; C25-F32 HydrophobicContact CB-CE2 3.73Å; R30-F32 HydrophobicContact CB-CE2 3.62Å; R30-F32 HydrophobicContact CB-CZ 3.59Å; R30-F32 WeakPolarHBondContact O-CD2 3.5Å; R30-F32 WeakPolarHBondContact O-CE2 3.45Å; F32-H36 HydrophobicContact CB-CB 4.02Å; F32-H36 WeakPolarHBondContact CB-O 3.41Å; F32-H36 HydrophobicContact CD1-CB 4.11Å; F32-H36 HydrophobicContact CG-CB 4.39Å; F32-H36 WeakPolarHBondContact CG-O 3.34Å; F32-H42 HydrophobicContact CD1-CB 3.71Å; F32-H42 HydrophobicContact CD2-CB 4.48Å; F32-H42 AromaticContact CD2-ND1 3.96Å; F32-H42 HydrophobicContact CE1-CB 3.48Å; F32-H42 VanDerWaalsContact CE1-CB 3.48Å; F32-H42 AromaticContact CE1-CD2 3.85Å; F32-H42 AromaticContact CE1-CG 3.74Å; F32-H42 HydrophobicContact CE2-CB 4.27Å; F32-H42 AromaticContact CE2-CD2 3.43Å; F32-H42 VanDerWaalsContact CE2-CD2 3.43Å; F32-H42 WeakPolarHBondContact CE2-CD2 3.37Å; F32-H42 AromaticContact CE2-CE1 3.77Å; F32-H42 AromaticContact CE2-CG 3.63Å; F32-H42 AromaticContact CE2-ND1 3.84Å; F32-H42 AromaticContact CE2-NE2 3.53Å; F32-H42 HydrophobicContact CG-CB 4.22Å; F32-H42 HydrophobicContact CZ-CB 3.79Å; F32-H42 AromaticContact CZ-CD2 3.18Å; F32-H42 WeakPolarHBondContact CZ-CD2 3.45Å; F32-H42 AromaticContact CZ-CG 3.48Å; F32-H42 VanDerWaalsContact CZ-CG 3.48Å; F32-H42 AromaticContact CZ-NE2 3.77Å
33	C	89.9	Confident	87.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.334	C	S	.	.			trans	-73.1	169.5	168.7	70.1	0	0	0	0	110.5	C10 Q17 I35 H36 S37	C10-C33 HydrophobicContact CB-CB 4.22Å; C10-C33 PolarHBondContact SG-N 3.41Å; Q17-C33 HydrophobicContact CB-CB 4.32Å; Q17-C33 HydrophobicContact CG-CB 4.21Å; Q17-C33 PolarHBondContact OE1-SG 3.43Å; C33-I35 PolarHBondContact O-N 3.09Å; C33-H36 CarbonylContact O-C 3.57Å; C33-H36 PolarHBondContact O-N 3.43Å; C33-H36 PolarHBondContact SG-ND1 3Å; C33-S37 PolarHBondContact O-N 3.41Å
34	K	89.1	Confident	87.7	Confident	171 Å²	171	62.5 Å²	62.5	74%	0.743	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-30.7	176.7	-175.6	177.2	177.8	-178.3	0	115.2	I23 S37	I23-K34 HydrophobicContact CD1-CB 4.4Å; K34-S37 PolarHBondContact O-OG 2.9Å
35	I	88.9	Confident	87.3	Confident	115 Å²	115	61.2 Å²	61.2	59%	0.59	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-32.7	-177.8	-58.3	171.5	0	0	0	111.2	C33 A41	C33-I35 PolarHBondContact O-N 3.09Å; I35-A41 WeakPolarHBondContact O-CB 2.84Å
36	H	89.9	Confident	86.8	Confident	44 Å²	44	65.1 Å²	65.1	20%	0.204	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	5.8	-174.9	-60.7	120.6	0	0	0	113.2	C10 Q12 C15 F32 C33 S38 H42	C10-H36 PolarHBondContact SG-ND1 3.18Å; Q12-H36 HydrophobicContact CG-CB 3.81Å; C15-H36 VanDerWaalsContact SG-CE1 3.53Å; C15-H36 PolarHBondContact SG-ND1 3.18Å; C15-H36 VanDerWaalsContact SG-ND1 3.42Å; F32-H36 HydrophobicContact CB-CB 4.02Å; F32-H36 WeakPolarHBondContact CB-O 3.41Å; F32-H36 HydrophobicContact CD1-CB 4.11Å; F32-H36 HydrophobicContact CG-CB 4.39Å; F32-H36 WeakPolarHBondContact CG-O 3.34Å; C33-H36 CarbonylContact O-C 3.57Å; C33-H36 PolarHBondContact O-N 3.43Å; C33-H36 PolarHBondContact SG-ND1 3Å; H36-S38 VanDerWaalsContact C-N 3.34Å; H36-S38 PolarHBondContact O-N 2.97Å; H36-H42 HydrophobicContact CB-CB 4.36Å; H36-H42 VanDerWaalsContact O-CB 3.3Å; H36-H42 WeakPolarHBondContact O-CB 3.3Å; H36-H42 PolarHBondContact O-ND1 3.43Å; H36-H42 VanDerWaalsContact O-ND1 3.17Å
37	S	89.1	Confident	85.8	Confident	40 Å²	40	62.3 Å²	62.3	28%	0.28	34%	0.337	S	S	.	.			trans	-72.2	-23.2	-175	62.7	0	0	0	0	114.4	C33 K34	C33-S37 PolarHBondContact O-N 3.41Å; K34-S37 PolarHBondContact O-OG 2.9Å
38	S	86.2	Confident	84.3	Confident	25 Å²	25	64.3 Å²	64.3	18%	0.175	36%	0.359	C	S	.	.	S	Bend	trans	-73.7	149.9	176.7	74.3	0	0	0	0	111	H36 T40 A41 H42	H36-S38 VanDerWaalsContact C-N 3.34Å; H36-S38 PolarHBondContact O-N 2.97Å; S38-T40 PolarHBondContact O-N 2.93Å; S38-T40 PolarHBondContact OG-OG1 3.05Å; S38-A41 PolarHBondContact O-N 2.92Å; S38-A41 WeakPolarHBondContact OG-CB 3.46Å; S38-A41 PolarHBondContact OG-N 3.47Å; S38-H42 PolarHBondContact O-N 2.89Å; S38-H42 PolarHBondContact O-ND1 2.9Å
39	I	84	Confident	82.5	Confident	42 Å²	42	67 Å²	67	22%	0.215	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-37.8	178.1	-63.3	168.8	0	0	0	111.4	H27 N43 C44 Y51	H27-I39 WeakPolarHBondContact CD2-CD1 3.46Å; H27-I39 VanDerWaalsContact NE2-CD1 3.26Å; H27-I39 WeakPolarHBondContact NE2-CD1 3.48Å; I39-N43 PolarHBondContact O-N 2.91Å; I39-C44 HydrophobicContact CB-CB 4.47Å; I39-C44 HydrophobicContact CG2-CB 3.76Å; I39-C44 PolarHBondContact O-N 2.92Å; I39-C44 VanDerWaalsContact O-N 3.08Å; I39-Y51 HydrophobicContact CD1-CE1 4.14Å
40	T	84.2	Confident	80.8	Confident	77 Å²	77	65 Å²	65	47%	0.472	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-34	178.6	49.4	0	0	0	0	112.9	S38 N43	S38-T40 PolarHBondContact O-N 2.93Å; S38-T40 PolarHBondContact OG-OG1 3.05Å; T40-N43 PolarHBondContact O-OD1 2.8Å
41	A	86.3	Confident	79.1	Confident	36 Å²	36	64.3 Å²	64.3	30%	0.298	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-28.4	-175.4	0	0	0	0	0	113.5	I35 S38	I35-A41 WeakPolarHBondContact O-CB 2.84Å; S38-A41 PolarHBondContact O-N 2.92Å; S38-A41 WeakPolarHBondContact OG-CB 3.46Å; S38-A41 PolarHBondContact OG-N 3.47Å
42	H	88	Confident	77.4	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.009	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	9.3	177.3	74.1	-91.8	0	0	0	114.3	Q12 C25 F32 H36 S38 C44	Q12-H42 HydrophobicContact CG-CB 3.92Å; Q12-H42 VanDerWaalsContact NE2-CA 3.25Å; Q12-H42 PolarHBondContact NE2-O 3.27Å; C25-H42 PolarHBondContact SG-CE1 2.82Å; F32-H42 HydrophobicContact CD1-CB 3.71Å; F32-H42 HydrophobicContact CD2-CB 4.48Å; F32-H42 AromaticContact CD2-ND1 3.96Å; F32-H42 HydrophobicContact CE1-CB 3.48Å; F32-H42 VanDerWaalsContact CE1-CB 3.48Å; F32-H42 AromaticContact CE1-CD2 3.85Å; F32-H42 AromaticContact CE1-CG 3.74Å; F32-H42 HydrophobicContact CE2-CB 4.27Å; F32-H42 AromaticContact CE2-CD2 3.43Å; F32-H42 VanDerWaalsContact CE2-CD2 3.43Å; F32-H42 WeakPolarHBondContact CE2-CD2 3.37Å; F32-H42 AromaticContact CE2-CE1 3.77Å; F32-H42 AromaticContact CE2-CG 3.63Å; F32-H42 AromaticContact CE2-ND1 3.84Å; F32-H42 AromaticContact CE2-NE2 3.53Å; F32-H42 HydrophobicContact CG-CB 4.22Å; F32-H42 HydrophobicContact CZ-CB 3.79Å; F32-H42 AromaticContact CZ-CD2 3.18Å; F32-H42 WeakPolarHBondContact CZ-CD2 3.45Å; F32-H42 AromaticContact CZ-CG 3.48Å; F32-H42 VanDerWaalsContact CZ-CG 3.48Å; F32-H42 AromaticContact CZ-NE2 3.77Å; H36-H42 HydrophobicContact CB-CB 4.36Å; H36-H42 VanDerWaalsContact O-CB 3.3Å; H36-H42 WeakPolarHBondContact O-CB 3.3Å; H36-H42 PolarHBondContact O-ND1 3.43Å; H36-H42 VanDerWaalsContact O-ND1 3.17Å; S38-H42 PolarHBondContact O-N 2.89Å; S38-H42 PolarHBondContact O-ND1 2.9Å; H42-C44 WeakPolarHBondContact NE2-CA 3.31Å; H42-C44 WeakPolarHBondContact NE2-CB 3.45Å; H42-C44 PolarHBondContact O-N 3.07Å
43	N	84.8	Confident	75.7	Confident	132 Å²	132	69.8 Å²	69.8	71%	0.706	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	62.2	-175.1	-66.6	-31.9	0	0	0	111.6	I39 T40	I39-N43 PolarHBondContact O-N 2.91Å; T40-N43 PolarHBondContact O-OD1 2.8Å
44	C	85.1	Confident	74.2	Confident	2 Å²	2	75.2 Å²	75.2	1%	0.014	42%	0.421	C	S	.	.			trans	-50.8	127	-175.3	-171.4	0	0	0	0	111.1	I39 H42 I46 S47	I39-C44 HydrophobicContact CB-CB 4.47Å; I39-C44 HydrophobicContact CG2-CB 3.76Å; I39-C44 PolarHBondContact O-N 2.92Å; I39-C44 VanDerWaalsContact O-N 3.08Å; H42-C44 WeakPolarHBondContact NE2-CA 3.31Å; H42-C44 WeakPolarHBondContact NE2-CB 3.45Å; H42-C44 PolarHBondContact O-N 3.07Å; C44-I46 PolarHBondContact O-N 2.89Å; C44-I46 VanDerWaalsContact O-N 3.09Å; C44-S47 WeakPolarHBondContact O-CB 3.43Å; C44-S47 PolarHBondContact O-N 2.92Å; C44-S47 VanDerWaalsContact O-N 3.09Å; C44-S47 PolarHBondContact O-OG 3.44Å
45	P	82.9	Confident	72.6	Confident	86 Å²	86	75.5 Å²	75.5	56%	0.558	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-16.7	-178.3	24.9	-34.4	0	0	0	112.2	C28 S47	C28-P45 HydrophobicContact CB-CG 4.04Å; P45-S47 VanDerWaalsContact C-N 3.32Å
46	I	76.4	Confident	70.5	Confident	89 Å²	89	74 Å²	74	46%	0.456	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	28.7	179.9	-59.7	160.9	0	0	0	109.6	H27 C28 C44 S48	H27-I46 HydrophobicContact CB-CB 4.26Å; H27-I46 HydrophobicContact CB-CG2 4.35Å; H27-I46 WeakPolarHBondContact O-CD1 3.49Å; C28-I46 HydrophobicContact CB-CD1 4.03Å; C44-I46 PolarHBondContact O-N 2.89Å; C44-I46 VanDerWaalsContact O-N 3.09Å; I46-S48 PolarHBondContact O-N 3.35Å
47	S	63.1	Low	68.6	Low	91 Å²	91	77.6 Å²	77.6	64%	0.636	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	12.8	-177.1	64.6	0	0	0	0	115.4	C44 P45	C44-S47 WeakPolarHBondContact O-CB 3.43Å; C44-S47 PolarHBondContact O-N 2.92Å; C44-S47 VanDerWaalsContact O-N 3.09Å; C44-S47 PolarHBondContact O-OG 3.44Å; P45-S47 VanDerWaalsContact C-N 3.32Å
48	S	52.7	Low	66.5	Low	113 Å²	113	80.1 Å²	80.1	79%	0.79	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	8.8	-166.2	68.5	0	0	0	0	116.2	I46	I46-S48 PolarHBondContact O-N 3.35Å
49	S	51.8	Low	64.8	Low	76 Å²	76	87.8 Å²	87.8	53%	0.531	51%	0.51	S	S	.	.	S	Bend	trans	-150.8	112.1	-179.2	176.6	0	0	0	0	111.7
50	T	53.1	Low	63.2	Low	87 Å²	87	91.4 Å²	91.4	53%	0.534	54%	0.539	S	S	.	.			trans	36.8	113.7	149.8	-50.8	0	0	0	0	115.8	Q52	T50-Q52 VanDerWaalsContact C-N 3.25Å; T50-Q52 HydrophobicContact CG2-CG 4.11Å; T50-Q52 PolarHBondContact O-N 3.49Å
51	Y	53.6	Low	61.2	Low	80 Å²	80	99 Å²	99	31%	0.314	56%	0.559	S	S	.	*			trans	-52.5	92.9	163.9	-64.5	-85	0	0	0	109.3	I39 C53 Y72 V101	I39-Y51 HydrophobicContact CD1-CE1 4.14Å; Y51-C53 PolarHBondContact O-N 3.1Å; Y51-Y72 WeakPolarHBondContact CD2-OH 3.34Å; Y51-V101 HydrophobicContact CD1-CG1 3.85Å; Y51-V101 HydrophobicContact CE1-CB 4.47Å; Y51-V101 HydrophobicContact CE1-CG1 3.86Å; Y51-V101 HydrophobicContact CE1-CG2 3.98Å; Y51-V101 HydrophobicContact CG-CG1 4.21Å
52	Q	54.7	Low	59.6	Low	136 Å²	136	101.2 Å²	101.2	64%	0.636	57%	0.573	S	S	*	*			trans	-87.7	98.1	178.3	-79.6	179	15.8	0	0	106	T50 H54	T50-Q52 VanDerWaalsContact C-N 3.25Å; T50-Q52 HydrophobicContact CG2-CG 4.11Å; T50-Q52 PolarHBondContact O-N 3.49Å; Q52-H54 PolarHBondContact O-N 3.26Å
53	C	57	Low	57.9	Low	21 Å²	21	108.7 Å²	108.7	14%	0.142	61%	0.613	C	S	.	*			trans	-53.3	129	158.1	-135.1	0	0	0	0	107.4	Y51 Q55 C75 Q77 C93 H96	Y51-C53 PolarHBondContact O-N 3.1Å; C53-Q55 PolarHBondContact O-N 2.87Å; C53-C75 PolarHBondContact SG-SG 3.42Å; C53-Q77 HydrophobicContact CB-CG 4.06Å; C53-Q77 PolarHBondContact SG-NE2 2.81Å; C53-Q77 PolarHBondContact SG-OE1 3.08Å; C53-C93 VanDerWaalsContact SG-SG 3.6Å; C53-H96 PolarHBondContact SG-CE1 3.24Å
54	H	58	Low	56.7	Low	114 Å²	114	109 Å²	109	53%	0.528	61%	0.614	S	S	.	*			trans	-36.7	132.3	-176.2	-60.6	-76.7	0	0	0	112.3	Q52 A56 Q77	Q52-H54 PolarHBondContact O-N 3.26Å; H54-A56 PolarHBondContact O-N 2.82Å; H54-Q77 PolarHBondContact O-NE2 3.26Å
55	Q	54.2	Low	55.3	Low	177 Å²	177	114.1 Å²	114.1	83%	0.827	66%	0.657	S	S	*	*			trans	-40.3	124.6	-179.5	-64.6	174.7	17.5	0	0	110	C53 S57	C53-Q55 PolarHBondContact O-N 2.87Å; Q55-S57 PolarHBondContact O-N 3.04Å
56	A	46.1	Very low	54.2	Low	84 Å²	84	117.2 Å²	117.2	69%	0.694	67%	0.669	S	S	*	*			trans	-53.9	105.8	178.6	0	0	0	0	0	108.9	H54 S58	H54-A56 PolarHBondContact O-N 2.82Å; A56-S58 PolarHBondContact O-N 3.01Å; A56-S58 PolarHBondContact O-OG 3.2Å
57	S	49.4	Very low	53.6	Low	120 Å²	120	116.2 Å²	116.2	84%	0.839	66%	0.664	S	S	*	*			trans	-68.7	82	158.6	55.6	0	0	0	0	106.3	Q55 Q59	Q55-S57 PolarHBondContact O-N 3.04Å; S57-Q59 PolarHBondContact O-N 2.99Å; S57-Q59 VanDerWaalsContact O-N 3.08Å
58	S	45.2	Very low	53.9	Low	93 Å²	93	117.1 Å²	117.1	65%	0.65	66%	0.657	S	S	*	*			trans	-64.6	95.4	175.2	38	0	0	0	0	108.9	A56	A56-S58 PolarHBondContact O-N 3.01Å; A56-S58 PolarHBondContact O-OG 3.2Å
59	Q	50.1	Low	55.3	Low	185 Å²	185	114.5 Å²	114.5	86%	0.864	63%	0.633	S	S	*	*			trans	-175.1	97.3	161	-102.2	149.2	63.1	0	0	112.1	S57	S57-Q59 PolarHBondContact O-N 2.99Å; S57-Q59 VanDerWaalsContact O-N 3.08Å
60	S	50.9	Low	56.8	Low	118 Å²	118	111.1 Å²	111.1	83%	0.825	61%	0.61	S	S	*	*				160.7	114.7	121.8	64.9	0	0	0	0	111.6
61	R	43.1	Very low	58.3	Low	236 Å²	236	111.5 Å²	111.5	89%	0.891	61%	0.609	S	S	*	*			trans	-47.9	124.9	174.9	-59.7	-85.9	169.2	164.1	-6.4	113.9
62	S	51.8	Low	59.7	Low	83 Å²	83	108.3 Å²	108.3	58%	0.58	60%	0.596	S	S	*	*			trans	-156.5	117.6	145.6	59.2	0	0	0	0	109.4	D64	S62-D64 PolarHBondContact O-N 3.28Å
63	D	52.6	Low	60.9	Low	160 Å²	160	108.2 Å²	108.2	86%	0.856	60%	0.595	S	S	*	*			trans	-77.4	56.8	-178.4	-66.4	-43.1	0	0	0	111.9
64	D	58.7	Low	61.6	Low	138 Å²	138	112.1 Å²	112.1	74%	0.738	61%	0.614	S	S	*	*			trans	-104.7	121.8	175.7	-91.6	-36.5	0	0	0	111.6	S62 N66	S62-D64 PolarHBondContact O-N 3.28Å; D64-N66 PolarHBondContact O-N 3.32Å
65	A	55.9	Low	62.5	Low	110 Å²	110	107.1 Å²	107.1	91%	0.909	59%	0.592	S	S	*	*	S	Bend	trans	-70.8	43.6	-164.1	0	0	0	0	0	116.2
66	N	60.8	Low	63.3	Low	150 Å²	150	105.2 Å²	105.2	80%	0.802	59%	0.587	S	S	*	*			trans	-143.9	61.8	175	-148.7	4.4	0	0	0	112.1	D64 K68	D64-N66 PolarHBondContact O-N 3.32Å; N66-K68 PolarHBondContact O-N 3.43Å
67	D	63.9	Low	64.4	Low	68 Å²	68	103 Å²	103	36%	0.364	56%	0.563	S	S	.	*			trans	-79.2	109.7	-164.3	-143.2	13.4	0	0	0	111.7	I69 R78	D67-I69 VanDerWaalsContact C-N 3.25Å; D67-I69 HydrophobicContact CB-CD1 3.92Å; D67-I69 HydrophobicContact CB-CG1 4.05Å; D67-I69 PolarHBondContact O-N 2.89Å; D67-I69 WeakPolarHBondContact OD2-CD1 3.3Å; D67-R78 WeakPolarHBondContact OD1-CD 3.37Å; D67-R78 IonicContact OD1-CZ 3.57Å; D67-R78 IonicContact OD1-NE 3.04Å; D67-R78 PolarHBondContact OD1-NE 3.13Å; D67-R78 IonicContact OD1-NH1 2.97Å; D67-R78 PolarHBondContact OD1-NH1 2.87Å; D67-R78 IonicContact OD1-NH2 2.89Å; D67-R78 IonicContact OD2-CZ 2.8Å; D67-R78 IonicContact OD2-NE 2.62Å; D67-R78 PolarHBondContact OD2-NE 2.67Å; D67-R78 IonicContact OD2-NH1 3.47Å; D67-R78 PolarHBondContact OD2-NH1 3.09Å; D67-R78 IonicContact OD2-NH2 2.61Å; D67-R78 PolarHBondContact OD2-NH2 2.93Å
68	K	69.2	Low	65.4	Low	110 Å²	110	104.9 Å²	104.9	48%	0.478	55%	0.551	S	S	.	*			trans	-74.8	72.3	179.8	-67.7	-169.1	-172.6	-170.6	0	111.4	N66 R78 Q79 L80 L82	N66-K68 PolarHBondContact O-N 3.43Å; K68-R78 VanDerWaalsContact O-CA 3.29Å; K68-R78 WeakPolarHBondContact O-CA 3.32Å; K68-Q79 VanDerWaalsContact CB-O 3.28Å; K68-Q79 WeakPolarHBondContact CB-O 3.24Å; K68-Q79 WeakPolarHBondContact CD-O 3.5Å; K68-Q79 PolarHBondContact O-N 3.34Å; K68-L80 WeakPolarHBondContact CD-O 3.47Å; K68-L80 PolarHBondContact NZ-O 2.88Å; K68-L82 VanDerWaalsContact CA-CD1 3.44Å; K68-L82 HydrophobicContact CB-CD1 3.54Å; K68-L82 HydrophobicContact CB-CG 4.13Å; K68-L82 HydrophobicContact CG-CD1 4.18Å
69	I	80.6	Confident	66.5	Low	58 Å²	58	102.5 Å²	102.5	30%	0.297	53%	0.53	S	S	.	.	B	Isolated β-bridge	trans	-93.1	148.7	-179.2	-55.2	163.2	0	0	0	111	D67 R78 L82	D67-I69 VanDerWaalsContact C-N 3.25Å; D67-I69 HydrophobicContact CB-CD1 3.92Å; D67-I69 HydrophobicContact CB-CG1 4.05Å; D67-I69 PolarHBondContact O-N 2.89Å; D67-I69 WeakPolarHBondContact OD2-CD1 3.3Å; I69-R78 HydrophobicContact CG1-CG 4.26Å; I69-L82 WeakPolarHBondContact O-CD1 3.33Å
70	C	85	Confident	67.5	Low	5 Å²	5	101.2 Å²	101.2	3%	0.034	53%	0.528	C	S	.	.			trans	-75.4	131.1	171.4	-175.5	0	0	0	0	111.9	Y72 C75 Q77 N91 C93	C70-Y72 PolarHBondContact O-N 3.46Å; C70-Y72 VanDerWaalsContact O-N 3.08Å; C70-C75 HydrophobicContact CB-CB 4.06Å; C70-C75 WeakPolarHBondContact CB-SG 3.27Å; C70-Q77 PolarHBondContact N-O 2.89Å; C70-N91 CarbonylContact C-O 3.31Å; C70-N91 WeakPolarHBondContact CA-O 3.33Å; C70-C93 HydrophobicContact CB-CB 4.3Å; C70-C93 PolarHBondContact SG-N 2.89Å
71	D	84.7	Confident	68.8	Low	96 Å²	96	100.2 Å²	100.2	51%	0.513	52%	0.517	S	S	.	.			trans	-76.6	10.5	179.1	-67.1	-22.5	0	0	0	113.9	G90 N91 F92	D71-G90 WeakPolarHBondContact OD2-CA 3.35Å; D71-N91 WeakPolarHBondContact CB-O 3.31Å; D71-N91 PolarHBondContact N-O 2.95Å; D71-N91 PolarHBondContact OD2-N 2.9Å; D71-F92 HydrophobicContact CB-CD1 4.39Å; D71-F92 HydrophobicContact CB-CE1 3.83Å; D71-F92 HydrophobicContact CB-CZ 4.18Å
