A0A3Q0KSI1_SCHMA Loading...

Putative sorting and assembly machinery (Sam50) protein

AlphaFold DB , UniProt , Accession A0A3Q0KSI1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 507 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	39.9	Very low	55.5	Low	214 Å²	214	117.8 Å²	117.8	100%	1.054	61%	0.61	S	S	*	*				0	137.7	0	-76.5	-69.5	-179.7	0	0	108.2
2	P	39.1	Very low	57.8	Low	96 Å²	96	113.4 Å²	113.4	62%	0.623	59%	0.587	S	S	*	*			trans	-70.1	148.3	-176.9	25.7	-30.6	0	0	0	113.1	D4 T5	P2-D4 VanDerWaalsContact C-N 3.33Å; P2-D4 PolarHBondContact O-N 3.41Å; P2-T5 PolarHBondContact O-OG1 2.87Å
3	T	50.1	Low	60	Low	102 Å²	102	109.5 Å²	109.5	63%	0.626	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-63.1	-24.7	-164.8	42	0	0	0	0	115.9	T5 Y6	T3-T5 VanDerWaalsContact C-N 3.25Å; T3-T5 PolarHBondContact O-N 3.41Å; T3-Y6 WeakPolarHBondContact O-CB 3.38Å; T3-Y6 PolarHBondContact O-N 2.75Å
4	D	50.7	Low	61.9	Low	137 Å²	137	101.7 Å²	101.7	73%	0.733	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-73.4	-15.1	-171.7	-62.3	-19	0	0	0	114	P2	P2-D4 VanDerWaalsContact C-N 3.33Å; P2-D4 PolarHBondContact O-N 3.41Å
5	T	54.3	Low	63.7	Low	93 Å²	93	99.5 Å²	99.5	57%	0.571	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-81.7	-9.8	174.3	40.6	0	0	0	0	114	P2 T3 Y7	P2-T5 PolarHBondContact O-OG1 2.87Å; T3-T5 VanDerWaalsContact C-N 3.25Å; T3-T5 PolarHBondContact O-N 3.41Å; T5-Y7 PolarHBondContact O-N 2.98Å
6	Y	51.3	Low	65.3	Low	113 Å²	113	94.9 Å²	94.9	44%	0.443	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-69.3	-32.2	-177.3	-92.1	-90.2	0	0	0	114	T3 N8 L9	T3-Y6 WeakPolarHBondContact O-CB 3.38Å; T3-Y6 PolarHBondContact O-N 2.75Å; Y6-N8 PolarHBondContact O-N 2.64Å; Y6-N8 VanDerWaalsContact O-N 3.12Å; Y6-L9 PolarHBondContact O-N 2.86Å
7	Y	55.8	Low	66.7	Low	201 Å²	201	92.5 Å²	92.5	79%	0.788	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-66	-19.6	-169.9	-75	-75.7	0	0	0	114.3	T5	T5-Y7 PolarHBondContact O-N 2.98Å
8	N	66.2	Low	68.1	Low	120 Å²	120	92.5 Å²	92.5	64%	0.642	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-103	1.4	-179.4	-119.7	-16.3	0	0	0	114.2	Y6 S11 I12	Y6-N8 PolarHBondContact O-N 2.64Å; Y6-N8 VanDerWaalsContact O-N 3.12Å; N8-S11 PolarHBondContact O-OG 3.07Å; N8-S11 PolarHBondContact OD1-OG 2.83Å; N8-I12 WeakPolarHBondContact O-CD1 3.46Å; N8-I12 WeakPolarHBondContact O-CG1 3.18Å
9	L	64	Low	69.4	Low	44 Å²	44	89.8 Å²	89.8	23%	0.23	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-19.1	177	-69	171.4	0	0	0	112.8	Y6 L45 R46	Y6-L9 PolarHBondContact O-N 2.86Å; L9-L45 HydrophobicContact CD2-CD2 3.54Å; L9-L45 HydrophobicContact CD2-CG 4.05Å; L9-R46 HydrophobicContact CB-CB 4.3Å
10	E	66.9	Low	70.6	Confident	101 Å²	101	87.5 Å²	87.5	47%	0.472	46%	0.463	S	S	.	.	S	Bend	trans	-76.2	-26.7	176.7	-64.8	-174.1	168.7	0	0	112.5	R46	E10-R46 IonicContact OE1-CZ 3.22Å; E10-R46 IonicContact OE1-NH1 3.33Å; E10-R46 PolarHBondContact OE1-NH1 3.2Å
11	S	72.7	Confident	71.7	Confident	75 Å²	75	85.1 Å²	85.1	52%	0.524	45%	0.452	S	S	.	.	S	Bend	trans	-81.9	-13.1	-179.8	55	0	0	0	0	113.5	N8 P13	N8-S11 PolarHBondContact O-OG 3.07Å; N8-S11 PolarHBondContact OD1-OG 2.83Å; S11-P13 WeakPolarHBondContact O-CD 3.36Å
12	I	82.9	Confident	74.2	Confident	65 Å²	65	77.9 Å²	77.9	33%	0.333	42%	0.423	S	S	.	.	S	Bend	trans	-93.2	110	-178.6	-57.9	169.2	0	0	0	109.1	N8 L45	N8-I12 WeakPolarHBondContact O-CD1 3.46Å; N8-I12 WeakPolarHBondContact O-CG1 3.18Å; I12-L45 HydrophobicContact CB-CB 4.25Å; I12-L45 HydrophobicContact CB-CD2 4.44Å; I12-L45 HydrophobicContact CD1-CD2 4.19Å; I12-L45 HydrophobicContact CG2-CB 4.35Å; I12-L45 HydrophobicContact CG2-CD2 4.24Å; I12-L45 PolarHBondContact O-N 3.24Å; I12-L45 VanDerWaalsContact O-N 3.09Å
13	P	86.1	Confident	76.6	Confident	63 Å²	63	74.9 Å²	74.9	41%	0.409	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-64.3	139	171.9	28.5	-33.4	0	0	0	109.5	S11	S11-P13 WeakPolarHBondContact O-CD 3.36Å
14	A	86	Confident	78.5	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.389	C	S	.	.			trans	-143.3	128.4	178	0	0	0	0	0	109.8	Q43 L45 L48 Y84	A14-Q43 PolarHBondContact N-O 2.79Å; A14-Q43 CarbonylContact O-C 3.55Å; A14-Q43 WeakPolarHBondContact O-CA 3.42Å; A14-L45 HydrophobicContact CB-CB 4.06Å; A14-L45 HydrophobicContact CB-CD1 4.27Å; A14-L48 HydrophobicContact CB-CD2 4.3Å; A14-Y84 HydrophobicContact CB-CD2 3.78Å; A14-Y84 HydrophobicContact CB-CE2 3.57Å
15	T	89	Confident	80.3	Confident	69 Å²	69	72.2 Å²	72.2	42%	0.423	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	144.8	177.8	58.3	0	0	0	0	109.9	D82 A83 Y84	T15-D82 PolarHBondContact N-O 2.81Å; T15-D82 PolarHBondContact OG1-O 2.91Å; T15-D82 VanDerWaalsContact OG1-O 3.04Å; T15-A83 WeakPolarHBondContact O-CA 3.49Å; T15-Y84 PolarHBondContact O-N 2.83Å
16	V	90.1	Very high	81.9	Confident	25 Å²	25	71 Å²	71	15%	0.152	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119.3	177.2	-176.1	0	0	0	0	109.1	V19 L39 L48 I86	V16-V19 HydrophobicContact CG1-CG2 3.62Å; V16-L39 WeakPolarHBondContact CG2-O 3.45Å; V16-L48 HydrophobicContact CG2-CD1 3.41Å; V16-L48 VanDerWaalsContact CG2-CD1 3.41Å; V16-I86 HydrophobicContact CB-CD1 4.49Å; V16-I86 HydrophobicContact CG1-CD1 3.76Å; V16-I86 HydrophobicContact CG1-CG1 4.35Å; V16-I86 HydrophobicContact CG2-CD1 3.9Å
17	D	89.6	Confident	83.9	Confident	55 Å²	55	65.9 Å²	65.9	29%	0.294	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-51.5	-179.1	-161	37.3	0	0	0	111	S75 K80 A83 Y84	D17-S75 WeakPolarHBondContact OD2-CB 3.42Å; D17-S75 PolarHBondContact OD2-OG 3Å; D17-K80 IonicContact OD1-NZ 2.79Å; D17-K80 PolarHBondContact OD1-NZ 2.77Å; D17-A83 HydrophobicContact CB-CB 4.02Å; D17-Y84 PolarHBondContact N-O 3.2Å
18	E	91.1	Very high	85.6	Confident	92 Å²	92	60.8 Å²	60.8	43%	0.43	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	138	-178.2	-168.2	-174.6	-169.5	0	0	111	V20 K85 I86	E18-V20 VanDerWaalsContact CD-CG2 3.44Å; E18-V20 HydrophobicContact CG-CG2 3.8Å; E18-V20 WeakPolarHBondContact OE1-CG2 3.5Å; E18-K85 HydrophobicContact CB-CG 4.34Å; E18-K85 WeakPolarHBondContact OE2-CE 3.42Å; E18-K85 IonicContact OE2-NZ 2.75Å; E18-K85 PolarHBondContact OE2-NZ 3.14Å; E18-I86 PolarHBondContact O-N 3.27Å
19	V	92.7	Very high	86.7	Confident	42 Å²	42	58.9 Å²	58.9	26%	0.255	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.8	169.6	-175.8	0	0	0	0	108.8	V16 F36 L39 I86 F88	V16-V19 HydrophobicContact CG1-CG2 3.62Å; V19-F36 HydrophobicContact CG1-CD1 4.32Å; V19-F36 HydrophobicContact CG1-CD2 4.08Å; V19-F36 HydrophobicContact CG1-CE1 4.44Å; V19-F36 HydrophobicContact CG1-CE2 4.18Å; V19-F36 HydrophobicContact CG1-CG 4.15Å; V19-F36 HydrophobicContact CG1-CZ 4.36Å; V19-L39 HydrophobicContact CG2-CD2 4.29Å; V19-I86 CarbonylContact C-O 3.6Å; V19-I86 WeakPolarHBondContact CA-O 3.39Å; V19-I86 HydrophobicContact CG2-CD1 4.46Å; V19-F88 HydrophobicContact CG1-CD2 4Å; V19-F88 HydrophobicContact CG1-CE2 4.09Å
20	V	92.6	Very high	87.9	Confident	43 Å²	43	58.4 Å²	58.4	26%	0.261	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.7	178.9	-178	0	0	0	0	109.2	E18 I86 T87 F88	E18-V20 VanDerWaalsContact CD-CG2 3.44Å; E18-V20 HydrophobicContact CG-CG2 3.8Å; E18-V20 WeakPolarHBondContact OE1-CG2 3.5Å; V20-I86 PolarHBondContact N-O 3.45Å; V20-T87 HydrophobicContact CB-CG2 4.45Å; V20-T87 CarbonylContact O-C 3.49Å; V20-T87 WeakPolarHBondContact O-CA 3.45Å; V20-F88 PolarHBondContact O-N 3.37Å
21	V	93.8	Very high	89	Confident	37 Å²	37	53.6 Å²	53.6	22%	0.224	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.5	170.8	-170.4	0	0	0	0	108.8	L24 V32 F36 F88 V90	V21-L24 HydrophobicContact CB-CD1 4.11Å; V21-L24 HydrophobicContact CG1-CD1 3.83Å; V21-L24 HydrophobicContact CG1-CD2 4.15Å; V21-L24 HydrophobicContact CG1-CG 3.83Å; V21-V32 HydrophobicContact CG1-CG1 4.33Å; V21-V32 HydrophobicContact CG2-CG1 4.09Å; V21-F36 HydrophobicContact CG2-CE2 3.49Å; V21-F36 VanDerWaalsContact CG2-CE2 3.49Å; V21-F36 HydrophobicContact CG2-CZ 3.68Å; V21-F88 CarbonylContact C-O 3.46Å; V21-F88 WeakPolarHBondContact CA-O 3.32Å; V21-F88 HydrophobicContact CG1-CB 4.36Å; V21-F88 HydrophobicContact CG2-CB 4.35Å; V21-V90 HydrophobicContact CG1-CG1 4.35Å; V21-V90 HydrophobicContact CG1-CG2 4Å
22	S	92.6	Very high	89.8	Confident	63 Å²	63	50.2 Å²	50.2	44%	0.441	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.4	179.8	-175.6	0	0	0	0	110.4	F88 V90	S22-F88 PolarHBondContact N-O 3.46Å; S22-V90 WeakPolarHBondContact O-CG2 3.3Å; S22-V90 PolarHBondContact O-N 2.79Å
23	G	91	Very high	90.3	Very high	32 Å²	32	53.8 Å²	53.8	33%	0.33	30%	0.296	S	S	.	.			trans	97.6	19.9	178.6	0	0	0	0	0	115.6	V90	G23-V90 WeakPolarHBondContact CA-O 3.43Å
24	L	89.4	Confident	90.5	Very high	43 Å²	43	56 Å²	56	23%	0.225	30%	0.299	C	S	.	.			trans	-81.8	122.4	168.3	-62.2	175.2	0	0	0	109.5	V21 V32 F65 V90	V21-L24 HydrophobicContact CB-CD1 4.11Å; V21-L24 HydrophobicContact CG1-CD1 3.83Å; V21-L24 HydrophobicContact CG1-CD2 4.15Å; V21-L24 HydrophobicContact CG1-CG 3.83Å; L24-V32 HydrophobicContact CD1-CG2 4.17Å; L24-V32 HydrophobicContact CD2-CG2 4.03Å; L24-F65 HydrophobicContact CD2-CE1 3.65Å; L24-F65 HydrophobicContact CD2-CZ 3.69Å; L24-V90 HydrophobicContact CD2-CG2 3.84Å; L24-V90 HydrophobicContact CG-CG2 4.29Å
25	D	87.8	Confident	90.7	Very high	141 Å²	141	56.5 Å²	56.5	75%	0.754	30%	0.302	S	S	*	.	S	Bend	trans	-109.9	-58	179.1	-73	-24.1	0	0	0	110.6	E92	D25-E92 PolarHBondContact N-OE1 3.46Å
26	R	88.8	Confident	90.9	Very high	67 Å²	67	53.8 Å²	53.8	25%	0.253	28%	0.284	S	S	.	.	S	Bend	trans	-110.6	-27	-174.6	-66	165.8	49.8	-133	-9.1	112.5	H28 E92 F95 N119 N120 R123	R26-H28 PolarHBondContact O-N 3.12Å; R26-E92 WeakPolarHBondContact CB-OE2 3.47Å; R26-E92 PolarHBondContact N-OE1 3.22Å; R26-E92 VanDerWaalsContact N-OE1 3.15Å; R26-E92 PolarHBondContact N-OE2 2.83Å; R26-E92 VanDerWaalsContact N-OE2 3.12Å; R26-F95 VanDerWaalsContact NH2-CD2 3.28Å; R26-N119 PolarHBondContact NH1-O 3.48Å; R26-N119 PolarHBondContact NH2-O 2.89Å; R26-N120 PolarHBondContact NH2-O 3.15Å; R26-R123 VanDerWaalsContact O-CB 3.3Å; R26-R123 WeakPolarHBondContact O-CB 3.18Å; R26-R123 WeakPolarHBondContact O-CD 3.49Å; R26-R123 VanDerWaalsContact O-CG 3.32Å; R26-R123 WeakPolarHBondContact O-CG 3.38Å
27	T	92	Very high	90.9	Very high	6 Å²	6	56.5 Å²	56.5	4%	0.037	30%	0.3	C	S	.	.	S	Bend	trans	-69.3	127.1	-175.1	-49.2	0	0	0	0	110.5	D29 I31 V32 V64 F65 E92 N120	T27-D29 PolarHBondContact O-N 2.93Å; T27-I31 HydrophobicContact CG2-CG2 3.49Å; T27-I31 VanDerWaalsContact CG2-CG2 3.49Å; T27-V32 HydrophobicContact CG2-CG2 4.16Å; T27-V64 HydrophobicContact CG2-CG1 4.45Å; T27-V64 VanDerWaalsContact OG1-CG1 3.25Å; T27-V64 WeakPolarHBondContact OG1-CG1 3.37Å; T27-F65 HydrophobicContact CG2-CZ 4.32Å; T27-E92 WeakPolarHBondContact CB-OE1 3.38Å; T27-E92 PolarHBondContact N-OE1 3.5Å; T27-E92 PolarHBondContact OG1-OE1 3.39Å; T27-E92 PolarHBondContact OG1-OE2 2.85Å; T27-N120 WeakPolarHBondContact CA-ND2 3.44Å; T27-N120 PolarHBondContact OG1-ND2 3.27Å
28	H	92.1	Very high	90.9	Very high	94 Å²	94	56.8 Å²	56.8	44%	0.435	30%	0.304	S	S	.	.			trans	-73.7	127.1	-177.7	-172.2	-89	0	0	0	111.9	R26 S30 I31 R123	R26-H28 PolarHBondContact O-N 3.12Å; H28-S30 PolarHBondContact CE1-OG 2.93Å; H28-S30 WeakPolarHBondContact ND1-CB 3.34Å; H28-S30 PolarHBondContact ND1-N 2.87Å; H28-S30 PolarHBondContact ND1-OG 2.89Å; H28-S30 PolarHBondContact O-N 2.97Å; H28-I31 WeakPolarHBondContact O-CG2 3.37Å; H28-I31 PolarHBondContact O-N 2.66Å; H28-R123 HydrophobicContact CB-CB 4.5Å; H28-R123 WeakPolarHBondContact CB-O 3.36Å; H28-R123 PolarHBondContact N-O 3.01Å
29	D	90	Very high	90.8	Very high	79 Å²	79	52.4 Å²	52.4	42%	0.422	28%	0.284	S	S	.	.	H	α-helix	trans	-47.6	-34.4	-175.2	-63.3	3.4	0	0	0	115.1	T27 I31 V32 K33	T27-D29 PolarHBondContact O-N 2.93Å; D29-I31 PolarHBondContact O-N 2.8Å; D29-V32 PolarHBondContact O-N 3.04Å; D29-V32 VanDerWaalsContact O-N 3.09Å; D29-K33 HydrophobicContact CB-CD 4.4Å; D29-K33 WeakPolarHBondContact O-CB 3.37Å; D29-K33 WeakPolarHBondContact O-CG 3.49Å; D29-K33 PolarHBondContact O-N 2.86Å
30	S	88.2	Confident	90.8	Very high	35 Å²	35	54.6 Å²	54.6	25%	0.245	30%	0.297	C	S	.	.	H	α-helix	trans	-57.9	-31.5	-178.6	69.8	0	0	0	0	113.7	H28 K34	H28-S30 PolarHBondContact CE1-OG 2.93Å; H28-S30 WeakPolarHBondContact ND1-CB 3.34Å; H28-S30 PolarHBondContact ND1-N 2.87Å; H28-S30 PolarHBondContact ND1-OG 2.89Å; H28-S30 PolarHBondContact O-N 2.97Å; S30-K34 WeakPolarHBondContact O-CG 3.48Å
31	I	89.6	Confident	90.6	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-73.6	-36.1	179.8	-163	165.9	0	0	0	111.2	T27 H28 D29 Q35 L62 R124 A125 P149 N152	T27-I31 HydrophobicContact CG2-CG2 3.49Å; T27-I31 VanDerWaalsContact CG2-CG2 3.49Å; H28-I31 WeakPolarHBondContact O-CG2 3.37Å; H28-I31 PolarHBondContact O-N 2.66Å; D29-I31 PolarHBondContact O-N 2.8Å; I31-Q35 PolarHBondContact O-NE2 2.78Å; I31-L62 HydrophobicContact CD1-CD2 4.18Å; I31-L62 HydrophobicContact CG1-CD1 4.4Å; I31-L62 HydrophobicContact CG1-CD2 4.25Å; I31-R124 VanDerWaalsContact CD1-C 3.43Å; I31-R124 HydrophobicContact CD1-CB 4.33Å; I31-R124 WeakPolarHBondContact CD1-O 3.49Å; I31-A125 HydrophobicContact CD1-CB 3.56Å; I31-P149 HydrophobicContact CD1-CG 4.41Å; I31-N152 HydrophobicContact CG1-CB 3.93Å
32	V	91.2	Very high	90.4	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.018	31%	0.307	C	S	.	.	H	α-helix	trans	-75.7	-46.9	-178.5	-164.9	0	0	0	0	109.8	V21 L24 T27 D29 K34 Q35 F36 L59 F65	V21-V32 HydrophobicContact CG1-CG1 4.33Å; V21-V32 HydrophobicContact CG2-CG1 4.09Å; L24-V32 HydrophobicContact CD1-CG2 4.17Å; L24-V32 HydrophobicContact CD2-CG2 4.03Å; T27-V32 HydrophobicContact CG2-CG2 4.16Å; D29-V32 PolarHBondContact O-N 3.04Å; D29-V32 VanDerWaalsContact O-N 3.09Å; V32-K34 VanDerWaalsContact C-N 3.26Å; V32-K34 PolarHBondContact O-N 2.78Å; V32-Q35 WeakPolarHBondContact O-CB 3.32Å; V32-Q35 PolarHBondContact O-N 2.85Å; V32-F36 HydrophobicContact CG1-CE2 3.57Å; V32-F36 HydrophobicContact CG1-CZ 3.85Å; V32-F36 WeakPolarHBondContact O-CD2 3.36Å; V32-L59 HydrophobicContact CG1-CD2 3.69Å; V32-F65 HydrophobicContact CG2-CZ 4.43Å
33	K	91.4	Very high	90.2	Very high	140 Å²	140	62 Å²	62	61%	0.609	32%	0.317	S	S	*	.	H	α-helix	trans	-54.3	-39.1	178.6	-74.7	177.2	178.9	176.2	0	112.9	D29 Q35 F36	D29-K33 HydrophobicContact CB-CD 4.4Å; D29-K33 WeakPolarHBondContact O-CB 3.37Å; D29-K33 WeakPolarHBondContact O-CG 3.49Å; D29-K33 PolarHBondContact O-N 2.86Å; K33-Q35 PolarHBondContact O-N 2.89Å; K33-F36 PolarHBondContact O-N 2.87Å
34	K	90.3	Very high	90	Very high	110 Å²	110	63.5 Å²	63.5	48%	0.478	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-62.3	-25.7	177.2	-77.8	-173.3	178.1	-171.8	0	113.7	S30 V32 F36 V37 E151 N152	S30-K34 WeakPolarHBondContact O-CG 3.48Å; V32-K34 VanDerWaalsContact C-N 3.26Å; V32-K34 PolarHBondContact O-N 2.78Å; K34-F36 VanDerWaalsContact C-N 3.32Å; K34-V37 WeakPolarHBondContact O-CG2 3.11Å; K34-E151 PolarHBondContact NZ-O 2.87Å; K34-N152 HydrophobicContact CD-CB 3.9Å; K34-N152 PolarHBondContact NZ-ND2 2.67Å
35	Q	91.1	Very high	90	Very high	10 Å²	10	62.1 Å²	62.1	5%	0.047	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-76.2	-21.4	-178.8	-51.3	-46.2	-41.6	0	0	113	I31 V32 K33 K58 L59 L62 N152 P154	I31-Q35 PolarHBondContact O-NE2 2.78Å; V32-Q35 WeakPolarHBondContact O-CB 3.32Å; V32-Q35 PolarHBondContact O-N 2.85Å; K33-Q35 PolarHBondContact O-N 2.89Å; Q35-K58 HydrophobicContact CB-CB 4.27Å; Q35-K58 HydrophobicContact CG-CB 4.44Å; Q35-L59 HydrophobicContact CB-CD2 4.33Å; Q35-L59 HydrophobicContact CG-CD2 4.14Å; Q35-L62 HydrophobicContact CG-CD1 4.27Å; Q35-N152 PolarHBondContact NE2-O 2.96Å; Q35-P154 VanDerWaalsContact OE1-CD 3.3Å