72	Y	82.5	Confident	70.7	Confident	12 Å²	12	90.5 Å²	90.5	5%	0.047	48%	0.482	C	S	.	.	S	Bend	trans	-84.6	123.4	176	-176.2	-114.9	0	0	0	109.1	Y51 C70 L74 C75 H96 V101 H102	Y51-Y72 WeakPolarHBondContact CD2-OH 3.34Å; C70-Y72 PolarHBondContact O-N 3.46Å; C70-Y72 VanDerWaalsContact O-N 3.08Å; Y72-L74 HydrophobicContact CD1-CB 4.09Å; Y72-L74 HydrophobicContact CE1-CB 3.75Å; Y72-L74 HydrophobicContact CE1-CD1 4.33Å; Y72-L74 HydrophobicContact CE1-CG 4.37Å; Y72-L74 PolarHBondContact O-N 3.48Å; Y72-C75 HydrophobicContact CD1-CB 3.91Å; Y72-C75 HydrophobicContact CG-CB 4.42Å; Y72-C75 PolarHBondContact O-N 3.43Å; Y72-H96 AromaticContact CD1-CD2 3.46Å; Y72-H96 VanDerWaalsContact CD1-CD2 3.46Å; Y72-H96 WeakPolarHBondContact CD1-CD2 3.47Å; Y72-H96 AromaticContact CD1-CE1 3.7Å; Y72-H96 AromaticContact CD1-CG 3.73Å; Y72-H96 AromaticContact CD1-ND1 3.85Å; Y72-H96 AromaticContact CD1-NE2 3.45Å; Y72-H96 WeakPolarHBondContact CD1-NE2 3.4Å; Y72-H96 AromaticContact CE1-CD2 3.69Å; Y72-H96 AromaticContact CE1-NE2 3.59Å; Y72-H96 HydrophobicContact CG-CB 4.23Å; Y72-H96 AromaticContact CG-CD2 3.94Å; Y72-H96 AromaticContact CG-CG 3.89Å; Y72-V101 WeakPolarHBondContact CE2-O 3.4Å; Y72-H102 HydrophobicContact CD2-CB 3.9Å
73	H	79.1	Confident	72.3	Confident	135 Å²	135	88.9 Å²	88.9	63%	0.625	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-18.7	-171.7	65.5	-72.5	0	0	0	116.1
74	L	72.4	Confident	74	Confident	103 Å²	103	84.7 Å²	84.7	54%	0.539	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	9.1	176.3	-58.7	170.4	0	0	0	113.3	Y72	Y72-L74 HydrophobicContact CD1-CB 4.09Å; Y72-L74 HydrophobicContact CE1-CB 3.75Å; Y72-L74 HydrophobicContact CE1-CD1 4.33Å; Y72-L74 HydrophobicContact CE1-CG 4.37Å; Y72-L74 PolarHBondContact O-N 3.48Å
75	C	77.4	Confident	75.4	Confident	9 Å²	9	78.4 Å²	78.4	6%	0.061	42%	0.417	C	S	.	.			trans	-120.9	120.5	-177.2	-177.6	0	0	0	0	111.4	C53 C70 Y72 H96	C53-C75 PolarHBondContact SG-SG 3.42Å; C70-C75 HydrophobicContact CB-CB 4.06Å; C70-C75 WeakPolarHBondContact CB-SG 3.27Å; Y72-C75 HydrophobicContact CD1-CB 3.91Å; Y72-C75 HydrophobicContact CG-CB 4.42Å; Y72-C75 PolarHBondContact O-N 3.43Å; C75-H96 VanDerWaalsContact CB-CE1 3.41Å; C75-H96 WeakPolarHBondContact CB-CE1 3.41Å; C75-H96 WeakPolarHBondContact CB-ND1 3.43Å; C75-H96 PolarHBondContact SG-ND1 3.36Å; C75-H96 VanDerWaalsContact SG-ND1 3.45Å
76	N	71.1	Confident	77	Confident	136 Å²	136	79.5 Å²	79.5	73%	0.727	41%	0.408	S	S	*	.			trans	-113.1	27.7	173.5	-156.5	17.2	0	0	0	112.3
77	Q	68.2	Low	78.1	Confident	39 Å²	39	73.5 Å²	73.5	18%	0.182	38%	0.381	C	S	.	.			trans	-79	134.2	178.4	-77.2	-165.1	-6.7	0	0	111.6	C53 H54 C70	C53-Q77 HydrophobicContact CB-CG 4.06Å; C53-Q77 PolarHBondContact SG-NE2 2.81Å; C53-Q77 PolarHBondContact SG-OE1 3.08Å; H54-Q77 PolarHBondContact O-NE2 3.26Å; C70-Q77 PolarHBondContact N-O 2.89Å
78	R	70.2	Confident	79.2	Confident	158 Å²	158	72 Å²	72	60%	0.596	38%	0.376	S	S	*	.	B	Isolated β-bridge	trans	-94.3	124.9	168.2	-60.4	176.7	-176.7	-162.9	2	108.6	D67 K68 I69	D67-R78 WeakPolarHBondContact OD1-CD 3.37Å; D67-R78 IonicContact OD1-CZ 3.57Å; D67-R78 IonicContact OD1-NE 3.04Å; D67-R78 PolarHBondContact OD1-NE 3.13Å; D67-R78 IonicContact OD1-NH1 2.97Å; D67-R78 PolarHBondContact OD1-NH1 2.87Å; D67-R78 IonicContact OD1-NH2 2.89Å; D67-R78 IonicContact OD2-CZ 2.8Å; D67-R78 IonicContact OD2-NE 2.62Å; D67-R78 PolarHBondContact OD2-NE 2.67Å; D67-R78 IonicContact OD2-NH1 3.47Å; D67-R78 PolarHBondContact OD2-NH1 3.09Å; D67-R78 IonicContact OD2-NH2 2.61Å; D67-R78 PolarHBondContact OD2-NH2 2.93Å; K68-R78 VanDerWaalsContact O-CA 3.29Å; K68-R78 WeakPolarHBondContact O-CA 3.32Å; I69-R78 HydrophobicContact CG1-CG 4.26Å
79	Q	68.5	Low	80	Confident	44 Å²	44	75.7 Å²	75.7	21%	0.206	39%	0.388	C	S	.	.			trans	-119.4	144.1	173.7	-72.8	-166.6	-29.4	0	0	110.2	K68 V81 C93 T94	K68-Q79 VanDerWaalsContact CB-O 3.28Å; K68-Q79 WeakPolarHBondContact CB-O 3.24Å; K68-Q79 WeakPolarHBondContact CD-O 3.5Å; K68-Q79 PolarHBondContact O-N 3.34Å; Q79-V81 WeakPolarHBondContact CB-O 3.23Å; Q79-V81 PolarHBondContact O-N 2.72Å; Q79-V81 PolarHBondContact OE1-O 2.84Å; Q79-C93 HydrophobicContact CG-CB 4.15Å; Q79-T94 PolarHBondContact NE2-OG1 3.12Å; Q79-T94 VanDerWaalsContact NE2-OG1 3.12Å
80	L	71.3	Confident	80.3	Confident	158 Å²	158	73.4 Å²	73.4	83%	0.827	38%	0.378	S	S	*	.	S	Bend	trans	-56.4	-31.9	173.1	-74	167.3	0	0	0	111.5	K68	K68-L80 WeakPolarHBondContact CD-O 3.47Å; K68-L80 PolarHBondContact NZ-O 2.88Å
81	V	78.1	Confident	80.5	Confident	96 Å²	96	76.3 Å²	76.3	58%	0.582	39%	0.394	S	S	*	.	S	Bend	trans	-125.8	116.7	178.1	-176.8	0	0	0	0	108.5	Q79 L83	Q79-V81 WeakPolarHBondContact CB-O 3.23Å; Q79-V81 PolarHBondContact O-N 2.72Å; Q79-V81 PolarHBondContact OE1-O 2.84Å; V81-L83 HydrophobicContact CG1-CD2 4.25Å
82	L	82.6	Confident	80.6	Confident	32 Å²	32	72.1 Å²	72.1	17%	0.168	37%	0.371	C	S	.	.			trans	-95	146.7	166.8	-77.2	161.8	0	0	0	109.1	K68 I69 N91	K68-L82 VanDerWaalsContact CA-CD1 3.44Å; K68-L82 HydrophobicContact CB-CD1 3.54Å; K68-L82 HydrophobicContact CB-CG 4.13Å; K68-L82 HydrophobicContact CG-CD1 4.18Å; I69-L82 WeakPolarHBondContact O-CD1 3.33Å; L82-N91 HydrophobicContact CB-CB 4Å; L82-N91 HydrophobicContact CD1-CB 3.83Å; L82-N91 HydrophobicContact CD2-CB 4.19Å; L82-N91 HydrophobicContact CG-CB 4.23Å
83	L	86.8	Confident	80.9	Confident	50 Å²	50	71.5 Å²	71.5	26%	0.262	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.6	179.5	-58.3	171.3	0	0	0	108	V81 F92 T94 K97	V81-L83 HydrophobicContact CG1-CD2 4.25Å; L83-F92 PolarHBondContact N-O 2.79Å; L83-F92 PolarHBondContact O-N 3Å; L83-T94 HydrophobicContact CD1-CG2 4.12Å; L83-K97 HydrophobicContact CB-CB 4.39Å; L83-K97 HydrophobicContact CB-CD 3.64Å; L83-K97 HydrophobicContact CB-CG 3.95Å; L83-K97 HydrophobicContact CD1-CB 4.41Å; L83-K97 HydrophobicContact CD1-CD 3.61Å; L83-K97 HydrophobicContact CD1-CG 4.43Å; L83-K97 HydrophobicContact CG-CD 4.17Å
84	S	88.1	Confident	81.1	Confident	71 Å²	71	69.6 Å²	69.6	50%	0.497	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	139.1	176.9	47.7	0	0	0	0	110.9	G90	S84-G90 CarbonylContact C-O 3.54Å; S84-G90 WeakPolarHBondContact CA-O 3.36Å
85	C	88.1	Confident	81.5	Confident	6 Å²	6	67 Å²	67	4%	0.041	36%	0.357	C	S	.	.			trans	-89.8	124	174.5	178.8	0	0	0	0	110.7	G87 C88 Y89 G90 F92 H102	C85-G87 PolarHBondContact O-N 2.82Å; C85-C88 VanDerWaalsContact SG-SG 3.66Å; C85-Y89 WeakPolarHBondContact O-CA 3.47Å; C85-Y89 PolarHBondContact O-N 2.79Å; C85-G90 PolarHBondContact N-O 3.2Å; C85-F92 HydrophobicContact CB-CD2 3.97Å; C85-F92 HydrophobicContact CB-CE2 3.65Å; C85-H102 VanDerWaalsContact SG-CE1 3.59Å; C85-H102 PolarHBondContact SG-NE2 2.88Å
86	D	87.8	Confident	81.8	Confident	134 Å²	134	66.7 Å²	66.7	72%	0.717	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-12.3	179.2	-55.3	-40.8	0	0	0	114.3
87	G	84.2	Confident	82.5	Confident	23 Å²	23	65 Å²	65	24%	0.237	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-48.7	-178.1	0	0	0	0	0	114.2	C85	C85-G87 PolarHBondContact O-N 2.82Å
88	C	88.2	Confident	83.3	Confident	38 Å²	38	67.8 Å²	67.8	26%	0.257	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-5.5	-178.5	62.3	0	0	0	0	113.7	C85 G90 H102 S105	C85-C88 VanDerWaalsContact SG-SG 3.66Å; C88-G90 PolarHBondContact O-N 2.84Å; C88-G90 VanDerWaalsContact O-N 3.08Å; C88-H102 PolarHBondContact SG-NE2 2.94Å; C88-S105 WeakPolarHBondContact CB-OG 3.47Å
89	Y	85.8	Confident	84.1	Confident	187 Å²	187	63.3 Å²	63.3	73%	0.733	34%	0.338	S	S	*	.			trans	58.5	13.2	-174.9	-57.7	-80	0	0	0	115.2	C85	C85-Y89 WeakPolarHBondContact O-CA 3.47Å; C85-Y89 PolarHBondContact O-N 2.79Å
90	G	86	Confident	84.7	Confident	9 Å²	9	66 Å²	66	9%	0.093	35%	0.351	C	S	.	.			trans	-74.1	152.7	172.5	0	0	0	0	0	112.3	D71 S84 C85 C88 F92	D71-G90 WeakPolarHBondContact OD2-CA 3.35Å; S84-G90 CarbonylContact C-O 3.54Å; S84-G90 WeakPolarHBondContact CA-O 3.36Å; C85-G90 PolarHBondContact N-O 3.2Å; C88-G90 PolarHBondContact O-N 2.84Å; C88-G90 VanDerWaalsContact O-N 3.08Å; G90-F92 VanDerWaalsContact C-CE2 3.41Å; G90-F92 WeakPolarHBondContact O-CD2 3.38Å; G90-F92 VanDerWaalsContact O-CE2 3.25Å; G90-F92 WeakPolarHBondContact O-CE2 3.34Å
91	N	89.3	Confident	85.2	Confident	67 Å²	67	58.9 Å²	58.9	36%	0.358	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.3	176.9	-73	-47	0	0	0	110.6	C70 D71 L82	C70-N91 CarbonylContact C-O 3.31Å; C70-N91 WeakPolarHBondContact CA-O 3.33Å; D71-N91 WeakPolarHBondContact CB-O 3.31Å; D71-N91 PolarHBondContact N-O 2.95Å; D71-N91 PolarHBondContact OD2-N 2.9Å; L82-N91 HydrophobicContact CB-CB 4Å; L82-N91 HydrophobicContact CD1-CB 3.83Å; L82-N91 HydrophobicContact CD2-CB 4.19Å; L82-N91 HydrophobicContact CG-CB 4.23Å
92	F	87.9	Confident	85.4	Confident	7 Å²	7	55.1 Å²	55.1	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.2	-178.4	-55.9	-79.1	0	0	0	111.7	D71 L83 C85 G90 H96 K97 H102	D71-F92 HydrophobicContact CB-CD1 4.39Å; D71-F92 HydrophobicContact CB-CE1 3.83Å; D71-F92 HydrophobicContact CB-CZ 4.18Å; L83-F92 PolarHBondContact N-O 2.79Å; L83-F92 PolarHBondContact O-N 3Å; C85-F92 HydrophobicContact CB-CD2 3.97Å; C85-F92 HydrophobicContact CB-CE2 3.65Å; G90-F92 VanDerWaalsContact C-CE2 3.41Å; G90-F92 WeakPolarHBondContact O-CD2 3.38Å; G90-F92 VanDerWaalsContact O-CE2 3.25Å; G90-F92 WeakPolarHBondContact O-CE2 3.34Å; F92-H96 HydrophobicContact CB-CB 4.28Å; F92-H96 HydrophobicContact CD1-CB 4.37Å; F92-K97 HydrophobicContact CB-CB 4.49Å; F92-H102 HydrophobicContact CD1-CB 3.76Å; F92-H102 AromaticContact CD1-CG 3.99Å; F92-H102 AromaticContact CD2-CE1 3.96Å; F92-H102 AromaticContact CD2-ND1 3.93Å; F92-H102 HydrophobicContact CE1-CB 3.42Å; F92-H102 VanDerWaalsContact CE1-CB 3.42Å; F92-H102 AromaticContact CE1-CD2 3.82Å; F92-H102 AromaticContact CE1-CG 3.58Å; F92-H102 AromaticContact CE2-CD2 3.62Å; F92-H102 AromaticContact CE2-CE1 3.69Å; F92-H102 AromaticContact CE2-CG 3.81Å; F92-H102 AromaticContact CE2-ND1 3.86Å; F92-H102 AromaticContact CE2-NE2 3.56Å; F92-H102 HydrophobicContact CG-CB 4.47Å; F92-H102 HydrophobicContact CZ-CB 3.87Å; F92-H102 AromaticContact CZ-CD2 3.27Å; F92-H102 WeakPolarHBondContact CZ-CD2 3.49Å; F92-H102 AromaticContact CZ-CG 3.48Å; F92-H102 VanDerWaalsContact CZ-CG 3.48Å; F92-H102 AromaticContact CZ-NE2 3.73Å
93	C	86.9	Confident	85.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.315	C	S	.	.			trans	-67.8	166.5	168	69.1	0	0	0	0	110.5	C53 C70 Q79 S95 H96 K97	C53-C93 VanDerWaalsContact SG-SG 3.6Å; C70-C93 HydrophobicContact CB-CB 4.3Å; C70-C93 PolarHBondContact SG-N 2.89Å; Q79-C93 HydrophobicContact CG-CB 4.15Å; C93-S95 PolarHBondContact O-N 3.4Å; C93-H96 PolarHBondContact O-N 3.19Å; C93-H96 PolarHBondContact SG-ND1 3.11Å; C93-K97 PolarHBondContact O-N 2.94Å; C93-K97 VanDerWaalsContact O-N 3.08Å
94	T	84.3	Confident	85.2	Confident	94 Å²	94	58.8 Å²	58.8	58%	0.577	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-34	175.8	50.3	0	0	0	0	113.3	Q79 L83	Q79-T94 PolarHBondContact NE2-OG1 3.12Å; Q79-T94 VanDerWaalsContact NE2-OG1 3.12Å; L83-T94 HydrophobicContact CD1-CG2 4.12Å
95	S	80.1	Confident	84.9	Confident	49 Å²	49	59.9 Å²	59.9	34%	0.343	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-23.1	-178.9	-47.2	0	0	0	0	114.5	C93	C93-S95 PolarHBondContact O-N 3.4Å
96	H	83.8	Confident	84.5	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.009	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	6.4	-176.3	-59	119.3	0	0	0	114.2	C53 Y72 C75 F92 C93 Q98 V101 H102	C53-H96 PolarHBondContact SG-CE1 3.24Å; Y72-H96 AromaticContact CD1-CD2 3.46Å; Y72-H96 VanDerWaalsContact CD1-CD2 3.46Å; Y72-H96 WeakPolarHBondContact CD1-CD2 3.47Å; Y72-H96 AromaticContact CD1-CE1 3.7Å; Y72-H96 AromaticContact CD1-CG 3.73Å; Y72-H96 AromaticContact CD1-ND1 3.85Å; Y72-H96 AromaticContact CD1-NE2 3.45Å; Y72-H96 WeakPolarHBondContact CD1-NE2 3.4Å; Y72-H96 AromaticContact CE1-CD2 3.69Å; Y72-H96 AromaticContact CE1-NE2 3.59Å; Y72-H96 HydrophobicContact CG-CB 4.23Å; Y72-H96 AromaticContact CG-CD2 3.94Å; Y72-H96 AromaticContact CG-CG 3.89Å; C75-H96 VanDerWaalsContact CB-CE1 3.41Å; C75-H96 WeakPolarHBondContact CB-CE1 3.41Å; C75-H96 WeakPolarHBondContact CB-ND1 3.43Å; C75-H96 PolarHBondContact SG-ND1 3.36Å; C75-H96 VanDerWaalsContact SG-ND1 3.45Å; F92-H96 HydrophobicContact CB-CB 4.28Å; F92-H96 HydrophobicContact CD1-CB 4.37Å; C93-H96 PolarHBondContact O-N 3.19Å; C93-H96 PolarHBondContact SG-ND1 3.11Å; H96-Q98 VanDerWaalsContact C-N 3.3Å; H96-Q98 PolarHBondContact O-N 2.99Å; H96-V101 HydrophobicContact CB-CG1 4.4Å; H96-H102 PolarHBondContact O-ND1 3.17Å; H96-H102 VanDerWaalsContact O-ND1 3.08Å
97	K	86.9	Confident	83.7	Confident	100 Å²	100	56.2 Å²	56.2	44%	0.435	29%	0.294	S	S	.	.			trans	-62.5	-33.4	179.1	-174.9	-170.7	-177	179.2	0	113.7	L83 F92 C93 K99 H102	L83-K97 HydrophobicContact CB-CB 4.39Å; L83-K97 HydrophobicContact CB-CD 3.64Å; L83-K97 HydrophobicContact CB-CG 3.95Å; L83-K97 HydrophobicContact CD1-CB 4.41Å; L83-K97 HydrophobicContact CD1-CD 3.61Å; L83-K97 HydrophobicContact CD1-CG 4.43Å; L83-K97 HydrophobicContact CG-CD 4.17Å; F92-K97 HydrophobicContact CB-CB 4.49Å; C93-K97 PolarHBondContact O-N 2.94Å; C93-K97 VanDerWaalsContact O-N 3.08Å; K97-K99 PolarHBondContact O-N 3.19Å; K97-H102 PolarHBondContact O-CE1 3.45Å; K97-H102 PolarHBondContact O-ND1 2.94Å
98	Q	83.9	Confident	82.7	Confident	99 Å²	99	57.9 Å²	57.9	46%	0.463	31%	0.306	S	S	.	.	S	Bend	trans	-58	132.4	-177.8	-71.6	-178.4	1.7	0	0	110.7	H96 E100 V101 H102	H96-Q98 VanDerWaalsContact C-N 3.3Å; H96-Q98 PolarHBondContact O-N 2.99Å; Q98-E100 PolarHBondContact O-N 3.41Å; Q98-V101 HydrophobicContact CB-CB 4.21Å; Q98-V101 HydrophobicContact CB-CG2 3.76Å; Q98-V101 PolarHBondContact O-N 3.22Å; Q98-H102 PolarHBondContact O-N 2.94Å; Q98-H102 PolarHBondContact O-ND1 3.04Å
99	K	86.5	Confident	81.4	Confident	63 Å²	63	63 Å²	63	27%	0.274	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.9	-173.2	-64	-176.1	179.5	-179.9	0	112	K97 Q103 C104 L107	K97-K99 PolarHBondContact O-N 3.19Å; K99-Q103 PolarHBondContact O-N 2.81Å; K99-C104 HydrophobicContact CB-CB 3.87Å; K99-C104 HydrophobicContact CG-CB 4.27Å; K99-C104 PolarHBondContact O-N 3.02Å; K99-L107 HydrophobicContact CB-CD1 3.33Å; K99-L107 HydrophobicContact CD-CD1 4.11Å; K99-L107 HydrophobicContact CG-CD1 4.37Å
100	E	81.9	Confident	79.9	Confident	101 Å²	101	57 Å²	57	47%	0.472	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-35.2	177.5	-54.2	72.6	-155.8	0	0	111.4	Q98	Q98-E100 PolarHBondContact O-N 3.41Å
101	V	82.1	Confident	78.5	Confident	8 Å²	8	60.2 Å²	60.2	5%	0.048	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-48.3	-175.1	177.9	0	0	0	0	110.9	Y51 Y72 H96 Q98 Q103	Y51-V101 HydrophobicContact CD1-CG1 3.85Å; Y51-V101 HydrophobicContact CE1-CB 4.47Å; Y51-V101 HydrophobicContact CE1-CG1 3.86Å; Y51-V101 HydrophobicContact CE1-CG2 3.98Å; Y51-V101 HydrophobicContact CG-CG1 4.21Å; Y72-V101 WeakPolarHBondContact CE2-O 3.4Å; H96-V101 HydrophobicContact CB-CG1 4.4Å; Q98-V101 HydrophobicContact CB-CB 4.21Å; Q98-V101 HydrophobicContact CB-CG2 3.76Å; Q98-V101 PolarHBondContact O-N 3.22Å; V101-Q103 PolarHBondContact O-N 2.87Å
102	H	82	Confident	76.7	Confident	18 Å²	18	66.3 Å²	66.3	8%	0.083	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	9.8	178.5	71.5	-98.2	0	0	0	114.4	Y72 C85 C88 F92 H96 K97 Q98 C104	Y72-H102 HydrophobicContact CD2-CB 3.9Å; C85-H102 VanDerWaalsContact SG-CE1 3.59Å; C85-H102 PolarHBondContact SG-NE2 2.88Å; C88-H102 PolarHBondContact SG-NE2 2.94Å; F92-H102 HydrophobicContact CD1-CB 3.76Å; F92-H102 AromaticContact CD1-CG 3.99Å; F92-H102 AromaticContact CD2-CE1 3.96Å; F92-H102 AromaticContact CD2-ND1 3.93Å; F92-H102 HydrophobicContact CE1-CB 3.42Å; F92-H102 VanDerWaalsContact CE1-CB 3.42Å; F92-H102 AromaticContact CE1-CD2 3.82Å; F92-H102 AromaticContact CE1-CG 3.58Å; F92-H102 AromaticContact CE2-CD2 3.62Å; F92-H102 AromaticContact CE2-CE1 3.69Å; F92-H102 AromaticContact CE2-CG 3.81Å; F92-H102 AromaticContact CE2-ND1 3.86Å; F92-H102 AromaticContact CE2-NE2 3.56Å; F92-H102 HydrophobicContact CG-CB 4.47Å; F92-H102 HydrophobicContact CZ-CB 3.87Å; F92-H102 AromaticContact CZ-CD2 3.27Å; F92-H102 WeakPolarHBondContact CZ-CD2 3.49Å; F92-H102 AromaticContact CZ-CG 3.48Å; F92-H102 VanDerWaalsContact CZ-CG 3.48Å; F92-H102 AromaticContact CZ-NE2 3.73Å; H96-H102 PolarHBondContact O-ND1 3.17Å; H96-H102 VanDerWaalsContact O-ND1 3.08Å; K97-H102 PolarHBondContact O-CE1 3.45Å; K97-H102 PolarHBondContact O-ND1 2.94Å; Q98-H102 PolarHBondContact O-N 2.94Å; Q98-H102 PolarHBondContact O-ND1 3.04Å; H102-C104 WeakPolarHBondContact NE2-CB 3.2Å; H102-C104 PolarHBondContact NE2-SG 2.95Å; H102-C104 PolarHBondContact O-N 2.63Å
103	Q	80.6	Confident	74.9	Confident	149 Å²	149	73.1 Å²	73.1	70%	0.696	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	54.5	179	-60.8	174.7	-8.5	0	0	111.6	K99 V101 S105	K99-Q103 PolarHBondContact O-N 2.81Å; V101-Q103 PolarHBondContact O-N 2.87Å; Q103-S105 PolarHBondContact O-N 3.42Å