36	F	92.6	Very high	90	Very high	13 Å²	13	61 Å²	61	6%	0.057	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-93.2	2.9	-175.6	-54.5	-55.6	0	0	0	114.5	V19 V21 V32 K33 K34 T38 L39 V40 A55 L59 F88	V19-F36 HydrophobicContact CG1-CD1 4.32Å; V19-F36 HydrophobicContact CG1-CD2 4.08Å; V19-F36 HydrophobicContact CG1-CE1 4.44Å; V19-F36 HydrophobicContact CG1-CE2 4.18Å; V19-F36 HydrophobicContact CG1-CG 4.15Å; V19-F36 HydrophobicContact CG1-CZ 4.36Å; V21-F36 HydrophobicContact CG2-CE2 3.49Å; V21-F36 VanDerWaalsContact CG2-CE2 3.49Å; V21-F36 HydrophobicContact CG2-CZ 3.68Å; V32-F36 HydrophobicContact CG1-CE2 3.57Å; V32-F36 HydrophobicContact CG1-CZ 3.85Å; V32-F36 WeakPolarHBondContact O-CD2 3.36Å; K33-F36 PolarHBondContact O-N 2.87Å; K34-F36 VanDerWaalsContact C-N 3.32Å; F36-T38 VanDerWaalsContact C-N 3.25Å; F36-T38 PolarHBondContact O-N 2.76Å; F36-L39 HydrophobicContact CB-CB 4.41Å; F36-L39 HydrophobicContact CD1-CD2 3.93Å; F36-L39 WeakPolarHBondContact O-CB 3.24Å; F36-L39 PolarHBondContact O-N 2.88Å; F36-V40 WeakPolarHBondContact O-CG2 3.37Å; F36-V40 PolarHBondContact O-N 3.39Å; F36-V40 VanDerWaalsContact O-N 3.08Å; F36-A55 HydrophobicContact CD1-CB 3.98Å; F36-A55 HydrophobicContact CE1-CB 4.2Å; F36-L59 HydrophobicContact CE1-CD1 3.91Å; F36-L59 HydrophobicContact CZ-CD1 3.86Å; F36-L59 HydrophobicContact CZ-CD2 4.4Å; F36-F88 AromaticContact CD1-CE2 3.97Å; F36-F88 HydrophobicContact CD1-CE2 3.97Å; F36-F88 HydrophobicContact CD1-CZ 4.37Å; F36-F88 HydrophobicContact CE1-CD1 4.49Å; F36-F88 AromaticContact CE1-CD2 3.61Å; F36-F88 HydrophobicContact CE1-CD2 3.61Å; F36-F88 HydrophobicContact CE1-CE1 4.3Å; F36-F88 AromaticContact CE1-CE2 3.38Å; F36-F88 HydrophobicContact CE1-CE2 3.38Å; F36-F88 HydrophobicContact CE1-CG 4.17Å; F36-F88 AromaticContact CE1-CZ 3.76Å; F36-F88 HydrophobicContact CE1-CZ 3.76Å; F36-F88 AromaticContact CZ-CD2 3.79Å; F36-F88 HydrophobicContact CZ-CD2 3.79Å; F36-F88 HydrophobicContact CZ-CE2 4.06Å; F36-F88 HydrophobicContact CZ-CG 4.21Å
37	V	90.8	Very high	90.1	Very high	81 Å²	81	60.7 Å²	60.7	49%	0.491	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-36.5	-178.2	176.6	0	0	0	0	112.3	K34	K34-V37 WeakPolarHBondContact O-CG2 3.11Å
38	T	89.2	Confident	90	Very high	61 Å²	61	60.4 Å²	60.4	37%	0.374	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-36.5	175.3	-46.8	0	0	0	0	111.5	F36 K41 N51	F36-T38 VanDerWaalsContact C-N 3.25Å; F36-T38 PolarHBondContact O-N 2.76Å; T38-K41 PolarHBondContact O-N 2.89Å; T38-N51 PolarHBondContact O-ND2 3.02Å
39	L	90.5	Very high	90	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-65.4	-40.3	-178	-179	61.8	0	0	0	112.7	V16 V19 F36 K41 S42 L48 N51 V52 A55 I86 F88	V16-L39 WeakPolarHBondContact CG2-O 3.45Å; V19-L39 HydrophobicContact CG2-CD2 4.29Å; F36-L39 HydrophobicContact CB-CB 4.41Å; F36-L39 HydrophobicContact CD1-CD2 3.93Å; F36-L39 WeakPolarHBondContact O-CB 3.24Å; F36-L39 PolarHBondContact O-N 2.88Å; L39-K41 PolarHBondContact O-N 3.48Å; L39-S42 WeakPolarHBondContact O-CB 3.21Å; L39-S42 PolarHBondContact O-N 2.81Å; L39-S42 PolarHBondContact O-OG 2.85Å; L39-L48 HydrophobicContact CD1-CD1 4.1Å; L39-N51 HydrophobicContact CB-CB 4.45Å; L39-N51 HydrophobicContact CD1-CB 3.8Å; L39-V52 HydrophobicContact CD1-CB 4.39Å; L39-V52 HydrophobicContact CD1-CG2 3.55Å; L39-V52 HydrophobicContact CD2-CG2 4.47Å; L39-A55 HydrophobicContact CD2-CB 4.41Å; L39-I86 HydrophobicContact CD1-CD1 3.75Å; L39-I86 HydrophobicContact CD2-CD1 3.73Å; L39-I86 HydrophobicContact CD2-CG2 4.46Å; L39-I86 HydrophobicContact CG-CD1 3.79Å; L39-F88 HydrophobicContact CD2-CE2 3.76Å; L39-F88 HydrophobicContact CD2-CZ 4.05Å
40	V	91	Very high	90.1	Very high	88 Å²	88	62 Å²	62	53%	0.533	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-67.9	-18.5	179.1	177.9	0	0	0	0	112.4	F36 S42	F36-V40 WeakPolarHBondContact O-CG2 3.37Å; F36-V40 PolarHBondContact O-N 3.39Å; F36-V40 VanDerWaalsContact O-N 3.08Å; V40-S42 VanDerWaalsContact C-N 3.35Å
41	K	90.2	Very high	90.4	Very high	151 Å²	151	61.3 Å²	61.3	66%	0.657	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-88.2	0.9	179.7	-67.3	-178.6	179.9	-174.6	0	113.9	T38 L39	T38-K41 PolarHBondContact O-N 2.89Å; L39-K41 PolarHBondContact O-N 3.48Å
42	S	88.2	Confident	90.7	Very high	6 Å²	6	61.9 Å²	61.9	4%	0.042	30%	0.298	C	S	.	.			trans	-62.4	135.7	-179.5	-72.1	0	0	0	0	112.3	L39 V40 D47 L48 N51	L39-S42 WeakPolarHBondContact O-CB 3.21Å; L39-S42 PolarHBondContact O-N 2.81Å; L39-S42 PolarHBondContact O-OG 2.85Å; V40-S42 VanDerWaalsContact C-N 3.35Å; S42-D47 VanDerWaalsContact CA-OD2 3.31Å; S42-D47 WeakPolarHBondContact CA-OD2 3.06Å; S42-D47 PolarHBondContact OG-O 3.3Å; S42-L48 WeakPolarHBondContact OG-CA 3.48Å; S42-N51 PolarHBondContact OG-ND2 2.72Å
43	Q	88.3	Confident	90.8	Very high	140 Å²	140	69.8 Å²	69.8	65%	0.654	33%	0.328	S	S	*	.			trans	-113.6	-26.1	179.6	-63.4	-177.8	1.8	0	0	113.7	A14 D47	A14-Q43 PolarHBondContact N-O 2.79Å; A14-Q43 CarbonylContact O-C 3.55Å; A14-Q43 WeakPolarHBondContact O-CA 3.42Å; Q43-D47 PolarHBondContact N-OD2 3.03Å
44	N	88.3	Confident	90.9	Very high	64 Å²	64	64.8 Å²	64.8	34%	0.342	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-122.5	153.6	-174.7	-60.2	-1.6	0	0	0	109.7	R46 D47 L48	N44-R46 VanDerWaalsContact C-N 3.27Å; N44-R46 PolarHBondContact O-N 3.04Å; N44-D47 HydrophobicContact CB-CB 4.31Å; N44-D47 PolarHBondContact O-N 2.95Å; N44-D47 VanDerWaalsContact O-N 3.1Å; N44-L48 PolarHBondContact O-N 2.92Å
45	L	88.1	Confident	91.1	Very high	15 Å²	15	59.6 Å²	59.6	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-35.6	-179.9	-173.2	57	0	0	0	112.6	L9 I12 A14 L48 F49 Y84	L9-L45 HydrophobicContact CD2-CD2 3.54Å; L9-L45 HydrophobicContact CD2-CG 4.05Å; I12-L45 HydrophobicContact CB-CB 4.25Å; I12-L45 HydrophobicContact CB-CD2 4.44Å; I12-L45 HydrophobicContact CD1-CD2 4.19Å; I12-L45 HydrophobicContact CG2-CB 4.35Å; I12-L45 HydrophobicContact CG2-CD2 4.24Å; I12-L45 PolarHBondContact O-N 3.24Å; I12-L45 VanDerWaalsContact O-N 3.09Å; A14-L45 HydrophobicContact CB-CB 4.06Å; A14-L45 HydrophobicContact CB-CD1 4.27Å; L45-L48 HydrophobicContact CD1-CD2 4.01Å; L45-L48 WeakPolarHBondContact O-CB 3.25Å; L45-L48 PolarHBondContact O-N 3.48Å; L45-F49 HydrophobicContact CD1-CD2 4.07Å; L45-F49 HydrophobicContact CD1-CE2 3.56Å; L45-F49 HydrophobicContact CD1-CZ 4.29Å; L45-F49 HydrophobicContact CD2-CE2 4.33Å; L45-F49 HydrophobicContact CG-CD2 4.08Å; L45-F49 HydrophobicContact CG-CE2 3.72Å; L45-F49 WeakPolarHBondContact O-CD2 3.42Å; L45-F49 PolarHBondContact O-N 3.3Å; L45-F49 VanDerWaalsContact O-N 3.12Å; L45-Y84 HydrophobicContact CD1-CE1 4.42Å; L45-Y84 HydrophobicContact CD1-CE2 4.26Å
46	R	88.5	Confident	91.2	Very high	117 Å²	117	63.5 Å²	63.5	44%	0.442	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-47.1	172.8	-177.2	179.5	179	174.2	2.7	112.6	L9 E10 N44 L48 F49 E50	L9-R46 HydrophobicContact CB-CB 4.3Å; E10-R46 IonicContact OE1-CZ 3.22Å; E10-R46 IonicContact OE1-NH1 3.33Å; E10-R46 PolarHBondContact OE1-NH1 3.2Å; N44-R46 VanDerWaalsContact C-N 3.27Å; N44-R46 PolarHBondContact O-N 3.04Å; R46-L48 VanDerWaalsContact C-N 3.3Å; R46-F49 PolarHBondContact O-N 3.28Å; R46-E50 PolarHBondContact O-N 2.83Å
47	D	90.1	Very high	91.2	Very high	60 Å²	60	66.6 Å²	66.6	32%	0.321	32%	0.318	S	S	.	.	H	α-helix	trans	-66.6	-35.2	179.8	-177.5	31.9	0	0	0	110.9	S42 Q43 N44 N51	S42-D47 VanDerWaalsContact CA-OD2 3.31Å; S42-D47 WeakPolarHBondContact CA-OD2 3.06Å; S42-D47 PolarHBondContact OG-O 3.3Å; Q43-D47 PolarHBondContact N-OD2 3.03Å; N44-D47 HydrophobicContact CB-CB 4.31Å; N44-D47 PolarHBondContact O-N 2.95Å; N44-D47 VanDerWaalsContact O-N 3.1Å; D47-N51 VanDerWaalsContact O-CB 3.26Å; D47-N51 WeakPolarHBondContact O-CB 3.43Å; D47-N51 VanDerWaalsContact O-CG 3.23Å; D47-N51 PolarHBondContact O-N 2.78Å; D47-N51 PolarHBondContact O-ND2 2.85Å; D47-N51 PolarHBondContact OD1-ND2 3.02Å
48	L	91.3	Very high	91.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.4	-54.7	170.9	-176.8	66.8	0	0	0	111.5	A14 V16 L39 S42 N44 L45 R46 E50 N51 V52 V72 Y84 I86	A14-L48 HydrophobicContact CB-CD2 4.3Å; V16-L48 HydrophobicContact CG2-CD1 3.41Å; V16-L48 VanDerWaalsContact CG2-CD1 3.41Å; L39-L48 HydrophobicContact CD1-CD1 4.1Å; S42-L48 WeakPolarHBondContact OG-CA 3.48Å; N44-L48 PolarHBondContact O-N 2.92Å; L45-L48 HydrophobicContact CD1-CD2 4.01Å; L45-L48 WeakPolarHBondContact O-CB 3.25Å; L45-L48 PolarHBondContact O-N 3.48Å; R46-L48 VanDerWaalsContact C-N 3.3Å; L48-E50 VanDerWaalsContact C-N 3.35Å; L48-E50 PolarHBondContact O-N 3.17Å; L48-N51 PolarHBondContact O-N 3.09Å; L48-V52 VanDerWaalsContact O-CG2 3.28Å; L48-V52 WeakPolarHBondContact O-CG2 3.5Å; L48-V52 PolarHBondContact O-N 2.87Å; L48-V72 HydrophobicContact CD2-CG1 4.1Å; L48-Y84 HydrophobicContact CD2-CD2 4.08Å; L48-Y84 HydrophobicContact CD2-CG 3.97Å; L48-I86 HydrophobicContact CD1-CD1 3.67Å
49	F	92.2	Very high	91.6	Very high	105 Å²	105	61.3 Å²	61.3	46%	0.461	28%	0.284	S	S	.	.	H	α-helix	trans	-63	-39.2	-178.9	-78.8	-63.2	0	0	0	113	L45 R46 V52 R53 V72	L45-F49 HydrophobicContact CD1-CD2 4.07Å; L45-F49 HydrophobicContact CD1-CE2 3.56Å; L45-F49 HydrophobicContact CD1-CZ 4.29Å; L45-F49 HydrophobicContact CD2-CE2 4.33Å; L45-F49 HydrophobicContact CG-CD2 4.08Å; L45-F49 HydrophobicContact CG-CE2 3.72Å; L45-F49 WeakPolarHBondContact O-CD2 3.42Å; L45-F49 PolarHBondContact O-N 3.3Å; L45-F49 VanDerWaalsContact O-N 3.12Å; R46-F49 PolarHBondContact O-N 3.28Å; F49-V52 PolarHBondContact O-N 2.93Å; F49-R53 PolarHBondContact O-N 3.31Å; F49-V72 HydrophobicContact CE1-CB 4.46Å; F49-V72 HydrophobicContact CE1-CG2 4.28Å
50	E	92	Very high	91.7	Very high	103 Å²	103	63.9 Å²	63.9	48%	0.481	31%	0.305	S	S	.	.	H	α-helix	trans	-66.2	-44.5	176.2	-171	56.7	-148.1	0	0	111.2	R46 L48 V52 R53 V54	R46-E50 PolarHBondContact O-N 2.83Å; L48-E50 VanDerWaalsContact C-N 3.35Å; L48-E50 PolarHBondContact O-N 3.17Å; E50-V52 VanDerWaalsContact C-N 3.33Å; E50-V52 PolarHBondContact O-N 2.82Å; E50-R53 WeakPolarHBondContact O-CB 3.43Å; E50-R53 PolarHBondContact O-N 2.86Å; E50-R53 VanDerWaalsContact O-N 3.16Å; E50-V54 WeakPolarHBondContact O-CG2 3.42Å; E50-V54 PolarHBondContact O-N 2.85Å
51	N	94	Very high	91.7	Very high	19 Å²	19	62.7 Å²	62.7	10%	0.102	29%	0.292	C	S	.	.	H	α-helix	trans	-68.5	-30.8	177.9	-70	-29	0	0	0	112.7	T38 L39 S42 D47 L48 A55	T38-N51 PolarHBondContact O-ND2 3.02Å; L39-N51 HydrophobicContact CB-CB 4.45Å; L39-N51 HydrophobicContact CD1-CB 3.8Å; S42-N51 PolarHBondContact OG-ND2 2.72Å; D47-N51 VanDerWaalsContact O-CB 3.26Å; D47-N51 WeakPolarHBondContact O-CB 3.43Å; D47-N51 VanDerWaalsContact O-CG 3.23Å; D47-N51 PolarHBondContact O-N 2.78Å; D47-N51 PolarHBondContact O-ND2 2.85Å; D47-N51 PolarHBondContact OD1-ND2 3.02Å; L48-N51 PolarHBondContact O-N 3.09Å; N51-A55 WeakPolarHBondContact O-CB 3.38Å; N51-A55 PolarHBondContact O-N 2.81Å
52	V	95	Very high	91.8	Very high	12 Å²	12	55.6 Å²	55.6	7%	0.073	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-44.3	170.8	170	0	0	0	0	110.2	L39 L48 F49 E50 A55 K56 A70 V72 I86 F88	L39-V52 HydrophobicContact CD1-CB 4.39Å; L39-V52 HydrophobicContact CD1-CG2 3.55Å; L39-V52 HydrophobicContact CD2-CG2 4.47Å; L48-V52 VanDerWaalsContact O-CG2 3.28Å; L48-V52 WeakPolarHBondContact O-CG2 3.5Å; L48-V52 PolarHBondContact O-N 2.87Å; F49-V52 PolarHBondContact O-N 2.93Å; E50-V52 VanDerWaalsContact C-N 3.33Å; E50-V52 PolarHBondContact O-N 2.82Å; V52-A55 PolarHBondContact O-N 2.88Å; V52-K56 WeakPolarHBondContact O-CB 3.33Å; V52-K56 PolarHBondContact O-N 3.42Å; V52-A70 HydrophobicContact CG1-CB 3.7Å; V52-V72 HydrophobicContact CG2-CG2 4.17Å; V52-I86 HydrophobicContact CG2-CD1 4.06Å; V52-I86 HydrophobicContact CG2-CG2 4.15Å; V52-F88 HydrophobicContact CG1-CZ 4.25Å
53	R	94.2	Very high	91.8	Very high	170 Å²	170	56.6 Å²	56.6	64%	0.642	27%	0.273	S	S	*	.	H	α-helix	trans	-59.9	-49.2	175.7	178	-171.4	172.5	118	1.5	111.1	F49 E50 A55 K56 E57	F49-R53 PolarHBondContact O-N 3.31Å; E50-R53 WeakPolarHBondContact O-CB 3.43Å; E50-R53 PolarHBondContact O-N 2.86Å; E50-R53 VanDerWaalsContact O-N 3.16Å; R53-A55 PolarHBondContact O-N 3.34Å; R53-K56 WeakPolarHBondContact O-CB 3.37Å; R53-K56 PolarHBondContact O-N 2.86Å; R53-E57 PolarHBondContact O-N 3.45Å
54	V	93	Very high	92	Very high	34 Å²	34	50.2 Å²	50.2	21%	0.206	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-42.5	177.8	171.9	0	0	0	0	111.3	E50 E57 K58	E50-V54 WeakPolarHBondContact O-CG2 3.42Å; E50-V54 PolarHBondContact O-N 2.85Å; V54-E57 PolarHBondContact O-N 3.09Å; V54-K58 HydrophobicContact CG1-CD 4.24Å; V54-K58 WeakPolarHBondContact O-CG 3.3Å; V54-K58 PolarHBondContact O-N 3.4Å
55	A	93.8	Very high	92.3	Very high	2 Å²	2	47.6 Å²	47.6	2%	0.017	23%	0.229	C	C	.	.	H	α-helix	trans	-63.5	-42.2	176.6	0	0	0	0	0	111.9	F36 L39 N51 V52 R53 E57 K58 L59 F88	F36-A55 HydrophobicContact CD1-CB 3.98Å; F36-A55 HydrophobicContact CE1-CB 4.2Å; L39-A55 HydrophobicContact CD2-CB 4.41Å; N51-A55 WeakPolarHBondContact O-CB 3.38Å; N51-A55 PolarHBondContact O-N 2.81Å; V52-A55 PolarHBondContact O-N 2.88Å; R53-A55 PolarHBondContact O-N 3.34Å; A55-E57 VanDerWaalsContact C-N 3.33Å; A55-E57 PolarHBondContact O-N 3.12Å; A55-K58 PolarHBondContact O-N 3.3Å; A55-L59 WeakPolarHBondContact O-CG 3.34Å; A55-L59 PolarHBondContact O-N 3.15Å; A55-F88 HydrophobicContact CB-CZ 4.02Å
56	K	94.8	Very high	92.5	Very high	91 Å²	91	53.2 Å²	53.2	40%	0.396	25%	0.253	S	S	.	.	H	α-helix	trans	-59.4	-43.4	173.9	179.2	177.8	175.7	175.1	0	111.6	V52 R53 L59 A60 I68 F88	V52-K56 WeakPolarHBondContact O-CB 3.33Å; V52-K56 PolarHBondContact O-N 3.42Å; R53-K56 WeakPolarHBondContact O-CB 3.37Å; R53-K56 PolarHBondContact O-N 2.86Å; K56-L59 PolarHBondContact O-N 3.01Å; K56-A60 PolarHBondContact O-N 3.04Å; K56-I68 WeakPolarHBondContact CE-O 3.43Å; K56-I68 HydrophobicContact CG-CB 4.45Å; K56-I68 HydrophobicContact CG-CG2 3.93Å; K56-I68 PolarHBondContact NZ-O 3.18Å; K56-F88 HydrophobicContact CB-CE1 4.38Å
57	E	92.6	Very high	92.8	Very high	79 Å²	79	49.8 Å²	49.8	37%	0.369	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-46.1	176.4	-169.8	-171.9	146.5	0	0	111.8	R53 V54 A55 L59 A60 K61	R53-E57 PolarHBondContact O-N 3.45Å; V54-E57 PolarHBondContact O-N 3.09Å; A55-E57 VanDerWaalsContact C-N 3.33Å; A55-E57 PolarHBondContact O-N 3.12Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 3.49Å; E57-A60 WeakPolarHBondContact O-CB 3.48Å; E57-A60 PolarHBondContact O-N 3.39Å; E57-A60 VanDerWaalsContact O-N 3.11Å; E57-K61 HydrophobicContact CG-CD 4.28Å; E57-K61 WeakPolarHBondContact O-CG 3.34Å; E57-K61 PolarHBondContact O-N 3.16Å; E57-K61 WeakPolarHBondContact OE1-CE 3.28Å; E57-K61 IonicContact OE1-NZ 2.66Å; E57-K61 PolarHBondContact OE1-NZ 3.29Å
58	K	92.9	Very high	93	Very high	31 Å²	31	47.9 Å²	47.9	14%	0.135	23%	0.234	C	C	.	.	H	α-helix	trans	-55.7	-44.8	175.3	-75.8	176.3	-179.6	174.9	0	111.8	Q35 V54 A55 K61 L62 P154 Y155	Q35-K58 HydrophobicContact CB-CB 4.27Å; Q35-K58 HydrophobicContact CG-CB 4.44Å; V54-K58 HydrophobicContact CG1-CD 4.24Å; V54-K58 WeakPolarHBondContact O-CG 3.3Å; V54-K58 PolarHBondContact O-N 3.4Å; A55-K58 PolarHBondContact O-N 3.3Å; K58-K61 PolarHBondContact O-N 2.94Å; K58-L62 PolarHBondContact O-N 3.13Å; K58-P154 HydrophobicContact CB-CG 3.9Å; K58-P154 HydrophobicContact CG-CG 3.9Å; K58-P154 WeakPolarHBondContact O-CB 3.42Å; K58-Y155 HydrophobicContact CG-CE2 4.1Å; K58-Y155 WeakPolarHBondContact CG-OH 3.27Å
59	L	93.7	Very high	93.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-40	176.3	-69.5	175.4	0	0	0	112.4	V32 Q35 F36 A55 K56 E57 K61 L62 F65 I68 F88	V32-L59 HydrophobicContact CG1-CD2 3.69Å; Q35-L59 HydrophobicContact CB-CD2 4.33Å; Q35-L59 HydrophobicContact CG-CD2 4.14Å; F36-L59 HydrophobicContact CE1-CD1 3.91Å; F36-L59 HydrophobicContact CZ-CD1 3.86Å; F36-L59 HydrophobicContact CZ-CD2 4.4Å; A55-L59 WeakPolarHBondContact O-CG 3.34Å; A55-L59 PolarHBondContact O-N 3.15Å; K56-L59 PolarHBondContact O-N 3.01Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 3.49Å; L59-K61 VanDerWaalsContact C-N 3.34Å; L59-L62 HydrophobicContact CD2-CD1 4.17Å; L59-L62 WeakPolarHBondContact O-CB 3.18Å; L59-L62 PolarHBondContact O-N 3.3Å; L59-F65 HydrophobicContact CB-CD2 4.35Å; L59-F65 HydrophobicContact CB-CE2 4.46Å; L59-F65 HydrophobicContact CD2-CE2 4.09Å; L59-I68 HydrophobicContact CB-CD1 3.7Å; L59-I68 HydrophobicContact CD1-CG2 4.4Å; L59-F88 HydrophobicContact CD1-CD1 3.91Å; L59-F88 HydrophobicContact CD1-CE1 4.28Å; L59-F88 HydrophobicContact CD1-CG 4.34Å
60	A	93	Very high	93.3	Very high	54 Å²	54	50.4 Å²	50.4	45%	0.446	25%	0.252	S	S	.	.	H	α-helix	trans	-63	-42.4	176.3	0	0	0	0	0	111.4	K56 E57 L62 G63 I68	K56-A60 PolarHBondContact O-N 3.04Å; E57-A60 WeakPolarHBondContact O-CB 3.48Å; E57-A60 PolarHBondContact O-N 3.39Å; E57-A60 VanDerWaalsContact O-N 3.11Å; A60-L62 VanDerWaalsContact C-N 3.31Å; A60-L62 PolarHBondContact O-N 3.2Å; A60-G63 PolarHBondContact O-N 3.25Å; A60-I68 VanDerWaalsContact CA-CD1 3.49Å; A60-I68 HydrophobicContact CB-CD1 3.84Å; A60-I68 VanDerWaalsContact N-CD1 3.27Å
61	K	91.6	Very high	93.4	Very high	64 Å²	64	48.7 Å²	48.7	28%	0.278	25%	0.248	S	C	.	.	H	α-helix	trans	-67.8	-22.7	-179.8	-75.5	-175.5	172.5	-175.2	0	114.5	E57 K58 L59 G63 P154 Y155 E188	E57-K61 HydrophobicContact CG-CD 4.28Å; E57-K61 WeakPolarHBondContact O-CG 3.34Å; E57-K61 PolarHBondContact O-N 3.16Å; E57-K61 WeakPolarHBondContact OE1-CE 3.28Å; E57-K61 IonicContact OE1-NZ 2.66Å; E57-K61 PolarHBondContact OE1-NZ 3.29Å; K58-K61 PolarHBondContact O-N 2.94Å; L59-K61 VanDerWaalsContact C-N 3.34Å; K61-G63 PolarHBondContact O-N 3.1Å; K61-G63 VanDerWaalsContact O-N 3.14Å; K61-P154 HydrophobicContact CB-CB 3.82Å; K61-Y155 HydrophobicContact CD-CD1 3.78Å; K61-Y155 HydrophobicContact CD-CE1 3.55Å; K61-E188 WeakPolarHBondContact CD-OE2 3.38Å; K61-E188 WeakPolarHBondContact CE-OE2 3.41Å; K61-E188 IonicContact NZ-OE2 3.18Å; K61-E188 PolarHBondContact NZ-OE2 2.84Å
62	L	91.5	Very high	93.3	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27	168.7	-68.4	175.6	0	0	0	112	I31 Q35 K58 L59 A60 V64 F65 A125 P154 R157	I31-L62 HydrophobicContact CD1-CD2 4.18Å; I31-L62 HydrophobicContact CG1-CD1 4.4Å; I31-L62 HydrophobicContact CG1-CD2 4.25Å; Q35-L62 HydrophobicContact CG-CD1 4.27Å; K58-L62 PolarHBondContact O-N 3.13Å; L59-L62 HydrophobicContact CD2-CD1 4.17Å; L59-L62 WeakPolarHBondContact O-CB 3.18Å; L59-L62 PolarHBondContact O-N 3.3Å; A60-L62 VanDerWaalsContact C-N 3.31Å; A60-L62 PolarHBondContact O-N 3.2Å; L62-V64 VanDerWaalsContact C-N 3.26Å; L62-V64 HydrophobicContact CB-CG2 4.4Å; L62-V64 PolarHBondContact O-N 3.3Å; L62-F65 HydrophobicContact CD1-CE2 4.47Å; L62-A125 HydrophobicContact CB-CB 4.49Å; L62-P154 HydrophobicContact CD2-CB 4Å; L62-P154 HydrophobicContact CG-CB 4.3Å; L62-R157 PolarHBondContact O-NH2 3.27Å; L62-R157 VanDerWaalsContact O-NH2 3.14Å
63	G	89.8	Confident	93.1	Very high	27 Å²	27	53 Å²	53	28%	0.278	27%	0.273	S	S	.	.	S	Bend	trans	78.1	6	175.4	0	0	0	0	0	114.6	A60 K61 K93	A60-G63 PolarHBondContact O-N 3.25Å; K61-G63 PolarHBondContact O-N 3.1Å; K61-G63 VanDerWaalsContact O-N 3.14Å; G63-K93 WeakPolarHBondContact O-CD 3.47Å; G63-K93 WeakPolarHBondContact O-CE 3.32Å; G63-K93 PolarHBondContact O-NZ 2.95Å
64	V	91.6	Very high	92.9	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.03	27%	0.27	C	S	.	.			trans	-87.6	-33.5	-177.8	-176.4	0	0	0	0	112.7	T27 L62 K93 N120 A125	T27-V64 HydrophobicContact CG2-CG1 4.45Å; T27-V64 VanDerWaalsContact OG1-CG1 3.25Å; T27-V64 WeakPolarHBondContact OG1-CG1 3.37Å; L62-V64 VanDerWaalsContact C-N 3.26Å; L62-V64 HydrophobicContact CB-CG2 4.4Å; L62-V64 PolarHBondContact O-N 3.3Å; V64-K93 WeakPolarHBondContact O-CB 3.17Å; V64-K93 WeakPolarHBondContact O-CG 3.48Å; V64-K93 PolarHBondContact O-N 2.83Å; V64-N120 HydrophobicContact CG1-CB 4.01Å; V64-N120 HydrophobicContact CG2-CB 4.42Å; V64-A125 HydrophobicContact CG2-CB 3.29Å
65	F	94.5	Very high	92.6	Very high	9 Å²	9	48.6 Å²	48.6	4%	0.039	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	142.7	-175.3	-52.2	-64.4	0	0	0	111.3	L24 T27 V32 L59 L62 I68 V90 E91 E92 K93	L24-F65 HydrophobicContact CD2-CE1 3.65Å; L24-F65 HydrophobicContact CD2-CZ 3.69Å; T27-F65 HydrophobicContact CG2-CZ 4.32Å; V32-F65 HydrophobicContact CG2-CZ 4.43Å; L59-F65 HydrophobicContact CB-CD2 4.35Å; L59-F65 HydrophobicContact CB-CE2 4.46Å; L59-F65 HydrophobicContact CD2-CE2 4.09Å; L62-F65 HydrophobicContact CD1-CE2 4.47Å; F65-I68 HydrophobicContact CB-CD1 4.03Å; F65-I68 HydrophobicContact CB-CG1 3.77Å; F65-I68 HydrophobicContact CD2-CD1 4.22Å; F65-I68 HydrophobicContact CD2-CG1 4.42Å; F65-I68 HydrophobicContact CG-CG1 4.33Å; F65-V90 HydrophobicContact CD1-CB 3.72Å; F65-V90 HydrophobicContact CD1-CG1 4.39Å; F65-V90 HydrophobicContact CD1-CG2 3.94Å; F65-V90 HydrophobicContact CE1-CB 4.01Å; F65-V90 HydrophobicContact CE1-CG2 3.74Å; F65-V90 HydrophobicContact CG-CB 4.15Å; F65-V90 HydrophobicContact CG-CG1 4.44Å; F65-V90 HydrophobicContact CZ-CG2 4.39Å; F65-E91 CarbonylContact C-O 3.57Å; F65-E91 WeakPolarHBondContact CA-O 3.21Å; F65-E92 HydrophobicContact CD1-CG 3.96Å; F65-E92 HydrophobicContact CE1-CG 3.85Å; F65-K93 WeakPolarHBondContact O-CE 3.35Å
66	K	93	Very high	92.1	Very high	133 Å²	133	55.9 Å²	55.9	58%	0.578	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	-47	173.5	179.9	-176.5	152.2	-146.9	0	110.6	E91 K93	K66-E91 PolarHBondContact N-O 3.41Å; K66-E91 IonicContact NZ-OE1 3.64Å; K66-E91 PolarHBondContact NZ-OE1 2.97Å; K66-E91 IonicContact NZ-OE2 3.54Å; K66-E91 PolarHBondContact NZ-OE2 3.37Å; K66-K93 HydrophobicContact CB-CG 4.09Å
67	T	93.8	Very high	91.5	Very high	46 Å²	46	55.7 Å²	55.7	28%	0.282	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.9	177.4	61.5	0	0	0	0	110.4	E91	T67-E91 PolarHBondContact O-N 3.36Å; T67-E91 VanDerWaalsContact OG1-CB 3.24Å; T67-E91 WeakPolarHBondContact OG1-CB 3.48Å; T67-E91 PolarHBondContact OG1-OE2 3.32Å
68	I	95	Very high	90.8	Very high	19 Å²	19	60.7 Å²	60.7	10%	0.097	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	117.8	179.9	-57.1	161.3	0	0	0	108.2	K56 L59 A60 F65 F88 V90	K56-I68 WeakPolarHBondContact CE-O 3.43Å; K56-I68 HydrophobicContact CG-CB 4.45Å; K56-I68 HydrophobicContact CG-CG2 3.93Å; K56-I68 PolarHBondContact NZ-O 3.18Å; L59-I68 HydrophobicContact CB-CD1 3.7Å; L59-I68 HydrophobicContact CD1-CG2 4.4Å; A60-I68 VanDerWaalsContact CA-CD1 3.49Å; A60-I68 HydrophobicContact CB-CD1 3.84Å; A60-I68 VanDerWaalsContact N-CD1 3.27Å; F65-I68 HydrophobicContact CB-CD1 4.03Å; F65-I68 HydrophobicContact CB-CG1 3.77Å; F65-I68 HydrophobicContact CD2-CD1 4.22Å; F65-I68 HydrophobicContact CD2-CG1 4.42Å; F65-I68 HydrophobicContact CG-CG1 4.33Å; I68-F88 HydrophobicContact CG2-CD1 4.33Å; I68-V90 HydrophobicContact CG1-CG1 4.24Å; I68-V90 HydrophobicContact CG2-CG1 4.18Å
69	F	95	Very high	90.1	Very high	122 Å²	122	64.7 Å²	64.7	54%	0.535	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.3	172	-59.3	-82.6	0	0	0	109.2	F88 K89	F69-F88 CarbonylContact O-C 3.52Å; F69-F88 WeakPolarHBondContact O-CA 3.29Å; F69-K89 HydrophobicContact CB-CB 4.37Å; F69-K89 PolarHBondContact N-O 3.22Å; F69-K89 PolarHBondContact O-N 3.42Å
70	A	94.2	Very high	89.4	Confident	36 Å²	36	69.5 Å²	69.5	30%	0.298	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129	174.8	0	0	0	0	0	107.7	V52 F88	V52-A70 HydrophobicContact CG1-CB 3.7Å; A70-F88 HydrophobicContact CB-CD1 3.88Å; A70-F88 HydrophobicContact CB-CE1 3.69Å; A70-F88 HydrophobicContact CB-CZ 4.36Å
71	V	93.7	Very high	88.6	Confident	67 Å²	67	71.9 Å²	71.9	41%	0.406	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.4	176.2	-175.7	0	0	0	0	107.3	D73 I86 T87	V71-D73 WeakPolarHBondContact CG1-OD2 3.22Å; V71-I86 WeakPolarHBondContact O-CA 3.26Å; V71-T87 PolarHBondContact N-O 3.14Å; V71-T87 PolarHBondContact O-N 3.04Å
72	V	92.2	Very high	88.3	Confident	38 Å²	38	72.2 Å²	72.2	23%	0.23	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113	178.2	-178.7	0	0	0	0	106.7	L48 F49 V52 Y84	L48-V72 HydrophobicContact CD2-CG1 4.1Å; F49-V72 HydrophobicContact CE1-CB 4.46Å; F49-V72 HydrophobicContact CE1-CG2 4.28Å; V52-V72 HydrophobicContact CG2-CG2 4.17Å; V72-Y84 HydrophobicContact CG1-CD1 4.01Å; V72-Y84 HydrophobicContact CG1-CG 4.49Å
73	D	91.5	Very high	88.2	Confident	84 Å²	84	72.1 Å²	72.1	45%	0.449	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	157.5	180	-68.2	-41.8	0	0	0	110	V71 Y84 K85	V71-D73 WeakPolarHBondContact CG1-OD2 3.22Å; D73-Y84 CarbonylContact O-C 3.56Å; D73-Y84 WeakPolarHBondContact O-CA 3.45Å; D73-K85 PolarHBondContact N-O 3.38Å; D73-K85 PolarHBondContact O-N 2.87Å
74	V	89.9	Confident	88.2	Confident	98 Å²	98	72.8 Å²	72.8	59%	0.594	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	141.3	172.1	-176.9	0	0	0	0	108.6	Y84	V74-Y84 HydrophobicContact CG2-CD1 4.46Å; V74-Y84 HydrophobicContact CG2-CE1 4.12Å
75	S	87	Confident	88.3	Confident	14 Å²	14	75 Å²	75	10%	0.098	40%	0.397	C	S	.	.			trans	-63.3	147.5	178.3	-171.2	0	0	0	0	111.6	D17 D77 A83	D17-S75 WeakPolarHBondContact OD2-CB 3.42Å; D17-S75 PolarHBondContact OD2-OG 3Å; S75-D77 PolarHBondContact O-N 3.08Å; S75-D77 PolarHBondContact OG-N 3.29Å; S75-A83 WeakPolarHBondContact CB-O 3.48Å; S75-A83 PolarHBondContact N-O 2.9Å
76	E	83	Confident	88.3	Confident	154 Å²	154	74.5 Å²	74.5	72%	0.72	40%	0.395	S	S	*	.	S	Bend	trans	-68.9	-21.8	174.7	-65.9	174.7	-163.2	0	0	111.4	H78	E76-H78 PolarHBondContact O-N 3.24Å
77	D	81.9	Confident	88.4	Confident	88 Å²	88	69.8 Å²	69.8	47%	0.471	38%	0.377	S	S	.	.			trans	-73.8	89.7	177.4	-79.5	-12.6	0	0	0	111.3	S75 S79 K80	S75-D77 PolarHBondContact O-N 3.08Å; S75-D77 PolarHBondContact OG-N 3.29Å; D77-S79 PolarHBondContact O-N 3.24Å; D77-K80 PolarHBondContact O-N 3.24Å
78	H	77.3	Confident	88.5	Confident	183 Å²	183	67.6 Å²	67.6	85%	0.847	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-8.1	173.7	-63.6	-56.2	0	0	0	114.9	E76 K80	E76-H78 PolarHBondContact O-N 3.24Å; H78-K80 VanDerWaalsContact C-N 3.3Å
79	S	79.1	Confident	88.5	Confident	116 Å²	116	73.2 Å²	73.2	81%	0.811	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.1	175.2	-55.9	0	0	0	0	113.1	D77	D77-S79 PolarHBondContact O-N 3.24Å
80	K	78.7	Confident	88.5	Confident	101 Å²	101	67.8 Å²	67.8	44%	0.439	36%	0.364	S	S	.	.			trans	-124	94.4	179.6	-59.6	178.5	-160	160.5	0	109	D17 D77 H78 D82 A83	D17-K80 IonicContact OD1-NZ 2.79Å; D17-K80 PolarHBondContact OD1-NZ 2.77Å; D77-K80 PolarHBondContact O-N 3.24Å; H78-K80 VanDerWaalsContact C-N 3.3Å; K80-D82 PolarHBondContact O-N 3.27Å; K80-A83 HydrophobicContact CB-CB 3.54Å; K80-A83 HydrophobicContact CD-CB 4.15Å; K80-A83 WeakPolarHBondContact O-CB 3.32Å; K80-A83 PolarHBondContact O-N 3.46Å
81	P	77.2	Confident	88.5	Confident	104 Å²	104	69.9 Å²	69.9	68%	0.675	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.5	-175.6	25.6	-34.1	0	0	0	113.5
82	D	84.6	Confident	88.5	Confident	70 Å²	70	67.7 Å²	67.7	37%	0.374	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	15.3	-176.1	-52.5	-31.1	0	0	0	112.5	T15 K80	T15-D82 PolarHBondContact N-O 2.81Å; T15-D82 PolarHBondContact OG1-O 2.91Å; T15-D82 VanDerWaalsContact OG1-O 3.04Å; K80-D82 PolarHBondContact O-N 3.27Å
83	A	88.9	Confident	88.6	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	128.5	-176.5	0	0	0	0	0	111.9	T15 D17 S75 K80	T15-A83 WeakPolarHBondContact O-CA 3.49Å; D17-A83 HydrophobicContact CB-CB 4.02Å; S75-A83 WeakPolarHBondContact CB-O 3.48Å; S75-A83 PolarHBondContact N-O 2.9Å; K80-A83 HydrophobicContact CB-CB 3.54Å; K80-A83 HydrophobicContact CD-CB 4.15Å; K80-A83 WeakPolarHBondContact O-CB 3.32Å; K80-A83 PolarHBondContact O-N 3.46Å
84	Y	91.2	Very high	88.7	Confident	42 Å²	42	75.5 Å²	75.5	17%	0.165	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.2	179.6	-67.8	-90.5	0	0	0	111.7	A14 T15 D17 L45 L48 V72 D73 V74	A14-Y84 HydrophobicContact CB-CD2 3.78Å; A14-Y84 HydrophobicContact CB-CE2 3.57Å; T15-Y84 PolarHBondContact O-N 2.83Å; D17-Y84 PolarHBondContact N-O 3.2Å; L45-Y84 HydrophobicContact CD1-CE1 4.42Å; L45-Y84 HydrophobicContact CD1-CE2 4.26Å; L48-Y84 HydrophobicContact CD2-CD2 4.08Å; L48-Y84 HydrophobicContact CD2-CG 3.97Å; V72-Y84 HydrophobicContact CG1-CD1 4.01Å; V72-Y84 HydrophobicContact CG1-CG 4.49Å; D73-Y84 CarbonylContact O-C 3.56Å; D73-Y84 WeakPolarHBondContact O-CA 3.45Å; V74-Y84 HydrophobicContact CG2-CD1 4.46Å; V74-Y84 HydrophobicContact CG2-CE1 4.12Å
85	K	92.4	Very high	88.8	Confident	50 Å²	50	75.7 Å²	75.7	22%	0.217	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.4	172.2	179.3	170.5	-179.2	148.7	0	109.7	E18 D73	E18-K85 HydrophobicContact CB-CG 4.34Å; E18-K85 WeakPolarHBondContact OE2-CE 3.42Å; E18-K85 IonicContact OE2-NZ 2.75Å; E18-K85 PolarHBondContact OE2-NZ 3.14Å; D73-K85 PolarHBondContact N-O 3.38Å; D73-K85 PolarHBondContact O-N 2.87Å
86	I	94.6	Very high	89.2	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.6	-176.9	-49.4	170.8	0	0	0	108.9	V16 E18 V19 V20 L39 L48 V52 V71 F88	V16-I86 HydrophobicContact CB-CD1 4.49Å; V16-I86 HydrophobicContact CG1-CD1 3.76Å; V16-I86 HydrophobicContact CG1-CG1 4.35Å; V16-I86 HydrophobicContact CG2-CD1 3.9Å; E18-I86 PolarHBondContact O-N 3.27Å; V19-I86 CarbonylContact C-O 3.6Å; V19-I86 WeakPolarHBondContact CA-O 3.39Å; V19-I86 HydrophobicContact CG2-CD1 4.46Å; V20-I86 PolarHBondContact N-O 3.45Å; L39-I86 HydrophobicContact CD1-CD1 3.75Å; L39-I86 HydrophobicContact CD2-CD1 3.73Å; L39-I86 HydrophobicContact CD2-CG2 4.46Å; L39-I86 HydrophobicContact CG-CD1 3.79Å; L48-I86 HydrophobicContact CD1-CD1 3.67Å; V52-I86 HydrophobicContact CG2-CD1 4.06Å; V52-I86 HydrophobicContact CG2-CG2 4.15Å; V71-I86 WeakPolarHBondContact O-CA 3.26Å; I86-F88 HydrophobicContact CG2-CD2 4.06Å; I86-F88 HydrophobicContact CG2-CE2 3.53Å; I86-F88 HydrophobicContact CG2-CZ 4.13Å
87	T	94.7	Very high	89.7	Confident	34 Å²	34	73.1 Å²	73.1	21%	0.209	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115.2	179.2	-56.8	0	0	0	0	110.3	V20 V71	V20-T87 HydrophobicContact CB-CG2 4.45Å; V20-T87 CarbonylContact O-C 3.49Å; V20-T87 WeakPolarHBondContact O-CA 3.45Å; V71-T87 PolarHBondContact N-O 3.14Å; V71-T87 PolarHBondContact O-N 3.04Å
88	F	95.7	Very high	90.3	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	113.9	169.6	-72	-88.3	0	0	0	109.8	V19 V20 V21 S22 F36 L39 V52 A55 K56 L59 I68 F69 A70 I86	V19-F88 HydrophobicContact CG1-CD2 4Å; V19-F88 HydrophobicContact CG1-CE2 4.09Å; V20-F88 PolarHBondContact O-N 3.37Å; V21-F88 CarbonylContact C-O 3.46Å; V21-F88 WeakPolarHBondContact CA-O 3.32Å; V21-F88 HydrophobicContact CG1-CB 4.36Å; V21-F88 HydrophobicContact CG2-CB 4.35Å; S22-F88 PolarHBondContact N-O 3.46Å; F36-F88 AromaticContact CD1-CE2 3.97Å; F36-F88 HydrophobicContact CD1-CE2 3.97Å; F36-F88 HydrophobicContact CD1-CZ 4.37Å; F36-F88 HydrophobicContact CE1-CD1 4.49Å; F36-F88 AromaticContact CE1-CD2 3.61Å; F36-F88 HydrophobicContact CE1-CD2 3.61Å; F36-F88 HydrophobicContact CE1-CE1 4.3Å; F36-F88 AromaticContact CE1-CE2 3.38Å; F36-F88 HydrophobicContact CE1-CE2 3.38Å; F36-F88 HydrophobicContact CE1-CG 4.17Å; F36-F88 AromaticContact CE1-CZ 3.76Å; F36-F88 HydrophobicContact CE1-CZ 3.76Å; F36-F88 AromaticContact CZ-CD2 3.79Å; F36-F88 HydrophobicContact CZ-CD2 3.79Å; F36-F88 HydrophobicContact CZ-CE2 4.06Å; F36-F88 HydrophobicContact CZ-CG 4.21Å; L39-F88 HydrophobicContact CD2-CE2 3.76Å; L39-F88 HydrophobicContact CD2-CZ 4.05Å; V52-F88 HydrophobicContact CG1-CZ 4.25Å; A55-F88 HydrophobicContact CB-CZ 4.02Å; K56-F88 HydrophobicContact CB-CE1 4.38Å; L59-F88 HydrophobicContact CD1-CD1 3.91Å; L59-F88 HydrophobicContact CD1-CE1 4.28Å; L59-F88 HydrophobicContact CD1-CG 4.34Å; I68-F88 HydrophobicContact CG2-CD1 4.33Å; F69-F88 CarbonylContact O-C 3.52Å; F69-F88 WeakPolarHBondContact O-CA 3.29Å; A70-F88 HydrophobicContact CB-CD1 3.88Å; A70-F88 HydrophobicContact CB-CE1 3.69Å; A70-F88 HydrophobicContact CB-CZ 4.36Å; I86-F88 HydrophobicContact CG2-CD2 4.06Å; I86-F88 HydrophobicContact CG2-CE2 3.53Å; I86-F88 HydrophobicContact CG2-CZ 4.13Å