104	C	84.5	Confident	73	Confident	9 Å²	9	81 Å²	81	6%	0.061	41%	0.409	C	S	.	.			trans	-54.9	128.3	-173.4	-169	0	0	0	0	112.2	K99 H102 G106 L107	K99-C104 HydrophobicContact CB-CB 3.87Å; K99-C104 HydrophobicContact CG-CB 4.27Å; K99-C104 PolarHBondContact O-N 3.02Å; H102-C104 WeakPolarHBondContact NE2-CB 3.2Å; H102-C104 PolarHBondContact NE2-SG 2.95Å; H102-C104 PolarHBondContact O-N 2.63Å; C104-G106 PolarHBondContact O-N 3.18Å; C104-G106 PolarHBondContact SG-N 3.39Å; C104-L107 HydrophobicContact CB-CB 4.29Å; C104-L107 VanDerWaalsContact O-CB 3.28Å; C104-L107 WeakPolarHBondContact O-CB 3.28Å; C104-L107 PolarHBondContact O-N 3.01Å
105	S	82.9	Confident	71.2	Confident	95 Å²	95	80.8 Å²	80.8	66%	0.664	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.6	169.9	54.7	0	0	0	0	112.7	C88 Q103	C88-S105 WeakPolarHBondContact CB-OG 3.47Å; Q103-S105 PolarHBondContact O-N 3.42Å
106	G	78.4	Confident	69.7	Low	4 Å²	4	87.3 Å²	87.3	4%	0.041	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.8	175.5	0	0	0	0	0	115.4	C104 A108 Q109 S110	C104-G106 PolarHBondContact O-N 3.18Å; C104-G106 PolarHBondContact SG-N 3.39Å; G106-A108 PolarHBondContact O-N 3.45Å; G106-Q109 PolarHBondContact O-N 3.28Å; G106-Q109 VanDerWaalsContact O-N 3.11Å; G106-S110 PolarHBondContact O-N 2.94Å
107	L	71	Confident	68.2	Low	58 Å²	58	93.4 Å²	93.4	30%	0.304	46%	0.458	S	S	.	.	H	α-helix	trans	-60.5	-37.1	-179.8	-160.1	79.8	0	0	0	111	K99 C104 Q109 S110 V111	K99-L107 HydrophobicContact CB-CD1 3.33Å; K99-L107 HydrophobicContact CD-CD1 4.11Å; K99-L107 HydrophobicContact CG-CD1 4.37Å; C104-L107 HydrophobicContact CB-CB 4.29Å; C104-L107 VanDerWaalsContact O-CB 3.28Å; C104-L107 WeakPolarHBondContact O-CB 3.28Å; C104-L107 PolarHBondContact O-N 3.01Å; L107-Q109 VanDerWaalsContact C-N 3.29Å; L107-Q109 PolarHBondContact O-N 2.92Å; L107-S110 PolarHBondContact O-N 3.45Å; L107-V111 WeakPolarHBondContact O-CG2 3.39Å; L107-V111 PolarHBondContact O-N 2.85Å
108	A	63.2	Low	66.6	Low	58 Å²	58	94 Å²	94	48%	0.479	46%	0.462	S	S	.	.	H	α-helix	trans	-65.6	-27.7	178.2	0	0	0	0	0	113.7	G106 R112	G106-A108 PolarHBondContact O-N 3.45Å; A108-R112 WeakPolarHBondContact O-CG 3.49Å; A108-R112 PolarHBondContact O-N 3.42Å
109	Q	61.4	Low	64.6	Low	147 Å²	147	94.8 Å²	94.8	69%	0.687	47%	0.474	S	S	*	.	H	α-helix	trans	-77.4	-33.8	177.9	-63.1	-177.7	6.4	0	0	111.4	G106 L107	G106-Q109 PolarHBondContact O-N 3.28Å; G106-Q109 VanDerWaalsContact O-N 3.11Å; L107-Q109 VanDerWaalsContact C-N 3.29Å; L107-Q109 PolarHBondContact O-N 2.92Å
110	S	54.1	Low	62.6	Low	61 Å²	61	97.3 Å²	97.3	43%	0.427	49%	0.494	S	S	.	.	H	α-helix	trans	-68.1	-36.7	176.4	-169.5	0	0	0	0	112.8	G106 L107	G106-S110 PolarHBondContact O-N 2.94Å; L107-S110 PolarHBondContact O-N 3.45Å
111	V	56.4	Low	60.9	Low	76 Å²	76	101.5 Å²	101.5	46%	0.461	51%	0.511	S	S	.	.	H	α-helix	trans	-76.1	-37.1	-178.6	-179.5	0	0	0	0	111.6	L107 Q113 W114 D115	L107-V111 WeakPolarHBondContact O-CG2 3.39Å; L107-V111 PolarHBondContact O-N 2.85Å; V111-Q113 PolarHBondContact O-N 2.62Å; V111-W114 WeakPolarHBondContact O-CB 3.45Å; V111-W114 PolarHBondContact O-N 3.26Å; V111-D115 PolarHBondContact O-N 3.15Å
112	R	51.7	Low	59.2	Low	194 Å²	194	107 Å²	107	73%	0.732	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-24.4	177.5	-71.3	-177	-166.1	-143.1	5.3	113.6	A108 K116	A108-R112 WeakPolarHBondContact O-CG 3.49Å; A108-R112 PolarHBondContact O-N 3.42Å; R112-K116 PolarHBondContact O-N 2.96Å
113	Q	50.5	Low	58	Low	151 Å²	151	111.6 Å²	111.6	71%	0.706	57%	0.574	S	S	*	*	H	α-helix	trans	-78.4	-25.2	175	-159.6	169.5	1.5	0	0	112.2	V111	V111-Q113 PolarHBondContact O-N 2.62Å
114	W	46.7	Very low	56.9	Low	165 Å²	165	110 Å²	110	63%	0.625	57%	0.57	S	S	*	*	H	α-helix	trans	-79.8	-40	173.2	-175.5	-86	0	0	0	112.4	V111 K116 I117 Q118	V111-W114 WeakPolarHBondContact O-CB 3.45Å; V111-W114 PolarHBondContact O-N 3.26Å; W114-K116 VanDerWaalsContact C-N 3.28Å; W114-K116 PolarHBondContact O-N 2.97Å; W114-I117 WeakPolarHBondContact O-CB 3.43Å; W114-I117 PolarHBondContact O-N 3.35Å; W114-Q118 VanDerWaalsContact NE1-CD 3.33Å; W114-Q118 VanDerWaalsContact NE1-NE2 3.15Å
115	D	46	Very low	56.2	Low	90 Å²	90	118.5 Å²	118.5	48%	0.481	60%	0.6	S	S	.	*	H	α-helix	trans	-67.8	-25	179.1	-84.3	-25	0	0	0	113.8	V111 I117 Q118	V111-D115 PolarHBondContact O-N 3.15Å; D115-I117 PolarHBondContact O-N 2.7Å; D115-Q118 PolarHBondContact O-N 2.98Å
116	K	50	Low	55.5	Low	186 Å²	186	118.1 Å²	118.1	81%	0.809	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-11.4	171.5	-105	-178.9	178	-177.2	0	113.7	R112 W114	R112-K116 PolarHBondContact O-N 2.96Å; W114-K116 VanDerWaalsContact C-N 3.28Å; W114-K116 PolarHBondContact O-N 2.97Å
117	I	52.2	Low	54.7	Low	129 Å²	129	121.1 Å²	121.1	66%	0.662	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-16	178.1	-55.9	174.7	0	0	0	111	W114 D115	W114-I117 WeakPolarHBondContact O-CB 3.43Å; W114-I117 PolarHBondContact O-N 3.35Å; D115-I117 PolarHBondContact O-N 2.7Å
118	Q	51.5	Low	54.3	Low	114 Å²	114	123.8 Å²	123.8	53%	0.533	63%	0.633	S	S	.	*	S	Bend	trans	-101.9	13.4	-170.7	-70.7	-160.7	-27.1	0	0	116.7	W114 D115	W114-Q118 VanDerWaalsContact NE1-CD 3.33Å; W114-Q118 VanDerWaalsContact NE1-NE2 3.15Å; D115-Q118 PolarHBondContact O-N 2.98Å
119	T	43	Very low	54.1	Low	115 Å²	115	126.3 Å²	126.3	71%	0.706	64%	0.638	S	S	*	*			trans	-114.9	15.8	179.4	46.8	0	0	0	0	116.4	K121	T119-K121 PolarHBondContact O-N 3.03Å
120	V	44.3	Very low	54.2	Low	115 Å²	115	122.7 Å²	122.7	70%	0.697	63%	0.634	S	S	*	*			trans	-84.8	69.6	162.4	-169.3	0	0	0	0	109.4	T122	V120-T122 PolarHBondContact O-N 3.04Å
121	K	46	Very low	54.5	Low	190 Å²	190	126.6 Å²	126.6	83%	0.826	65%	0.648	S	S	*	*			trans	-76.9	77.9	166.8	-72.9	-176.5	179.8	177.8	0	108.8	T119	T119-K121 PolarHBondContact O-N 3.03Å
122	T	47	Very low	54.5	Low	123 Å²	123	127.2 Å²	127.2	76%	0.755	66%	0.656	S	S	*	*			trans	172	79.9	155.5	24.9	0	0	0	0	105.4	V120 D124	V120-T122 PolarHBondContact O-N 3.04Å; T122-D124 PolarHBondContact O-N 3.36Å
123	V	55.7	Low	54.5	Low	115 Å²	115	124.7 Å²	124.7	70%	0.697	65%	0.652	S	S	*	*			trans	-73.4	98.9	172.1	-162.9	0	0	0	0	106.2	R125	V123-R125 PolarHBondContact O-N 2.88Å
124	D	58.2	Low	54.1	Low	115 Å²	115	124.1 Å²	124.1	62%	0.615	66%	0.659	S	S	*	*			trans	-65.2	101.9	171.6	-168.6	-3.7	0	0	0	108.6	T122 T126	T122-D124 PolarHBondContact O-N 3.36Å; D124-T126 PolarHBondContact O-N 2.88Å; D124-T126 VanDerWaalsContact OD1-CB 3.31Å; D124-T126 WeakPolarHBondContact OD1-CB 3.46Å; D124-T126 WeakPolarHBondContact OD1-CG2 3.34Å; D124-T126 PolarHBondContact OD1-N 3.14Å; D124-T126 VanDerWaalsContact OD1-N 3.16Å; D124-T126 PolarHBondContact OD1-OG1 2.91Å; D124-T126 PolarHBondContact OD2-OG1 3.33Å; D124-T126 VanDerWaalsContact OD2-OG1 3.05Å
125	R	69.1	Low	54	Low	187 Å²	187	122.9 Å²	122.9	71%	0.706	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-2.4	-179.3	-74.5	179.6	153.8	146.2	-4.9	112.6	V123 A127 L128 N129	V123-R125 PolarHBondContact O-N 2.88Å; R125-A127 VanDerWaalsContact C-N 3.28Å; R125-A127 PolarHBondContact O-N 2.73Å; R125-L128 PolarHBondContact O-N 3.25Å; R125-L128 VanDerWaalsContact O-N 3.14Å; R125-N129 PolarHBondContact O-N 2.77Å; R125-N129 VanDerWaalsContact O-N 3.1Å
126	T	69.4	Low	53.9	Low	88 Å²	88	125.7 Å²	125.7	54%	0.54	68%	0.676	S	S	.	*	H	α-helix	trans	-57.2	-39.2	179	50	0	0	0	0	112.6	D124 L128 N129 A130	D124-T126 PolarHBondContact O-N 2.88Å; D124-T126 VanDerWaalsContact OD1-CB 3.31Å; D124-T126 WeakPolarHBondContact OD1-CB 3.46Å; D124-T126 WeakPolarHBondContact OD1-CG2 3.34Å; D124-T126 PolarHBondContact OD1-N 3.14Å; D124-T126 VanDerWaalsContact OD1-N 3.16Å; D124-T126 PolarHBondContact OD1-OG1 2.91Å; D124-T126 PolarHBondContact OD2-OG1 3.33Å; D124-T126 VanDerWaalsContact OD2-OG1 3.05Å; T126-L128 VanDerWaalsContact C-N 3.33Å; T126-L128 PolarHBondContact O-N 3.3Å; T126-N129 PolarHBondContact O-N 3Å; T126-A130 WeakPolarHBondContact O-CB 3.25Å; T126-A130 PolarHBondContact O-N 3.31Å
127	A	61.7	Low	53.8	Low	66 Å²	66	122.2 Å²	122.2	55%	0.545	67%	0.673	S	S	.	*	H	α-helix	trans	-68.5	-27.9	178.9	0	0	0	0	0	113.9	R125 I131	R125-A127 VanDerWaalsContact C-N 3.28Å; R125-A127 PolarHBondContact O-N 2.73Å; A127-I131 WeakPolarHBondContact O-CG1 2.89Å
128	L	61.7	Low	53.2	Low	115 Å²	115	121.4 Å²	121.4	60%	0.602	67%	0.674	S	S	*	*	H	α-helix	trans	-78.1	-35.5	174	-89.1	156.7	0	0	0	111.6	R125 T126 A130	R125-L128 PolarHBondContact O-N 3.25Å; R125-L128 VanDerWaalsContact O-N 3.14Å; T126-L128 VanDerWaalsContact C-N 3.33Å; T126-L128 PolarHBondContact O-N 3.3Å; L128-A130 VanDerWaalsContact C-N 3.34Å
129	N	60.6	Low	52.7	Low	110 Å²	110	125.3 Å²	125.3	59%	0.588	69%	0.69	S	S	*	*	H	α-helix	trans	-71.1	-30.1	173.6	-71.7	-14.4	0	0	0	112.2	R125 T126 I131 S132	R125-N129 PolarHBondContact O-N 2.77Å; R125-N129 VanDerWaalsContact O-N 3.1Å; T126-N129 PolarHBondContact O-N 3Å; N129-I131 VanDerWaalsContact C-N 3.28Å; N129-I131 PolarHBondContact O-N 3.09Å; N129-S132 WeakPolarHBondContact O-CB 3.44Å; N129-S132 PolarHBondContact O-N 3.2Å; N129-S132 VanDerWaalsContact O-N 3.17Å
130	A	62.2	Low	52.5	Low	72 Å²	72	125.8 Å²	125.8	60%	0.595	69%	0.692	S	S	*	*	H	α-helix	trans	-66.2	-26.2	177.2	0	0	0	0	0	113.6	T126 L128 S132	T126-A130 WeakPolarHBondContact O-CB 3.25Å; T126-A130 PolarHBondContact O-N 3.31Å; L128-A130 VanDerWaalsContact C-N 3.34Å; A130-S132 VanDerWaalsContact C-N 3.32Å
131	I	60.8	Low	52	Low	143 Å²	143	127.4 Å²	127.4	73%	0.733	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-17.9	177.3	-59.5	164.6	0	0	0	111.1	A127 N129 H133	A127-I131 WeakPolarHBondContact O-CG1 2.89Å; N129-I131 VanDerWaalsContact C-N 3.28Å; N129-I131 PolarHBondContact O-N 3.09Å; I131-H133 VanDerWaalsContact C-N 3.34Å; I131-H133 PolarHBondContact O-N 3.41Å
132	S	56.6	Low	51.8	Low	89 Å²	89	126 Å²	126	62%	0.622	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-8.4	-176.7	-169.5	0	0	0	0	114.3	N129 A130	N129-S132 WeakPolarHBondContact O-CB 3.44Å; N129-S132 PolarHBondContact O-N 3.2Å; N129-S132 VanDerWaalsContact O-N 3.17Å; A130-S132 VanDerWaalsContact C-N 3.32Å
133	H	51.3	Low	51.3	Low	141 Å²	141	126.2 Å²	126.2	65%	0.653	70%	0.7	S	S	*	*	S	Bend	trans	-111.7	112.4	176.9	-70.9	-70.6	0	0	0	111	I131 I135	I131-H133 VanDerWaalsContact C-N 3.34Å; I131-H133 PolarHBondContact O-N 3.41Å; H133-I135 PolarHBondContact O-N 2.9Å; H133-I135 VanDerWaalsContact O-N 3.09Å
134	T	41.5	Very low	50.9	Low	138 Å²	138	128.9 Å²	128.9	85%	0.847	71%	0.71	S	S	*	*			trans	-44.1	108.5	165.4	-41.1	0	0	0	0	110.5
135	I	46.2	Very low	50.2	Low	140 Å²	140	128.5 Å²	128.5	72%	0.718	72%	0.716	S	S	*	*			trans	-135.9	108.9	166.9	-58	179.3	0	0	0	108	H133 P137	H133-I135 PolarHBondContact O-N 2.9Å; H133-I135 VanDerWaalsContact O-N 3.09Å; I135-P137 WeakPolarHBondContact O-CD 3.11Å
136	I	43.4	Very low	49.3	Very low	148 Å²	148	126.1 Å²	126.1	76%	0.759	72%	0.722	S	S	*	*			trans	-65.8	130	158.7	-61.4	162.5	0	0	0	107.1
137	P	46.8	Very low	48.6	Very low	114 Å²	114	130.5 Å²	130.5	74%	0.74	73%	0.733	S	S	*	*			trans	-120	117.6	152.6	11.6	10.8	0	0	0	110	I135	I135-P137 WeakPolarHBondContact O-CD 3.11Å
138	T	40.6	Very low	48.6	Very low	112 Å²	112	133.1 Å²	133.1	69%	0.687	75%	0.745	S	S	*	*			trans	-63.7	136.1	163.9	45.6	0	0	0	0	111.6
139	K	39.7	Very low	48.9	Very low	196 Å²	196	132.3 Å²	132.3	85%	0.852	74%	0.741	S	S	*	*			trans	59.6	136.4	144.8	-66.3	-175.5	-178.5	-178.1	0	116
140	T	39.1	Very low	49.9	Very low	124 Å²	124	131 Å²	131	76%	0.761	74%	0.74	S	S	*	*			cis	-172.5	152.5	34.7	25.8	0	0	0	0	107.5
141	N	35.3	Very low	50.8	Low	149 Å²	149	133.5 Å²	133.5	80%	0.797	74%	0.743	S	S	*	*			trans	8.3	119.2	155.5	-65.8	-8.7	0	0	0	118.6
142	D	40.8	Very low	51.8	Low	161 Å²	161	135.9 Å²	135.9	86%	0.861	74%	0.743	S	S	*	*				-162.6	130.6	122.9	-101	-26.4	0	0	0	111.8
143	T	36.9	Very low	53.1	Low	128 Å²	128	133.5 Å²	133.5	79%	0.785	73%	0.729	S	S	*	*			trans	-48.3	132.6	165	-39.9	0	0	0	0	109.5
144	L	46.5	Very low	54.6	Low	171 Å²	171	130.8 Å²	130.8	90%	0.895	71%	0.713	S	S	*	*			trans	160.3	125.4	151.3	-84.2	154.5	0	0	0	112.3
145	S	43.6	Very low	56.6	Low	107 Å²	107	125 Å²	125	75%	0.748	68%	0.678	S	S	*	*			trans	49.5	91.4	160.4	-159.1	0	0	0	0	118	K147	S145-K147 PolarHBondContact O-N 2.88Å
146	V	51.4	Low	58.5	Low	137 Å²	137	121.8 Å²	121.8	83%	0.83	67%	0.666	S	S	*	*			trans	-68.6	99.5	167.8	-175.9	0	0	0	0	108.6
147	K	54.4	Low	60.6	Low	179 Å²	179	119 Å²	119	78%	0.778	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-57.5	135.1	164.9	-70	178.4	-179.8	176.2	0	108.1	S145 L149	S145-K147 PolarHBondContact O-N 2.88Å; K147-L149 PolarHBondContact O-N 2.78Å; K147-L149 VanDerWaalsContact O-N 3.16Å
148	P	62	Low	62.5	Low	121 Å²	121	113.6 Å²	113.6	79%	0.786	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-55.1	126.1	178	19.6	-29	0	0	0	109.4	S150	P148-S150 PolarHBondContact O-N 3.49Å
149	L	68.3	Low	64.8	Low	99 Å²	99	114.2 Å²	114.2	52%	0.518	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-55.2	131	175.7	-83.1	138.6	0	0	0	108.9	K147 A153	K147-L149 PolarHBondContact O-N 2.78Å; K147-L149 VanDerWaalsContact O-N 3.16Å; L149-A153 HydrophobicContact CB-CB 4.44Å; L149-A153 HydrophobicContact CD2-CB 3.73Å
150	S	79.8	Confident	67.2	Low	81 Å²	81	110 Å²	110	57%	0.566	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-54	144.6	172.4	173.1	0	0	0	0	110.2	P148 R152 A153 R154	P148-S150 PolarHBondContact O-N 3.49Å; S150-R152 PolarHBondContact O-N 3.01Å; S150-R152 VanDerWaalsContact O-N 3.08Å; S150-A153 WeakPolarHBondContact O-CA 3.45Å; S150-A153 WeakPolarHBondContact O-CB 3.28Å; S150-A153 PolarHBondContact O-N 3.13Å; S150-R154 PolarHBondContact O-N 3.36Å
151	D	80.8	Confident	69.6	Low	126 Å²	126	105.9 Å²	105.9	67%	0.674	57%	0.566	S	S	*	*	H	α-helix	trans	-53.4	-33.8	178.8	-61.1	-33.1	0	0	0	112.5	A153 R154 A155	D151-A153 PolarHBondContact O-N 2.89Å; D151-R154 PolarHBondContact O-N 3.28Å; D151-A155 WeakPolarHBondContact O-CB 3.38Å; D151-A155 PolarHBondContact O-N 2.74Å
152	R	81.9	Confident	72.2	Confident	193 Å²	193	100 Å²	100	73%	0.728	53%	0.534	S	S	*	.	H	α-helix	trans	-64.3	-39.4	173.8	-176.1	175.5	-176.7	140.6	1.1	112.8	S150 T156	S150-R152 PolarHBondContact O-N 3.01Å; S150-R152 VanDerWaalsContact O-N 3.08Å; R152-T156 WeakPolarHBondContact O-CB 3.34Å; R152-T156 PolarHBondContact O-N 2.95Å; R152-T156 PolarHBondContact O-OG1 2.78Å
153	A	84.8	Confident	74.7	Confident	39 Å²	39	97 Å²	97	32%	0.322	52%	0.517	S	S	.	.	H	α-helix	trans	-68.1	-41.9	177.5	0	0	0	0	0	110.5	L149 S150 D151 T156 K157	L149-A153 HydrophobicContact CB-CB 4.44Å; L149-A153 HydrophobicContact CD2-CB 3.73Å; S150-A153 WeakPolarHBondContact O-CA 3.45Å; S150-A153 WeakPolarHBondContact O-CB 3.28Å; S150-A153 PolarHBondContact O-N 3.13Å; D151-A153 PolarHBondContact O-N 2.89Å; A153-T156 PolarHBondContact O-N 3.17Å; A153-K157 WeakPolarHBondContact O-CB 3.16Å; A153-K157 PolarHBondContact O-N 3.34Å
154	R	83.8	Confident	77.3	Confident	84 Å²	84	96.7 Å²	96.7	32%	0.317	51%	0.505	S	S	.	.	H	α-helix	trans	-59.4	-47.1	173.4	-163.4	-169.9	-42.7	-100.9	-6.9	111.7	S150 D151 T156 K157 A158 E242	S150-R154 PolarHBondContact O-N 3.36Å; D151-R154 PolarHBondContact O-N 3.28Å; R154-T156 PolarHBondContact O-N 3.24Å; R154-K157 PolarHBondContact O-N 3Å; R154-A158 PolarHBondContact O-N 3.06Å; R154-E242 IonicContact CZ-OE2 2.87Å; R154-E242 IonicContact NH1-OE2 2.63Å; R154-E242 PolarHBondContact NH1-OE2 3.4Å
155	A	83.2	Confident	79.5	Confident	15 Å²	15	88.8 Å²	88.8	12%	0.124	46%	0.464	C	S	.	.	H	α-helix	trans	-58.9	-44.8	176.7	0	0	0	0	0	112.9	D151 K157 A158 K159 Y243	D151-A155 WeakPolarHBondContact O-CB 3.38Å; D151-A155 PolarHBondContact O-N 2.74Å; A155-K157 VanDerWaalsContact C-N 3.35Å; A155-A158 PolarHBondContact O-N 2.92Å; A155-K159 WeakPolarHBondContact O-CB 3.38Å; A155-K159 WeakPolarHBondContact O-CG 3.49Å; A155-K159 PolarHBondContact O-N 3.43Å; A155-Y243 VanDerWaalsContact CA-CE2 3.41Å; A155-Y243 HydrophobicContact CB-CD2 3.78Å; A155-Y243 HydrophobicContact CB-CE2 3.12Å
156	T	86.4	Confident	81.9	Confident	73 Å²	73	87.8 Å²	87.8	45%	0.448	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-43.1	178.6	-54	0	0	0	0	110.2	R152 A153 R154 K159 L160	R152-T156 WeakPolarHBondContact O-CB 3.34Å; R152-T156 PolarHBondContact O-N 2.95Å; R152-T156 PolarHBondContact O-OG1 2.78Å; A153-T156 PolarHBondContact O-N 3.17Å; R154-T156 PolarHBondContact O-N 3.24Å; T156-K159 PolarHBondContact O-N 3.49Å; T156-L160 HydrophobicContact CG2-CD1 4.28Å; T156-L160 VanDerWaalsContact O-CG 3.28Å; T156-L160 WeakPolarHBondContact O-CG 3.14Å; T156-L160 PolarHBondContact O-N 2.98Å