89	K	95.7	Very high	90.9	Very high	137 Å²	137	69.6 Å²	69.6	60%	0.596	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.7	172	-172.3	175	-176.6	175.4	0	108.9	F69	F69-K89 HydrophobicContact CB-CB 4.37Å; F69-K89 PolarHBondContact N-O 3.22Å; F69-K89 PolarHBondContact O-N 3.42Å
90	V	95.4	Very high	91.3	Very high	8 Å²	8	72.7 Å²	72.7	5%	0.048	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	146.6	-176.1	-59.9	0	0	0	0	111.3	V21 S22 G23 L24 F65 I68	V21-V90 HydrophobicContact CG1-CG1 4.35Å; V21-V90 HydrophobicContact CG1-CG2 4Å; S22-V90 WeakPolarHBondContact O-CG2 3.3Å; S22-V90 PolarHBondContact O-N 2.79Å; G23-V90 WeakPolarHBondContact CA-O 3.43Å; L24-V90 HydrophobicContact CD2-CG2 3.84Å; L24-V90 HydrophobicContact CG-CG2 4.29Å; F65-V90 HydrophobicContact CD1-CB 3.72Å; F65-V90 HydrophobicContact CD1-CG1 4.39Å; F65-V90 HydrophobicContact CD1-CG2 3.94Å; F65-V90 HydrophobicContact CE1-CB 4.01Å; F65-V90 HydrophobicContact CE1-CG2 3.74Å; F65-V90 HydrophobicContact CG-CB 4.15Å; F65-V90 HydrophobicContact CG-CG1 4.44Å; F65-V90 HydrophobicContact CZ-CG2 4.39Å; I68-V90 HydrophobicContact CG1-CG1 4.24Å; I68-V90 HydrophobicContact CG2-CG1 4.18Å
91	E	94.7	Very high	91.5	Very high	80 Å²	80	71 Å²	71	37%	0.374	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116.3	170.6	-173.6	-168.1	170.4	0	0	108.1	F65 K66 T67	F65-E91 CarbonylContact C-O 3.57Å; F65-E91 WeakPolarHBondContact CA-O 3.21Å; K66-E91 PolarHBondContact N-O 3.41Å; K66-E91 IonicContact NZ-OE1 3.64Å; K66-E91 PolarHBondContact NZ-OE1 2.97Å; K66-E91 IonicContact NZ-OE2 3.54Å; K66-E91 PolarHBondContact NZ-OE2 3.37Å; T67-E91 PolarHBondContact O-N 3.36Å; T67-E91 VanDerWaalsContact OG1-CB 3.24Å; T67-E91 WeakPolarHBondContact OG1-CB 3.48Å; T67-E91 PolarHBondContact OG1-OE2 3.32Å
92	E	93.6	Very high	91.7	Very high	21 Å²	21	72.7 Å²	72.7	10%	0.098	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	145.9	176.7	-70.7	-168.2	-173	0	0	112.3	D25 R26 T27 F65	D25-E92 PolarHBondContact N-OE1 3.46Å; R26-E92 WeakPolarHBondContact CB-OE2 3.47Å; R26-E92 PolarHBondContact N-OE1 3.22Å; R26-E92 VanDerWaalsContact N-OE1 3.15Å; R26-E92 PolarHBondContact N-OE2 2.83Å; R26-E92 VanDerWaalsContact N-OE2 3.12Å; T27-E92 WeakPolarHBondContact CB-OE1 3.38Å; T27-E92 PolarHBondContact N-OE1 3.5Å; T27-E92 PolarHBondContact OG1-OE1 3.39Å; T27-E92 PolarHBondContact OG1-OE2 2.85Å; F65-E92 HydrophobicContact CD1-CG 3.96Å; F65-E92 HydrophobicContact CE1-CG 3.85Å
93	K	93.2	Very high	91.5	Very high	72 Å²	72	72 Å²	72	31%	0.313	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-67.5	149.2	169.2	-70.3	176.7	-175	170.6	0	110.4	G63 V64 F65 K66 N119	G63-K93 WeakPolarHBondContact O-CD 3.47Å; G63-K93 WeakPolarHBondContact O-CE 3.32Å; G63-K93 PolarHBondContact O-NZ 2.95Å; V64-K93 WeakPolarHBondContact O-CB 3.17Å; V64-K93 WeakPolarHBondContact O-CG 3.48Å; V64-K93 PolarHBondContact O-N 2.83Å; F65-K93 WeakPolarHBondContact O-CE 3.35Å; K66-K93 HydrophobicContact CB-CG 4.09Å; K93-N119 HydrophobicContact CB-CB 4.47Å
94	R	93.9	Very high	91	Very high	214 Å²	214	77.4 Å²	77.4	81%	0.808	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-55	148.3	171.8	-66.9	-175.2	177.1	-174.9	-1	110.9	V96 N119	R94-V96 VanDerWaalsContact C-N 3.28Å; R94-V96 PolarHBondContact O-N 3.23Å; R94-N119 PolarHBondContact O-ND2 3.07Å
95	F	92.5	Very high	90	Very high	101 Å²	101	76 Å²	76	44%	0.443	37%	0.372	S	S	.	.	S	Bend	trans	-54.7	-44.7	179.1	176.9	-120.7	0	0	0	112.5	R26 L118 N119 F121	R26-F95 VanDerWaalsContact NH2-CD2 3.28Å; F95-L118 HydrophobicContact CE1-CD2 4.3Å; F95-L118 HydrophobicContact CZ-CD2 4.4Å; F95-L118 CarbonylContact O-C 3.54Å; F95-L118 WeakPolarHBondContact O-CA 3.35Å; F95-N119 PolarHBondContact O-N 3.46Å; F95-F121 HydrophobicContact CE2-CB 3.97Å
96	V	95.1	Very high	88.8	Confident	70 Å²	70	75 Å²	75	42%	0.424	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.2	175.6	-171	0	0	0	0	109.1	R94 V116 R117 L118	R94-V96 VanDerWaalsContact C-N 3.28Å; R94-V96 PolarHBondContact O-N 3.23Å; V96-V116 HydrophobicContact CG1-CG1 3.93Å; V96-R117 CarbonylContact C-O 3.58Å; V96-R117 WeakPolarHBondContact CA-O 3.37Å; V96-L118 HydrophobicContact CB-CD2 4.45Å; V96-L118 HydrophobicContact CG1-CD2 4.32Å; V96-L118 HydrophobicContact CG2-CD2 3.75Å
97	T	93.6	Very high	87.6	Confident	44 Å²	44	76.6 Å²	76.6	27%	0.27	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	112.3	168.9	-61	0	0	0	0	108	R99 R117 N119	T97-R99 HydrophobicContact CG2-CG 4.33Å; T97-R117 PolarHBondContact N-O 3.03Å; T97-R117 PolarHBondContact O-N 3.16Å; T97-N119 PolarHBondContact OG1-ND2 2.86Å
98	A	93.5	Very high	86.6	Confident	73 Å²	73	76.6 Å²	76.6	60%	0.603	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.3	171.8	0	0	0	0	0	109.1	N115	A98-N115 CarbonylContact C-O 3.57Å; A98-N115 VanDerWaalsContact CA-O 3.3Å; A98-N115 WeakPolarHBondContact CA-O 3.36Å
99	R	90.5	Very high	85.9	Confident	125 Å²	125	77.1 Å²	77.1	47%	0.472	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.4	172.8	-67.4	178.4	-74.2	-173.2	-0	107.8	T97 G114 N115 R117	T97-R99 HydrophobicContact CG2-CG 4.33Å; R99-G114 CarbonylContact O-C 3.59Å; R99-G114 WeakPolarHBondContact O-CA 3.36Å; R99-N115 HydrophobicContact CB-CB 4.26Å; R99-N115 PolarHBondContact N-O 3.28Å; R99-N115 PolarHBondContact NE-OD1 3Å; R99-N115 PolarHBondContact NH2-OD1 3.3Å; R99-N115 PolarHBondContact O-N 2.92Å; R99-R117 VanDerWaalsContact NH2-CZ 3.35Å; R99-R117 VanDerWaalsContact NH2-NH2 3.16Å
100	M	88	Confident	85.3	Confident	180 Å²	180	72.9 Å²	72.9	89%	0.887	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.7	172	-65.4	177.3	68.3	0	0	107.1	C113	M100-C113 CarbonylContact C-O 3.58Å; M100-C113 WeakPolarHBondContact CA-O 3.37Å
101	S	82.2	Confident	85	Confident	65 Å²	65	74.5 Å²	74.5	46%	0.455	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.5	175.7	57.1	0	0	0	0	108.9	C113	S101-C113 PolarHBondContact N-O 3Å; S101-C113 PolarHBondContact O-N 3.11Å; S101-C113 WeakPolarHBondContact OG-CB 3.45Å
102	M	82.3	Confident	84.8	Confident	141 Å²	141	72.5 Å²	72.5	70%	0.695	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.9	171.3	-165.6	70.8	147.8	0	0	107.4	K111 A112	M102-K111 WeakPolarHBondContact CA-O 3.08Å; M102-A112 HydrophobicContact CE-CB 4.32Å; M102-A112 WeakPolarHBondContact SD-CA 3.35Å; M102-A112 HydrophobicContact SD-CB 3.49Å; M102-A112 WeakPolarHBondContact SD-CB 3.46Å
103	T	80.5	Confident	84.6	Confident	56 Å²	56	73.1 Å²	73.1	34%	0.344	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.8	-178.7	-52.5	0	0	0	0	108.6	K111	T103-K111 PolarHBondContact N-O 2.92Å; T103-K111 PolarHBondContact O-N 2.66Å
104	Y	76.7	Confident	84.6	Confident	113 Å²	113	70.9 Å²	70.9	44%	0.443	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	112.8	169	-171.2	-79.3	0	0	0	108	G108 T110 F502	Y104-G108 PolarHBondContact OH-O 2.81Å; Y104-T110 HydrophobicContact CD2-CG2 3.24Å; Y104-T110 HydrophobicContact CE2-CG2 3.69Å; Y104-T110 HydrophobicContact CG-CG2 4.2Å; Y104-F502 HydrophobicContact CD1-CD2 4.19Å; Y104-F502 AromaticContact CD1-CE2 3.78Å; Y104-F502 HydrophobicContact CD1-CE2 3.78Å; Y104-F502 AromaticContact CG-CE2 3.95Å; Y104-F502 HydrophobicContact CG-CE2 3.95Å; Y104-F502 WeakPolarHBondContact O-CD2 3.2Å
105	G	70.1	Confident	84.7	Confident	11 Å²	11	61.3 Å²	61.3	11%	0.113	35%	0.346	C	S	.	.			trans	-70	157.5	-177.4	0	0	0	0	0	113.1	D107 G108 I109	G105-D107 VanDerWaalsContact C-OD1 3.29Å; G105-D107 WeakPolarHBondContact CA-OD1 3.36Å; G105-D107 PolarHBondContact O-N 3.39Å; G105-G108 PolarHBondContact O-N 3.5Å; G105-I109 WeakPolarHBondContact CA-O 3.35Å; G105-I109 PolarHBondContact N-O 2.83Å
106	T	67.8	Low	84.9	Confident	30 Å²	30	59.5 Å²	59.5	18%	0.184	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-24.3	178.1	45.6	0	0	0	0	114.2	G108 P333 L334 W341	T106-G108 PolarHBondContact O-N 2.78Å; T106-P333 HydrophobicContact CG2-CG 3.69Å; T106-P333 WeakPolarHBondContact O-CD 3.33Å; T106-P333 WeakPolarHBondContact O-CG 3.47Å; T106-L334 HydrophobicContact CG2-CB 3.95Å; T106-L334 HydrophobicContact CG2-CD1 3.36Å; T106-L334 HydrophobicContact CG2-CG 3.36Å; T106-W341 VanDerWaalsContact CB-CZ3 3.47Å; T106-W341 WeakPolarHBondContact OG1-CH2 3.38Å; T106-W341 WeakPolarHBondContact OG1-CZ3 3.41Å
107	D	70.5	Confident	84.8	Confident	34 Å²	34	59.6 Å²	59.6	18%	0.182	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-7.9	169.1	48.9	8.1	0	0	0	113.1	G105 I109 W341	G105-D107 VanDerWaalsContact C-OD1 3.29Å; G105-D107 WeakPolarHBondContact CA-OD1 3.36Å; G105-D107 PolarHBondContact O-N 3.39Å; D107-I109 HydrophobicContact CB-CD1 4.07Å; D107-I109 HydrophobicContact CB-CG1 4.38Å; D107-I109 WeakPolarHBondContact OD1-CB 3.49Å; D107-I109 PolarHBondContact OD1-N 3.02Å; D107-I109 VanDerWaalsContact OD2-CD1 3.27Å; D107-I109 WeakPolarHBondContact OD2-CD1 3.5Å; D107-W341 HydrophobicContact CB-CD2 3.8Å; D107-W341 HydrophobicContact CB-CE3 4.43Å; D107-W341 HydrophobicContact CB-CG 3.86Å; D107-W341 HydrophobicContact CB-CZ2 4.41Å
108	G	72.9	Confident	85	Confident	33 Å²	33	60.1 Å²	60.1	34%	0.34	34%	0.337	S	S	.	.	S	Bend	trans	86.5	7.5	-173.1	0	0	0	0	0	113.7	Y104 G105 T106	Y104-G108 PolarHBondContact OH-O 2.81Å; G105-G108 PolarHBondContact O-N 3.5Å; T106-G108 PolarHBondContact O-N 2.78Å
109	I	80.7	Confident	85	Confident	11 Å²	11	57 Å²	57	6%	0.056	31%	0.31	C	S	.	.			trans	-93.5	124.4	-178.4	-65.9	162.7	0	0	0	109.1	G105 D107 K111 S136 N137 Y170	G105-I109 WeakPolarHBondContact CA-O 3.35Å; G105-I109 PolarHBondContact N-O 2.83Å; D107-I109 HydrophobicContact CB-CD1 4.07Å; D107-I109 HydrophobicContact CB-CG1 4.38Å; D107-I109 WeakPolarHBondContact OD1-CB 3.49Å; D107-I109 PolarHBondContact OD1-N 3.02Å; D107-I109 VanDerWaalsContact OD2-CD1 3.27Å; D107-I109 WeakPolarHBondContact OD2-CD1 3.5Å; I109-K111 HydrophobicContact CG2-CG 4.2Å; I109-S136 WeakPolarHBondContact CG2-OG 3.19Å; I109-N137 HydrophobicContact CD1-CB 3.77Å; I109-N137 WeakPolarHBondContact CD1-ND2 3.24Å; I109-N137 HydrophobicContact CG1-CB 4.01Å; I109-N137 HydrophobicContact CG2-CB 4.33Å; I109-N137 VanDerWaalsContact CG2-OD1 3.31Å; I109-N137 WeakPolarHBondContact CG2-OD1 3.26Å; I109-Y170 HydrophobicContact CD1-CE1 4.33Å
110	T	84.4	Confident	85	Confident	49 Å²	49	51.3 Å²	51.3	30%	0.301	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	129.1	170.8	44.5	0	0	0	0	109.8	Y104 G135 S136	Y104-T110 HydrophobicContact CD2-CG2 3.24Å; Y104-T110 HydrophobicContact CE2-CG2 3.69Å; Y104-T110 HydrophobicContact CG-CG2 4.2Å; T110-G135 CarbonylContact O-C 3.58Å; T110-G135 VanDerWaalsContact O-CA 3.26Å; T110-G135 WeakPolarHBondContact O-CA 3.38Å; T110-S136 PolarHBondContact N-OG 3.22Å; T110-S136 PolarHBondContact O-N 3.37Å; T110-S136 VanDerWaalsContact OG1-CB 3.3Å; T110-S136 WeakPolarHBondContact OG1-CB 3.31Å; T110-S136 PolarHBondContact OG1-OG 2.8Å
111	K	87.8	Confident	85.1	Confident	41 Å²	41	46.9 Å²	46.9	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	118.5	-178.5	-66.9	168.5	163.3	-142.2	0	109.5	M102 T103 I109 E133 I134	M102-K111 WeakPolarHBondContact CA-O 3.08Å; T103-K111 PolarHBondContact N-O 2.92Å; T103-K111 PolarHBondContact O-N 2.66Å; I109-K111 HydrophobicContact CG2-CG 4.2Å; K111-E133 HydrophobicContact CB-CG 4.33Å; K111-E133 WeakPolarHBondContact CD-OE1 3.46Å; K111-E133 VanDerWaalsContact CE-OE1 3.27Å; K111-E133 WeakPolarHBondContact CE-OE1 3.49Å; K111-E133 IonicContact NZ-OE1 3.67Å; K111-E133 PolarHBondContact NZ-OE1 3.34Å; K111-I134 CarbonylContact C-O 3.51Å; K111-I134 VanDerWaalsContact CA-O 3.32Å; K111-I134 WeakPolarHBondContact CA-O 3.45Å
112	A	90.1	Very high	85.5	Confident	39 Å²	39	46 Å²	46	32%	0.322	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114	169	0	0	0	0	0	108.7	M102 E133 I134	M102-A112 HydrophobicContact CE-CB 4.32Å; M102-A112 WeakPolarHBondContact SD-CA 3.35Å; M102-A112 HydrophobicContact SD-CB 3.49Å; M102-A112 WeakPolarHBondContact SD-CB 3.46Å; A112-E133 CarbonylContact O-C 3.52Å; A112-E133 WeakPolarHBondContact O-CA 3.49Å; A112-I134 PolarHBondContact N-O 2.82Å; A112-I134 PolarHBondContact O-N 2.85Å
113	C	90	Very high	85.9	Confident	33 Å²	33	47 Å²	47	22%	0.223	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.5	175.6	-43.5	0	0	0	0	110.1	M100 S101 V132	M100-C113 CarbonylContact C-O 3.58Å; M100-C113 WeakPolarHBondContact CA-O 3.37Å; S101-C113 PolarHBondContact N-O 3Å; S101-C113 PolarHBondContact O-N 3.11Å; S101-C113 WeakPolarHBondContact OG-CB 3.45Å; C113-V132 CarbonylContact C-O 3.59Å; C113-V132 VanDerWaalsContact CA-O 3.31Å; C113-V132 WeakPolarHBondContact CA-O 3.32Å
114	G	94.1	Very high	86.4	Confident	25 Å²	25	49.1 Å²	49.1	26%	0.258	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.8	170.2	0	0	0	0	0	110.1	R99 D131 V132	R99-G114 CarbonylContact O-C 3.59Å; R99-G114 WeakPolarHBondContact O-CA 3.36Å; G114-D131 CarbonylContact O-C 3.53Å; G114-D131 WeakPolarHBondContact O-CA 3.41Å; G114-V132 PolarHBondContact N-O 2.81Å; G114-V132 PolarHBondContact O-N 2.81Å
115	N	94.6	Very high	87.1	Confident	13 Å²	13	43.9 Å²	43.9	7%	0.07	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.3	173.4	169.3	-112.9	0	0	0	109	A98 R99 D129 I130 D131	A98-N115 CarbonylContact C-O 3.57Å; A98-N115 VanDerWaalsContact CA-O 3.3Å; A98-N115 WeakPolarHBondContact CA-O 3.36Å; R99-N115 HydrophobicContact CB-CB 4.26Å; R99-N115 PolarHBondContact N-O 3.28Å; R99-N115 PolarHBondContact NE-OD1 3Å; R99-N115 PolarHBondContact NH2-OD1 3.3Å; R99-N115 PolarHBondContact O-N 2.92Å; N115-D129 PolarHBondContact ND2-OD1 3.27Å; N115-D129 VanDerWaalsContact ND2-OD1 3.16Å; N115-I130 CarbonylContact C-O 3.56Å; N115-I130 WeakPolarHBondContact CA-O 3.5Å; N115-D131 WeakPolarHBondContact CB-OD1 3.38Å; N115-D131 VanDerWaalsContact CG-OD1 3.22Å; N115-D131 PolarHBondContact ND2-OD1 2.78Å
116	V	96.5	Very high	88.2	Confident	63 Å²	63	44 Å²	44	38%	0.382	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	114.9	169.5	-179	0	0	0	0	108.1	V96 I130	V96-V116 HydrophobicContact CG1-CG1 3.93Å; V116-I130 PolarHBondContact N-O 2.89Å; V116-I130 PolarHBondContact O-N 2.88Å
117	R	95	Very high	89.4	Confident	73 Å²	73	43.3 Å²	43.3	28%	0.275	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.8	179.7	-175.4	175.4	-63.3	-151.6	-14.2	111.3	V96 T97 R99 N119 A128 D129	V96-R117 CarbonylContact C-O 3.58Å; V96-R117 WeakPolarHBondContact CA-O 3.37Å; T97-R117 PolarHBondContact N-O 3.03Å; T97-R117 PolarHBondContact O-N 3.16Å; R99-R117 VanDerWaalsContact NH2-CZ 3.35Å; R99-R117 VanDerWaalsContact NH2-NH2 3.16Å; R117-N119 WeakPolarHBondContact CD-OD1 3.17Å; R117-N119 WeakPolarHBondContact CG-OD1 3.48Å; R117-A128 CarbonylContact C-O 3.51Å; R117-A128 WeakPolarHBondContact CA-O 3.44Å; R117-D129 WeakPolarHBondContact CB-OD1 3.48Å; R117-D129 WeakPolarHBondContact CG-OD1 3.39Å; R117-D129 IonicContact CZ-OD1 2.78Å; R117-D129 IonicContact CZ-OD2 3.44Å; R117-D129 VanDerWaalsContact NE-CG 3.34Å; R117-D129 IonicContact NE-OD1 3.39Å; R117-D129 PolarHBondContact NE-OD1 3.41Å; R117-D129 IonicContact NE-OD2 3.75Å; R117-D129 PolarHBondContact NE-OD2 3.46Å; R117-D129 IonicContact NH2-OD1 2.88Å; R117-D129 PolarHBondContact NH2-OD1 2.98Å; R117-D129 IonicContact NH2-OD2 2.86Å; R117-D129 PolarHBondContact NH2-OD2 3.27Å
118	L	95.9	Very high	90.6	Very high	55 Å²	55	42.5 Å²	42.5	29%	0.288	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	107.4	168.4	-55.7	-179.5	0	0	0	109	F95 V96 F121 C127 A128	F95-L118 HydrophobicContact CE1-CD2 4.3Å; F95-L118 HydrophobicContact CZ-CD2 4.4Å; F95-L118 CarbonylContact O-C 3.54Å; F95-L118 WeakPolarHBondContact O-CA 3.35Å; V96-L118 HydrophobicContact CB-CD2 4.45Å; V96-L118 HydrophobicContact CG1-CD2 4.32Å; V96-L118 HydrophobicContact CG2-CD2 3.75Å; L118-F121 HydrophobicContact CB-CB 4.49Å; L118-C127 VanDerWaalsContact O-CA 3.26Å; L118-C127 WeakPolarHBondContact O-CA 3.13Å; L118-A128 HydrophobicContact CB-CB 4.25Å; L118-A128 HydrophobicContact CD1-CB 4.38Å; L118-A128 PolarHBondContact N-O 3.12Å; L118-A128 PolarHBondContact O-N 2.97Å; L118-A128 VanDerWaalsContact O-N 3.1Å
119	N	93.3	Very high	91.7	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.043	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	132.4	-178.2	-61.5	-51.4	0	0	0	111.3	R26 K93 R94 F95 T97 R117 F121	R26-N119 PolarHBondContact NH1-O 3.48Å; R26-N119 PolarHBondContact NH2-O 2.89Å; K93-N119 HydrophobicContact CB-CB 4.47Å; R94-N119 PolarHBondContact O-ND2 3.07Å; F95-N119 PolarHBondContact O-N 3.46Å; T97-N119 PolarHBondContact OG1-ND2 2.86Å; R117-N119 WeakPolarHBondContact CD-OD1 3.17Å; R117-N119 WeakPolarHBondContact CG-OD1 3.48Å; N119-F121 VanDerWaalsContact C-N 3.28Å; N119-F121 PolarHBondContact O-N 3.22Å
120	N	90.7	Very high	92.5	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	37	171.4	-166.7	28	0	0	0	113.6	R26 T27 V64 A122 R123 R124 A125 E126	R26-N120 PolarHBondContact NH2-O 3.15Å; T27-N120 WeakPolarHBondContact CA-ND2 3.44Å; T27-N120 PolarHBondContact OG1-ND2 3.27Å; V64-N120 HydrophobicContact CG1-CB 4.01Å; V64-N120 HydrophobicContact CG2-CB 4.42Å; N120-A122 VanDerWaalsContact C-N 3.28Å; N120-A122 PolarHBondContact O-N 3.19Å; N120-R123 PolarHBondContact O-N 2.97Å; N120-R123 WeakPolarHBondContact OD1-CA 3.39Å; N120-R123 PolarHBondContact OD1-N 3.46Å; N120-R124 PolarHBondContact OD1-N 3.24Å; N120-R124 VanDerWaalsContact OD1-N 3.13Å; N120-A125 PolarHBondContact OD1-N 2.86Å; N120-E126 CarbonylContact C-O 3.58Å; N120-E126 WeakPolarHBondContact CA-O 3.36Å; N120-E126 PolarHBondContact N-O 3.1Å
121	F	91.6	Very high	93	Very high	87 Å²	87	45.7 Å²	45.7	38%	0.382	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.7	-167.6	73.4	-91.9	0	0	0	113.4	F95 L118 N119 E126 A128 I146	F95-F121 HydrophobicContact CE2-CB 3.97Å; L118-F121 HydrophobicContact CB-CB 4.49Å; N119-F121 VanDerWaalsContact C-N 3.28Å; N119-F121 PolarHBondContact O-N 3.22Å; F121-E126 HydrophobicContact CD1-CB 3.96Å; F121-E126 HydrophobicContact CE1-CB 3.47Å; F121-E126 VanDerWaalsContact CE1-CB 3.47Å; F121-E126 HydrophobicContact CZ-CB 3.92Å; F121-E126 PolarHBondContact N-O 3.12Å; F121-A128 HydrophobicContact CD1-CB 4.31Å; F121-A128 HydrophobicContact CE1-CB 4.24Å; F121-I146 HydrophobicContact CE1-CG2 4.28Å; F121-I146 HydrophobicContact CZ-CG2 4.18Å
122	A	90	Very high	93.3	Very high	48 Å²	48	46.4 Å²	46.4	40%	0.397	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	17.3	175.2	0	0	0	0	0	113.8	N120 R124 E126	N120-A122 VanDerWaalsContact C-N 3.28Å; N120-A122 PolarHBondContact O-N 3.19Å; A122-R124 PolarHBondContact O-N 2.99Å; A122-E126 HydrophobicContact CB-CB 4.45Å; A122-E126 HydrophobicContact CB-CG 4.26Å; A122-E126 WeakPolarHBondContact CB-OE2 3.42Å
123	R	90.5	Very high	93.5	Very high	162 Å²	162	46.4 Å²	46.4	61%	0.611	24%	0.239	S	C	*	.	S	Bend	trans	66.2	5.3	175.4	-54.3	-175.8	-175	178.7	-0.6	116.4	R26 H28 N120	R26-R123 VanDerWaalsContact O-CB 3.3Å; R26-R123 WeakPolarHBondContact O-CB 3.18Å; R26-R123 WeakPolarHBondContact O-CD 3.49Å; R26-R123 VanDerWaalsContact O-CG 3.32Å; R26-R123 WeakPolarHBondContact O-CG 3.38Å; H28-R123 HydrophobicContact CB-CB 4.5Å; H28-R123 WeakPolarHBondContact CB-O 3.36Å; H28-R123 PolarHBondContact N-O 3.01Å; N120-R123 PolarHBondContact O-N 2.97Å; N120-R123 WeakPolarHBondContact OD1-CA 3.39Å; N120-R123 PolarHBondContact OD1-N 3.46Å
124	R	91	Very high	93.6	Very high	100 Å²	100	49.1 Å²	49.1	38%	0.377	25%	0.25	S	S	.	.	S	Bend	trans	-123.6	42.4	177.6	-51.2	171.2	171.3	-89.5	-2.1	112	I31 N120 A122 E126	I31-R124 VanDerWaalsContact CD1-C 3.43Å; I31-R124 HydrophobicContact CD1-CB 4.33Å; I31-R124 WeakPolarHBondContact CD1-O 3.49Å; N120-R124 PolarHBondContact OD1-N 3.24Å; N120-R124 VanDerWaalsContact OD1-N 3.13Å; A122-R124 PolarHBondContact O-N 2.99Å; R124-E126 WeakPolarHBondContact CA-OE2 3.42Å; R124-E126 WeakPolarHBondContact CB-OE1 3.36Å; R124-E126 WeakPolarHBondContact CB-OE2 3.14Å; R124-E126 PolarHBondContact N-OE2 3.23Å; R124-E126 PolarHBondContact O-N 3.24Å
125	A	91.3	Very high	93.4	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.025	24%	0.241	C	C	.	.	S	Bend	trans	63.2	21.9	178.4	0	0	0	0	0	115.4	I31 L62 V64 N120 P149	I31-A125 HydrophobicContact CD1-CB 3.56Å; L62-A125 HydrophobicContact CB-CB 4.49Å; V64-A125 HydrophobicContact CG2-CB 3.29Å; N120-A125 PolarHBondContact OD1-N 2.86Å; A125-P149 HydrophobicContact CB-CG 4.01Å; A125-P149 WeakPolarHBondContact O-CD 3.36Å
126	E	93.5	Very high	93	Very high	14 Å²	14	51.1 Å²	51.1	7%	0.065	26%	0.263	C	S	.	.			trans	-70.5	140.4	167.4	-57.8	90.8	164.2	0	0	111	N120 F121 A122 R124 S147 K148	N120-E126 CarbonylContact C-O 3.58Å; N120-E126 WeakPolarHBondContact CA-O 3.36Å; N120-E126 PolarHBondContact N-O 3.1Å; F121-E126 HydrophobicContact CD1-CB 3.96Å; F121-E126 HydrophobicContact CE1-CB 3.47Å; F121-E126 VanDerWaalsContact CE1-CB 3.47Å; F121-E126 HydrophobicContact CZ-CB 3.92Å; F121-E126 PolarHBondContact N-O 3.12Å; A122-E126 HydrophobicContact CB-CB 4.45Å; A122-E126 HydrophobicContact CB-CG 4.26Å; A122-E126 WeakPolarHBondContact CB-OE2 3.42Å; R124-E126 WeakPolarHBondContact CA-OE2 3.42Å; R124-E126 WeakPolarHBondContact CB-OE1 3.36Å; R124-E126 WeakPolarHBondContact CB-OE2 3.14Å; R124-E126 PolarHBondContact N-OE2 3.23Å; R124-E126 PolarHBondContact O-N 3.24Å; E126-S147 CarbonylContact C-O 3.6Å; E126-S147 VanDerWaalsContact CA-O 3.29Å; E126-S147 WeakPolarHBondContact CA-O 3.42Å; E126-K148 HydrophobicContact CG-CB 4.11Å; E126-K148 HydrophobicContact CG-CD 4.2Å; E126-K148 HydrophobicContact CG-CG 3.98Å
127	C	92.9	Very high	92.5	Very high	14 Å²	14	49.6 Å²	49.6	10%	0.095	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.8	170.5	80.2	0	0	0	0	111.2	L118 D129 I146 S147	L118-C127 VanDerWaalsContact O-CA 3.26Å; L118-C127 WeakPolarHBondContact O-CA 3.13Å; C127-D129 PolarHBondContact SG-OD2 2.79Å; C127-D129 VanDerWaalsContact SG-OD2 3.37Å; C127-I146 CarbonylContact O-C 3.59Å; C127-I146 WeakPolarHBondContact O-CA 3.43Å; C127-S147 PolarHBondContact N-O 3.27Å; C127-S147 PolarHBondContact O-N 2.94Å; C127-S147 PolarHBondContact SG-OG 3.47Å
128	A	96.5	Very high	91.9	Very high	18 Å²	18	54.3 Å²	54.3	15%	0.149	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.7	167.4	0	0	0	0	0	108.1	R117 L118 F121 T145 I146	R117-A128 CarbonylContact C-O 3.51Å; R117-A128 WeakPolarHBondContact CA-O 3.44Å; L118-A128 HydrophobicContact CB-CB 4.25Å; L118-A128 HydrophobicContact CD1-CB 4.38Å; L118-A128 PolarHBondContact N-O 3.12Å; L118-A128 PolarHBondContact O-N 2.97Å; L118-A128 VanDerWaalsContact O-N 3.1Å; F121-A128 HydrophobicContact CD1-CB 4.31Å; F121-A128 HydrophobicContact CE1-CB 4.24Å; A128-T145 CarbonylContact C-O 3.53Å; A128-T145 VanDerWaalsContact CA-O 3.32Å; A128-T145 WeakPolarHBondContact CA-O 3.46Å; A128-I146 HydrophobicContact CB-CG1 4.3Å
129	D	95	Very high	91.5	Very high	14 Å²	14	52.3 Å²	52.3	8%	0.075	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131	-176.7	-86.5	-73.8	0	0	0	109.1	N115 R117 C127 A144 T145	N115-D129 PolarHBondContact ND2-OD1 3.27Å; N115-D129 VanDerWaalsContact ND2-OD1 3.16Å; R117-D129 WeakPolarHBondContact CB-OD1 3.48Å; R117-D129 WeakPolarHBondContact CG-OD1 3.39Å; R117-D129 IonicContact CZ-OD1 2.78Å; R117-D129 IonicContact CZ-OD2 3.44Å; R117-D129 VanDerWaalsContact NE-CG 3.34Å; R117-D129 IonicContact NE-OD1 3.39Å; R117-D129 PolarHBondContact NE-OD1 3.41Å; R117-D129 IonicContact NE-OD2 3.75Å; R117-D129 PolarHBondContact NE-OD2 3.46Å; R117-D129 IonicContact NH2-OD1 2.88Å; R117-D129 PolarHBondContact NH2-OD1 2.98Å; R117-D129 IonicContact NH2-OD2 2.86Å; R117-D129 PolarHBondContact NH2-OD2 3.27Å; C127-D129 PolarHBondContact SG-OD2 2.79Å; C127-D129 VanDerWaalsContact SG-OD2 3.37Å; D129-A144 CarbonylContact O-C 3.59Å; D129-A144 WeakPolarHBondContact O-CA 3.28Å; D129-T145 PolarHBondContact N-O 2.76Å; D129-T145 PolarHBondContact O-N 2.81Å
130	I	97	Very high	91.5	Very high	93 Å²	93	54 Å²	54	48%	0.477	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	117.4	172.2	-60	173	0	0	0	107.2	N115 V116 V132 F143	N115-I130 CarbonylContact C-O 3.56Å; N115-I130 WeakPolarHBondContact CA-O 3.5Å; V116-I130 PolarHBondContact N-O 2.89Å; V116-I130 PolarHBondContact O-N 2.88Å; I130-V132 HydrophobicContact CG2-CG2 4.49Å; I130-F143 CarbonylContact C-O 3.11Å; I130-F143 WeakPolarHBondContact CA-O 3.49Å
131	D	95.1	Very high	91.7	Very high	53 Å²	53	53.9 Å²	53.9	28%	0.283	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.5	177.9	-61.6	-69.5	0	0	0	110	G114 N115 K142 F143	G114-D131 CarbonylContact O-C 3.53Å; G114-D131 WeakPolarHBondContact O-CA 3.41Å; N115-D131 WeakPolarHBondContact CB-OD1 3.38Å; N115-D131 VanDerWaalsContact CG-OD1 3.22Å; N115-D131 PolarHBondContact ND2-OD1 2.78Å; D131-K142 CarbonylContact O-C 3.52Å; D131-K142 WeakPolarHBondContact O-CA 3.31Å; D131-F143 HydrophobicContact CB-CB 4.12Å; D131-F143 HydrophobicContact CB-CD2 4.09Å; D131-F143 PolarHBondContact N-O 2.79Å; D131-F143 PolarHBondContact O-N 2.62Å
132	V	95.7	Very high	91.9	Very high	56 Å²	56	54.1 Å²	54.1	34%	0.339	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.7	174.8	-178.8	0	0	0	0	108.2	C113 G114 I130 I134 S141	C113-V132 CarbonylContact C-O 3.59Å; C113-V132 VanDerWaalsContact CA-O 3.31Å; C113-V132 WeakPolarHBondContact CA-O 3.32Å; G114-V132 PolarHBondContact N-O 2.81Å; G114-V132 PolarHBondContact O-N 2.81Å; I130-V132 HydrophobicContact CG2-CG2 4.49Å; V132-I134 HydrophobicContact CG1-CD1 4.32Å; V132-I134 HydrophobicContact CG1-CG1 4.12Å; V132-S141 CarbonylContact C-O 3.58Å; V132-S141 WeakPolarHBondContact CA-O 3.45Å
133	E	92.4	Very high	92.2	Very high	38 Å²	38	55 Å²	55	18%	0.178	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.9	176.9	-179.7	-179.6	157.2	0	0	109.1	K111 A112 M139 V140 S141	K111-E133 HydrophobicContact CB-CG 4.33Å; K111-E133 WeakPolarHBondContact CD-OE1 3.46Å; K111-E133 VanDerWaalsContact CE-OE1 3.27Å; K111-E133 WeakPolarHBondContact CE-OE1 3.49Å; K111-E133 IonicContact NZ-OE1 3.67Å; K111-E133 PolarHBondContact NZ-OE1 3.34Å; A112-E133 CarbonylContact O-C 3.52Å; A112-E133 WeakPolarHBondContact O-CA 3.49Å; E133-M139 VanDerWaalsContact OE1-CE 3.32Å; E133-M139 WeakPolarHBondContact OE1-CE 3.3Å; E133-V140 CarbonylContact O-C 3.52Å; E133-V140 WeakPolarHBondContact O-CA 3.45Å; E133-S141 PolarHBondContact N-O 2.8Å; E133-S141 PolarHBondContact O-N 2.86Å
134	I	92.4	Very high	92.6	Very high	90 Å²	90	49.6 Å²	49.6	46%	0.462	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.5	179.3	-57.5	171	0	0	0	108.4	K111 A112 V132 M139	K111-I134 CarbonylContact C-O 3.51Å; K111-I134 VanDerWaalsContact CA-O 3.32Å; K111-I134 WeakPolarHBondContact CA-O 3.45Å; A112-I134 PolarHBondContact N-O 2.82Å; A112-I134 PolarHBondContact O-N 2.85Å; V132-I134 HydrophobicContact CG1-CD1 4.32Å; V132-I134 HydrophobicContact CG1-CG1 4.12Å; I134-M139 CarbonylContact C-O 3.56Å; I134-M139 WeakPolarHBondContact CA-O 3.43Å
135	G	90.2	Very high	92.8	Very high	7 Å²	7	46.1 Å²	46.1	7%	0.072	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	151.5	177.4	0	0	0	0	0	113.2	T110 N137 Q138 M139	T110-G135 CarbonylContact O-C 3.58Å; T110-G135 VanDerWaalsContact O-CA 3.26Å; T110-G135 WeakPolarHBondContact O-CA 3.38Å; G135-N137 PolarHBondContact O-N 3.23Å; G135-Q138 PolarHBondContact O-N 2.94Å; G135-Q138 VanDerWaalsContact O-N 3.09Å; G135-M139 PolarHBondContact N-O 3.16Å
136	S	87.2	Confident	93.1	Very high	74 Å²	74	50.2 Å²	50.2	52%	0.517	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.4	174.5	57.9	0	0	0	0	114.1	I109 T110 Q138	I109-S136 WeakPolarHBondContact CG2-OG 3.19Å; T110-S136 PolarHBondContact N-OG 3.22Å; T110-S136 PolarHBondContact O-N 3.37Å; T110-S136 VanDerWaalsContact OG1-CB 3.3Å; T110-S136 WeakPolarHBondContact OG1-CB 3.31Å; T110-S136 PolarHBondContact OG1-OG 2.8Å; S136-Q138 PolarHBondContact O-N 3.09Å
137	N	85.3	Confident	93.1	Very high	31 Å²	31	50 Å²	50	17%	0.166	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	21.7	173.3	69.9	-31.7	0	0	0	113.2	I109 G135 M139	I109-N137 HydrophobicContact CD1-CB 3.77Å; I109-N137 WeakPolarHBondContact CD1-ND2 3.24Å; I109-N137 HydrophobicContact CG1-CB 4.01Å; I109-N137 HydrophobicContact CG2-CB 4.33Å; I109-N137 VanDerWaalsContact CG2-OD1 3.31Å; I109-N137 WeakPolarHBondContact CG2-OD1 3.26Å; G135-N137 PolarHBondContact O-N 3.23Å; N137-M139 PolarHBondContact O-N 2.83Å; N137-M139 VanDerWaalsContact O-N 3.16Å; N137-M139 WeakPolarHBondContact OD1-CB 2.95Å; N137-M139 PolarHBondContact OD1-N 2.67Å
138	Q	82.6	Confident	93.2	Very high	172 Å²	172	54.4 Å²	54.4	80%	0.804	29%	0.291	S	S	*	.	S	Bend	trans	64.4	12.1	-175.5	-47.6	174.5	13.4	0	0	114.3	G135 S136 V140	G135-Q138 PolarHBondContact O-N 2.94Å; G135-Q138 VanDerWaalsContact O-N 3.09Å; S136-Q138 PolarHBondContact O-N 3.09Å; Q138-V140 PolarHBondContact O-N 2.91Å
139	M	87.8	Confident	93	Very high	13 Å²	13	53.6 Å²	53.6	6%	0.064	28%	0.284	C	S	.	.			trans	-61.3	129.2	168	171.2	176.3	167.9	0	0	108.9	E133 I134 G135 N137 N166	E133-M139 VanDerWaalsContact OE1-CE 3.32Å; E133-M139 WeakPolarHBondContact OE1-CE 3.3Å; I134-M139 CarbonylContact C-O 3.56Å; I134-M139 WeakPolarHBondContact CA-O 3.43Å; G135-M139 PolarHBondContact N-O 3.16Å; N137-M139 PolarHBondContact O-N 2.83Å; N137-M139 VanDerWaalsContact O-N 3.16Å; N137-M139 WeakPolarHBondContact OD1-CB 2.95Å; N137-M139 PolarHBondContact OD1-N 2.67Å; M139-N166 WeakPolarHBondContact CA-O 3.47Å; M139-N166 WeakPolarHBondContact CG-O 3.37Å
140	V	93.5	Very high	92.7	Very high	43 Å²	43	57.2 Å²	57.2	26%	0.261	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.4	173.8	178.7	0	0	0	0	107.3	E133 Q138 K142 G165 N166	E133-V140 CarbonylContact O-C 3.52Å; E133-V140 WeakPolarHBondContact O-CA 3.45Å; Q138-V140 PolarHBondContact O-N 2.91Å; V140-K142 HydrophobicContact CG1-CG 4.31Å; V140-G165 CarbonylContact O-C 3.58Å; V140-G165 VanDerWaalsContact O-CA 3.26Å; V140-G165 WeakPolarHBondContact O-CA 3.19Å; V140-N166 PolarHBondContact N-O 2.7Å; V140-N166 PolarHBondContact O-N 2.82Å
141	S	94.5	Very high	92.1	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	129.5	175.8	-159.7	0	0	0	0	109.8	V132 E133 F143 E164	V132-S141 CarbonylContact C-O 3.58Å; V132-S141 WeakPolarHBondContact CA-O 3.45Å; E133-S141 PolarHBondContact N-O 2.8Å; E133-S141 PolarHBondContact O-N 2.86Å; S141-F143 WeakPolarHBondContact OG-CE2 3.26Å; S141-F143 WeakPolarHBondContact OG-CZ 3.26Å; S141-E164 CarbonylContact C-O 3.51Å; S141-E164 WeakPolarHBondContact CA-O 3.12Å