157	K	87.2	Confident	83.9	Confident	89 Å²	89	88.5 Å²	88.5	39%	0.387	44%	0.442	S	S	.	.	H	α-helix	trans	-61.8	-47.2	177	-167.2	178.4	-178	-161	0	112	A153 R154 A155 K159 L160 I161 E239	A153-K157 WeakPolarHBondContact O-CB 3.16Å; A153-K157 PolarHBondContact O-N 3.34Å; R154-K157 PolarHBondContact O-N 3Å; A155-K157 VanDerWaalsContact C-N 3.35Å; K157-K159 PolarHBondContact O-N 2.88Å; K157-L160 PolarHBondContact O-N 3.14Å; K157-I161 HydrophobicContact CG-CD1 4.19Å; K157-I161 WeakPolarHBondContact O-CG1 2.97Å; K157-I161 PolarHBondContact O-N 2.89Å; K157-E239 WeakPolarHBondContact CD-OE2 3.41Å; K157-E239 WeakPolarHBondContact CE-OE2 3.36Å; K157-E239 IonicContact NZ-OE1 2.96Å; K157-E239 PolarHBondContact NZ-OE1 3.23Å; K157-E239 IonicContact NZ-OE2 2.7Å; K157-E239 PolarHBondContact NZ-OE2 3.42Å
158	A	86.9	Confident	85.7	Confident	1 Å²	1	85 Å²	85	1%	0.008	43%	0.428	C	S	.	.	H	α-helix	trans	-60.3	-44.5	176.9	0	0	0	0	0	112.1	R154 A155 L160 I161 L162 L240 Y243	R154-A158 PolarHBondContact O-N 3.06Å; A155-A158 PolarHBondContact O-N 2.92Å; A158-L160 VanDerWaalsContact C-N 3.33Å; A158-L160 PolarHBondContact O-N 2.99Å; A158-I161 PolarHBondContact O-N 2.67Å; A158-L162 PolarHBondContact O-N 3.37Å; A158-L240 HydrophobicContact CB-CD2 3.88Å; A158-L240 WeakPolarHBondContact O-CD2 3.45Å; A158-Y243 HydrophobicContact CB-CD1 3.82Å; A158-Y243 HydrophobicContact CB-CG 3.85Å
159	K	88.1	Confident	87.2	Confident	126 Å²	126	80 Å²	80	55%	0.548	40%	0.398	S	S	.	.	H	α-helix	trans	-60.6	-40.9	174.5	-74.6	179.3	-178.4	-176.3	0	112.6	A155 T156 K157 L162 L163	A155-K159 WeakPolarHBondContact O-CB 3.38Å; A155-K159 WeakPolarHBondContact O-CG 3.49Å; A155-K159 PolarHBondContact O-N 3.43Å; T156-K159 PolarHBondContact O-N 3.49Å; K157-K159 PolarHBondContact O-N 2.88Å; K159-L162 PolarHBondContact O-N 3.3Å; K159-L163 VanDerWaalsContact O-CB 3.31Å; K159-L163 WeakPolarHBondContact O-CB 3.3Å; K159-L163 PolarHBondContact O-N 2.82Å
160	L	90.7	Very high	88.4	Confident	106 Å²	106	79.4 Å²	79.4	56%	0.555	40%	0.395	S	S	*	.	H	α-helix	trans	-66	-41.5	176.8	-71.9	174.9	0	0	0	112	T156 K157 A158 L163 K164	T156-L160 HydrophobicContact CG2-CD1 4.28Å; T156-L160 VanDerWaalsContact O-CG 3.28Å; T156-L160 WeakPolarHBondContact O-CG 3.14Å; T156-L160 PolarHBondContact O-N 2.98Å; K157-L160 PolarHBondContact O-N 3.14Å; A158-L160 VanDerWaalsContact C-N 3.33Å; A158-L160 PolarHBondContact O-N 2.99Å; L160-L163 PolarHBondContact O-N 3.26Å; L160-K164 WeakPolarHBondContact O-CB 3.44Å; L160-K164 PolarHBondContact O-N 3.49Å
161	I	88.7	Confident	89.2	Confident	39 Å²	39	76.9 Å²	76.9	20%	0.2	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-47.7	174.9	-67.6	165.4	0	0	0	110	K157 A158 K164 T165 E239 L240	K157-I161 HydrophobicContact CG-CD1 4.19Å; K157-I161 WeakPolarHBondContact O-CG1 2.97Å; K157-I161 PolarHBondContact O-N 2.89Å; A158-I161 PolarHBondContact O-N 2.67Å; I161-K164 PolarHBondContact O-N 2.68Å; I161-T165 WeakPolarHBondContact O-CB 3.4Å; I161-T165 PolarHBondContact O-N 2.56Å; I161-T165 PolarHBondContact O-OG1 3.37Å; I161-E239 HydrophobicContact CD1-CB 4.29Å; I161-E239 WeakPolarHBondContact CD1-OE2 3.18Å; I161-L240 HydrophobicContact CB-CD2 3.93Å; I161-L240 HydrophobicContact CG2-CD1 4.08Å; I161-L240 HydrophobicContact CG2-CD2 3.89Å; I161-L240 HydrophobicContact CG2-CG 4.02Å
162	L	91.2	Very high	89.7	Confident	24 Å²	24	71.1 Å²	71.1	13%	0.126	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-46.7	178	179.3	57.2	0	0	0	111.9	A158 K159 K164 T165 K166 L240 F244 E279	A158-L162 PolarHBondContact O-N 3.37Å; K159-L162 PolarHBondContact O-N 3.3Å; L162-K164 PolarHBondContact O-N 2.85Å; L162-T165 PolarHBondContact O-N 2.91Å; L162-K166 HydrophobicContact CD1-CD 4.37Å; L162-K166 HydrophobicContact CD1-CG 4.17Å; L162-K166 HydrophobicContact CG-CD 4.41Å; L162-K166 WeakPolarHBondContact O-CG 3.32Å; L162-K166 PolarHBondContact O-N 3.4Å; L162-L240 HydrophobicContact CB-CD2 4.48Å; L162-F244 HydrophobicContact CD2-CE2 4.3Å; L162-F244 HydrophobicContact CD2-CZ 3.9Å; L162-E279 HydrophobicContact CD1-CB 4.09Å; L162-E279 HydrophobicContact CD1-CG 4.05Å; L162-E279 WeakPolarHBondContact CD1-O 3.41Å
163	L	91.9	Very high	90.2	Very high	98 Å²	98	63.3 Å²	63.3	51%	0.513	33%	0.326	S	S	.	.	H	α-helix	trans	-58.7	-48	178.4	-179.4	64.7	0	0	0	111.1	K159 L160 T165 K166 M167	K159-L163 VanDerWaalsContact O-CB 3.31Å; K159-L163 WeakPolarHBondContact O-CB 3.3Å; K159-L163 PolarHBondContact O-N 2.82Å; L160-L163 PolarHBondContact O-N 3.26Å; L163-T165 PolarHBondContact O-N 2.96Å; L163-K166 PolarHBondContact O-N 3.19Å; L163-M167 HydrophobicContact CD1-SD 4.48Å; L163-M167 HydrophobicContact CG-SD 4.29Å; L163-M167 VanDerWaalsContact O-CG 3.3Å; L163-M167 WeakPolarHBondContact O-CG 3.46Å; L163-M167 PolarHBondContact O-N 2.96Å
164	K	92.7	Very high	90.5	Very high	122 Å²	122	67.5 Å²	67.5	53%	0.53	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-46.5	176.6	-176.9	179.5	177.7	-177	0	111.4	L160 I161 L162 K166 M167 E168	L160-K164 WeakPolarHBondContact O-CB 3.44Å; L160-K164 PolarHBondContact O-N 3.49Å; I161-K164 PolarHBondContact O-N 2.68Å; L162-K164 PolarHBondContact O-N 2.85Å; K164-K166 VanDerWaalsContact C-N 3.34Å; K164-K166 PolarHBondContact O-N 3.21Å; K164-M167 PolarHBondContact O-N 3.06Å; K164-E168 VanDerWaalsContact CE-CD 3.46Å; K164-E168 WeakPolarHBondContact CE-OE1 3.4Å; K164-E168 WeakPolarHBondContact CE-OE2 3.4Å; K164-E168 HydrophobicContact CG-CG 4.46Å; K164-E168 IonicContact NZ-OE1 3.26Å; K164-E168 WeakPolarHBondContact O-CG 3.47Å; K164-E168 PolarHBondContact O-N 3.37Å
165	T	92.3	Very high	90.9	Very high	6 Å²	6	72.4 Å²	72.4	4%	0.037	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-44.7	179	-54.9	0	0	0	0	111.1	I161 L162 L163 E168 A169 V186 R188 S203	I161-T165 WeakPolarHBondContact O-CB 3.4Å; I161-T165 PolarHBondContact O-N 2.56Å; I161-T165 PolarHBondContact O-OG1 3.37Å; L162-T165 PolarHBondContact O-N 2.91Å; L163-T165 PolarHBondContact O-N 2.96Å; T165-E168 PolarHBondContact O-N 3.36Å; T165-A169 WeakPolarHBondContact O-CB 3.28Å; T165-A169 PolarHBondContact O-N 3.5Å; T165-V186 HydrophobicContact CG2-CG1 3.59Å; T165-R188 HydrophobicContact CG2-CG 3.5Å; T165-R188 VanDerWaalsContact CG2-CG 3.5Å; T165-S203 WeakPolarHBondContact CG2-OG 3.35Å; T165-S203 WeakPolarHBondContact O-CB 3.33Å
166	K	93.4	Very high	91.3	Very high	85 Å²	85	71.7 Å²	71.7	37%	0.37	35%	0.352	S	S	.	.	H	α-helix	trans	-63.3	-40.6	176.4	-73.3	-174.7	177.8	-153.4	0	112.6	L162 L163 K164 A169 V186 E279	L162-K166 HydrophobicContact CD1-CD 4.37Å; L162-K166 HydrophobicContact CD1-CG 4.17Å; L162-K166 HydrophobicContact CG-CD 4.41Å; L162-K166 WeakPolarHBondContact O-CG 3.32Å; L162-K166 PolarHBondContact O-N 3.4Å; L163-K166 PolarHBondContact O-N 3.19Å; K164-K166 VanDerWaalsContact C-N 3.34Å; K164-K166 PolarHBondContact O-N 3.21Å; K166-A169 PolarHBondContact O-N 3.42Å; K166-V186 HydrophobicContact CG-CB 4.48Å; K166-V186 HydrophobicContact CG-CG2 3.99Å; K166-E279 WeakPolarHBondContact CE-OE1 3.32Å; K166-E279 WeakPolarHBondContact CE-OE2 3.48Å; K166-E279 IonicContact NZ-OE1 3.22Å; K166-E279 PolarHBondContact NZ-OE1 3.13Å; K166-E279 IonicContact NZ-OE2 3.47Å; K166-E279 PolarHBondContact NZ-OE2 3.2Å
167	M	92.6	Very high	91.7	Very high	152 Å²	152	75.6 Å²	75.6	75%	0.749	36%	0.359	S	S	*	.	H	α-helix	trans	-67.4	-35.9	179.2	-72.7	-176.8	71.8	0	0	112.7	L163 K164	L163-M167 HydrophobicContact CD1-SD 4.48Å; L163-M167 HydrophobicContact CG-SD 4.29Å; L163-M167 VanDerWaalsContact O-CG 3.3Å; L163-M167 WeakPolarHBondContact O-CG 3.46Å; L163-M167 PolarHBondContact O-N 2.96Å; K164-M167 PolarHBondContact O-N 3.06Å
168	E	92.6	Very high	92	Very high	105 Å²	105	78.8 Å²	78.8	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-89.6	-3.1	-179.2	-66	173.6	171.2	0	0	113.1	K164 T165 L170	K164-E168 VanDerWaalsContact CE-CD 3.46Å; K164-E168 WeakPolarHBondContact CE-OE1 3.4Å; K164-E168 WeakPolarHBondContact CE-OE2 3.4Å; K164-E168 HydrophobicContact CG-CG 4.46Å; K164-E168 IonicContact NZ-OE1 3.26Å; K164-E168 WeakPolarHBondContact O-CG 3.47Å; K164-E168 PolarHBondContact O-N 3.37Å; T165-E168 PolarHBondContact O-N 3.36Å; E168-L170 PolarHBondContact O-N 2.81Å
169	A	93.6	Very high	92.3	Very high	17 Å²	17	80.2 Å²	80.2	14%	0.14	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-68.5	119.4	-171	0	0	0	0	0	112.6	T165 K166 V186 S203 Y205	T165-A169 WeakPolarHBondContact O-CB 3.28Å; T165-A169 PolarHBondContact O-N 3.5Å; K166-A169 PolarHBondContact O-N 3.42Å; A169-V186 HydrophobicContact CB-CG1 3.78Å; A169-V186 HydrophobicContact CB-CG2 4.3Å; A169-S203 CarbonylContact C-O 3.58Å; A169-S203 VanDerWaalsContact CA-O 3.31Å; A169-S203 WeakPolarHBondContact CA-O 3.48Å; A169-Y205 HydrophobicContact CB-CD1 3.89Å; A169-Y205 WeakPolarHBondContact O-CD1 3.26Å; A169-Y205 WeakPolarHBondContact O-CE1 3.18Å
170	L	94.5	Very high	92.6	Very high	87 Å²	87	77.6 Å²	77.6	46%	0.455	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	150.9	174	-61.5	176.2	0	0	0	111.4	E168 G172 S203 V204 Y205	E168-L170 PolarHBondContact O-N 2.81Å; L170-G172 PolarHBondContact O-N 2.89Å; L170-S203 PolarHBondContact N-O 3.04Å; L170-V204 HydrophobicContact CB-CG1 4.23Å; L170-V204 CarbonylContact O-C 3.57Å; L170-V204 VanDerWaalsContact O-CA 3.24Å; L170-V204 WeakPolarHBondContact O-CA 3.26Å; L170-Y205 VanDerWaalsContact O-CD1 3.27Å; L170-Y205 WeakPolarHBondContact O-CD1 3.31Å; L170-Y205 PolarHBondContact O-N 3.01Å
171	P	95.1	Very high	92.6	Very high	27 Å²	27	80.1 Å²	80.1	18%	0.175	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	126.6	173.4	23.4	-31.8	0	0	0	111.5	G173 A176 R177 Y205	P171-G173 PolarHBondContact O-N 3.27Å; P171-A176 HydrophobicContact CB-CB 4.11Å; P171-R177 HydrophobicContact CB-CG 3.49Å; P171-R177 VanDerWaalsContact CB-CG 3.49Å; P171-R177 HydrophobicContact CG-CG 3.68Å; P171-Y205 HydrophobicContact CB-CE1 4.05Å; P171-Y205 HydrophobicContact CB-CE2 4.18Å; P171-Y205 WeakPolarHBondContact CB-OH 3.25Å
172	G	92.6	Very high	92.7	Very high	5 Å²	5	82.3 Å²	82.3	5%	0.052	41%	0.406	C	S	.	.	S	Bend	trans	-69.4	68.5	170.5	0	0	0	0	0	113.1	L170 A176 Y205 F206	L170-G172 PolarHBondContact O-N 2.89Å; G172-A176 WeakPolarHBondContact O-CB 3.26Å; G172-Y205 PolarHBondContact N-O 3.11Å; G172-F206 VanDerWaalsContact CA-CE1 3.41Å
173	G	91.5	Very high	92.8	Very high	30 Å²	30	83.5 Å²	83.5	31%	0.309	41%	0.411	S	S	.	.	S	Bend	trans	86.7	177.8	-177.6	0	0	0	0	0	114	P171 R175 A176 Y218	P171-G173 PolarHBondContact O-N 3.27Å; G173-R175 PolarHBondContact O-N 2.63Å; G173-A176 WeakPolarHBondContact O-CB 3.41Å; G173-A176 PolarHBondContact O-N 2.98Å; G173-Y218 VanDerWaalsContact N-CE2 3.32Å
174	Q	91.1	Very high	93	Very high	127 Å²	127	82.2 Å²	82.2	59%	0.593	40%	0.399	S	S	*	.	H	α-helix	trans	-62	-42.9	-173.6	-172.3	67.7	-3.1	0	0	112.4	A176 R177	Q174-A176 PolarHBondContact O-N 3.05Å; Q174-A176 VanDerWaalsContact O-N 3.16Å; Q174-R177 WeakPolarHBondContact O-CB 3.34Å; Q174-R177 PolarHBondContact O-N 2.66Å; Q174-R177 VanDerWaalsContact O-N 3.13Å
175	R	91.7	Very high	93.1	Very high	187 Å²	187	77.1 Å²	77.1	71%	0.706	38%	0.377	S	S	*	.	H	α-helix	trans	-61.8	-24.4	179.3	-64.7	177.9	70.8	179.9	2.9	113	G173 W210	G173-R175 PolarHBondContact O-N 2.63Å; R175-W210 HydrophobicContact CB-CH2 3.63Å; R175-W210 HydrophobicContact CB-CZ2 3.8Å
176	A	93.5	Very high	93.2	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-75.9	-31.3	-179.2	0	0	0	0	0	110.9	P171 G172 G173 Q174 E178 L179 Y205 W210	P171-A176 HydrophobicContact CB-CB 4.11Å; G172-A176 WeakPolarHBondContact O-CB 3.26Å; G173-A176 WeakPolarHBondContact O-CB 3.41Å; G173-A176 PolarHBondContact O-N 2.98Å; Q174-A176 PolarHBondContact O-N 3.05Å; Q174-A176 VanDerWaalsContact O-N 3.16Å; A176-E178 PolarHBondContact O-N 3.32Å; A176-L179 HydrophobicContact CB-CD1 4.33Å; A176-L179 WeakPolarHBondContact O-CB 3.36Å; A176-L179 PolarHBondContact O-N 3.16Å; A176-Y205 HydrophobicContact CB-CD2 4.32Å; A176-Y205 HydrophobicContact CB-CE2 4.07Å; A176-Y205 VanDerWaalsContact O-CE2 3.3Å; A176-Y205 WeakPolarHBondContact O-CE2 3.36Å; A176-W210 HydrophobicContact CB-CH2 3.81Å; A176-W210 HydrophobicContact CB-CZ3 4.14Å
177	R	93.6	Very high	93.2	Very high	155 Å²	155	73.2 Å²	73.2	59%	0.585	36%	0.36	S	S	*	.	H	α-helix	trans	-57.9	-32.9	179.7	-64	-175.9	-178.6	-161.1	0.8	112.7	P171 Q174 L179	P171-R177 HydrophobicContact CB-CG 3.49Å; P171-R177 VanDerWaalsContact CB-CG 3.49Å; P171-R177 HydrophobicContact CG-CG 3.68Å; Q174-R177 WeakPolarHBondContact O-CB 3.34Å; Q174-R177 PolarHBondContact O-N 2.66Å; Q174-R177 VanDerWaalsContact O-N 3.13Å; R177-L179 VanDerWaalsContact C-N 3.34Å
178	E	93.1	Very high	93.3	Very high	155 Å²	155	66.7 Å²	66.7	72%	0.724	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-6.8	-178.3	-64.3	170.4	-166.1	0	0	113.3	A176	A176-E178 PolarHBondContact O-N 3.32Å
179	L	93.3	Very high	93.3	Very high	31 Å²	31	61.7 Å²	61.7	16%	0.162	30%	0.304	C	S	.	.	S	Bend	trans	-74	134.1	-178.2	-66.8	173	0	0	0	111.5	A176 R177 R184 G207 W210	A176-L179 HydrophobicContact CB-CD1 4.33Å; A176-L179 WeakPolarHBondContact O-CB 3.36Å; A176-L179 PolarHBondContact O-N 3.16Å; R177-L179 VanDerWaalsContact C-N 3.34Å; L179-R184 HydrophobicContact CB-CG 4.14Å; L179-R184 VanDerWaalsContact O-CZ 3.25Å; L179-R184 PolarHBondContact O-NE 2.81Å; L179-R184 PolarHBondContact O-NH2 3.08Å; L179-G207 VanDerWaalsContact CD1-CA 3.45Å; L179-G207 VanDerWaalsContact CD1-N 3.35Å; L179-W210 HydrophobicContact CD1-CH2 4.21Å; L179-W210 HydrophobicContact CD1-CZ2 3.84Å; L179-W210 HydrophobicContact CD2-CZ2 4.46Å; L179-W210 HydrophobicContact CG-CZ2 4.37Å
180	P	94.1	Very high	93.2	Very high	72 Å²	72	61 Å²	61	47%	0.468	30%	0.298	S	S	.	.			trans	-66.2	151.7	169.5	29.3	-34	0	0	0	110.5	S182 E183 R184	P180-S182 PolarHBondContact O-N 3.1Å; P180-S182 VanDerWaalsContact O-N 3.12Å; P180-E183 HydrophobicContact CG-CB 4.01Å; P180-E183 HydrophobicContact CG-CG 3.88Å; P180-E183 PolarHBondContact O-N 3.14Å; P180-R184 WeakPolarHBondContact O-CG 3.48Å; P180-R184 PolarHBondContact O-N 3.35Å
181	E	91.1	Very high	93	Very high	158 Å²	158	57.1 Å²	57.1	74%	0.738	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-55	-34.6	-176.7	-170.4	177	163	0	0	113.2	E183 R184	E181-E183 PolarHBondContact O-N 3.31Å; E181-R184 PolarHBondContact O-N 3.5Å
182	S	92.2	Very high	92.5	Very high	85 Å²	85	58.2 Å²	58.2	59%	0.594	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-64	-22.5	177.3	57.9	0	0	0	0	114.5	P180 K208	P180-S182 PolarHBondContact O-N 3.1Å; P180-S182 VanDerWaalsContact O-N 3.12Å; S182-K208 VanDerWaalsContact O-CE 3.32Å; S182-K208 WeakPolarHBondContact O-CE 3.07Å; S182-K208 PolarHBondContact O-NZ 2.72Å
183	E	93.3	Very high	91.8	Very high	49 Å²	49	61.8 Å²	61.8	23%	0.229	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-101	-7.1	179.2	-72.3	-71	179.1	0	0	112.9	P180 E181 G207 K208 R209	P180-E183 HydrophobicContact CG-CB 4.01Å; P180-E183 HydrophobicContact CG-CG 3.88Å; P180-E183 PolarHBondContact O-N 3.14Å; E181-E183 PolarHBondContact O-N 3.31Å; E183-G207 WeakPolarHBondContact O-CA 3.21Å; E183-K208 WeakPolarHBondContact O-CG 3.44Å; E183-K208 PolarHBondContact O-N 3.49Å; E183-R209 IonicContact OE1-CZ 3.46Å; E183-R209 IonicContact OE1-NH1 3.51Å; E183-R209 PolarHBondContact OE1-NH1 2.99Å; E183-R209 IonicContact OE1-NH2 3.51Å; E183-R209 PolarHBondContact OE1-NH2 2.92Å; E183-R209 IonicContact OE2-CZ 2.78Å; E183-R209 IonicContact OE2-NH1 2.67Å; E183-R209 PolarHBondContact OE2-NH1 3.16Å; E183-R209 IonicContact OE2-NH2 2.72Å
184	R	94.8	Very high	90.9	Very high	72 Å²	72	68.4 Å²	68.4	27%	0.272	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	142	176.8	-63.6	177.4	-167.3	172	-1.3	110	L179 P180 E181 Y205 F206 K208	L179-R184 HydrophobicContact CB-CG 4.14Å; L179-R184 VanDerWaalsContact O-CZ 3.25Å; L179-R184 PolarHBondContact O-NE 2.81Å; L179-R184 PolarHBondContact O-NH2 3.08Å; P180-R184 WeakPolarHBondContact O-CG 3.48Å; P180-R184 PolarHBondContact O-N 3.35Å; E181-R184 PolarHBondContact O-N 3.5Å; R184-Y205 HydrophobicContact CB-CD2 4.18Å; R184-Y205 HydrophobicContact CG-CD2 3.66Å; R184-Y205 HydrophobicContact CG-CE2 4.01Å; R184-Y205 HydrophobicContact CG-CG 4.41Å; R184-F206 CarbonylContact C-O 3.58Å; R184-F206 WeakPolarHBondContact CA-O 3.47Å; R184-K208 WeakPolarHBondContact O-CE 3.41Å
185	F	94.4	Very high	90.1	Very high	15 Å²	15	63.8 Å²	63.8	7%	0.066	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	116.5	170.8	-167.1	-87.9	0	0	0	107.7	I187 Y205 F206 K208 L268 V272 F277	F185-I187 HydrophobicContact CD1-CD1 4.03Å; F185-I187 HydrophobicContact CD1-CG1 3.72Å; F185-I187 HydrophobicContact CE1-CD1 4.33Å; F185-I187 HydrophobicContact CE1-CG1 3.88Å; F185-Y205 WeakPolarHBondContact O-CA 3.16Å; F185-F206 PolarHBondContact N-O 2.9Å; F185-F206 PolarHBondContact O-N 3.42Å; F185-K208 HydrophobicContact CB-CG 3.85Å; F185-K208 HydrophobicContact CD2-CG 4.24Å; F185-K208 HydrophobicContact CG-CG 4.49Å; F185-L268 HydrophobicContact CB-CD1 4.06Å; F185-L268 HydrophobicContact CD1-CD1 3.93Å; F185-L268 HydrophobicContact CD1-CD2 4.03Å; F185-L268 HydrophobicContact CD1-CG 4.4Å; F185-L268 HydrophobicContact CE1-CD2 4.18Å; F185-L268 HydrophobicContact CG-CD1 4.26Å; F185-V272 HydrophobicContact CD2-CG2 4.43Å; F185-V272 HydrophobicContact CE2-CG2 3.52Å; F185-V272 HydrophobicContact CZ-CG2 3.7Å; F185-F277 HydrophobicContact CZ-CB 4.44Å