142	K	96.7	Very high	91.5	Very high	93 Å²	93	59 Å²	59	40%	0.404	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	132.4	-179.4	-52.6	175.3	-157.2	152.4	0	108	D131 V140 T163 E164	D131-K142 CarbonylContact O-C 3.52Å; D131-K142 WeakPolarHBondContact O-CA 3.31Å; V140-K142 HydrophobicContact CG1-CG 4.31Å; K142-T163 CarbonylContact O-C 3.59Å; K142-T163 VanDerWaalsContact O-CA 3.28Å; K142-T163 WeakPolarHBondContact O-CA 3.4Å; K142-E164 PolarHBondContact N-O 2.82Å; K142-E164 IonicContact NZ-OE1 2.73Å; K142-E164 IonicContact NZ-OE2 3.25Å; K142-E164 PolarHBondContact NZ-OE2 2.88Å; K142-E164 PolarHBondContact O-N 2.79Å
143	F	96.4	Very high	91.1	Very high	65 Å²	65	59.5 Å²	59.5	29%	0.285	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.3	178	-50.4	-101.1	0	0	0	108.5	I130 D131 S141 T163	I130-F143 CarbonylContact C-O 3.11Å; I130-F143 WeakPolarHBondContact CA-O 3.49Å; D131-F143 HydrophobicContact CB-CB 4.12Å; D131-F143 HydrophobicContact CB-CD2 4.09Å; D131-F143 PolarHBondContact N-O 2.79Å; D131-F143 PolarHBondContact O-N 2.62Å; S141-F143 WeakPolarHBondContact OG-CE2 3.26Å; S141-F143 WeakPolarHBondContact OG-CZ 3.26Å; F143-T163 HydrophobicContact CD1-CG2 3.31Å; F143-T163 HydrophobicContact CE1-CG2 3.79Å; F143-T163 HydrophobicContact CG-CG2 4.3Å
144	A	97.5	Very high	90.8	Very high	50 Å²	50	58.2 Å²	58.2	41%	0.413	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.4	172.3	0	0	0	0	0	108.6	D129 G161 G162	D129-A144 CarbonylContact O-C 3.59Å; D129-A144 WeakPolarHBondContact O-CA 3.28Å; A144-G161 CarbonylContact O-C 3.55Å; A144-G161 WeakPolarHBondContact O-CA 3.38Å; A144-G162 PolarHBondContact N-O 2.78Å; A144-G162 PolarHBondContact O-N 2.85Å
145	T	96.6	Very high	90.7	Very high	27 Å²	27	56.8 Å²	56.8	17%	0.166	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.1	-174.6	-51.6	0	0	0	0	110.5	A128 D129 F182	A128-T145 CarbonylContact C-O 3.53Å; A128-T145 VanDerWaalsContact CA-O 3.32Å; A128-T145 WeakPolarHBondContact CA-O 3.46Å; D129-T145 PolarHBondContact N-O 2.76Å; D129-T145 PolarHBondContact O-N 2.81Å; T145-F182 HydrophobicContact CG2-CE2 4.4Å; T145-F182 HydrophobicContact CG2-CZ 4.34Å
146	I	96.8	Very high	90.9	Very high	89 Å²	89	58.1 Å²	58.1	46%	0.456	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.9	169.8	-60.8	172.8	0	0	0	107.1	F121 C127 A128 S159 I160	F121-I146 HydrophobicContact CE1-CG2 4.28Å; F121-I146 HydrophobicContact CZ-CG2 4.18Å; C127-I146 CarbonylContact O-C 3.59Å; C127-I146 WeakPolarHBondContact O-CA 3.43Å; A128-I146 HydrophobicContact CB-CG1 4.3Å; I146-S159 CarbonylContact O-C 3.31Å; I146-S159 WeakPolarHBondContact O-CA 3.35Å; I146-I160 HydrophobicContact CB-CG2 4.35Å; I146-I160 PolarHBondContact N-O 3.49Å; I146-I160 PolarHBondContact O-N 2.87Å
147	S	94.3	Very high	91.2	Very high	8 Å²	8	56.5 Å²	56.5	6%	0.056	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.6	178.6	88.2	0	0	0	0	112.8	E126 C127 R157 V158 S159	E126-S147 CarbonylContact C-O 3.6Å; E126-S147 VanDerWaalsContact CA-O 3.29Å; E126-S147 WeakPolarHBondContact CA-O 3.42Å; C127-S147 PolarHBondContact N-O 3.27Å; C127-S147 PolarHBondContact O-N 2.94Å; C127-S147 PolarHBondContact SG-OG 3.47Å; S147-R157 WeakPolarHBondContact OG-CD 3.31Å; S147-R157 PolarHBondContact OG-NH1 2.8Å; S147-R157 VanDerWaalsContact OG-NH1 3.09Å; S147-V158 CarbonylContact C-O 3.55Å; S147-V158 WeakPolarHBondContact CA-O 3.35Å; S147-S159 WeakPolarHBondContact CB-OG 3.42Å
148	K	93.6	Very high	91.7	Very high	108 Å²	108	57.6 Å²	57.6	47%	0.47	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	136	179.3	176.8	173.6	-179.9	178.5	0	110.9	E126 L150 R157 V158	E126-K148 HydrophobicContact CG-CB 4.11Å; E126-K148 HydrophobicContact CG-CD 4.2Å; E126-K148 HydrophobicContact CG-CG 3.98Å; K148-L150 PolarHBondContact O-N 3.21Å; K148-R157 WeakPolarHBondContact O-CA 3.26Å; K148-V158 PolarHBondContact N-O 3.12Å; K148-V158 PolarHBondContact O-N 2.88Å
149	P	92.6	Very high	92.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	129	170.1	27.6	-32.9	0	0	0	110.9	I31 A125 E151 V156	I31-P149 HydrophobicContact CD1-CG 4.41Å; A125-P149 HydrophobicContact CB-CG 4.01Å; A125-P149 WeakPolarHBondContact O-CD 3.36Å; P149-E151 PolarHBondContact O-N 2.62Å; P149-V156 WeakPolarHBondContact CA-O 2.95Å
150	L	88.5	Confident	92.8	Very high	89 Å²	89	53.6 Å²	53.6	47%	0.466	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-71	126.8	-178.7	-174.4	65.7	0	0	0	109.9	K148 N152 N153 V156 V158	K148-L150 PolarHBondContact O-N 3.21Å; L150-N152 PolarHBondContact O-N 2.81Å; L150-N153 VanDerWaalsContact O-CB 3.24Å; L150-N153 WeakPolarHBondContact O-CB 2.98Å; L150-N153 PolarHBondContact O-N 2.97Å; L150-V156 HydrophobicContact CB-CB 4.23Å; L150-V156 HydrophobicContact CB-CG1 3.87Å; L150-V156 HydrophobicContact CD2-CG1 3.85Å; L150-V156 PolarHBondContact N-O 2.84Å; L150-V158 HydrophobicContact CB-CG2 4.32Å; L150-V158 HydrophobicContact CD1-CG2 4.36Å
151	E	84.7	Confident	93	Very high	166 Å²	166	52.1 Å²	52.1	78%	0.776	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	53.1	19.4	-179	-62.6	-168	169.7	0	0	116.5	K34 P149 N153	K34-E151 PolarHBondContact NZ-O 2.87Å; P149-E151 PolarHBondContact O-N 2.62Å; E151-N153 VanDerWaalsContact C-N 3.26Å
152	N	81.8	Confident	93.2	Very high	18 Å²	18	53.2 Å²	53.2	10%	0.096	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	68.3	19.4	-169.6	-51	-24.6	0	0	0	114	I31 K34 Q35 L150	I31-N152 HydrophobicContact CG1-CB 3.93Å; K34-N152 HydrophobicContact CD-CB 3.9Å; K34-N152 PolarHBondContact NZ-ND2 2.67Å; Q35-N152 PolarHBondContact NE2-O 2.96Å; L150-N152 PolarHBondContact O-N 2.81Å
153	N	87.5	Confident	93.2	Very high	66 Å²	66	49.9 Å²	49.9	35%	0.353	27%	0.266	S	S	.	.			trans	-78.3	123.1	171.1	-172.3	-14.5	0	0	0	109.5	L150 E151 Y155	L150-N153 VanDerWaalsContact O-CB 3.24Å; L150-N153 WeakPolarHBondContact O-CB 2.98Å; L150-N153 PolarHBondContact O-N 2.97Å; E151-N153 VanDerWaalsContact C-N 3.26Å; N153-Y155 PolarHBondContact O-N 3.47Å; N153-Y155 VanDerWaalsContact OD1-CD2 3.26Å; N153-Y155 WeakPolarHBondContact OD1-CD2 3.17Å; N153-Y155 PolarHBondContact OD1-N 2.92Å
154	P	85.9	Confident	93.2	Very high	11 Å²	11	49.9 Å²	49.9	7%	0.071	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.7	179.5	28.2	-35.7	0	0	0	113.8	Q35 K58 K61 L62	Q35-P154 VanDerWaalsContact OE1-CD 3.3Å; K58-P154 HydrophobicContact CB-CG 3.9Å; K58-P154 HydrophobicContact CG-CG 3.9Å; K58-P154 WeakPolarHBondContact O-CB 3.42Å; K61-P154 HydrophobicContact CB-CB 3.82Å; L62-P154 HydrophobicContact CD2-CB 4Å; L62-P154 HydrophobicContact CG-CB 4.3Å
155	Y	90.9	Very high	93.1	Very high	61 Å²	61	47.5 Å²	47.5	24%	0.239	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-13.3	-177.2	-57.2	-71.5	0	0	0	113.9	K58 K61 N153 A187 E188	K58-Y155 HydrophobicContact CG-CE2 4.1Å; K58-Y155 WeakPolarHBondContact CG-OH 3.27Å; K61-Y155 HydrophobicContact CD-CD1 3.78Å; K61-Y155 HydrophobicContact CD-CE1 3.55Å; N153-Y155 PolarHBondContact O-N 3.47Å; N153-Y155 VanDerWaalsContact OD1-CD2 3.26Å; N153-Y155 WeakPolarHBondContact OD1-CD2 3.17Å; N153-Y155 PolarHBondContact OD1-N 2.92Å; Y155-A187 WeakPolarHBondContact O-CA 3.32Å; Y155-E188 HydrophobicContact CD1-CB 4.25Å; Y155-E188 PolarHBondContact O-N 2.78Å
156	V	93.7	Very high	93	Very high	35 Å²	35	49.5 Å²	49.5	21%	0.212	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.9	-177.8	-174.8	0	0	0	0	110.1	P149 L150 Q186 A187	P149-V156 WeakPolarHBondContact CA-O 2.95Å; L150-V156 HydrophobicContact CB-CB 4.23Å; L150-V156 HydrophobicContact CB-CG1 3.87Å; L150-V156 HydrophobicContact CD2-CG1 3.85Å; L150-V156 PolarHBondContact N-O 2.84Å; V156-Q186 CarbonylContact C-O 3.54Å; V156-Q186 VanDerWaalsContact CA-O 3.26Å; V156-Q186 WeakPolarHBondContact CA-O 3.26Å; V156-A187 HydrophobicContact CG2-CB 4.15Å
157	R	94	Very high	92.8	Very high	40 Å²	40	47.6 Å²	47.6	15%	0.151	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.8	-178.3	-175.8	175.7	-67.3	-84.6	-2.9	110.1	L62 S147 K148 Q186	L62-R157 PolarHBondContact O-NH2 3.27Å; L62-R157 VanDerWaalsContact O-NH2 3.14Å; S147-R157 WeakPolarHBondContact OG-CD 3.31Å; S147-R157 PolarHBondContact OG-NH1 2.8Å; S147-R157 VanDerWaalsContact OG-NH1 3.09Å; K148-R157 WeakPolarHBondContact O-CA 3.26Å; R157-Q186 HydrophobicContact CB-CB 4.47Å; R157-Q186 PolarHBondContact N-O 3.06Å; R157-Q186 PolarHBondContact O-N 3.43Å
158	V	96.1	Very high	92.6	Very high	53 Å²	53	48.7 Å²	48.7	32%	0.321	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.6	175.3	179	0	0	0	0	108.3	S147 K148 L150 E184 A185	S147-V158 CarbonylContact C-O 3.55Å; S147-V158 WeakPolarHBondContact CA-O 3.35Å; K148-V158 PolarHBondContact N-O 3.12Å; K148-V158 PolarHBondContact O-N 2.88Å; L150-V158 HydrophobicContact CB-CG2 4.32Å; L150-V158 HydrophobicContact CD1-CG2 4.36Å; V158-E184 CarbonylContact C-O 3.49Å; V158-E184 WeakPolarHBondContact CA-O 3.5Å; V158-A185 HydrophobicContact CG2-CB 4.49Å
159	S	96.3	Very high	92.5	Very high	7 Å²	7	44 Å²	44	5%	0.049	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.8	-177.9	-53.5	0	0	0	0	110.2	I146 S147 T183 E184	I146-S159 CarbonylContact O-C 3.31Å; I146-S159 WeakPolarHBondContact O-CA 3.35Å; S147-S159 WeakPolarHBondContact CB-OG 3.42Å; S159-T183 CarbonylContact O-C 3.54Å; S159-T183 WeakPolarHBondContact O-CA 3.31Å; S159-E184 PolarHBondContact N-O 2.94Å; S159-E184 PolarHBondContact O-N 2.86Å
160	I	97.7	Very high	92.3	Very high	94 Å²	94	47.3 Å²	47.3	48%	0.482	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.1	170.1	-167.7	166.9	0	0	0	108.3	I146 F182	I146-I160 HydrophobicContact CB-CG2 4.35Å; I146-I160 PolarHBondContact N-O 3.49Å; I146-I160 PolarHBondContact O-N 2.87Å; I160-F182 WeakPolarHBondContact CA-O 3.36Å
161	G	97.2	Very high	92.3	Very high	12 Å²	12	44.5 Å²	44.5	12%	0.124	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	177.5	-175.8	0	0	0	0	0	113.5	A144 V181 F182	A144-G161 CarbonylContact O-C 3.55Å; A144-G161 WeakPolarHBondContact O-CA 3.38Å; G161-V181 WeakPolarHBondContact O-CA 3.19Å; G161-F182 PolarHBondContact N-O 2.74Å; G161-F182 PolarHBondContact O-N 2.9Å
162	G	98	Very high	92.6	Very high	24 Å²	24	36.6 Å²	36.6	25%	0.247	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	154.5	172.2	0	0	0	0	0	111.3	A144 S180	A144-G162 PolarHBondContact N-O 2.78Å; A144-G162 PolarHBondContact O-N 2.85Å; G162-S180 CarbonylContact C-O 3.57Å; G162-S180 WeakPolarHBondContact CA-O 3.05Å
163	T	96.8	Very high	93.1	Very high	24 Å²	24	37.5 Å²	37.5	15%	0.147	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.3	178.9	82.7	0	0	0	0	110.6	K142 F143 R179 S180 F182	K142-T163 CarbonylContact O-C 3.59Å; K142-T163 VanDerWaalsContact O-CA 3.28Å; K142-T163 WeakPolarHBondContact O-CA 3.4Å; F143-T163 HydrophobicContact CD1-CG2 3.31Å; F143-T163 HydrophobicContact CE1-CG2 3.79Å; F143-T163 HydrophobicContact CG-CG2 4.3Å; T163-R179 CarbonylContact O-C 3.59Å; T163-R179 VanDerWaalsContact O-CA 3.28Å; T163-R179 WeakPolarHBondContact O-CA 2.87Å; T163-S180 PolarHBondContact N-O 3.02Å; T163-S180 PolarHBondContact O-N 3.47Å; T163-S180 PolarHBondContact OG1-OG 3.43Å; T163-F182 HydrophobicContact CG2-CD1 3.89Å; T163-F182 HydrophobicContact CG2-CE1 3.54Å
164	E	97.3	Very high	93.3	Very high	65 Å²	65	34.3 Å²	34.3	30%	0.304	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	126.6	169.3	179.4	-168.2	-173.4	0	0	106.8	S141 K142 E178 R179	S141-E164 CarbonylContact C-O 3.51Å; S141-E164 WeakPolarHBondContact CA-O 3.12Å; K142-E164 PolarHBondContact N-O 2.82Å; K142-E164 IonicContact NZ-OE1 2.73Å; K142-E164 IonicContact NZ-OE2 3.25Å; K142-E164 PolarHBondContact NZ-OE2 2.88Å; K142-E164 PolarHBondContact O-N 2.79Å; E164-E178 CarbonylContact C-O 3.57Å; E164-E178 WeakPolarHBondContact CA-O 3.38Å; E164-R179 HydrophobicContact CG-CG 4.27Å
165	G	95.4	Very high	93.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	147.2	-178.4	0	0	0	0	0	114.4	V140 W167 H177 E178	V140-G165 CarbonylContact O-C 3.58Å; V140-G165 VanDerWaalsContact O-CA 3.26Å; V140-G165 WeakPolarHBondContact O-CA 3.19Å; G165-W167 VanDerWaalsContact CA-CZ3 3.45Å; G165-W167 WeakPolarHBondContact O-CZ3 3.36Å; G165-H177 CarbonylContact O-C 3.54Å; G165-H177 WeakPolarHBondContact O-CA 3.35Å; G165-H177 PolarHBondContact O-ND1 3.34Å; G165-E178 PolarHBondContact N-O 3.39Å; G165-E178 PolarHBondContact O-N 2.82Å
166	N	95	Very high	93.9	Very high	68 Å²	68	35.5 Å²	35.5	36%	0.364	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.3	173.3	-65.7	-17.3	0	0	0	108.4	M139 V140 R176 H177	M139-N166 WeakPolarHBondContact CA-O 3.47Å; M139-N166 WeakPolarHBondContact CG-O 3.37Å; V140-N166 PolarHBondContact N-O 2.7Å; V140-N166 PolarHBondContact O-N 2.82Å; N166-R176 WeakPolarHBondContact CA-O 3.27Å; N166-H177 PolarHBondContact OD1-CE1 3.24Å; N166-H177 PolarHBondContact OD1-ND1 3.09Å
167	W	91.4	Very high	94	Very high	50 Å²	50	35.3 Å²	35.3	19%	0.189	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.5	178.3	-65.9	-90.9	0	0	0	111.3	G165 H169 R176 E178	G165-W167 VanDerWaalsContact CA-CZ3 3.45Å; G165-W167 WeakPolarHBondContact O-CZ3 3.36Å; W167-H169 PolarHBondContact O-ND1 3.01Å; W167-R176 HydrophobicContact CB-CB 4.39Å; W167-R176 PolarHBondContact N-O 3.26Å; W167-R176 PolarHBondContact O-N 2.75Å; W167-E178 HydrophobicContact CE3-CG 4.29Å; W167-E178 HydrophobicContact CH2-CB 4.47Å; W167-E178 HydrophobicContact CZ3-CB 3.75Å; W167-E178 HydrophobicContact CZ3-CG 3.76Å
168	D	91.2	Very high	94.1	Very high	30 Å²	30	34.6 Å²	34.6	16%	0.16	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	107.2	172.8	178.1	8.7	0	0	0	110.4	Y170 L175 K208	D168-Y170 PolarHBondContact O-N 2.94Å; D168-Y170 PolarHBondContact OD1-N 2.79Å; D168-L175 HydrophobicContact CB-CD2 3.87Å; D168-K208 WeakPolarHBondContact OD1-CD 3.47Å; D168-K208 IonicContact OD1-NZ 2.67Å; D168-K208 PolarHBondContact OD1-NZ 3.44Å; D168-K208 IonicContact OD2-NZ 3.24Å; D168-K208 PolarHBondContact OD2-NZ 2.86Å
169	H	90.7	Very high	94.2	Very high	10 Å²	10	38.6 Å²	38.6	5%	0.046	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	62.8	175.1	-64.1	67.8	0	0	0	109.5	W167 W171 A172 K173 F174	W167-H169 PolarHBondContact O-ND1 3.01Å; H169-W171 HydrophobicContact CB-CH2 4.2Å; H169-W171 HydrophobicContact CB-CZ2 3.91Å; H169-W171 AromaticContact CD2-CH2 3.84Å; H169-W171 AromaticContact CD2-CZ2 3.31Å; H169-W171 WeakPolarHBondContact CD2-CZ2 3.09Å; H169-W171 AromaticContact CG-CZ2 3.81Å; H169-W171 PolarHBondContact O-N 2.78Å; H169-W171 VanDerWaalsContact O-N 3.1Å; H169-A172 CarbonylContact O-C 3.55Å; H169-A172 PolarHBondContact O-N 2.89Å; H169-K173 PolarHBondContact O-N 2.78Å; H169-F174 CarbonylContact C-O 3.58Å; H169-F174 WeakPolarHBondContact CA-O 3.35Å; H169-F174 HydrophobicContact CB-CD1 3.87Å; H169-F174 HydrophobicContact CB-CD2 4.01Å; H169-F174 HydrophobicContact CB-CE1 3.6Å; H169-F174 HydrophobicContact CB-CE2 3.75Å; H169-F174 HydrophobicContact CB-CG 4.07Å; H169-F174 HydrophobicContact CB-CZ 3.54Å; H169-F174 WeakPolarHBondContact CB-O 3.23Å; H169-F174 AromaticContact CD2-CE2 3.74Å; H169-F174 AromaticContact CD2-CZ 3.29Å; H169-F174 WeakPolarHBondContact CD2-CZ 3.27Å; H169-F174 AromaticContact CE1-CE2 3.87Å; H169-F174 AromaticContact CG-CE1 3.91Å; H169-F174 AromaticContact CG-CE2 3.4Å; H169-F174 AromaticContact CG-CZ 3.3Å; H169-F174 PolarHBondContact N-O 3.38Å; H169-F174 AromaticContact ND1-CE2 3.47Å; H169-F174 WeakPolarHBondContact ND1-CE2 3.48Å; H169-F174 AromaticContact ND1-CZ 3.87Å; H169-F174 AromaticContact NE2-CZ 3.91Å; H169-F174 PolarHBondContact O-N 2.82Å
170	Y	88.9	Confident	94.2	Very high	70 Å²	70	38.9 Å²	38.9	28%	0.275	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.8	-172.5	66.8	-93.3	0	0	0	113.7	I109 D168 A172 K173	I109-Y170 HydrophobicContact CD1-CE1 4.33Å; D168-Y170 PolarHBondContact O-N 2.94Å; D168-Y170 PolarHBondContact OD1-N 2.79Å; Y170-A172 VanDerWaalsContact C-N 3.29Å; Y170-A172 PolarHBondContact O-N 2.75Å; Y170-K173 PolarHBondContact O-N 2.84Å
171	W	89	Confident	94.2	Very high	31 Å²	31	38.1 Å²	38.1	12%	0.117	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.2	177.7	59.5	90.3	0	0	0	112.8	H169 F329 W341 R342 S384 P385	H169-W171 HydrophobicContact CB-CH2 4.2Å; H169-W171 HydrophobicContact CB-CZ2 3.91Å; H169-W171 AromaticContact CD2-CH2 3.84Å; H169-W171 AromaticContact CD2-CZ2 3.31Å; H169-W171 WeakPolarHBondContact CD2-CZ2 3.09Å; H169-W171 AromaticContact CG-CZ2 3.81Å; H169-W171 PolarHBondContact O-N 2.78Å; H169-W171 VanDerWaalsContact O-N 3.1Å; W171-F329 AromaticContact NE1-CD1 3.68Å; W171-F329 AromaticContact NE1-CE1 3.74Å; W171-W341 AromaticContact CE3-CD1 3.68Å; W171-W341 AromaticContact CH2-NE1 3.92Å; W171-W341 AromaticContact CZ3-CD1 3.69Å; W171-W341 AromaticContact CZ3-NE1 3.62Å; W171-R342 HydrophobicContact CD2-CB 3.93Å; W171-R342 VanDerWaalsContact CE2-CD 3.48Å; W171-R342 HydrophobicContact CG-CB 4.01Å; W171-R342 HydrophobicContact CZ2-CB 4.33Å; W171-R342 HydrophobicContact CZ2-CG 4.37Å; W171-S384 PolarHBondContact O-OG 2.88Å; W171-S384 VanDerWaalsContact O-OG 3.1Å; W171-P385 HydrophobicContact CB-CG 4.36Å; W171-P385 VanDerWaalsContact O-CD 3.32Å; W171-P385 WeakPolarHBondContact O-CD 3.41Å; W171-P385 WeakPolarHBondContact O-CG 3.1Å
172	A	90.6	Very high	94.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	5.2	179.9	0	0	0	0	0	112.9	H169 Y170 F174 I324 F329 P385	H169-A172 CarbonylContact O-C 3.55Å; H169-A172 PolarHBondContact O-N 2.89Å; Y170-A172 VanDerWaalsContact C-N 3.29Å; Y170-A172 PolarHBondContact O-N 2.75Å; A172-F174 VanDerWaalsContact C-N 3.34Å; A172-F174 HydrophobicContact CB-CD1 3.57Å; A172-F174 HydrophobicContact CB-CE1 3.46Å; A172-F174 VanDerWaalsContact CB-CE1 3.46Å; A172-F174 PolarHBondContact O-N 3.37Å; A172-I324 HydrophobicContact CB-CD1 4.49Å; A172-F329 HydrophobicContact CB-CE1 4.41Å; A172-P385 WeakPolarHBondContact CB-O 3.35Å
173	K	91.4	Very high	94.2	Very high	36 Å²	36	39.6 Å²	39.6	16%	0.157	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	34.2	175.3	-57	-177.9	167.5	-169.9	0	115.4	H169 Y170 K208 D209 T211 A212 L350	H169-K173 PolarHBondContact O-N 2.78Å; Y170-K173 PolarHBondContact O-N 2.84Å; K173-K208 WeakPolarHBondContact O-CB 3.3Å; K173-K208 PolarHBondContact O-N 2.83Å; K173-D209 HydrophobicContact CB-CB 4.47Å; K173-D209 HydrophobicContact CD-CB 4.3Å; K173-T211 PolarHBondContact NZ-OG1 2.83Å; K173-A212 HydrophobicContact CB-CB 3.97Å; K173-L350 HydrophobicContact CD-CD2 3.77Å; K173-L350 VanDerWaalsContact NZ-CD2 3.28Å
174	F	92.8	Very high	94.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	156.2	173.1	73.5	-92	0	0	0	112.8	H169 A172 R176 T205 E206 V216 I324	H169-F174 CarbonylContact C-O 3.58Å; H169-F174 WeakPolarHBondContact CA-O 3.35Å; H169-F174 HydrophobicContact CB-CD1 3.87Å; H169-F174 HydrophobicContact CB-CD2 4.01Å; H169-F174 HydrophobicContact CB-CE1 3.6Å; H169-F174 HydrophobicContact CB-CE2 3.75Å; H169-F174 HydrophobicContact CB-CG 4.07Å; H169-F174 HydrophobicContact CB-CZ 3.54Å; H169-F174 WeakPolarHBondContact CB-O 3.23Å; H169-F174 AromaticContact CD2-CE2 3.74Å; H169-F174 AromaticContact CD2-CZ 3.29Å; H169-F174 WeakPolarHBondContact CD2-CZ 3.27Å; H169-F174 AromaticContact CE1-CE2 3.87Å; H169-F174 AromaticContact CG-CE1 3.91Å; H169-F174 AromaticContact CG-CE2 3.4Å; H169-F174 AromaticContact CG-CZ 3.3Å; H169-F174 PolarHBondContact N-O 3.38Å; H169-F174 AromaticContact ND1-CE2 3.47Å; H169-F174 WeakPolarHBondContact ND1-CE2 3.48Å; H169-F174 AromaticContact ND1-CZ 3.87Å; H169-F174 AromaticContact NE2-CZ 3.91Å; H169-F174 PolarHBondContact O-N 2.82Å; A172-F174 VanDerWaalsContact C-N 3.34Å; A172-F174 HydrophobicContact CB-CD1 3.57Å; A172-F174 HydrophobicContact CB-CE1 3.46Å; A172-F174 VanDerWaalsContact CB-CE1 3.46Å; A172-F174 PolarHBondContact O-N 3.37Å; F174-R176 HydrophobicContact CD2-CB 4.49Å; F174-R176 HydrophobicContact CE2-CB 4.21Å; F174-T205 HydrophobicContact CB-CG2 4.21Å; F174-T205 HydrophobicContact CD2-CG2 3.8Å; F174-T205 HydrophobicContact CE2-CG2 4.49Å; F174-T205 HydrophobicContact CG-CG2 4.22Å; F174-E206 CarbonylContact C-O 3.47Å; F174-E206 VanDerWaalsContact CA-O 3.28Å; F174-E206 WeakPolarHBondContact CA-O 3.22Å; F174-E206 WeakPolarHBondContact CB-O 3.27Å; F174-V216 HydrophobicContact CB-CG1 3.76Å; F174-V216 HydrophobicContact CD1-CG1 4.32Å; F174-V216 HydrophobicContact CG-CG1 4.38Å; F174-I324 HydrophobicContact CD1-CD1 3.93Å; F174-I324 HydrophobicContact CD1-CG1 4.46Å; F174-I324 HydrophobicContact CE1-CD1 3.64Å; F174-I324 HydrophobicContact CE1-CG1 3.74Å; F174-I324 HydrophobicContact CE1-CG2 4.18Å; F174-I324 HydrophobicContact CE2-CG2 4.48Å; F174-I324 HydrophobicContact CZ-CG1 4.19Å; F174-I324 HydrophobicContact CZ-CG2 4.14Å
175	L	94.6	Very high	94.2	Very high	56 Å²	56	38.7 Å²	38.7	29%	0.293	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	144.9	171.5	-59.3	176.2	0	0	0	109	D168 T205 E206 K208	D168-L175 HydrophobicContact CB-CD2 3.87Å; L175-T205 WeakPolarHBondContact O-CA 3.36Å; L175-E206 HydrophobicContact CB-CB 4.3Å; L175-E206 PolarHBondContact N-O 2.8Å; L175-E206 PolarHBondContact O-N 2.84Å; L175-K208 HydrophobicContact CD2-CD 4.33Å; L175-K208 HydrophobicContact CD2-CG 4.43Å; L175-K208 HydrophobicContact CG-CB 4.22Å
176	R	94.2	Very high	94.2	Very high	41 Å²	41	41 Å²	41	16%	0.155	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.2	179	-172.4	-177.7	73.2	156.7	-7.4	110.2	N166 W167 F174 E178 E204	N166-R176 WeakPolarHBondContact CA-O 3.27Å; W167-R176 HydrophobicContact CB-CB 4.39Å; W167-R176 PolarHBondContact N-O 3.26Å; W167-R176 PolarHBondContact O-N 2.75Å; F174-R176 HydrophobicContact CD2-CB 4.49Å; F174-R176 HydrophobicContact CE2-CB 4.21Å; R176-E178 VanDerWaalsContact CD-OE1 3.23Å; R176-E178 WeakPolarHBondContact CD-OE1 3.37Å; R176-E178 HydrophobicContact CG-CG 3.89Å; R176-E178 VanDerWaalsContact CZ-CD 3.44Å; R176-E178 IonicContact CZ-OE1 2.78Å; R176-E178 VanDerWaalsContact CZ-OE1 3.23Å; R176-E178 IonicContact CZ-OE2 2.62Å; R176-E178 IonicContact NE-OE1 2.73Å; R176-E178 PolarHBondContact NE-OE1 2.73Å; R176-E178 IonicContact NE-OE2 3.64Å; R176-E178 VanDerWaalsContact NH1-CD 3.35Å; R176-E178 IonicContact NH1-OE1 3.17Å; R176-E178 PolarHBondContact NH1-OE1 3.19Å; R176-E178 IonicContact NH1-OE2 3.11Å; R176-E178 PolarHBondContact NH1-OE2 2.76Å; R176-E178 IonicContact NH2-OE2 2.95Å; R176-E204 WeakPolarHBondContact CA-O 2.98Å
177	H	95.7	Very high	94.2	Very high	30 Å²	30	39.2 Å²	39.2	14%	0.139	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.7	169.8	-177.8	54.2	0	0	0	109	G165 N166 R179 R203 E204	G165-H177 CarbonylContact O-C 3.54Å; G165-H177 WeakPolarHBondContact O-CA 3.35Å; G165-H177 PolarHBondContact O-ND1 3.34Å; N166-H177 PolarHBondContact OD1-CE1 3.24Å; N166-H177 PolarHBondContact OD1-ND1 3.09Å; H177-R179 PolarHBondContact NE2-NE 3.02Å; H177-R179 PolarHBondContact NE2-NH2 3.42Å; H177-R203 CarbonylContact O-C 3.5Å; H177-R203 VanDerWaalsContact O-CA 3.28Å; H177-R203 WeakPolarHBondContact O-CA 3.48Å; H177-E204 HydrophobicContact CB-CB 4.32Å; H177-E204 IonicContact CD2-OE2 3.71Å; H177-E204 PolarHBondContact N-O 3.16Å; H177-E204 PolarHBondContact O-N 2.74Å
178	E	96.3	Very high	94.2	Very high	26 Å²	26	40.2 Å²	40.2	12%	0.121	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.1	174.7	-48.3	-176.8	147.7	0	0	111.1	E164 G165 W167 R176 V201 W202 R203	E164-E178 CarbonylContact C-O 3.57Å; E164-E178 WeakPolarHBondContact CA-O 3.38Å; G165-E178 PolarHBondContact N-O 3.39Å; G165-E178 PolarHBondContact O-N 2.82Å; W167-E178 HydrophobicContact CE3-CG 4.29Å; W167-E178 HydrophobicContact CH2-CB 4.47Å; W167-E178 HydrophobicContact CZ3-CB 3.75Å; W167-E178 HydrophobicContact CZ3-CG 3.76Å; R176-E178 VanDerWaalsContact CD-OE1 3.23Å; R176-E178 WeakPolarHBondContact CD-OE1 3.37Å; R176-E178 HydrophobicContact CG-CG 3.89Å; R176-E178 VanDerWaalsContact CZ-CD 3.44Å; R176-E178 IonicContact CZ-OE1 2.78Å; R176-E178 VanDerWaalsContact CZ-OE1 3.23Å; R176-E178 IonicContact CZ-OE2 2.62Å; R176-E178 IonicContact NE-OE1 2.73Å; R176-E178 PolarHBondContact NE-OE1 2.73Å; R176-E178 IonicContact NE-OE2 3.64Å; R176-E178 VanDerWaalsContact NH1-CD 3.35Å; R176-E178 IonicContact NH1-OE1 3.17Å; R176-E178 PolarHBondContact NH1-OE1 3.19Å; R176-E178 IonicContact NH1-OE2 3.11Å; R176-E178 PolarHBondContact NH1-OE2 2.76Å; R176-E178 IonicContact NH2-OE2 2.95Å; E178-V201 HydrophobicContact CB-CG1 3.94Å; E178-V201 HydrophobicContact CG-CG1 4.37Å; E178-W202 CarbonylContact C-O 3.41Å; E178-W202 VanDerWaalsContact CA-O 3.28Å; E178-W202 WeakPolarHBondContact CA-O 3.5Å; E178-R203 HydrophobicContact CG-CB 3.91Å
179	R	97.4	Very high	94.1	Very high	136 Å²	136	41.3 Å²	41.3	51%	0.513	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.1	168.9	-61.5	179.4	-170.2	170.9	6.2	107.6	T163 E164 H177 V201 W202	T163-R179 CarbonylContact O-C 3.59Å; T163-R179 VanDerWaalsContact O-CA 3.28Å; T163-R179 WeakPolarHBondContact O-CA 2.87Å; E164-R179 HydrophobicContact CG-CG 4.27Å; H177-R179 PolarHBondContact NE2-NE 3.02Å; H177-R179 PolarHBondContact NE2-NH2 3.42Å; R179-V201 CarbonylContact O-C 3.54Å; R179-W202 PolarHBondContact N-O 2.76Å; R179-W202 PolarHBondContact O-N 2.88Å
180	S	96.5	Very high	93.9	Very high	13 Å²	13	47 Å²	47	9%	0.091	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	157.2	-178.9	85.3	0	0	0	0	113.5	G162 T163 A200	G162-S180 CarbonylContact C-O 3.57Å; G162-S180 WeakPolarHBondContact CA-O 3.05Å; T163-S180 PolarHBondContact N-O 3.02Å; T163-S180 PolarHBondContact O-N 3.47Å; T163-S180 PolarHBondContact OG1-OG 3.43Å; S180-A200 CarbonylContact C-O 3.54Å; S180-A200 WeakPolarHBondContact CA-O 3.41Å; S180-A200 WeakPolarHBondContact CB-O 3.4Å
181	V	98.1	Very high	93.9	Very high	79 Å²	79	48.1 Å²	48.1	48%	0.479	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.7	162.7	177.4	0	0	0	0	106.8	G161 A200	G161-V181 WeakPolarHBondContact O-CA 3.19Å; V181-A200 PolarHBondContact N-O 3Å; V181-A200 PolarHBondContact O-N 2.81Å
182	F	97.3	Very high	94	Very high	18 Å²	18	47.4 Å²	47.4	8%	0.079	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	151.7	-177.9	67.8	-89.2	0	0	0	112.5	T145 I160 G161 T163 Q197 W198 D199	T145-F182 HydrophobicContact CG2-CE2 4.4Å; T145-F182 HydrophobicContact CG2-CZ 4.34Å; I160-F182 WeakPolarHBondContact CA-O 3.36Å; G161-F182 PolarHBondContact N-O 2.74Å; G161-F182 PolarHBondContact O-N 2.9Å; T163-F182 HydrophobicContact CG2-CD1 3.89Å; T163-F182 HydrophobicContact CG2-CE1 3.54Å; F182-Q197 HydrophobicContact CB-CG 4.49Å; F182-W198 CarbonylContact C-O 3.5Å; F182-W198 WeakPolarHBondContact CA-O 3.5Å; F182-W198 WeakPolarHBondContact CB-O 2.99Å; F182-D199 WeakPolarHBondContact CB-OD1 3.18Å
183	T	98.1	Very high	94.3	Very high	49 Å²	49	48.7 Å²	48.7	30%	0.301	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.7	170.7	-58.4	0	0	0	0	108.5	S159 Q197 W198	S159-T183 CarbonylContact O-C 3.54Å; S159-T183 WeakPolarHBondContact O-CA 3.31Å; T183-Q197 CarbonylContact O-C 3.56Å; T183-Q197 WeakPolarHBondContact O-CA 3.36Å; T183-W198 PolarHBondContact N-O 3.48Å; T183-W198 PolarHBondContact O-N 2.91Å
184	E	96.9	Very high	94.6	Very high	34 Å²	34	49.2 Å²	49.2	16%	0.159	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131	-178.1	-177.1	-171.2	-141.2	0	0	110.4	V158 S159 F196 Q197	V158-E184 CarbonylContact C-O 3.49Å; V158-E184 WeakPolarHBondContact CA-O 3.5Å; S159-E184 PolarHBondContact N-O 2.94Å; S159-E184 PolarHBondContact O-N 2.86Å; E184-F196 CarbonylContact C-O 3.54Å; E184-F196 VanDerWaalsContact CA-O 3.31Å; E184-F196 WeakPolarHBondContact CA-O 3.39Å; E184-Q197 HydrophobicContact CB-CB 4.44Å; E184-Q197 HydrophobicContact CB-CG 4.44Å; E184-Q197 HydrophobicContact CG-CB 4.39Å
185	A	96.8	Very high	94.8	Very high	36 Å²	36	51.7 Å²	51.7	30%	0.298	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.9	167.4	0	0	0	0	0	109.2	V158 F196	V158-A185 HydrophobicContact CG2-CB 4.49Å; A185-F196 PolarHBondContact N-O 2.67Å; A185-F196 PolarHBondContact O-N 2.95Å
186	Q	95	Very high	94.9	Very high	49 Å²	49	53.9 Å²	53.9	23%	0.229	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.3	177.2	-178	-178.1	-2.3	0	0	109.2	V156 R157 L193 H194 K195	V156-Q186 CarbonylContact C-O 3.54Å; V156-Q186 VanDerWaalsContact CA-O 3.26Å; V156-Q186 WeakPolarHBondContact CA-O 3.26Å; R157-Q186 HydrophobicContact CB-CB 4.47Å; R157-Q186 PolarHBondContact N-O 3.06Å; R157-Q186 PolarHBondContact O-N 3.43Å; Q186-L193 HydrophobicContact CG-CD1 3.6Å; Q186-L193 HydrophobicContact CG-CG 4.34Å; Q186-H194 CarbonylContact C-O 3.51Å; Q186-H194 WeakPolarHBondContact CA-O 3.28Å; Q186-K195 HydrophobicContact CG-CG 4.26Å
187	A	94.4	Very high	95.1	Very high	29 Å²	29	54 Å²	54	24%	0.24	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	123.3	177.6	0	0	0	0	0	111	Y155 V156 H194	Y155-A187 WeakPolarHBondContact O-CA 3.32Å; V156-A187 HydrophobicContact CG2-CB 4.15Å; A187-H194 PolarHBondContact N-O 2.97Å; A187-H194 PolarHBondContact O-N 3.4Å
188	E	91.4	Very high	95.2	Very high	71 Å²	71	58.2 Å²	58.2	33%	0.332	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	118.2	172.9	-72.5	177.6	-164.9	0	0	110.4	K61 Y155 L193	K61-E188 WeakPolarHBondContact CD-OE2 3.38Å; K61-E188 WeakPolarHBondContact CE-OE2 3.41Å; K61-E188 IonicContact NZ-OE2 3.18Å; K61-E188 PolarHBondContact NZ-OE2 2.84Å; Y155-E188 HydrophobicContact CD1-CB 4.25Å; Y155-E188 PolarHBondContact O-N 2.78Å; E188-L193 HydrophobicContact CB-CD1 4.34Å; E188-L193 HydrophobicContact CG-CD1 3.33Å
189	S	89.4	Confident	95.2	Very high	53 Å²	53	57.5 Å²	57.5	37%	0.371	31%	0.308	S	S	.	.			trans	-101.4	173.8	169.9	79.6	0	0	0	0	110.4	V191 G192 H194	S189-V191 PolarHBondContact O-N 2.92Å; S189-V191 PolarHBondContact OG-N 2.78Å; S189-G192 WeakPolarHBondContact CA-O 3.35Å; S189-G192 PolarHBondContact N-O 2.87Å; S189-G192 PolarHBondContact OG-N 2.82Å; S189-G192 PolarHBondContact OG-O 2.83Å; S189-H194 PolarHBondContact OG-CD2 2.87Å; S189-H194 PolarHBondContact OG-NE2 3.01Å
190	S	87.1	Confident	95.2	Very high	130 Å²	130	52.6 Å²	52.6	91%	0.909	30%	0.297	S	S	*	.	S	Bend	trans	-67.1	-21.4	173.7	52.2	0	0	0	0	113.5
191	V	88.1	Confident	95.3	Very high	93 Å²	93	52.8 Å²	52.8	56%	0.564	30%	0.297	S	S	*	.	S	Bend	trans	-91.2	-25.6	-177.4	-169	0	0	0	0	111.1	S189 F232 S234	S189-V191 PolarHBondContact O-N 2.92Å; S189-V191 PolarHBondContact OG-N 2.78Å; V191-F232 HydrophobicContact CG1-CE2 4.47Å; V191-F232 HydrophobicContact CG1-CZ 3.98Å; V191-S234 WeakPolarHBondContact O-CB 3.45Å; V191-S234 PolarHBondContact O-OG 3.31Å
192	G	92.6	Very high	95.2	Very high	16 Å²	16	54.7 Å²	54.7	17%	0.165	30%	0.296	C	S	.	.			trans	161.8	-165.5	179	0	0	0	0	0	112.6	S189	S189-G192 WeakPolarHBondContact CA-O 3.35Å; S189-G192 PolarHBondContact N-O 2.87Å; S189-G192 PolarHBondContact OG-N 2.82Å; S189-G192 PolarHBondContact OG-O 2.83Å
193	L	95.6	Very high	95.1	Very high	27 Å²	27	53.9 Å²	53.9	14%	0.141	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	128.2	-178.3	-176.1	67.8	0	0	0	110.8	Q186 E188 K195 F232 E233	Q186-L193 HydrophobicContact CG-CD1 3.6Å; Q186-L193 HydrophobicContact CG-CG 4.34Å; E188-L193 HydrophobicContact CB-CD1 4.34Å; E188-L193 HydrophobicContact CG-CD1 3.33Å; L193-K195 VanDerWaalsContact CD2-CE 3.41Å; L193-K195 HydrophobicContact CD2-CG 4.49Å; L193-K195 HydrophobicContact CG-CG 4.42Å; L193-F232 CarbonylContact O-C 3.52Å; L193-F232 WeakPolarHBondContact O-CA 3.45Å; L193-E233 HydrophobicContact CB-CB 4.41Å; L193-E233 PolarHBondContact N-O 3.15Å; L193-E233 PolarHBondContact O-N 3.08Å