186	V	95.1	Very high	89.3	Confident	8 Å²	8	56.7 Å²	56.7	5%	0.048	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.3	-175.9	-174.4	0	0	0	0	110.2	T165 K166 A169 V204 E279 G280	T165-V186 HydrophobicContact CG2-CG1 3.59Å; K166-V186 HydrophobicContact CG-CB 4.48Å; K166-V186 HydrophobicContact CG-CG2 3.99Å; A169-V186 HydrophobicContact CB-CG1 3.78Å; A169-V186 HydrophobicContact CB-CG2 4.3Å; V186-V204 WeakPolarHBondContact CA-O 3.47Å; V186-E279 HydrophobicContact CB-CG 4.19Å; V186-G280 WeakPolarHBondContact O-CA 3.33Å; V186-G280 PolarHBondContact O-N 2.94Å
187	I	93.8	Very high	87.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	146.9	-179	-63.6	172	0	0	0	108.4	F185 V204 F206 I215 L268 Q281 L283	F185-I187 HydrophobicContact CD1-CD1 4.03Å; F185-I187 HydrophobicContact CD1-CG1 3.72Å; F185-I187 HydrophobicContact CE1-CD1 4.33Å; F185-I187 HydrophobicContact CE1-CG1 3.88Å; I187-V204 PolarHBondContact N-O 2.93Å; I187-V204 PolarHBondContact O-N 2.92Å; I187-V204 VanDerWaalsContact O-O 3.11Å; I187-F206 HydrophobicContact CD1-CD2 4.37Å; I187-I215 HydrophobicContact CD1-CD1 3.58Å; I187-L268 HydrophobicContact CD1-CD1 3.86Å; I187-L268 HydrophobicContact CD1-CD2 3.4Å; I187-L268 HydrophobicContact CD1-CG 4.25Å; I187-L268 HydrophobicContact CG1-CD2 4.47Å; I187-Q281 WeakPolarHBondContact CG2-O 3.47Å; I187-L283 HydrophobicContact CD1-CD1 4.24Å; I187-L283 HydrophobicContact CG2-CB 4.22Å; I187-L283 HydrophobicContact CG2-CD1 3.83Å; I187-L283 HydrophobicContact CG2-CG 3.8Å
188	R	93.4	Very high	86.8	Confident	15 Å²	15	58.8 Å²	58.8	6%	0.057	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.9	165.6	-71.4	175.3	-68.2	150.6	3.2	108.7	T165 M201 I202 D238 G280 Q281 L282 L283	T165-R188 HydrophobicContact CG2-CG 3.5Å; T165-R188 VanDerWaalsContact CG2-CG 3.5Å; R188-M201 HydrophobicContact CB-CG 4.17Å; R188-M201 HydrophobicContact CB-SD 4.03Å; R188-M201 HydrophobicContact CG-SD 4.27Å; R188-I202 CarbonylContact C-O 3.54Å; R188-I202 WeakPolarHBondContact CA-O 3.3Å; R188-D238 IonicContact CZ-OD2 3.86Å; R188-D238 IonicContact NH1-OD2 3.07Å; R188-D238 PolarHBondContact NH1-OD2 3.37Å; R188-D238 VanDerWaalsContact NH2-CG 3.29Å; R188-D238 IonicContact NH2-OD1 2.88Å; R188-D238 PolarHBondContact NH2-OD1 3.28Å; R188-D238 IonicContact NH2-OD2 3.45Å; R188-D238 PolarHBondContact NH2-OD2 3.03Å; R188-G280 VanDerWaalsContact CZ-O 3.3Å; R188-G280 PolarHBondContact NE-O 2.86Å; R188-G280 PolarHBondContact NH2-O 2.97Å; R188-Q281 PolarHBondContact N-O 2.91Å; R188-L282 HydrophobicContact CB-CD1 3.85Å; R188-L282 WeakPolarHBondContact O-CA 3.29Å; R188-L283 PolarHBondContact O-N 3.08Å
189	L	93.5	Very high	85.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.3	-179	-165.4	63.4	0	0	0	109.3	M201 I202 V204 I215 F223 L233 L283 I285	L189-M201 WeakPolarHBondContact O-CA 3.31Å; L189-I202 HydrophobicContact CB-CD1 4.49Å; L189-I202 HydrophobicContact CB-CG1 3.95Å; L189-I202 PolarHBondContact N-O 2.77Å; L189-I202 PolarHBondContact O-N 3.2Å; L189-V204 HydrophobicContact CB-CG2 4.2Å; L189-I215 HydrophobicContact CD1-CG2 4.44Å; L189-F223 HydrophobicContact CD2-CE2 4.06Å; L189-F223 HydrophobicContact CG-CE2 4.06Å; L189-L233 HydrophobicContact CD1-CD2 3.88Å; L189-L283 WeakPolarHBondContact CA-O 3.41Å; L189-L283 HydrophobicContact CD1-CB 4.09Å; L189-I285 HydrophobicContact CD1-CD1 4.12Å; L189-I285 HydrophobicContact CD1-CG1 3.93Å; L189-I285 HydrophobicContact CD2-CD1 3.98Å; L189-I285 HydrophobicContact CG-CD1 4.01Å; L189-I285 HydrophobicContact CG-CG1 4.32Å
190	S	91.7	Very high	84.7	Confident	4 Å²	4	59.8 Å²	59.8	3%	0.028	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	162.7	175.3	63.6	0	0	0	0	109.8	L283 Q284 I285	S190-L283 PolarHBondContact N-O 3.49Å; S190-L283 PolarHBondContact OG-O 2.59Å; S190-Q284 CarbonylContact O-C 3.54Å; S190-Q284 WeakPolarHBondContact O-CA 3.34Å; S190-Q284 WeakPolarHBondContact OG-CB 3.39Å; S190-I285 PolarHBondContact O-N 3.21Å
191	V	89.5	Confident	84.4	Confident	5 Å²	5	61 Å²	61	3%	0.03	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.5	174.8	-175.1	0	0	0	0	108.5	V195 L196 F223 L225 I285	V191-V195 HydrophobicContact CG1-CB 3.78Å; V191-V195 HydrophobicContact CG1-CG1 4.05Å; V191-L196 HydrophobicContact CB-CB 4.35Å; V191-L196 HydrophobicContact CG1-CB 4.11Å; V191-F223 HydrophobicContact CG2-CB 3.9Å; V191-F223 HydrophobicContact CG2-CD1 3.94Å; V191-F223 HydrophobicContact CG2-CD2 3.29Å; V191-F223 HydrophobicContact CG2-CE1 4.25Å; V191-F223 HydrophobicContact CG2-CE2 3.67Å; V191-F223 HydrophobicContact CG2-CG 3.44Å; V191-F223 VanDerWaalsContact CG2-CG 3.44Å; V191-F223 HydrophobicContact CG2-CZ 4.11Å; V191-L225 HydrophobicContact CG1-CD1 4.48Å; V191-L225 HydrophobicContact CG1-CD2 4.08Å; V191-L225 HydrophobicContact CG2-CD2 4.46Å; V191-I285 HydrophobicContact CG2-CB 4.45Å; V191-I285 HydrophobicContact CG2-CD1 4.23Å
192	M	84.4	Confident	84.5	Confident	49 Å²	49	54.7 Å²	54.7	24%	0.241	30%	0.3	C	S	.	.			trans	-57.7	137.9	173	-79.6	-156.6	85.4	0	0	111.3	E194 V195 L196 Q284 I285 V286	M192-E194 PolarHBondContact O-N 2.85Å; M192-V195 PolarHBondContact O-N 3.42Å; M192-L196 PolarHBondContact O-N 3.37Å; M192-Q284 VanDerWaalsContact CG-CD 3.48Å; M192-Q284 HydrophobicContact CG-CG 3.76Å; M192-I285 PolarHBondContact N-O 2.98Å; M192-V286 HydrophobicContact CG-CB 4.24Å; M192-V286 HydrophobicContact CG-CG1 3.74Å; M192-V286 HydrophobicContact SD-CB 3.86Å; M192-V286 HydrophobicContact SD-CG1 3.54Å; M192-V286 VanDerWaalsContact SD-CG1 3.54Å
193	P	78	Confident	84.6	Confident	81 Å²	81	51.1 Å²	51.1	53%	0.526	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-27.8	179.7	-27.3	34.5	0	0	0	114.6	V195 L196	P193-V195 VanDerWaalsContact C-N 3.26Å; P193-V195 PolarHBondContact O-N 3.08Å; P193-L196 CarbonylContact C-O 3.58Å; P193-L196 WeakPolarHBondContact CA-O 3.28Å; P193-L196 CarbonylContact O-C 3.32Å
194	E	73.7	Confident	84.7	Confident	168 Å²	168	48.8 Å²	48.8	79%	0.785	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-26.3	177.7	-65.5	176.3	-175.4	0	0	113.2	M192	M192-E194 PolarHBondContact O-N 2.85Å
195	V	73.8	Confident	84.8	Confident	31 Å²	31	46.6 Å²	46.6	19%	0.188	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-43.7	179.1	-176.4	0	0	0	0	110.4	V191 M192 P193 L225 Y231 C287	V191-V195 HydrophobicContact CG1-CB 3.78Å; V191-V195 HydrophobicContact CG1-CG1 4.05Å; M192-V195 PolarHBondContact O-N 3.42Å; P193-V195 VanDerWaalsContact C-N 3.26Å; P193-V195 PolarHBondContact O-N 3.08Å; V195-L225 HydrophobicContact CG1-CD2 3.79Å; V195-Y231 HydrophobicContact CG1-CE1 3.89Å; V195-Y231 HydrophobicContact CG2-CE1 4.33Å; V195-C287 HydrophobicContact CG2-CB 3.86Å
196	L	75.7	Confident	84.8	Confident	38 Å²	38	46 Å²	46	20%	0.199	25%	0.253	C	S	.	.			trans	-130.7	116.9	175.9	-123.2	87.4	0	0	0	109.4	V191 M192 P193 T198 L225	V191-L196 HydrophobicContact CB-CB 4.35Å; V191-L196 HydrophobicContact CG1-CB 4.11Å; M192-L196 PolarHBondContact O-N 3.37Å; P193-L196 CarbonylContact C-O 3.58Å; P193-L196 WeakPolarHBondContact CA-O 3.28Å; P193-L196 CarbonylContact O-C 3.32Å; L196-T198 PolarHBondContact O-N 3.32Å; L196-L225 HydrophobicContact CD1-CD2 3.65Å
197	S	64.1	Low	84.8	Confident	121 Å²	121	45.7 Å²	45.7	85%	0.846	25%	0.252	S	S	*	.	S	Bend	trans	-66	-20.4	-178	-45.2	0	0	0	0	113.5
198	T	68.9	Low	84.9	Confident	78 Å²	78	49.2 Å²	49.2	48%	0.479	27%	0.268	S	S	.	.	S	Bend	trans	-86.3	119.3	174.8	52.9	0	0	0	0	109.7	L196 N200	L196-T198 PolarHBondContact O-N 3.32Å; T198-N200 PolarHBondContact O-N 3.08Å; T198-N200 PolarHBondContact OG1-ND2 2.92Å
199	N	66.4	Low	84.9	Confident	134 Å²	134	56 Å²	56	72%	0.717	29%	0.293	S	S	*	.			trans	-70.8	80.2	174.1	-169.9	9.6	0	0	0	110.3
200	N	76.5	Confident	84.9	Confident	73 Å²	73	58.2 Å²	58.2	39%	0.39	30%	0.302	S	S	.	.			trans	-96.6	107.3	178.3	-64	-23.9	0	0	0	108.1	T198 F223	T198-N200 PolarHBondContact O-N 3.08Å; T198-N200 PolarHBondContact OG1-ND2 2.92Å; N200-F223 HydrophobicContact CB-CD1 4.33Å; N200-F223 HydrophobicContact CB-CE1 3.77Å; N200-F223 WeakPolarHBondContact O-CE1 3.18Å
201	M	87.6	Confident	85.1	Confident	98 Å²	98	60.3 Å²	60.3	48%	0.483	32%	0.315	S	S	.	.			trans	-99.8	131.1	168.7	-176.9	-179.3	71.7	0	0	108.4	R188 L189 L282	R188-M201 HydrophobicContact CB-CG 4.17Å; R188-M201 HydrophobicContact CB-SD 4.03Å; R188-M201 HydrophobicContact CG-SD 4.27Å; L189-M201 WeakPolarHBondContact O-CA 3.31Å; M201-L282 HydrophobicContact CG-CD1 4.38Å; M201-L282 HydrophobicContact SD-CD1 4.01Å
202	I	92.9	Very high	85.3	Confident	24 Å²	24	60.1 Å²	60.1	12%	0.123	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.7	174.3	66.6	-178.8	0	0	0	110.1	R188 L189 V204 Y218 H222 F223	R188-I202 CarbonylContact C-O 3.54Å; R188-I202 WeakPolarHBondContact CA-O 3.3Å; L189-I202 HydrophobicContact CB-CD1 4.49Å; L189-I202 HydrophobicContact CB-CG1 3.95Å; L189-I202 PolarHBondContact N-O 2.77Å; L189-I202 PolarHBondContact O-N 3.2Å; I202-V204 HydrophobicContact CD1-CG1 3.86Å; I202-V204 HydrophobicContact CG1-CG1 4.04Å; I202-V204 HydrophobicContact CG1-CG2 4.47Å; I202-Y218 HydrophobicContact CD1-CE1 4.09Å; I202-H222 HydrophobicContact CD1-CB 4.41Å; I202-F223 HydrophobicContact CB-CZ 4.41Å; I202-F223 HydrophobicContact CD1-CE1 4.43Å; I202-F223 HydrophobicContact CD1-CE2 3.86Å; I202-F223 HydrophobicContact CD1-CZ 3.67Å; I202-F223 HydrophobicContact CG1-CE2 4.23Å; I202-F223 HydrophobicContact CG1-CZ 3.74Å; I202-F223 HydrophobicContact CG2-CE1 4.06Å; I202-F223 HydrophobicContact CG2-CZ 3.98Å
203	S	94.2	Very high	85.7	Confident	11 Å²	11	58.5 Å²	58.5	8%	0.077	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.4	170.2	-58.3	0	0	0	0	107.9	T165 A169 L170	T165-S203 WeakPolarHBondContact CG2-OG 3.35Å; T165-S203 WeakPolarHBondContact O-CB 3.33Å; A169-S203 CarbonylContact C-O 3.58Å; A169-S203 VanDerWaalsContact CA-O 3.31Å; A169-S203 WeakPolarHBondContact CA-O 3.48Å; L170-S203 PolarHBondContact N-O 3.04Å
204	V	95.7	Very high	86.5	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.5	-175.5	-77.8	0	0	0	0	110.7	L170 V186 I187 L189 I202 F206 Y218	L170-V204 HydrophobicContact CB-CG1 4.23Å; L170-V204 CarbonylContact O-C 3.57Å; L170-V204 VanDerWaalsContact O-CA 3.24Å; L170-V204 WeakPolarHBondContact O-CA 3.26Å; V186-V204 WeakPolarHBondContact CA-O 3.47Å; I187-V204 PolarHBondContact N-O 2.93Å; I187-V204 PolarHBondContact O-N 2.92Å; I187-V204 VanDerWaalsContact O-O 3.11Å; L189-V204 HydrophobicContact CB-CG2 4.2Å; I202-V204 HydrophobicContact CD1-CG1 3.86Å; I202-V204 HydrophobicContact CG1-CG1 4.04Å; I202-V204 HydrophobicContact CG1-CG2 4.47Å; V204-F206 HydrophobicContact CB-CE2 3.85Å; V204-F206 HydrophobicContact CB-CZ 4.33Å; V204-F206 HydrophobicContact CG2-CD2 4.42Å; V204-F206 HydrophobicContact CG2-CE2 3.49Å; V204-F206 VanDerWaalsContact CG2-CE2 3.49Å; V204-F206 HydrophobicContact CG2-CZ 4.15Å; V204-Y218 HydrophobicContact CB-CE1 4.45Å; V204-Y218 HydrophobicContact CG1-CD1 4.5Å; V204-Y218 HydrophobicContact CG1-CE1 3.61Å
205	Y	96.5	Very high	87.5	Confident	26 Å²	26	49.3 Å²	49.3	10%	0.102	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.6	177.2	69.9	-99.5	0	0	0	112.3	A169 L170 P171 G172 A176 R184 F185	A169-Y205 HydrophobicContact CB-CD1 3.89Å; A169-Y205 WeakPolarHBondContact O-CD1 3.26Å; A169-Y205 WeakPolarHBondContact O-CE1 3.18Å; L170-Y205 VanDerWaalsContact O-CD1 3.27Å; L170-Y205 WeakPolarHBondContact O-CD1 3.31Å; L170-Y205 PolarHBondContact O-N 3.01Å; P171-Y205 HydrophobicContact CB-CE1 4.05Å; P171-Y205 HydrophobicContact CB-CE2 4.18Å; P171-Y205 WeakPolarHBondContact CB-OH 3.25Å; G172-Y205 PolarHBondContact N-O 3.11Å; A176-Y205 HydrophobicContact CB-CD2 4.32Å; A176-Y205 HydrophobicContact CB-CE2 4.07Å; A176-Y205 VanDerWaalsContact O-CE2 3.3Å; A176-Y205 WeakPolarHBondContact O-CE2 3.36Å; R184-Y205 HydrophobicContact CB-CD2 4.18Å; R184-Y205 HydrophobicContact CG-CD2 3.66Å; R184-Y205 HydrophobicContact CG-CE2 4.01Å; R184-Y205 HydrophobicContact CG-CG 4.41Å; F185-Y205 WeakPolarHBondContact O-CA 3.16Å
206	F	96.2	Very high	88.4	Confident	1 Å²	1	48.3 Å²	48.3	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	170.5	179.2	-61.6	-90.1	0	0	0	110.4	G172 R184 F185 I187 V204 W210 I215 Y218 L268	G172-F206 VanDerWaalsContact CA-CE1 3.41Å; R184-F206 CarbonylContact C-O 3.58Å; R184-F206 WeakPolarHBondContact CA-O 3.47Å; F185-F206 PolarHBondContact N-O 2.9Å; F185-F206 PolarHBondContact O-N 3.42Å; I187-F206 HydrophobicContact CD1-CD2 4.37Å; V204-F206 HydrophobicContact CB-CE2 3.85Å; V204-F206 HydrophobicContact CB-CZ 4.33Å; V204-F206 HydrophobicContact CG2-CD2 4.42Å; V204-F206 HydrophobicContact CG2-CE2 3.49Å; V204-F206 VanDerWaalsContact CG2-CE2 3.49Å; V204-F206 HydrophobicContact CG2-CZ 4.15Å; F206-W210 HydrophobicContact CB-CE3 3.92Å; F206-W210 HydrophobicContact CB-CZ3 4.39Å; F206-W210 AromaticContact CD1-CE3 3.79Å; F206-W210 HydrophobicContact CD1-CE3 3.79Å; F206-W210 AromaticContact CD1-CZ3 3.83Å; F206-W210 HydrophobicContact CD1-CZ3 3.83Å; F206-W210 HydrophobicContact CG-CE3 4.36Å; F206-I215 HydrophobicContact CB-CG1 4.49Å; F206-I215 HydrophobicContact CD1-CG1 4.01Å; F206-I215 HydrophobicContact CD2-CD1 4.14Å; F206-I215 HydrophobicContact CD2-CG1 3.91Å; F206-I215 HydrophobicContact CD2-CG2 4.21Å; F206-I215 HydrophobicContact CE1-CB 4.42Å; F206-I215 HydrophobicContact CE1-CG1 4.16Å; F206-I215 HydrophobicContact CE2-CB 4.22Å; F206-I215 HydrophobicContact CE2-CG1 4.06Å; F206-I215 HydrophobicContact CE2-CG2 3.62Å; F206-I215 HydrophobicContact CG-CD1 4.32Å; F206-I215 HydrophobicContact CG-CG1 3.88Å; F206-I215 HydrophobicContact CZ-CB 4.16Å; F206-I215 HydrophobicContact CZ-CG1 4.19Å; F206-I215 HydrophobicContact CZ-CG2 3.83Å; F206-Y218 HydrophobicContact CE1-CD1 4.37Å; F206-Y218 HydrophobicContact CE1-CG 4Å; F206-Y218 AromaticContact CZ-CD1 3.76Å; F206-Y218 HydrophobicContact CZ-CD1 3.76Å; F206-Y218 AromaticContact CZ-CG 3.86Å; F206-Y218 HydrophobicContact CZ-CG 3.86Å; F206-L268 HydrophobicContact CB-CD1 3.98Å
207	G	95.1	Very high	89.3	Confident	2 Å²	2	51.6 Å²	51.6	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	136.6	173	0	0	0	0	0	111.8	L179 E183 R209 W210	L179-G207 VanDerWaalsContact CD1-CA 3.45Å; L179-G207 VanDerWaalsContact CD1-N 3.35Å; E183-G207 WeakPolarHBondContact O-CA 3.21Å; G207-R209 PolarHBondContact O-N 3.15Å; G207-W210 WeakPolarHBondContact O-CB 3.21Å; G207-W210 PolarHBondContact O-N 3.18Å
208	K	94.1	Very high	90.7	Very high	75 Å²	75	47.6 Å²	47.6	33%	0.326	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-30	177.4	-73.6	172.3	-177.9	178.6	0	113.8	S182 E183 R184 F185 L268 K269	S182-K208 VanDerWaalsContact O-CE 3.32Å; S182-K208 WeakPolarHBondContact O-CE 3.07Å; S182-K208 PolarHBondContact O-NZ 2.72Å; E183-K208 WeakPolarHBondContact O-CG 3.44Å; E183-K208 PolarHBondContact O-N 3.49Å; R184-K208 WeakPolarHBondContact O-CE 3.41Å; F185-K208 HydrophobicContact CB-CG 3.85Å; F185-K208 HydrophobicContact CD2-CG 4.24Å; F185-K208 HydrophobicContact CG-CG 4.49Å; K208-L268 WeakPolarHBondContact O-CB 3.27Å; K208-K269 VanDerWaalsContact O-CB 3.26Å; K208-K269 WeakPolarHBondContact O-CB 3.21Å; K208-K269 PolarHBondContact O-N 3.08Å
209	R	93.4	Very high	91.9	Very high	156 Å²	156	43.9 Å²	43.9	59%	0.589	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	1	-179.6	-67.3	-175.2	-71.3	-79.9	2.1	114.2	E183 G207 S267	E183-R209 IonicContact OE1-CZ 3.46Å; E183-R209 IonicContact OE1-NH1 3.51Å; E183-R209 PolarHBondContact OE1-NH1 2.99Å; E183-R209 IonicContact OE1-NH2 3.51Å; E183-R209 PolarHBondContact OE1-NH2 2.92Å; E183-R209 IonicContact OE2-CZ 2.78Å; E183-R209 IonicContact OE2-NH1 2.67Å; E183-R209 PolarHBondContact OE2-NH1 3.16Å; E183-R209 IonicContact OE2-NH2 2.72Å; G207-R209 PolarHBondContact O-N 3.15Å; R209-S267 WeakPolarHBondContact O-CB 3.27Å
210	W	94.7	Very high	93.1	Very high	47 Å²	47	38.8 Å²	38.8	18%	0.178	20%	0.196	C	C	.	.	S	Bend	trans	-80.9	143.2	-176.3	-65.6	6.3	0	0	0	111.2	R175 A176 L179 F206 G207 S267 L268	R175-W210 HydrophobicContact CB-CH2 3.63Å; R175-W210 HydrophobicContact CB-CZ2 3.8Å; A176-W210 HydrophobicContact CB-CH2 3.81Å; A176-W210 HydrophobicContact CB-CZ3 4.14Å; L179-W210 HydrophobicContact CD1-CH2 4.21Å; L179-W210 HydrophobicContact CD1-CZ2 3.84Å; L179-W210 HydrophobicContact CD2-CZ2 4.46Å; L179-W210 HydrophobicContact CG-CZ2 4.37Å; F206-W210 HydrophobicContact CB-CE3 3.92Å; F206-W210 HydrophobicContact CB-CZ3 4.39Å; F206-W210 AromaticContact CD1-CE3 3.79Å; F206-W210 HydrophobicContact CD1-CE3 3.79Å; F206-W210 AromaticContact CD1-CZ3 3.83Å; F206-W210 HydrophobicContact CD1-CZ3 3.83Å; F206-W210 HydrophobicContact CG-CE3 4.36Å; G207-W210 WeakPolarHBondContact O-CB 3.21Å; G207-W210 PolarHBondContact O-N 3.18Å; W210-S267 CarbonylContact O-C 3.54Å; W210-S267 VanDerWaalsContact O-CA 3.25Å; W210-S267 WeakPolarHBondContact O-CA 3.41Å; W210-L268 PolarHBondContact O-N 3.46Å
211	P	95.6	Very high	93.8	Very high	49 Å²	49	42.5 Å²	42.5	32%	0.318	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-68.4	148.3	176.2	30.1	-34.3	0	0	0	110.9	G213 C214 S266	P211-G213 PolarHBondContact O-N 3.35Å; P211-C214 PolarHBondContact O-N 2.73Å; P211-C214 VanDerWaalsContact O-N 3.13Å; P211-S266 WeakPolarHBondContact CA-O 3.19Å
212	L	93.7	Very high	94	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-26.7	176.7	-73.8	-168.7	0	0	0	112.8	C214 I215 L216 L233 L262 L264 S266 L268 H271 F277 L283	L212-C214 VanDerWaalsContact C-N 3.28Å; L212-C214 PolarHBondContact O-N 3.49Å; L212-I215 HydrophobicContact CD2-CD1 3.56Å; L212-I215 WeakPolarHBondContact O-CA 3.3Å; L212-I215 VanDerWaalsContact O-CB 3.28Å; L212-I215 WeakPolarHBondContact O-CB 3.48Å; L212-I215 PolarHBondContact O-N 3.17Å; L212-L216 PolarHBondContact O-N 3.2Å; L212-L233 HydrophobicContact CB-CD1 4.24Å; L212-L262 HydrophobicContact CD1-CB 3.68Å; L212-L262 HydrophobicContact CD1-CD1 3.95Å; L212-L262 HydrophobicContact CD1-CG 4.34Å; L212-L264 HydrophobicContact CB-CD2 4.22Å; L212-L264 PolarHBondContact N-O 3.42Å; L212-S266 PolarHBondContact N-O 2.77Å; L212-L268 HydrophobicContact CD2-CD2 3.46Å; L212-L268 VanDerWaalsContact CD2-CD2 3.46Å; L212-L268 HydrophobicContact CD2-CG 4.07Å; L212-H271 VanDerWaalsContact CD1-CD2 3.41Å; L212-H271 WeakPolarHBondContact CD1-CD2 3.41Å; L212-H271 WeakPolarHBondContact CD1-NE2 3.45Å; L212-F277 HydrophobicContact CD1-CE2 4.42Å; L212-F277 HydrophobicContact CD2-CE2 4.39Å; L212-L283 HydrophobicContact CD2-CD1 4.38Å
213	G	93.8	Very high	93.9	Very high	16 Å²	16	40.7 Å²	40.7	17%	0.165	20%	0.2	C	C	.	.	H	α-helix	trans	-54.8	-40.7	174	0	0	0	0	0	113	P211 I215 L216 D217 L264	P211-G213 PolarHBondContact O-N 3.35Å; G213-I215 PolarHBondContact O-N 3.4Å; G213-L216 WeakPolarHBondContact O-CB 3.39Å; G213-L216 PolarHBondContact O-N 3.33Å; G213-D217 PolarHBondContact O-N 3.17Å; G213-L264 PolarHBondContact N-O 3.48Å
214	C	94	Very high	93.7	Very high	55 Å²	55	48.1 Å²	48.1	37%	0.372	23%	0.233	S	C	.	.	H	α-helix	trans	-65	-29.6	176.5	-66.2	0	0	0	0	112.9	P211 L212 Y218	P211-C214 PolarHBondContact O-N 2.73Å; P211-C214 VanDerWaalsContact O-N 3.13Å; L212-C214 VanDerWaalsContact C-N 3.28Å; L212-C214 PolarHBondContact O-N 3.49Å; C214-Y218 WeakPolarHBondContact O-CB 3.5Å; C214-Y218 PolarHBondContact O-N 3.41Å; C214-Y218 VanDerWaalsContact O-N 3.09Å
215	I	94.2	Very high	93.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-73.4	-42.2	177.7	-53.1	179.1	0	0	0	109.5	I187 L189 F206 L212 G213 Y218 G219 L233 L268	I187-I215 HydrophobicContact CD1-CD1 3.58Å; L189-I215 HydrophobicContact CD1-CG2 4.44Å; F206-I215 HydrophobicContact CB-CG1 4.49Å; F206-I215 HydrophobicContact CD1-CG1 4.01Å; F206-I215 HydrophobicContact CD2-CD1 4.14Å; F206-I215 HydrophobicContact CD2-CG1 3.91Å; F206-I215 HydrophobicContact CD2-CG2 4.21Å; F206-I215 HydrophobicContact CE1-CB 4.42Å; F206-I215 HydrophobicContact CE1-CG1 4.16Å; F206-I215 HydrophobicContact CE2-CB 4.22Å; F206-I215 HydrophobicContact CE2-CG1 4.06Å; F206-I215 HydrophobicContact CE2-CG2 3.62Å; F206-I215 HydrophobicContact CG-CD1 4.32Å; F206-I215 HydrophobicContact CG-CG1 3.88Å; F206-I215 HydrophobicContact CZ-CB 4.16Å; F206-I215 HydrophobicContact CZ-CG1 4.19Å; F206-I215 HydrophobicContact CZ-CG2 3.83Å; L212-I215 HydrophobicContact CD2-CD1 3.56Å; L212-I215 WeakPolarHBondContact O-CA 3.3Å; L212-I215 VanDerWaalsContact O-CB 3.28Å; L212-I215 WeakPolarHBondContact O-CB 3.48Å; L212-I215 PolarHBondContact O-N 3.17Å; G213-I215 PolarHBondContact O-N 3.4Å; I215-Y218 PolarHBondContact O-N 3.02Å; I215-G219 PolarHBondContact O-N 3.39Å; I215-L233 HydrophobicContact CB-CD1 4.4Å; I215-L233 HydrophobicContact CG2-CD1 4.47Å; I215-L268 HydrophobicContact CD1-CD1 3.64Å; I215-L268 HydrophobicContact CD1-CD2 3.72Å; I215-L268 HydrophobicContact CD1-CG 3.73Å
216	L	93.9	Very high	93	Very high	11 Å²	11	50.1 Å²	50.1	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-47.7	174	-179.3	62	0	0	0	111	L212 G213 Y218 G219 C220 Y231 L233 L264 I285	L212-L216 PolarHBondContact O-N 3.2Å; G213-L216 WeakPolarHBondContact O-CB 3.39Å; G213-L216 PolarHBondContact O-N 3.33Å; L216-Y218 VanDerWaalsContact C-N 3.35Å; L216-Y218 PolarHBondContact O-N 3.5Å; L216-G219 PolarHBondContact O-N 3.01Å; L216-G219 VanDerWaalsContact O-N 3.1Å; L216-C220 WeakPolarHBondContact O-CB 3.23Å; L216-C220 PolarHBondContact O-N 3.32Å; L216-C220 PolarHBondContact O-SG 2.93Å; L216-Y231 WeakPolarHBondContact CD2-O 3.41Å; L216-L233 HydrophobicContact CB-CD1 4.01Å; L216-L233 HydrophobicContact CB-CG 4.15Å; L216-L233 HydrophobicContact CD1-CD2 4.06Å; L216-L233 HydrophobicContact CD1-CG 4.08Å; L216-L264 HydrophobicContact CB-CD2 4.4Å; L216-L264 HydrophobicContact CD2-CD1 3.56Å; L216-L264 HydrophobicContact CD2-CD2 4.1Å; L216-I285 HydrophobicContact CD1-CB 4.46Å; L216-I285 HydrophobicContact CD1-CD1 4.39Å; L216-I285 HydrophobicContact CD1-CG1 4Å; L216-I285 HydrophobicContact CD1-CG2 3.78Å
217	D	93.6	Very high	92.5	Very high	107 Å²	107	61.8 Å²	61.8	57%	0.572	29%	0.293	S	S	*	.	H	α-helix	trans	-58	-46.9	178.4	-67.4	-24.3	0	0	0	111.5	G213 G219 C220 E221	G213-D217 PolarHBondContact O-N 3.17Å; D217-G219 VanDerWaalsContact C-N 3.33Å; D217-G219 PolarHBondContact O-N 2.97Å; D217-C220 PolarHBondContact O-N 2.87Å; D217-E221 PolarHBondContact O-N 2.92Å
218	Y	94.4	Very high	92	Very high	36 Å²	36	67 Å²	67	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-44.2	174.6	176.1	-86.2	0	0	0	111.6	G173 I202 V204 F206 C214 I215 L216 E221 H222	G173-Y218 VanDerWaalsContact N-CE2 3.32Å; I202-Y218 HydrophobicContact CD1-CE1 4.09Å; V204-Y218 HydrophobicContact CB-CE1 4.45Å; V204-Y218 HydrophobicContact CG1-CD1 4.5Å; V204-Y218 HydrophobicContact CG1-CE1 3.61Å; F206-Y218 HydrophobicContact CE1-CD1 4.37Å; F206-Y218 HydrophobicContact CE1-CG 4Å; F206-Y218 AromaticContact CZ-CD1 3.76Å; F206-Y218 HydrophobicContact CZ-CD1 3.76Å; F206-Y218 AromaticContact CZ-CG 3.86Å; F206-Y218 HydrophobicContact CZ-CG 3.86Å; C214-Y218 WeakPolarHBondContact O-CB 3.5Å; C214-Y218 PolarHBondContact O-N 3.41Å; C214-Y218 VanDerWaalsContact O-N 3.09Å; I215-Y218 PolarHBondContact O-N 3.02Å; L216-Y218 VanDerWaalsContact C-N 3.35Å; L216-Y218 PolarHBondContact O-N 3.5Å; Y218-E221 PolarHBondContact O-N 2.96Å; Y218-H222 HydrophobicContact CD1-CB 4.37Å; Y218-H222 HydrophobicContact CE1-CB 3.97Å; Y218-H222 AromaticContact CZ-CD2 3.94Å; Y218-H222 VanDerWaalsContact O-CB 3.22Å; Y218-H222 WeakPolarHBondContact O-CB 3.45Å; Y218-H222 PolarHBondContact O-N 3.34Å; Y218-H222 PolarHBondContact OH-CD2 3.03Å
219	G	92.8	Very high	91.7	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-45.7	177.2	0	0	0	0	0	112.6	I215 L216 D217 E221 H222 F223	I215-G219 PolarHBondContact O-N 3.39Å; L216-G219 PolarHBondContact O-N 3.01Å; L216-G219 VanDerWaalsContact O-N 3.1Å; D217-G219 VanDerWaalsContact C-N 3.33Å; D217-G219 PolarHBondContact O-N 2.97Å; G219-E221 VanDerWaalsContact C-N 3.3Å; G219-E221 PolarHBondContact O-N 3.06Å; G219-H222 PolarHBondContact O-N 3.01Å; G219-F223 WeakPolarHBondContact O-CB 3.37Å; G219-F223 WeakPolarHBondContact O-CD2 3.19Å; G219-F223 PolarHBondContact O-N 3.44Å
220	C	92.2	Very high	91.5	Very high	28 Å²	28	66.7 Å²	66.7	19%	0.189	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-42.3	176.1	-70.3	0	0	0	0	111.8	L216 D217 H224 L225	L216-C220 WeakPolarHBondContact O-CB 3.23Å; L216-C220 PolarHBondContact O-N 3.32Å; L216-C220 PolarHBondContact O-SG 2.93Å; D217-C220 PolarHBondContact O-N 2.87Å; C220-H224 PolarHBondContact O-N 2.79Å; C220-L225 HydrophobicContact CB-CB 4.4Å; C220-L225 PolarHBondContact O-N 3.04Å
221	E	91.9	Very high	91.3	Very high	151 Å²	151	65.4 Å²	65.4	71%	0.706	32%	0.318	S	S	*	.	H	α-helix	trans	-68.9	-49.8	175.8	-172.2	178.6	-178.2	0	0	111.9	D217 Y218 G219 F223 H224	D217-E221 PolarHBondContact O-N 2.92Å; Y218-E221 PolarHBondContact O-N 2.96Å; G219-E221 VanDerWaalsContact C-N 3.3Å; G219-E221 PolarHBondContact O-N 3.06Å; E221-F223 PolarHBondContact O-N 2.83Å; E221-H224 PolarHBondContact O-N 3.31Å; E221-H224 VanDerWaalsContact O-N 3.13Å
222	H	91.5	Very high	91.2	Very high	70 Å²	70	63 Å²	63	32%	0.324	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-42.4	-176.5	-174.6	-74.3	0	0	0	112.4	I202 Y218 G219 H224	I202-H222 HydrophobicContact CD1-CB 4.41Å; Y218-H222 HydrophobicContact CD1-CB 4.37Å; Y218-H222 HydrophobicContact CE1-CB 3.97Å; Y218-H222 AromaticContact CZ-CD2 3.94Å; Y218-H222 VanDerWaalsContact O-CB 3.22Å; Y218-H222 WeakPolarHBondContact O-CB 3.45Å; Y218-H222 PolarHBondContact O-N 3.34Å; Y218-H222 PolarHBondContact OH-CD2 3.03Å; G219-H222 PolarHBondContact O-N 3.01Å; H222-H224 VanDerWaalsContact C-N 3.29Å; H222-H224 PolarHBondContact O-ND1 3.32Å; H222-H224 VanDerWaalsContact O-ND1 3.16Å
223	F	91.4	Very high	91.1	Very high	14 Å²	14	63 Å²	63	6%	0.061	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	3.4	178.2	-63.5	-67	0	0	0	113.5	L189 V191 N200 I202 G219 E221 L225 I285	L189-F223 HydrophobicContact CD2-CE2 4.06Å; L189-F223 HydrophobicContact CG-CE2 4.06Å; V191-F223 HydrophobicContact CG2-CB 3.9Å; V191-F223 HydrophobicContact CG2-CD1 3.94Å; V191-F223 HydrophobicContact CG2-CD2 3.29Å; V191-F223 HydrophobicContact CG2-CE1 4.25Å; V191-F223 HydrophobicContact CG2-CE2 3.67Å; V191-F223 HydrophobicContact CG2-CG 3.44Å; V191-F223 VanDerWaalsContact CG2-CG 3.44Å; V191-F223 HydrophobicContact CG2-CZ 4.11Å; N200-F223 HydrophobicContact CB-CD1 4.33Å; N200-F223 HydrophobicContact CB-CE1 3.77Å; N200-F223 WeakPolarHBondContact O-CE1 3.18Å; I202-F223 HydrophobicContact CB-CZ 4.41Å; I202-F223 HydrophobicContact CD1-CE1 4.43Å; I202-F223 HydrophobicContact CD1-CE2 3.86Å; I202-F223 HydrophobicContact CD1-CZ 3.67Å; I202-F223 HydrophobicContact CG1-CE2 4.23Å; I202-F223 HydrophobicContact CG1-CZ 3.74Å; I202-F223 HydrophobicContact CG2-CE1 4.06Å; I202-F223 HydrophobicContact CG2-CZ 3.98Å; G219-F223 WeakPolarHBondContact O-CB 3.37Å; G219-F223 WeakPolarHBondContact O-CD2 3.19Å; G219-F223 PolarHBondContact O-N 3.44Å; E221-F223 PolarHBondContact O-N 2.83Å; F223-L225 VanDerWaalsContact C-N 3.29Å; F223-L225 HydrophobicContact CB-CD2 3.81Å; F223-L225 HydrophobicContact CB-CG 3.98Å; F223-L225 PolarHBondContact O-N 3.45Å; F223-I285 HydrophobicContact CD2-CD1 4.07Å; F223-I285 HydrophobicContact CE2-CD1 4.31Å
224	H	90	Very high	90.9	Very high	166 Å²	166	63.2 Å²	63.2	77%	0.769	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	44.8	-179.5	-58.4	75.3	0	0	0	112.6	C220 E221 H222	C220-H224 PolarHBondContact O-N 2.79Å; E221-H224 PolarHBondContact O-N 3.31Å; E221-H224 VanDerWaalsContact O-N 3.13Å; H222-H224 VanDerWaalsContact C-N 3.29Å; H222-H224 PolarHBondContact O-ND1 3.32Å; H222-H224 VanDerWaalsContact O-ND1 3.16Å
225	L	89.5	Confident	90.7	Very high	10 Å²	10	61.3 Å²	61.3	5%	0.052	29%	0.285	C	S	.	.			trans	-70.7	142.8	-176.5	-59	-171.8	0	0	0	111.6	V191 V195 L196 C220 F223 R227 Y231 I285	V191-L225 HydrophobicContact CG1-CD1 4.48Å; V191-L225 HydrophobicContact CG1-CD2 4.08Å; V191-L225 HydrophobicContact CG2-CD2 4.46Å; V195-L225 HydrophobicContact CG1-CD2 3.79Å; L196-L225 HydrophobicContact CD1-CD2 3.65Å; C220-L225 HydrophobicContact CB-CB 4.4Å; C220-L225 PolarHBondContact O-N 3.04Å; F223-L225 VanDerWaalsContact C-N 3.29Å; F223-L225 HydrophobicContact CB-CD2 3.81Å; F223-L225 HydrophobicContact CB-CG 3.98Å; F223-L225 PolarHBondContact O-N 3.45Å; L225-R227 PolarHBondContact O-N 3.06Å; L225-Y231 HydrophobicContact CB-CE1 4.47Å; L225-Y231 HydrophobicContact CB-CE2 3.98Å; L225-Y231 HydrophobicContact CD1-CD1 4.18Å; L225-Y231 HydrophobicContact CD1-CE1 4.04Å; L225-Y231 HydrophobicContact CD1-CE2 4.43Å; L225-Y231 HydrophobicContact CD1-CG 4.45Å; L225-I285 HydrophobicContact CD1-CD1 4.33Å; L225-I285 HydrophobicContact CD1-CG2 3.73Å
226	P	87.7	Confident	90.2	Very high	59 Å²	59	63 Å²	63	38%	0.383	29%	0.294	S	S	.	.			trans	-57.6	124.7	175.2	-25.2	32.5	0	0	0	112.6	D228 Y231	P226-D228 VanDerWaalsContact C-N 3.28Å; P226-D228 WeakPolarHBondContact CB-OD1 3.3Å; P226-D228 PolarHBondContact O-N 3.19Å; P226-Y231 VanDerWaalsContact CD-OH 3.3Å; P226-Y231 WeakPolarHBondContact CD-OH 3.44Å; P226-Y231 WeakPolarHBondContact O-CE2 3.38Å; P226-Y231 PolarHBondContact O-OH 3.44Å
227	R	85.3	Confident	89.5	Confident	245 Å²	245	65.7 Å²	65.7	93%	0.925	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-8	-176.9	-70.8	-168.6	-72.9	-95.5	1.6	114.9	L225 K229	L225-R227 PolarHBondContact O-N 3.06Å; R227-K229 VanDerWaalsContact C-N 3.29Å
228	D	85	Confident	88.8	Confident	112 Å²	112	62.2 Å²	62.2	60%	0.599	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-19.6	176.9	62.1	-44.1	0	0	0	112.8	P226 Q290	P226-D228 VanDerWaalsContact C-N 3.28Å; P226-D228 WeakPolarHBondContact CB-OD1 3.3Å; P226-D228 PolarHBondContact O-N 3.19Å; D228-Q290 PolarHBondContact O-NE2 3Å; D228-Q290 VanDerWaalsContact O-NE2 3.08Å
229	K	86.5	Confident	87.7	Confident	91 Å²	91	64 Å²	64	40%	0.396	31%	0.305	S	S	.	.	S	Bend	trans	-99.1	150.9	-179.4	-63.5	179.3	-179.5	-174.5	0	111.4	R227 Y231	R227-K229 VanDerWaalsContact C-N 3.29Å; K229-Y231 HydrophobicContact CB-CE1 4.33Å; K229-Y231 HydrophobicContact CB-CE2 4.06Å; K229-Y231 WeakPolarHBondContact O-CE2 3.27Å
230	K	89.4	Confident	87	Confident	133 Å²	133	64 Å²	64	58%	0.578	31%	0.305	S	S	*	.			trans	-88.9	134.3	169.6	-67.6	-177.5	-178.5	174.8	0	108.4	L288	K230-L288 HydrophobicContact CB-CB 4.18Å; K230-L288 HydrophobicContact CB-CD1 4.45Å; K230-L288 PolarHBondContact O-N 3.15Å
231	Y	91.8	Very high	85.9	Confident	20 Å²	20	63 Å²	63	8%	0.078	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	158.3	177	-59.3	-80.8	0	0	0	111.2	V195 L216 L225 P226 K229 I285 V286 C287	V195-Y231 HydrophobicContact CG1-CE1 3.89Å; V195-Y231 HydrophobicContact CG2-CE1 4.33Å; L216-Y231 WeakPolarHBondContact CD2-O 3.41Å; L225-Y231 HydrophobicContact CB-CE1 4.47Å; L225-Y231 HydrophobicContact CB-CE2 3.98Å; L225-Y231 HydrophobicContact CD1-CD1 4.18Å; L225-Y231 HydrophobicContact CD1-CE1 4.04Å; L225-Y231 HydrophobicContact CD1-CE2 4.43Å; L225-Y231 HydrophobicContact CD1-CG 4.45Å; P226-Y231 VanDerWaalsContact CD-OH 3.3Å; P226-Y231 WeakPolarHBondContact CD-OH 3.44Å; P226-Y231 WeakPolarHBondContact O-CE2 3.38Å; P226-Y231 PolarHBondContact O-OH 3.44Å; K229-Y231 HydrophobicContact CB-CE1 4.33Å; K229-Y231 HydrophobicContact CB-CE2 4.06Å; K229-Y231 WeakPolarHBondContact O-CE2 3.27Å; Y231-I285 HydrophobicContact CD1-CG2 3.89Å; Y231-I285 HydrophobicContact CG-CG2 4.11Å; Y231-V286 CarbonylContact C-O 3.53Å; Y231-V286 VanDerWaalsContact CA-O 3.23Å; Y231-V286 WeakPolarHBondContact CA-O 3.49Å; Y231-C287 HydrophobicContact CD1-CB 4.37Å; Y231-C287 HydrophobicContact CE1-CB 4.31Å
232	G	91.9	Very high	84.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	171.7	172.9	0	0	0	0	0	110.8	I285 V286	G232-I285 WeakPolarHBondContact O-CA 3.42Å; G232-V286 PolarHBondContact N-O 2.61Å; G232-V286 PolarHBondContact O-N 3.04Å
233	L	92.1	Very high	83.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.3	171.1	-69.3	172	0	0	0	109.2	L189 L212 I215 L216 L262 L264 L283 Q284 I285	L189-L233 HydrophobicContact CD1-CD2 3.88Å; L212-L233 HydrophobicContact CB-CD1 4.24Å; I215-L233 HydrophobicContact CB-CD1 4.4Å; I215-L233 HydrophobicContact CG2-CD1 4.47Å; L216-L233 HydrophobicContact CB-CD1 4.01Å; L216-L233 HydrophobicContact CB-CG 4.15Å; L216-L233 HydrophobicContact CD1-CD2 4.06Å; L216-L233 HydrophobicContact CD1-CG 4.08Å; L233-L262 HydrophobicContact CB-CB 4.49Å; L233-L262 HydrophobicContact CB-CD1 3.96Å; L233-L262 WeakPolarHBondContact O-CB 3.35Å; L233-L262 WeakPolarHBondContact O-CG 3.5Å; L233-L262 PolarHBondContact O-N 3.3Å; L233-L264 HydrophobicContact CB-CD2 4.25Å; L233-L264 HydrophobicContact CD1-CD2 4.01Å; L233-L264 HydrophobicContact CG-CD2 4.14Å; L233-L283 HydrophobicContact CD1-CD1 4.44Å; L233-L283 HydrophobicContact CD2-CB 4.49Å; L233-Q284 WeakPolarHBondContact CA-O 3.15Å; L233-I285 HydrophobicContact CD2-CB 4.49Å; L233-I285 HydrophobicContact CD2-CG1 3.61Å
234	I	90.3	Very high	82.5	Confident	19 Å²	19	60.8 Å²	60.8	10%	0.097	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.8	166.3	68.7	172.5	0	0	0	109.5	L236 S260 L283 Q284 V286	I234-L236 HydrophobicContact CD1-CD2 3.86Å; I234-L236 HydrophobicContact CG1-CD2 4.3Å; I234-S260 WeakPolarHBondContact CA-O 3.44Å; I234-S260 WeakPolarHBondContact CG2-O 3.48Å; I234-L283 WeakPolarHBondContact O-CA 3.28Å; I234-Q284 HydrophobicContact CD1-CB 4.4Å; I234-Q284 HydrophobicContact CG1-CB 3.88Å; I234-Q284 PolarHBondContact N-O 2.8Å; I234-Q284 PolarHBondContact O-N 2.92Å; I234-V286 HydrophobicContact CB-CG1 4.26Å; I234-V286 HydrophobicContact CD1-CG1 3.62Å; I234-V286 HydrophobicContact CG1-CG1 3.62Å; I234-V286 HydrophobicContact CG2-CG1 3.74Å; I234-V286 HydrophobicContact CG2-CG2 4.01Å
235	R	89.2	Confident	81.1	Confident	15 Å²	15	55.3 Å²	55.3	6%	0.057	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.1	168.8	-179.1	-173.3	178.7	166.5	6.8	109.4	D241 N259 L262 N275 C276 F277 Q281 L283	R235-D241 IonicContact CZ-OD1 2.94Å; R235-D241 IonicContact NE-OD1 2.9Å; R235-D241 IonicContact NH2-OD1 4Å; R235-D241 PolarHBondContact NH2-OD1 3.45Å; R235-N259 PolarHBondContact O-N 3.48Å; R235-L262 HydrophobicContact CB-CD1 4.43Å; R235-N275 PolarHBondContact NH1-O 2.86Å; R235-C276 PolarHBondContact NH1-O 3.28Å; R235-C276 PolarHBondContact NH2-O 2.88Å; R235-F277 HydrophobicContact CB-CE1 4.27Å; R235-F277 HydrophobicContact CB-CZ 4.46Å; R235-F277 HydrophobicContact CG-CE1 4.32Å; R235-Q281 HydrophobicContact CG-CG 4.08Å; R235-Q281 VanDerWaalsContact CZ-OE1 3.24Å; R235-L283 HydrophobicContact CB-CD2 4.2Å; R235-L283 HydrophobicContact CG-CD2 4.48Å
236	L	84.5	Confident	79.4	Confident	36 Å²	36	59.4 Å²	59.4	19%	0.188	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136.1	166.4	-62.1	-176.9	0	0	0	109.2	I234 N259 Q281 L282 Q284	I234-L236 HydrophobicContact CD1-CD2 3.86Å; I234-L236 HydrophobicContact CG1-CD2 4.3Å; L236-N259 WeakPolarHBondContact CD2-OD1 3.4Å; L236-Q281 PolarHBondContact O-NE2 3.49Å; L236-Q281 VanDerWaalsContact O-NE2 3.15Å; L236-L282 HydrophobicContact CB-CB 4.41Å; L236-L282 HydrophobicContact CB-CD2 3.96Å; L236-L282 HydrophobicContact CB-CG 4.04Å; L236-L282 HydrophobicContact CD1-CD2 3.93Å; L236-L282 HydrophobicContact CD1-CG 4.22Å; L236-L282 PolarHBondContact N-O 2.87Å; L236-Q284 HydrophobicContact CD1-CB 3.77Å; L236-Q284 HydrophobicContact CD1-CG 4.37Å; L236-Q284 HydrophobicContact CG-CB 3.95Å
237	S	78.4	Confident	77.8	Confident	67 Å²	67	60.6 Å²	60.6	47%	0.469	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-83.4	132.3	173.5	-64.4	0	0	0	0	110.7	D241 S258	S237-D241 WeakPolarHBondContact CA-OD2 2.96Å; S237-S258 PolarHBondContact OG-OG 3.02Å
238	D	78.5	Confident	76.2	Confident	34 Å²	34	56.4 Å²	56.4	18%	0.182	29%	0.286	C	S	.	.			trans	-140.2	-168.7	173.9	84.5	-7.5	0	0	0	113.7	R188 L240 D241 E242	R188-D238 IonicContact CZ-OD2 3.86Å; R188-D238 IonicContact NH1-OD2 3.07Å; R188-D238 PolarHBondContact NH1-OD2 3.37Å; R188-D238 VanDerWaalsContact NH2-CG 3.29Å; R188-D238 IonicContact NH2-OD1 2.88Å; R188-D238 PolarHBondContact NH2-OD1 3.28Å; R188-D238 IonicContact NH2-OD2 3.45Å; R188-D238 PolarHBondContact NH2-OD2 3.03Å; D238-L240 PolarHBondContact O-N 3.12Å; D238-L240 VanDerWaalsContact O-N 3.14Å; D238-L240 WeakPolarHBondContact OD1-CB 3.43Å; D238-L240 PolarHBondContact OD1-N 3.5Å; D238-D241 PolarHBondContact N-OD2 3.46Å; D238-D241 WeakPolarHBondContact O-CB 3.09Å; D238-D241 PolarHBondContact O-N 3.19Å; D238-E242 PolarHBondContact O-N 2.79Å
239	E	72.7	Confident	74.1	Confident	75 Å²	75	53.1 Å²	53.1	35%	0.35	27%	0.272	S	S	.	.	H	α-helix	trans	-59.3	-24.5	-176	-59.5	-177.1	176.7	0	0	114	K157 I161	K157-E239 WeakPolarHBondContact CD-OE2 3.41Å; K157-E239 WeakPolarHBondContact CE-OE2 3.36Å; K157-E239 IonicContact NZ-OE1 2.96Å; K157-E239 PolarHBondContact NZ-OE1 3.23Å; K157-E239 IonicContact NZ-OE2 2.7Å; K157-E239 PolarHBondContact NZ-OE2 3.42Å; I161-E239 HydrophobicContact CD1-CB 4.29Å; I161-E239 WeakPolarHBondContact CD1-OE2 3.18Å
240	L	76.4	Confident	72	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-70.3	-41.8	173.6	-64.4	-172.6	0	0	0	110.7	A158 I161 L162 D238 E242 Y243 F244 V278 G280	A158-L240 HydrophobicContact CB-CD2 3.88Å; A158-L240 WeakPolarHBondContact O-CD2 3.45Å; I161-L240 HydrophobicContact CB-CD2 3.93Å; I161-L240 HydrophobicContact CG2-CD1 4.08Å; I161-L240 HydrophobicContact CG2-CD2 3.89Å; I161-L240 HydrophobicContact CG2-CG 4.02Å; L162-L240 HydrophobicContact CB-CD2 4.48Å; D238-L240 PolarHBondContact O-N 3.12Å; D238-L240 VanDerWaalsContact O-N 3.14Å; D238-L240 WeakPolarHBondContact OD1-CB 3.43Å; D238-L240 PolarHBondContact OD1-N 3.5Å; L240-E242 PolarHBondContact O-N 3.27Å; L240-Y243 PolarHBondContact O-N 3.38Å; L240-F244 HydrophobicContact CB-CD2 4.33Å; L240-F244 HydrophobicContact CD2-CE2 4.21Å; L240-F244 VanDerWaalsContact O-CD2 3.28Å; L240-F244 WeakPolarHBondContact O-CD2 3.47Å; L240-F244 PolarHBondContact O-N 3.26Å; L240-V278 HydrophobicContact CB-CG2 4.22Å; L240-G280 WeakPolarHBondContact CD1-O 3.22Å
241	D	69.9	Low	69.7	Low	7 Å²	7	56.2 Å²	56.2	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-46.3	-178.8	-63	-61.9	0	0	0	111.1	R235 S237 D238 Y243 F244 T245 Q281	R235-D241 IonicContact CZ-OD1 2.94Å; R235-D241 IonicContact NE-OD1 2.9Å; R235-D241 IonicContact NH2-OD1 4Å; R235-D241 PolarHBondContact NH2-OD1 3.45Å; S237-D241 WeakPolarHBondContact CA-OD2 2.96Å; D238-D241 PolarHBondContact N-OD2 3.46Å; D238-D241 WeakPolarHBondContact O-CB 3.09Å; D238-D241 PolarHBondContact O-N 3.19Å; D241-Y243 PolarHBondContact O-N 3.08Å; D241-F244 PolarHBondContact O-N 3.01Å; D241-T245 VanDerWaalsContact O-CB 3.25Å; D241-T245 WeakPolarHBondContact O-CB 3.15Å; D241-T245 WeakPolarHBondContact O-CG2 3.36Å; D241-T245 PolarHBondContact O-N 2.97Å; D241-T245 PolarHBondContact O-OG1 3.36Å; D241-Q281 VanDerWaalsContact CG-NE2 3.33Å; D241-Q281 VanDerWaalsContact OD1-CD 3.31Å; D241-Q281 PolarHBondContact OD1-NE2 3.19Å; D241-Q281 PolarHBondContact OD1-OE1 3.04Å; D241-Q281 PolarHBondContact OD2-NE2 2.83Å
242	E	68	Low	67.4	Low	102 Å²	102	62.1 Å²	62.1	48%	0.477	33%	0.33	S	S	.	.	H	α-helix	trans	-56.8	-37.4	178.5	-68.7	-171.3	179.3	0	0	112.7	R154 D238 L240 T246	R154-E242 IonicContact CZ-OE2 2.87Å; R154-E242 IonicContact NH1-OE2 2.63Å; R154-E242 PolarHBondContact NH1-OE2 3.4Å; D238-E242 PolarHBondContact O-N 2.79Å; L240-E242 PolarHBondContact O-N 3.27Å; E242-T246 WeakPolarHBondContact O-CG2 3.39Å; E242-T246 PolarHBondContact O-OG1 3.35Å
243	Y	69.5	Low	64.8	Low	45 Å²	45	69.5 Å²	69.5	18%	0.176	36%	0.364	C	S	.	.	H	α-helix	trans	-82	-44.8	-176.4	177.7	-104.1	0	0	0	113.2	A155 A158 L240 D241 T246 T247	A155-Y243 VanDerWaalsContact CA-CE2 3.41Å; A155-Y243 HydrophobicContact CB-CD2 3.78Å; A155-Y243 HydrophobicContact CB-CE2 3.12Å; A158-Y243 HydrophobicContact CB-CD1 3.82Å; A158-Y243 HydrophobicContact CB-CG 3.85Å; L240-Y243 PolarHBondContact O-N 3.38Å; D241-Y243 PolarHBondContact O-N 3.08Å; Y243-T246 PolarHBondContact O-OG1 3.43Å; Y243-T247 PolarHBondContact O-OG1 2.93Å
244	F	66.9	Low	62.5	Low	41 Å²	41	79.3 Å²	79.3	18%	0.18	41%	0.407	C	S	.	.	H	α-helix	trans	-80.8	-34.8	-175.2	-74.9	-70.5	0	0	0	112.4	L162 L240 D241 T246 T247 E248 V278	L162-F244 HydrophobicContact CD2-CE2 4.3Å; L162-F244 HydrophobicContact CD2-CZ 3.9Å; L240-F244 HydrophobicContact CB-CD2 4.33Å; L240-F244 HydrophobicContact CD2-CE2 4.21Å; L240-F244 VanDerWaalsContact O-CD2 3.28Å; L240-F244 WeakPolarHBondContact O-CD2 3.47Å; L240-F244 PolarHBondContact O-N 3.26Å; D241-F244 PolarHBondContact O-N 3.01Å; F244-T246 VanDerWaalsContact C-N 3.28Å; F244-T246 PolarHBondContact O-N 3.39Å; F244-T247 PolarHBondContact O-N 2.88Å; F244-T247 VanDerWaalsContact O-N 3.11Å; F244-E248 PolarHBondContact O-N 3.25Å; F244-E248 VanDerWaalsContact O-N 3.08Å; F244-V278 HydrophobicContact CB-CB 4.09Å; F244-V278 HydrophobicContact CB-CG1 3.48Å; F244-V278 VanDerWaalsContact CB-CG1 3.48Å; F244-V278 HydrophobicContact CD2-CB 4.31Å; F244-V278 HydrophobicContact CD2-CG2 4.39Å; F244-V278 HydrophobicContact CG-CB 4.37Å; F244-V278 HydrophobicContact CG-CG1 4.26Å
245	T	59.6	Low	60.4	Low	50 Å²	50	84.7 Å²	84.7	31%	0.307	44%	0.436	S	S	.	.	H	α-helix	trans	-64.7	-33.2	175.7	59.5	0	0	0	0	112.3	D241 T247 C249	D241-T245 VanDerWaalsContact O-CB 3.25Å; D241-T245 WeakPolarHBondContact O-CB 3.15Å; D241-T245 WeakPolarHBondContact O-CG2 3.36Å; D241-T245 PolarHBondContact O-N 2.97Å; D241-T245 PolarHBondContact O-OG1 3.36Å; T245-T247 VanDerWaalsContact C-N 3.27Å; T245-T247 PolarHBondContact O-N 3.09Å; T245-C249 WeakPolarHBondContact O-CB 3.37Å; T245-C249 PolarHBondContact O-N 3.09Å; T245-C249 VanDerWaalsContact O-N 3.15Å
246	T	54.2	Low	58.5	Low	96 Å²	96	87.7 Å²	87.7	59%	0.589	45%	0.452	S	S	*	.	H	α-helix	trans	-72.7	-18.7	175.6	50.9	0	0	0	0	113.7	E242 Y243 F244	E242-T246 WeakPolarHBondContact O-CG2 3.39Å; E242-T246 PolarHBondContact O-OG1 3.35Å; Y243-T246 PolarHBondContact O-OG1 3.43Å; F244-T246 VanDerWaalsContact C-N 3.28Å; F244-T246 PolarHBondContact O-N 3.39Å
247	T	53.5	Low	57	Low	84 Å²	84	89.3 Å²	89.3	52%	0.515	46%	0.463	S	S	.	.	H	α-helix	trans	-97.2	-32.8	-177.1	-50.8	0	0	0	0	112.7	Y243 F244 T245	Y243-T247 PolarHBondContact O-OG1 2.93Å; F244-T247 PolarHBondContact O-N 2.88Å; F244-T247 VanDerWaalsContact O-N 3.11Å; T245-T247 VanDerWaalsContact C-N 3.27Å; T245-T247 PolarHBondContact O-N 3.09Å
248	E	51.4	Low	56	Low	157 Å²	157	89.2 Å²	89.2	73%	0.734	46%	0.463	S	S	*	.	H	α-helix	trans	-116	-11.8	-172.1	-66.4	-177.2	166.6	0	0	114.4	F244	F244-E248 PolarHBondContact O-N 3.25Å; F244-E248 VanDerWaalsContact O-N 3.08Å
249	C	42.2	Very low	55.2	Low	44 Å²	44	92.5 Å²	92.5	30%	0.297	48%	0.48	S	S	.	.			trans	-123.7	72.4	-174.3	-142.7	0	0	0	0	111.9	T245 Q251	T245-C249 WeakPolarHBondContact O-CB 3.37Å; T245-C249 PolarHBondContact O-N 3.09Å; T245-C249 VanDerWaalsContact O-N 3.15Å; C249-Q251 PolarHBondContact O-N 3.08Å
250	S	41.1	Very low	55.2	Low	109 Å²	109	90.5 Å²	90.5	76%	0.762	48%	0.475	S	S	*	.	S	Bend	trans	-73.5	1.3	-175.4	-55.4	0	0	0	0	115.5
251	Q	42.8	Very low	55.7	Low	180 Å²	180	95.2 Å²	95.2	84%	0.841	50%	0.499	S	S	*	.	S	Bend	trans	-152.8	8.4	-168.2	-103	158.1	18.4	0	0	117.9	C249	C249-Q251 PolarHBondContact O-N 3.08Å
252	H	42.1	Very low	56.6	Low	143 Å²	143	95.3 Å²	95.3	66%	0.662	50%	0.5	S	S	*	.	S	Bend	trans	-112.2	106.5	169.7	-85	-20	0	0	0	112.1	K254 I256	H252-K254 PolarHBondContact O-N 3.05Å; H252-I256 HydrophobicContact CB-CD1 4.14Å
253	Q	38.7	Very low	57.7	Low	156 Å²	156	94.1 Å²	94.1	73%	0.729	50%	0.497	S	S	*	.			trans	-13.3	121	164.2	-147.2	144.7	-10.8	0	0	113.3	D255	Q253-D255 PolarHBondContact O-N 3.01Å
254	K	43.2	Very low	58.7	Low	206 Å²	206	94.5 Å²	94.5	90%	0.896	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	19.7	-178.3	-74.6	173.5	169.5	175.5	0	115.8	H252	H252-K254 PolarHBondContact O-N 3.05Å
255	D	45.4	Very low	59.9	Low	131 Å²	131	97 Å²	97	70%	0.701	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	6.7	-175.9	-68.3	-42.6	0	0	0	113.6	Q253 V257	Q253-D255 PolarHBondContact O-N 3.01Å; D255-V257 PolarHBondContact O-N 3.32Å
256	I	48.9	Very low	61.4	Low	78 Å²	78	96 Å²	96	40%	0.4	52%	0.519	S	S	.	.	S	Bend	trans	-82	73.7	-179.5	-55.4	177.9	0	0	0	110.4	H252	H252-I256 HydrophobicContact CB-CD1 4.14Å
257	V	53.2	Low	63.2	Low	70 Å²	70	92.9 Å²	92.9	42%	0.424	50%	0.501	S	S	.	.			trans	61.1	57	141.5	-125.9	0	0	0	0	118.4	D255 N259 S260	D255-V257 PolarHBondContact O-N 3.32Å; V257-N259 PolarHBondContact O-N 2.93Å; V257-S260 WeakPolarHBondContact CB-OG 3.17Å; V257-S260 WeakPolarHBondContact CG1-OG 3.26Å; V257-S260 PolarHBondContact O-OG 2.92Å
258	S	57.1	Low	65	Low	65 Å²	65	88.9 Å²	88.9	46%	0.455	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	128	150.8	-44.5	0	0	0	0	108.3	S237	S237-S258 PolarHBondContact OG-OG 3.02Å
259	N	62	Low	66.9	Low	104 Å²	104	87.6 Å²	87.6	56%	0.556	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	12.9	-179.8	-45.6	-33.5	0	0	0	118.4	R235 L236 V257	R235-N259 PolarHBondContact O-N 3.48Å; L236-N259 WeakPolarHBondContact CD2-OD1 3.4Å; V257-N259 PolarHBondContact O-N 2.93Å
260	S	74.1	Confident	69.2	Low	33 Å²	33	89.4 Å²	89.4	23%	0.231	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-76.7	151.7	163.5	47.3	0	0	0	0	112.4	I234 V257 L262	I234-S260 WeakPolarHBondContact CA-O 3.44Å; I234-S260 WeakPolarHBondContact CG2-O 3.48Å; V257-S260 WeakPolarHBondContact CB-OG 3.17Å; V257-S260 WeakPolarHBondContact CG1-OG 3.26Å; V257-S260 PolarHBondContact O-OG 2.92Å; S260-L262 PolarHBondContact O-N 3.13Å
261	L	85.9	Confident	71.4	Confident	98 Å²	98	84.4 Å²	84.4	51%	0.513	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-63.8	122.3	164	-172.2	63.9	0	0	0	109.8	L288	L261-L288 HydrophobicContact CD1-CD2 3.78Å; L261-L288 HydrophobicContact CD2-CD1 4.42Å; L261-L288 HydrophobicContact CD2-CD2 3.95Å
262	L	88.9	Confident	73.6	Confident	9 Å²	9	78.5 Å²	78.5	5%	0.047	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-80.6	144.9	179.1	-61.6	164.8	0	0	0	111	L212 L233 R235 S260 L264 F277 L283	L212-L262 HydrophobicContact CD1-CB 3.68Å; L212-L262 HydrophobicContact CD1-CD1 3.95Å; L212-L262 HydrophobicContact CD1-CG 4.34Å; L233-L262 HydrophobicContact CB-CB 4.49Å; L233-L262 HydrophobicContact CB-CD1 3.96Å; L233-L262 WeakPolarHBondContact O-CB 3.35Å; L233-L262 WeakPolarHBondContact O-CG 3.5Å; L233-L262 PolarHBondContact O-N 3.3Å; R235-L262 HydrophobicContact CB-CD1 4.43Å; S260-L262 PolarHBondContact O-N 3.13Å; L262-L264 PolarHBondContact O-N 3.11Å; L262-F277 HydrophobicContact CD1-CE2 4.32Å; L262-F277 HydrophobicContact CD1-CZ 3.6Å; L262-F277 HydrophobicContact CD2-CE1 3.95Å; L262-F277 HydrophobicContact CD2-CZ 3.61Å; L262-F277 HydrophobicContact CG-CZ 4.23Å; L262-L283 HydrophobicContact CD1-CD2 3.82Å
263	D	90.1	Very high	75.7	Confident	78 Å²	78	76.5 Å²	76.5	42%	0.417	41%	0.411	S	S	.	.			trans	-68.1	111.7	171.8	173.6	21.5	0	0	0	110.8	S265 S266 H271	D263-S265 VanDerWaalsContact CG-OG 3.25Å; D263-S265 PolarHBondContact O-N 3.43Å; D263-S265 WeakPolarHBondContact OD1-CB 3.35Å; D263-S265 PolarHBondContact OD1-N 3.33Å; D263-S265 PolarHBondContact OD1-OG 3.3Å; D263-S265 PolarHBondContact OD2-OG 3Å; D263-S266 PolarHBondContact O-N 2.82Å; D263-S266 WeakPolarHBondContact OD2-CB 3.28Å; D263-S266 PolarHBondContact OD2-N 3.31Å; D263-S266 PolarHBondContact OD2-OG 3.18Å; D263-H271 PolarHBondContact O-NE2 2.73Å; D263-H271 VanDerWaalsContact O-NE2 3.09Å
264	L	91.1	Very high	77.8	Confident	52 Å²	52	73.2 Å²	73.2	27%	0.272	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-17.2	-177.9	-61	177.8	0	0	0	113.4	L212 G213 L216 L233 L262	L212-L264 HydrophobicContact CB-CD2 4.22Å; L212-L264 PolarHBondContact N-O 3.42Å; G213-L264 PolarHBondContact N-O 3.48Å; L216-L264 HydrophobicContact CB-CD2 4.4Å; L216-L264 HydrophobicContact CD2-CD1 3.56Å; L216-L264 HydrophobicContact CD2-CD2 4.1Å; L233-L264 HydrophobicContact CB-CD2 4.25Å; L233-L264 HydrophobicContact CD1-CD2 4.01Å; L233-L264 HydrophobicContact CG-CD2 4.14Å; L262-L264 PolarHBondContact O-N 3.11Å
265	S	92.1	Very high	79.6	Confident	93 Å²	93	65.2 Å²	65.2	65%	0.65	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-23.5	179.7	73.8	0	0	0	0	113	D263	D263-S265 VanDerWaalsContact CG-OG 3.25Å; D263-S265 PolarHBondContact O-N 3.43Å; D263-S265 WeakPolarHBondContact OD1-CB 3.35Å; D263-S265 PolarHBondContact OD1-N 3.33Å; D263-S265 PolarHBondContact OD1-OG 3.3Å; D263-S265 PolarHBondContact OD2-OG 3Å
266	S	91.3	Very high	81.3	Confident	29 Å²	29	60.6 Å²	60.6	20%	0.203	34%	0.343	C	S	.	.	S	Bend	trans	-77.7	143.6	-177.9	-79	0	0	0	0	112.4	P211 L212 D263 H271	P211-S266 WeakPolarHBondContact CA-O 3.19Å; L212-S266 PolarHBondContact N-O 2.77Å; D263-S266 PolarHBondContact O-N 2.82Å; D263-S266 WeakPolarHBondContact OD2-CB 3.28Å; D263-S266 PolarHBondContact OD2-N 3.31Å; D263-S266 PolarHBondContact OD2-OG 3.18Å; S266-H271 VanDerWaalsContact CB-NE2 3.26Å; S266-H271 WeakPolarHBondContact CB-NE2 3.46Å
267	S	93	Very high	83.1	Confident	31 Å²	31	57.1 Å²	57.1	22%	0.217	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-75.9	155.9	-179.5	73.7	0	0	0	0	112.6	R209 W210 K269 Q270 H271	R209-S267 WeakPolarHBondContact O-CB 3.27Å; W210-S267 CarbonylContact O-C 3.54Å; W210-S267 VanDerWaalsContact O-CA 3.25Å; W210-S267 WeakPolarHBondContact O-CA 3.41Å; S267-K269 PolarHBondContact O-N 3.35Å; S267-Q270 WeakPolarHBondContact O-CA 3.39Å; S267-Q270 VanDerWaalsContact O-CB 3.28Å; S267-Q270 WeakPolarHBondContact O-CB 3.16Å; S267-Q270 PolarHBondContact O-N 3.39Å; S267-Q270 PolarHBondContact OG-N 3.36Å; S267-H271 PolarHBondContact O-CD2 3.32Å; S267-H271 PolarHBondContact O-N 2.97Å
268	L	91.5	Very high	84.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-53.2	-43.1	173.8	-80	168.9	0	0	0	112.8	F185 I187 F206 K208 W210 L212 I215 Q270 H271 V272 F277	F185-L268 HydrophobicContact CB-CD1 4.06Å; F185-L268 HydrophobicContact CD1-CD1 3.93Å; F185-L268 HydrophobicContact CD1-CD2 4.03Å; F185-L268 HydrophobicContact CD1-CG 4.4Å; F185-L268 HydrophobicContact CE1-CD2 4.18Å; F185-L268 HydrophobicContact CG-CD1 4.26Å; I187-L268 HydrophobicContact CD1-CD1 3.86Å; I187-L268 HydrophobicContact CD1-CD2 3.4Å; I187-L268 HydrophobicContact CD1-CG 4.25Å; I187-L268 HydrophobicContact CG1-CD2 4.47Å; F206-L268 HydrophobicContact CB-CD1 3.98Å; K208-L268 WeakPolarHBondContact O-CB 3.27Å; W210-L268 PolarHBondContact O-N 3.46Å; L212-L268 HydrophobicContact CD2-CD2 3.46Å; L212-L268 VanDerWaalsContact CD2-CD2 3.46Å; L212-L268 HydrophobicContact CD2-CG 4.07Å; I215-L268 HydrophobicContact CD1-CD1 3.64Å; I215-L268 HydrophobicContact CD1-CD2 3.72Å; I215-L268 HydrophobicContact CD1-CG 3.73Å; L268-Q270 PolarHBondContact O-N 3.49Å; L268-H271 PolarHBondContact O-N 3.38Å; L268-H271 VanDerWaalsContact O-N 3.14Å; L268-V272 VanDerWaalsContact O-CG2 3.31Å; L268-V272 WeakPolarHBondContact O-CG2 3.46Å; L268-V272 PolarHBondContact O-N 3.45Å; L268-F277 HydrophobicContact CD2-CD2 4.39Å
269	K	91	Very high	86.4	Confident	131 Å²	131	54.1 Å²	54.1	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-58.6	-36.6	175.6	-174	179.6	179.9	-174.3	0	111.7	K208 S267 V272 V273	K208-K269 VanDerWaalsContact O-CB 3.26Å; K208-K269 WeakPolarHBondContact O-CB 3.21Å; K208-K269 PolarHBondContact O-N 3.08Å; S267-K269 PolarHBondContact O-N 3.35Å; K269-V272 PolarHBondContact O-N 2.68Å; K269-V273 WeakPolarHBondContact O-CG2 3.25Å; K269-V273 PolarHBondContact O-N 3.48Å
270	Q	90.1	Very high	87.7	Confident	82 Å²	82	49.2 Å²	49.2	38%	0.383	27%	0.274	S	S	.	.	H	α-helix	trans	-69	-44.1	175.9	-164.7	61.9	32.9	0	0	111	S267 L268 V272 V273 D274	S267-Q270 WeakPolarHBondContact O-CA 3.39Å; S267-Q270 VanDerWaalsContact O-CB 3.28Å; S267-Q270 WeakPolarHBondContact O-CB 3.16Å; S267-Q270 PolarHBondContact O-N 3.39Å; S267-Q270 PolarHBondContact OG-N 3.36Å; L268-Q270 PolarHBondContact O-N 3.49Å; Q270-V272 VanDerWaalsContact C-N 3.3Å; Q270-V272 PolarHBondContact O-N 3.27Å; Q270-V273 PolarHBondContact O-N 3.11Å; Q270-D274 VanDerWaalsContact CG-OD2 3.3Å; Q270-D274 WeakPolarHBondContact CG-OD2 3.44Å; Q270-D274 PolarHBondContact NE2-OD1 3.48Å; Q270-D274 PolarHBondContact NE2-OD2 3.4Å; Q270-D274 PolarHBondContact O-N 3.08Å
271	H	87.4	Confident	88.5	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-28.5	175	-74.4	-79.7	0	0	0	114	L212 D263 S266 S267 L268 V273 N275 C276 F277	L212-H271 VanDerWaalsContact CD1-CD2 3.41Å; L212-H271 WeakPolarHBondContact CD1-CD2 3.41Å; L212-H271 WeakPolarHBondContact CD1-NE2 3.45Å; D263-H271 PolarHBondContact O-NE2 2.73Å; D263-H271 VanDerWaalsContact O-NE2 3.09Å; S266-H271 VanDerWaalsContact CB-NE2 3.26Å; S266-H271 WeakPolarHBondContact CB-NE2 3.46Å; S267-H271 PolarHBondContact O-CD2 3.32Å; S267-H271 PolarHBondContact O-N 2.97Å; L268-H271 PolarHBondContact O-N 3.38Å; L268-H271 VanDerWaalsContact O-N 3.14Å; H271-V273 VanDerWaalsContact C-N 3.29Å; H271-N275 PolarHBondContact ND1-ND2 3.45Å; H271-N275 CarbonylContact O-C 3.54Å; H271-N275 VanDerWaalsContact O-C 3.31Å; H271-N275 VanDerWaalsContact O-CA 3.3Å; H271-N275 WeakPolarHBondContact O-CA 3.34Å; H271-N275 WeakPolarHBondContact O-CB 3.19Å; H271-N275 PolarHBondContact O-N 3.08Å; H271-C276 PolarHBondContact O-N 2.75Å; H271-C276 VanDerWaalsContact O-N 3.13Å; H271-F277 HydrophobicContact CB-CD1 4.09Å; H271-F277 HydrophobicContact CB-CD2 3.66Å; H271-F277 HydrophobicContact CB-CE1 4.18Å; H271-F277 HydrophobicContact CB-CE2 3.76Å; H271-F277 HydrophobicContact CB-CG 3.83Å; H271-F277 HydrophobicContact CB-CZ 4.02Å; H271-F277 PolarHBondContact O-N 3.28Å
272	V	87.8	Confident	88.7	Confident	56 Å²	56	44.1 Å²	44.1	34%	0.339	24%	0.244	S	C	.	.	H	α-helix	trans	-61.9	-39.9	170.4	172.3	0	0	0	0	110.7	F185 L268 K269 Q270 C276 F277	F185-V272 HydrophobicContact CD2-CG2 4.43Å; F185-V272 HydrophobicContact CE2-CG2 3.52Å; F185-V272 HydrophobicContact CZ-CG2 3.7Å; L268-V272 VanDerWaalsContact O-CG2 3.31Å; L268-V272 WeakPolarHBondContact O-CG2 3.46Å; L268-V272 PolarHBondContact O-N 3.45Å; K269-V272 PolarHBondContact O-N 2.68Å; Q270-V272 VanDerWaalsContact C-N 3.3Å; Q270-V272 PolarHBondContact O-N 3.27Å; V272-C276 VanDerWaalsContact O-CA 3.27Å; V272-C276 WeakPolarHBondContact O-CA 3.41Å; V272-C276 PolarHBondContact O-N 3.33Å; V272-F277 HydrophobicContact CG2-CB 4.01Å
273	V	86.9	Confident	88.9	Confident	100 Å²	100	43.7 Å²	43.7	61%	0.606	24%	0.242	S	C	*	.	H	α-helix	trans	-78.4	-54.2	179.9	177.6	0	0	0	0	111.5	K269 Q270 H271	K269-V273 WeakPolarHBondContact O-CG2 3.25Å; K269-V273 PolarHBondContact O-N 3.48Å; Q270-V273 PolarHBondContact O-N 3.11Å; H271-V273 VanDerWaalsContact C-N 3.29Å
274	D	83.9	Confident	89	Confident	87 Å²	87	41.2 Å²	41.2	47%	0.465	23%	0.228	S	C	.	.	H	α-helix	trans	-80.8	-36.3	-169	-63.9	-10.4	0	0	0	112.3	Q270	Q270-D274 VanDerWaalsContact CG-OD2 3.3Å; Q270-D274 WeakPolarHBondContact CG-OD2 3.44Å; Q270-D274 PolarHBondContact NE2-OD1 3.48Å; Q270-D274 PolarHBondContact NE2-OD2 3.4Å; Q270-D274 PolarHBondContact O-N 3.08Å
275	N	80	Confident	89	Confident	38 Å²	38	38.7 Å²	38.7	20%	0.203	22%	0.215	C	C	.	.	S	Bend	trans	-110.3	1.5	-175.4	-62.5	-80.9	0	0	0	112.1	R235 H271 F277	R235-N275 PolarHBondContact NH1-O 2.86Å; H271-N275 PolarHBondContact ND1-ND2 3.45Å; H271-N275 CarbonylContact O-C 3.54Å; H271-N275 VanDerWaalsContact O-C 3.31Å; H271-N275 VanDerWaalsContact O-CA 3.3Å; H271-N275 WeakPolarHBondContact O-CA 3.34Å; H271-N275 WeakPolarHBondContact O-CB 3.19Å; H271-N275 PolarHBondContact O-N 3.08Å; N275-F277 HydrophobicContact CB-CD1 3.79Å; N275-F277 HydrophobicContact CB-CE1 3.72Å; N275-F277 PolarHBondContact O-N 3.33Å
276	C	81.6	Confident	88.9	Confident	34 Å²	34	35 Å²	35	23%	0.23	19%	0.188	C	C	.	.			trans	57.3	42.3	-177.8	-57.1	0	0	0	0	113.5	R235 H271 V272	R235-C276 PolarHBondContact NH1-O 3.28Å; R235-C276 PolarHBondContact NH2-O 2.88Å; H271-C276 PolarHBondContact O-N 2.75Å; H271-C276 VanDerWaalsContact O-N 3.13Å; V272-C276 VanDerWaalsContact O-CA 3.27Å; V272-C276 WeakPolarHBondContact O-CA 3.41Å; V272-C276 PolarHBondContact O-N 3.33Å
277	F	87.2	Confident	88.8	Confident	6 Å²	6	35.9 Å²	35.9	3%	0.026	19%	0.194	C	C	.	.			trans	-65.3	137.3	172.9	-82	24	0	0	0	110.9	F185 L212 R235 L262 L268 H271 V272 N275 Q281 L283	F185-F277 HydrophobicContact CZ-CB 4.44Å; L212-F277 HydrophobicContact CD1-CE2 4.42Å; L212-F277 HydrophobicContact CD2-CE2 4.39Å; R235-F277 HydrophobicContact CB-CE1 4.27Å; R235-F277 HydrophobicContact CB-CZ 4.46Å; R235-F277 HydrophobicContact CG-CE1 4.32Å; L262-F277 HydrophobicContact CD1-CE2 4.32Å; L262-F277 HydrophobicContact CD1-CZ 3.6Å; L262-F277 HydrophobicContact CD2-CE1 3.95Å; L262-F277 HydrophobicContact CD2-CZ 3.61Å; L262-F277 HydrophobicContact CG-CZ 4.23Å; L268-F277 HydrophobicContact CD2-CD2 4.39Å; H271-F277 HydrophobicContact CB-CD1 4.09Å; H271-F277 HydrophobicContact CB-CD2 3.66Å; H271-F277 HydrophobicContact CB-CE1 4.18Å; H271-F277 HydrophobicContact CB-CE2 3.76Å; H271-F277 HydrophobicContact CB-CG 3.83Å; H271-F277 HydrophobicContact CB-CZ 4.02Å; H271-F277 PolarHBondContact O-N 3.28Å; V272-F277 HydrophobicContact CG2-CB 4.01Å; N275-F277 HydrophobicContact CB-CD1 3.79Å; N275-F277 HydrophobicContact CB-CE1 3.72Å; N275-F277 PolarHBondContact O-N 3.33Å; F277-Q281 HydrophobicContact CD2-CG 4.44Å; F277-Q281 HydrophobicContact CG-CG 4.39Å; F277-L283 HydrophobicContact CE2-CD1 4.25Å; F277-L283 HydrophobicContact CE2-CD2 3.85Å; F277-L283 HydrophobicContact CZ-CD2 3.9Å
278	V	87.9	Confident	88.5	Confident	14 Å²	14	36.7 Å²	36.7	9%	0.085	20%	0.196	C	C	.	.			trans	-108.4	155.4	177.7	-58.9	0	0	0	0	110.3	L240 F244 G280 Q281	L240-V278 HydrophobicContact CB-CG2 4.22Å; F244-V278 HydrophobicContact CB-CB 4.09Å; F244-V278 HydrophobicContact CB-CG1 3.48Å; F244-V278 VanDerWaalsContact CB-CG1 3.48Å; F244-V278 HydrophobicContact CD2-CB 4.31Å; F244-V278 HydrophobicContact CD2-CG2 4.39Å; F244-V278 HydrophobicContact CG-CB 4.37Å; F244-V278 HydrophobicContact CG-CG1 4.26Å; V278-G280 PolarHBondContact O-N 2.89Å; V278-Q281 VanDerWaalsContact O-CB 3.3Å; V278-Q281 WeakPolarHBondContact O-CB 3.46Å; V278-Q281 PolarHBondContact O-N 2.8Å
279	E	89.8	Confident	87.8	Confident	58 Å²	58	41.9 Å²	41.9	27%	0.271	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	132.9	175.6	-162	174.3	-175.8	0	0	109.7	L162 K166 V186	L162-E279 HydrophobicContact CD1-CB 4.09Å; L162-E279 HydrophobicContact CD1-CG 4.05Å; L162-E279 WeakPolarHBondContact CD1-O 3.41Å; K166-E279 WeakPolarHBondContact CE-OE1 3.32Å; K166-E279 WeakPolarHBondContact CE-OE2 3.48Å; K166-E279 IonicContact NZ-OE1 3.22Å; K166-E279 PolarHBondContact NZ-OE1 3.13Å; K166-E279 IonicContact NZ-OE2 3.47Å; K166-E279 PolarHBondContact NZ-OE2 3.2Å; V186-E279 HydrophobicContact CB-CG 4.19Å
280	G	90.5	Very high	86.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	11.2	-169.9	0	0	0	0	0	114.4	V186 R188 L240 V278 L282	V186-G280 WeakPolarHBondContact O-CA 3.33Å; V186-G280 PolarHBondContact O-N 2.94Å; R188-G280 VanDerWaalsContact CZ-O 3.3Å; R188-G280 PolarHBondContact NE-O 2.86Å; R188-G280 PolarHBondContact NH2-O 2.97Å; L240-G280 WeakPolarHBondContact CD1-O 3.22Å; V278-G280 PolarHBondContact O-N 2.89Å; G280-L282 PolarHBondContact O-N 3.45Å
281	Q	90.5	Very high	84.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-47	135.9	176.4	-170.2	64.9	58.5	0	0	111.7	I187 R188 R235 L236 D241 F277 V278 L283	I187-Q281 WeakPolarHBondContact CG2-O 3.47Å; R188-Q281 PolarHBondContact N-O 2.91Å; R235-Q281 HydrophobicContact CG-CG 4.08Å; R235-Q281 VanDerWaalsContact CZ-OE1 3.24Å; L236-Q281 PolarHBondContact O-NE2 3.49Å; L236-Q281 VanDerWaalsContact O-NE2 3.15Å; D241-Q281 VanDerWaalsContact CG-NE2 3.33Å; D241-Q281 VanDerWaalsContact OD1-CD 3.31Å; D241-Q281 PolarHBondContact OD1-NE2 3.19Å; D241-Q281 PolarHBondContact OD1-OE1 3.04Å; D241-Q281 PolarHBondContact OD2-NE2 2.83Å; F277-Q281 HydrophobicContact CD2-CG 4.44Å; F277-Q281 HydrophobicContact CG-CG 4.39Å; V278-Q281 VanDerWaalsContact O-CB 3.3Å; V278-Q281 WeakPolarHBondContact O-CB 3.46Å; V278-Q281 PolarHBondContact O-N 2.8Å; Q281-L283 HydrophobicContact CG-CD2 3.93Å
282	L	91.2	Very high	84.7	Confident	24 Å²	24	49.5 Å²	49.5	13%	0.126	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	115.5	170.7	-177.9	59.6	0	0	0	110.4	R188 M201 L236 G280	R188-L282 HydrophobicContact CB-CD1 3.85Å; R188-L282 WeakPolarHBondContact O-CA 3.29Å; M201-L282 HydrophobicContact CG-CD1 4.38Å; M201-L282 HydrophobicContact SD-CD1 4.01Å; L236-L282 HydrophobicContact CB-CB 4.41Å; L236-L282 HydrophobicContact CB-CD2 3.96Å; L236-L282 HydrophobicContact CB-CG 4.04Å; L236-L282 HydrophobicContact CD1-CD2 3.93Å; L236-L282 HydrophobicContact CD1-CG 4.22Å; L236-L282 PolarHBondContact N-O 2.87Å; G280-L282 PolarHBondContact O-N 3.45Å
283	L	92.1	Very high	84.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.3	170.5	-58.4	-173.9	0	0	0	109.7	I187 R188 L189 S190 L212 L233 I234 R235 L262 F277 Q281	I187-L283 HydrophobicContact CD1-CD1 4.24Å; I187-L283 HydrophobicContact CG2-CB 4.22Å; I187-L283 HydrophobicContact CG2-CD1 3.83Å; I187-L283 HydrophobicContact CG2-CG 3.8Å; R188-L283 PolarHBondContact O-N 3.08Å; L189-L283 WeakPolarHBondContact CA-O 3.41Å; L189-L283 HydrophobicContact CD1-CB 4.09Å; S190-L283 PolarHBondContact N-O 3.49Å; S190-L283 PolarHBondContact OG-O 2.59Å; L212-L283 HydrophobicContact CD2-CD1 4.38Å; L233-L283 HydrophobicContact CD1-CD1 4.44Å; L233-L283 HydrophobicContact CD2-CB 4.49Å; I234-L283 WeakPolarHBondContact O-CA 3.28Å; R235-L283 HydrophobicContact CB-CD2 4.2Å; R235-L283 HydrophobicContact CG-CD2 4.48Å; L262-L283 HydrophobicContact CD1-CD2 3.82Å; F277-L283 HydrophobicContact CE2-CD1 4.25Å; F277-L283 HydrophobicContact CE2-CD2 3.85Å; F277-L283 HydrophobicContact CZ-CD2 3.9Å; Q281-L283 HydrophobicContact CG-CD2 3.93Å
284	Q	91.3	Very high	84.4	Confident	26 Å²	26	46.3 Å²	46.3	12%	0.121	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.6	176.6	-172.6	173	57.5	0	0	110.5	S190 M192 L233 I234 L236	S190-Q284 CarbonylContact O-C 3.54Å; S190-Q284 WeakPolarHBondContact O-CA 3.34Å; S190-Q284 WeakPolarHBondContact OG-CB 3.39Å; M192-Q284 VanDerWaalsContact CG-CD 3.48Å; M192-Q284 HydrophobicContact CG-CG 3.76Å; L233-Q284 WeakPolarHBondContact CA-O 3.15Å; I234-Q284 HydrophobicContact CD1-CB 4.4Å; I234-Q284 HydrophobicContact CG1-CB 3.88Å; I234-Q284 PolarHBondContact N-O 2.8Å; I234-Q284 PolarHBondContact O-N 2.92Å; L236-Q284 HydrophobicContact CD1-CB 3.77Å; L236-Q284 HydrophobicContact CD1-CG 4.37Å; L236-Q284 HydrophobicContact CG-CB 3.95Å
285	I	92.1	Very high	84.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	120.6	172.9	-60.5	169.5	0	0	0	108.4	L189 S190 V191 M192 L216 F223 L225 Y231 G232 L233	L189-I285 HydrophobicContact CD1-CD1 4.12Å; L189-I285 HydrophobicContact CD1-CG1 3.93Å; L189-I285 HydrophobicContact CD2-CD1 3.98Å; L189-I285 HydrophobicContact CG-CD1 4.01Å; L189-I285 HydrophobicContact CG-CG1 4.32Å; S190-I285 PolarHBondContact O-N 3.21Å; V191-I285 HydrophobicContact CG2-CB 4.45Å; V191-I285 HydrophobicContact CG2-CD1 4.23Å; M192-I285 PolarHBondContact N-O 2.98Å; L216-I285 HydrophobicContact CD1-CB 4.46Å; L216-I285 HydrophobicContact CD1-CD1 4.39Å; L216-I285 HydrophobicContact CD1-CG1 4Å; L216-I285 HydrophobicContact CD1-CG2 3.78Å; F223-I285 HydrophobicContact CD2-CD1 4.07Å; F223-I285 HydrophobicContact CE2-CD1 4.31Å; L225-I285 HydrophobicContact CD1-CD1 4.33Å; L225-I285 HydrophobicContact CD1-CG2 3.73Å; Y231-I285 HydrophobicContact CD1-CG2 3.89Å; Y231-I285 HydrophobicContact CG-CG2 4.11Å; G232-I285 WeakPolarHBondContact O-CA 3.42Å; L233-I285 HydrophobicContact CD2-CB 4.49Å; L233-I285 HydrophobicContact CD2-CG1 3.61Å
286	V	90.4	Very high	84.7	Confident	14 Å²	14	44.3 Å²	44.3	9%	0.085	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.8	179.6	-51.7	0	0	0	0	109.9	M192 Y231 G232 I234 L288	M192-V286 HydrophobicContact CG-CB 4.24Å; M192-V286 HydrophobicContact CG-CG1 3.74Å; M192-V286 HydrophobicContact SD-CB 3.86Å; M192-V286 HydrophobicContact SD-CG1 3.54Å; M192-V286 VanDerWaalsContact SD-CG1 3.54Å; Y231-V286 CarbonylContact C-O 3.53Å; Y231-V286 VanDerWaalsContact CA-O 3.23Å; Y231-V286 WeakPolarHBondContact CA-O 3.49Å; G232-V286 PolarHBondContact N-O 2.61Å; G232-V286 PolarHBondContact O-N 3.04Å; I234-V286 HydrophobicContact CB-CG1 4.26Å; I234-V286 HydrophobicContact CD1-CG1 3.62Å; I234-V286 HydrophobicContact CG1-CG1 3.62Å; I234-V286 HydrophobicContact CG2-CG1 3.74Å; I234-V286 HydrophobicContact CG2-CG2 4.01Å; V286-L288 HydrophobicContact CG2-CD2 4.27Å
287	C	88.6	Confident	84.9	Confident	49 Å²	49	45 Å²	45	33%	0.331	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.8	168.8	-172.6	0	0	0	0	109.1	V195 Y231	V195-C287 HydrophobicContact CG2-CB 3.86Å; Y231-C287 HydrophobicContact CD1-CB 4.37Å; Y231-C287 HydrophobicContact CE1-CB 4.31Å
288	L	86	Confident	84.7	Confident	48 Å²	48	47.8 Å²	47.8	25%	0.251	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-84.4	142.3	174.4	-61.4	175.9	0	0	0	109.7	K230 L261 V286 Q290	K230-L288 HydrophobicContact CB-CB 4.18Å; K230-L288 HydrophobicContact CB-CD1 4.45Å; K230-L288 PolarHBondContact O-N 3.15Å; L261-L288 HydrophobicContact CD1-CD2 3.78Å; L261-L288 HydrophobicContact CD2-CD1 4.42Å; L261-L288 HydrophobicContact CD2-CD2 3.95Å; V286-L288 HydrophobicContact CG2-CD2 4.27Å; L288-Q290 PolarHBondContact O-N 3.47Å
289	P	77.8	Confident	84.5	Confident	109 Å²	109	50.4 Å²	50.4	71%	0.708	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-61.4	133	172.5	25.3	-31.7	0	0	0	109.6	T291	P289-T291 PolarHBondContact O-N 2.82Å; P289-T291 VanDerWaalsContact O-N 3.11Å
290	Q	67.4	Low	84	Confident	136 Å²	136	49.8 Å²	49.8	64%	0.636	29%	0.286	S	S	*	.			trans	-71.8	102.8	169.7	-68.3	-178.8	-3.6	0	0	107.5	D228 L288	D228-Q290 PolarHBondContact O-NE2 3Å; D228-Q290 VanDerWaalsContact O-NE2 3.08Å; L288-Q290 PolarHBondContact O-N 3.47Å
291	T	50.1	Low	83.4	Confident	191 Å²	191	54.3 Å²	54.3	100%	1.172	31%	0.312	S	S	*	.			trans	-70.5	0	164.6	54.9	0	0	0	0	110.7	P289	P289-T291 PolarHBondContact O-N 2.82Å; P289-T291 VanDerWaalsContact O-N 3.11Å

Retrieved 291 of 291 residues in 604.7 ms (Link to these results)

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