194	H	97.5	Very high	94.9	Very high	48 Å²	48	54.9 Å²	54.9	22%	0.222	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127	173.3	-58.6	-106.1	0	0	0	109	Q186 A187 S189 F196 H230 V231 F232	Q186-H194 CarbonylContact C-O 3.51Å; Q186-H194 WeakPolarHBondContact CA-O 3.28Å; A187-H194 PolarHBondContact N-O 2.97Å; A187-H194 PolarHBondContact O-N 3.4Å; S189-H194 PolarHBondContact OG-CD2 2.87Å; S189-H194 PolarHBondContact OG-NE2 3.01Å; H194-F196 HydrophobicContact CB-CD2 4.46Å; H194-F196 HydrophobicContact CB-CE2 3.79Å; H194-F196 HydrophobicContact CB-CZ 4.43Å; H194-H230 AromaticContact ND1-NE2 3.56Å; H194-V231 CarbonylContact C-O 3.48Å; H194-F232 AromaticContact CE1-CD2 3.45Å; H194-F232 VanDerWaalsContact CE1-CD2 3.45Å; H194-F232 WeakPolarHBondContact CE1-CD2 3.41Å; H194-F232 AromaticContact CE1-CE2 3.78Å; H194-F232 AromaticContact ND1-CD2 3.77Å; H194-F232 AromaticContact NE2-CD2 3.71Å; H194-F232 AromaticContact NE2-CE2 3.68Å
195	K	97.1	Very high	94.7	Very high	52 Å²	52	53.5 Å²	53.5	23%	0.226	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.5	172.2	-62.3	171.6	-179.4	161.7	0	108.5	Q186 L193 H230 V231 E233	Q186-K195 HydrophobicContact CG-CG 4.26Å; L193-K195 VanDerWaalsContact CD2-CE 3.41Å; L193-K195 HydrophobicContact CD2-CG 4.49Å; L193-K195 HydrophobicContact CG-CG 4.42Å; K195-H230 CarbonylContact O-C 3.55Å; K195-H230 WeakPolarHBondContact O-CA 3.49Å; K195-V231 HydrophobicContact CB-CB 4.26Å; K195-V231 PolarHBondContact N-O 2.95Å; K195-V231 PolarHBondContact O-N 2.86Å; K195-E233 IonicContact NZ-OE2 3.21Å; K195-E233 PolarHBondContact NZ-OE2 3.02Å
196	F	98	Very high	94.6	Very high	101 Å²	101	57.9 Å²	57.9	44%	0.443	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.1	174.7	-64	-87.2	0	0	0	108	E184 A185 H194 R229 H230	E184-F196 CarbonylContact C-O 3.54Å; E184-F196 VanDerWaalsContact CA-O 3.31Å; E184-F196 WeakPolarHBondContact CA-O 3.39Å; A185-F196 PolarHBondContact N-O 2.67Å; A185-F196 PolarHBondContact O-N 2.95Å; H194-F196 HydrophobicContact CB-CD2 4.46Å; H194-F196 HydrophobicContact CB-CE2 3.79Å; H194-F196 HydrophobicContact CB-CZ 4.43Å; F196-R229 CarbonylContact C-O 3.51Å; F196-R229 WeakPolarHBondContact CA-O 3.37Å; F196-H230 HydrophobicContact CD1-CB 4.16Å; F196-H230 AromaticContact CD1-CD2 3.46Å; F196-H230 VanDerWaalsContact CD1-CD2 3.46Å; F196-H230 WeakPolarHBondContact CD1-CD2 3.33Å; F196-H230 HydrophobicContact CE1-CB 4.23Å; F196-H230 AromaticContact CE1-CD2 3.12Å; F196-H230 WeakPolarHBondContact CE1-CD2 3.12Å; F196-H230 AromaticContact CE1-CG 3.69Å; F196-H230 AromaticContact CE1-NE2 3.68Å; F196-H230 AromaticContact CZ-CD2 3.43Å; F196-H230 VanDerWaalsContact CZ-CD2 3.43Å; F196-H230 WeakPolarHBondContact CZ-CD2 3.42Å; F196-H230 AromaticContact CZ-NE2 3.54Å
197	Q	97.3	Very high	94.5	Very high	44 Å²	44	57.6 Å²	57.6	21%	0.206	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	127.1	-174.4	-178.7	176	-29	0	0	109.7	F182 T183 E184 D199 L228 R229	F182-Q197 HydrophobicContact CB-CG 4.49Å; T183-Q197 CarbonylContact O-C 3.56Å; T183-Q197 WeakPolarHBondContact O-CA 3.36Å; E184-Q197 HydrophobicContact CB-CB 4.44Å; E184-Q197 HydrophobicContact CB-CG 4.44Å; E184-Q197 HydrophobicContact CG-CB 4.39Å; Q197-D199 VanDerWaalsContact NE2-CG 3.26Å; Q197-D199 PolarHBondContact NE2-OD1 2.9Å; Q197-D199 PolarHBondContact NE2-OD2 2.86Å; Q197-L228 CarbonylContact O-C 3.53Å; Q197-R229 HydrophobicContact CB-CB 4.36Å; Q197-R229 PolarHBondContact N-O 2.79Å; Q197-R229 PolarHBondContact O-N 2.9Å
198	W	98.1	Very high	94.2	Very high	119 Å²	119	59.9 Å²	59.9	45%	0.451	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.1	168.3	172.1	72.2	0	0	0	108.7	F182 T183 A200 S227 L228	F182-W198 CarbonylContact C-O 3.5Å; F182-W198 WeakPolarHBondContact CA-O 3.5Å; F182-W198 WeakPolarHBondContact CB-O 2.99Å; T183-W198 PolarHBondContact N-O 3.48Å; T183-W198 PolarHBondContact O-N 2.91Å; W198-A200 HydrophobicContact CH2-CB 4.21Å; W198-A200 HydrophobicContact CZ2-CB 4.2Å; W198-S227 WeakPolarHBondContact CA-O 3.41Å; W198-L228 HydrophobicContact CB-CD1 4.31Å
199	D	97	Very high	94.1	Very high	11 Å²	11	59.4 Å²	59.4	6%	0.059	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.4	-175.2	-67	-54.8	0	0	0	110.7	F182 Q197 V201 S226 S227	F182-D199 WeakPolarHBondContact CB-OD1 3.18Å; Q197-D199 VanDerWaalsContact NE2-CG 3.26Å; Q197-D199 PolarHBondContact NE2-OD1 2.9Å; Q197-D199 PolarHBondContact NE2-OD2 2.86Å; D199-V201 HydrophobicContact CB-CG2 4.16Å; D199-S226 CarbonylContact O-C 3.59Å; D199-S226 VanDerWaalsContact O-CA 3.31Å; D199-S226 WeakPolarHBondContact O-CA 3.01Å; D199-S227 PolarHBondContact N-O 2.95Å; D199-S227 PolarHBondContact O-N 2.83Å
200	A	97.6	Very high	93.9	Very high	33 Å²	33	62.5 Å²	62.5	27%	0.273	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	107.8	165.6	0	0	0	0	0	108.4	S180 V181 W198	S180-A200 CarbonylContact C-O 3.54Å; S180-A200 WeakPolarHBondContact CA-O 3.41Å; S180-A200 WeakPolarHBondContact CB-O 3.4Å; V181-A200 PolarHBondContact N-O 3Å; V181-A200 PolarHBondContact O-N 2.81Å; W198-A200 HydrophobicContact CH2-CB 4.21Å; W198-A200 HydrophobicContact CZ2-CB 4.2Å
201	V	96.8	Very high	94	Very high	17 Å²	17	58.6 Å²	58.6	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	118.8	-171.8	-170.4	0	0	0	0	109.6	E178 R179 D199 R203 V224 K225	E178-V201 HydrophobicContact CB-CG1 3.94Å; E178-V201 HydrophobicContact CG-CG1 4.37Å; R179-V201 CarbonylContact O-C 3.54Å; D199-V201 HydrophobicContact CB-CG2 4.16Å; V201-R203 HydrophobicContact CG1-CB 4.47Å; V201-V224 CarbonylContact O-C 3.48Å; V201-V224 WeakPolarHBondContact O-CA 3.25Å; V201-K225 HydrophobicContact CB-CB 4.31Å; V201-K225 PolarHBondContact N-O 2.84Å; V201-K225 PolarHBondContact O-N 3.15Å
202	W	97.1	Very high	94.2	Very high	118 Å²	118	54.2 Å²	54.2	45%	0.447	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120	160.5	-178	-80.9	0	0	0	108.2	E178 R179 E204 V224	E178-W202 CarbonylContact C-O 3.41Å; E178-W202 VanDerWaalsContact CA-O 3.28Å; E178-W202 WeakPolarHBondContact CA-O 3.5Å; R179-W202 PolarHBondContact N-O 2.76Å; R179-W202 PolarHBondContact O-N 2.88Å; W202-E204 PolarHBondContact NE1-OE1 3.35Å; W202-V224 HydrophobicContact CD2-CG2 4.39Å; W202-V224 HydrophobicContact CE3-CG2 3.46Å; W202-V224 VanDerWaalsContact CE3-CG2 3.46Å; W202-V224 HydrophobicContact CZ3-CG2 3.68Å
203	R	94.7	Very high	94.1	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.008	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.9	179.7	64.9	176.6	-168.5	-171.2	1.7	111.2	H177 E178 V201 S222 A223 I258 H323 D326	H177-R203 CarbonylContact O-C 3.5Å; H177-R203 VanDerWaalsContact O-CA 3.28Å; H177-R203 WeakPolarHBondContact O-CA 3.48Å; E178-R203 HydrophobicContact CG-CB 3.91Å; V201-R203 HydrophobicContact CG1-CB 4.47Å; R203-S222 CarbonylContact O-C 3.6Å; R203-S222 WeakPolarHBondContact O-CA 3.39Å; R203-A223 HydrophobicContact CG-CB 4.03Å; R203-A223 VanDerWaalsContact CG-O 3.3Å; R203-A223 WeakPolarHBondContact CG-O 3.48Å; R203-A223 PolarHBondContact N-O 3.14Å; R203-A223 PolarHBondContact O-N 2.76Å; R203-I258 VanDerWaalsContact NH2-CG2 3.31Å; R203-H323 PolarHBondContact NH1-ND1 2.86Å; R203-H323 PolarHBondContact NH2-CD2 3.39Å; R203-H323 VanDerWaalsContact NH2-CD2 3.29Å; R203-H323 PolarHBondContact NH2-ND1 2.63Å; R203-D326 IonicContact CZ-OD2 2.78Å; R203-D326 IonicContact NH1-OD1 2.68Å; R203-D326 IonicContact NH1-OD2 3.24Å; R203-D326 PolarHBondContact NH1-OD2 3.1Å; R203-D326 IonicContact NH2-OD2 3.75Å
204	E	94.7	Very high	93.8	Very high	70 Å²	70	56.5 Å²	56.5	33%	0.327	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	127.6	176.3	-60.4	-179.8	163.6	0	0	108.8	R176 H177 W202 G221 S222	R176-E204 WeakPolarHBondContact CA-O 2.98Å; H177-E204 HydrophobicContact CB-CB 4.32Å; H177-E204 IonicContact CD2-OE2 3.71Å; H177-E204 PolarHBondContact N-O 3.16Å; H177-E204 PolarHBondContact O-N 2.74Å; W202-E204 PolarHBondContact NE1-OE1 3.35Å; E204-G221 WeakPolarHBondContact CA-O 3.32Å; E204-S222 PolarHBondContact OE1-OG 2.84Å
205	T	93.3	Very high	93.2	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.031	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.6	176.2	-51.7	0	0	0	0	108.3	F174 L175 C220 G221 H323	F174-T205 HydrophobicContact CB-CG2 4.21Å; F174-T205 HydrophobicContact CD2-CG2 3.8Å; F174-T205 HydrophobicContact CE2-CG2 4.49Å; F174-T205 HydrophobicContact CG-CG2 4.22Å; L175-T205 WeakPolarHBondContact O-CA 3.36Å; T205-C220 CarbonylContact O-C 3.53Å; T205-C220 WeakPolarHBondContact O-CA 3.32Å; T205-C220 WeakPolarHBondContact O-CB 3.12Å; T205-G221 PolarHBondContact N-O 3.48Å; T205-G221 PolarHBondContact O-N 2.84Å; T205-H323 PolarHBondContact OG1-CE1 2.82Å; T205-H323 PolarHBondContact OG1-NE2 2.84Å
206	E	93	Very high	92.9	Very high	127 Å²	127	52.3 Å²	52.3	59%	0.593	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.7	178.3	-177.5	179.9	-172.6	0	0	110.2	F174 L175	F174-E206 CarbonylContact C-O 3.47Å; F174-E206 VanDerWaalsContact CA-O 3.28Å; F174-E206 WeakPolarHBondContact CA-O 3.22Å; F174-E206 WeakPolarHBondContact CB-O 3.27Å; L175-E206 HydrophobicContact CB-CB 4.3Å; L175-E206 PolarHBondContact N-O 2.8Å; L175-E206 PolarHBondContact O-N 2.84Å
207	V	92.8	Very high	92.5	Very high	44 Å²	44	50.3 Å²	50.3	27%	0.267	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.5	175.8	-162.8	0	0	0	0	109.2	D209 A212 L217 C220	V207-D209 WeakPolarHBondContact CG1-O 3.32Å; V207-A212 HydrophobicContact CG1-CB 3.69Å; V207-L217 HydrophobicContact CB-CD2 4.01Å; V207-L217 HydrophobicContact CG1-CD2 3.45Å; V207-L217 VanDerWaalsContact CG1-CD2 3.45Å; V207-L217 HydrophobicContact CG2-CD2 3.29Å; V207-C220 HydrophobicContact CG2-CB 4.24Å; V207-C220 WeakPolarHBondContact CG2-SG 3.23Å
208	K	89.7	Confident	92.1	Very high	76 Å²	76	53 Å²	53	33%	0.33	27%	0.268	S	S	.	.	S	Bend	trans	-81.4	-48.7	174.5	-174.7	178.2	-175.2	170.3	0	112.2	D168 K173 L175	D168-K208 WeakPolarHBondContact OD1-CD 3.47Å; D168-K208 IonicContact OD1-NZ 2.67Å; D168-K208 PolarHBondContact OD1-NZ 3.44Å; D168-K208 IonicContact OD2-NZ 3.24Å; D168-K208 PolarHBondContact OD2-NZ 2.86Å; K173-K208 WeakPolarHBondContact O-CB 3.3Å; K173-K208 PolarHBondContact O-N 2.83Å; L175-K208 HydrophobicContact CD2-CD 4.33Å; L175-K208 HydrophobicContact CD2-CG 4.43Å; L175-K208 HydrophobicContact CG-CB 4.22Å
209	D	87.7	Confident	91.6	Very high	61 Å²	61	47.8 Å²	47.8	33%	0.326	25%	0.249	S	C	.	.	S	Bend	trans	-121.4	139.4	-175.9	-64.7	-32.3	0	0	0	110.5	K173 V207 T211 A212	K173-D209 HydrophobicContact CB-CB 4.47Å; K173-D209 HydrophobicContact CD-CB 4.3Å; V207-D209 WeakPolarHBondContact CG1-O 3.32Å; D209-T211 PolarHBondContact O-N 2.75Å; D209-A212 VanDerWaalsContact O-CB 3.23Å; D209-A212 WeakPolarHBondContact O-CB 2.89Å; D209-A212 PolarHBondContact O-N 3.27Å
210	P	86.8	Confident	91.3	Very high	119 Å²	119	49.1 Å²	49.1	77%	0.773	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-13.2	177.5	27.9	-35.7	0	0	0	113.6	A212	P210-A212 VanDerWaalsContact C-N 3.29Å
211	T	89.2	Confident	91	Very high	48 Å²	48	49.4 Å²	49.4	29%	0.294	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-0.8	174.8	61.8	0	0	0	0	113.2	K173 D209 L350 L351	K173-T211 PolarHBondContact NZ-OG1 2.83Å; D209-T211 PolarHBondContact O-N 2.75Å; T211-L350 WeakPolarHBondContact O-CB 3.03Å; T211-L350 VanDerWaalsContact O-CD2 3.32Å; T211-L350 WeakPolarHBondContact O-CD2 3.33Å; T211-L351 PolarHBondContact O-N 2.98Å; T211-L351 VanDerWaalsContact O-N 3.1Å
212	A	90.7	Very high	90.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-54	147.8	-179.8	0	0	0	0	0	111.8	K173 V207 D209 P210 L217 L351	K173-A212 HydrophobicContact CB-CB 3.97Å; V207-A212 HydrophobicContact CG1-CB 3.69Å; D209-A212 VanDerWaalsContact O-CB 3.23Å; D209-A212 WeakPolarHBondContact O-CB 2.89Å; D209-A212 PolarHBondContact O-N 3.27Å; P210-A212 VanDerWaalsContact C-N 3.29Å; A212-L217 HydrophobicContact CB-CD2 4.37Å; A212-L351 VanDerWaalsContact O-CD1 3.27Å; A212-L351 WeakPolarHBondContact O-CD1 3.49Å; A212-L351 VanDerWaalsContact O-CG 3.27Å; A212-L351 WeakPolarHBondContact O-CG 3.44Å
213	P	90.5	Very high	90.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.259	C	S	.	.			trans	-57.6	149.9	176.9	-21.9	31.7	0	0	0	112.6	G215 V216 L217 E348 L350 V386	P213-G215 PolarHBondContact O-N 3.06Å; P213-V216 HydrophobicContact CB-CG2 4.23Å; P213-V216 HydrophobicContact CG-CG2 4.2Å; P213-V216 WeakPolarHBondContact O-CB 3.45Å; P213-V216 PolarHBondContact O-N 3.46Å; P213-V216 VanDerWaalsContact O-N 3.08Å; P213-L217 PolarHBondContact O-N 2.88Å; P213-E348 HydrophobicContact CB-CB 3.68Å; P213-E348 HydrophobicContact CG-CB 4.11Å; P213-L350 HydrophobicContact CG-CD2 4.22Å; P213-V386 HydrophobicContact CG-CG1 4.44Å
214	L	89.2	Confident	90.6	Very high	91 Å²	91	48.8 Å²	48.8	48%	0.476	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-33.7	179.9	-176.6	62.9	0	0	0	112.8	V216 L217 K218 L351	L214-V216 VanDerWaalsContact C-N 3.31Å; L214-V216 PolarHBondContact O-N 3.28Å; L214-L217 HydrophobicContact CD1-CD1 4.43Å; L214-L217 PolarHBondContact O-N 3.02Å; L214-K218 WeakPolarHBondContact O-CG 3.48Å; L214-K218 PolarHBondContact O-N 2.89Å; L214-L351 HydrophobicContact CB-CD2 4.3Å
215	G	86.8	Confident	90.6	Very high	12 Å²	12	46.3 Å²	46.3	12%	0.124	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-41.3	176.4	0	0	0	0	0	112.1	P213 K218 E219 T264 E348	P213-G215 PolarHBondContact O-N 3.06Å; G215-K218 PolarHBondContact O-N 3.47Å; G215-E219 PolarHBondContact O-N 3.25Å; G215-T264 WeakPolarHBondContact O-CG2 3.47Å; G215-E348 WeakPolarHBondContact CA-OE2 3.42Å; G215-E348 PolarHBondContact N-OE2 3.36Å
216	V	90	Very high	90.7	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-64.1	-46.4	176.1	-177	0	0	0	0	110.6	F174 P213 L214 K218 E219 C220 I324 V386	F174-V216 HydrophobicContact CB-CG1 3.76Å; F174-V216 HydrophobicContact CD1-CG1 4.32Å; F174-V216 HydrophobicContact CG-CG1 4.38Å; P213-V216 HydrophobicContact CB-CG2 4.23Å; P213-V216 HydrophobicContact CG-CG2 4.2Å; P213-V216 WeakPolarHBondContact O-CB 3.45Å; P213-V216 PolarHBondContact O-N 3.46Å; P213-V216 VanDerWaalsContact O-N 3.08Å; L214-V216 VanDerWaalsContact C-N 3.31Å; L214-V216 PolarHBondContact O-N 3.28Å; V216-K218 VanDerWaalsContact C-N 3.27Å; V216-K218 PolarHBondContact O-N 3.3Å; V216-E219 PolarHBondContact O-N 3.01Å; V216-E219 VanDerWaalsContact O-N 3.1Å; V216-C220 PolarHBondContact O-N 2.89Å; V216-C220 PolarHBondContact O-SG 3.31Å; V216-I324 HydrophobicContact CG2-CD1 3.7Å; V216-V386 HydrophobicContact CG2-CG1 4.37Å
217	L	90.2	Very high	90.9	Very high	59 Å²	59	42.6 Å²	42.6	31%	0.309	25%	0.253	S	S	.	.	H	α-helix	trans	-58.4	-38	178.3	-63.5	-172.6	0	0	0	113	V207 A212 P213 L214 E219 C220 L351	V207-L217 HydrophobicContact CB-CD2 4.01Å; V207-L217 HydrophobicContact CG1-CD2 3.45Å; V207-L217 VanDerWaalsContact CG1-CD2 3.45Å; V207-L217 HydrophobicContact CG2-CD2 3.29Å; A212-L217 HydrophobicContact CB-CD2 4.37Å; P213-L217 PolarHBondContact O-N 2.88Å; L214-L217 HydrophobicContact CD1-CD1 4.43Å; L214-L217 PolarHBondContact O-N 3.02Å; L217-E219 VanDerWaalsContact C-N 3.29Å; L217-E219 PolarHBondContact O-N 2.85Å; L217-C220 WeakPolarHBondContact O-CB 3.4Å; L217-C220 PolarHBondContact O-N 2.78Å; L217-L351 HydrophobicContact CD1-CD1 3.35Å; L217-L351 HydrophobicContact CG-CD1 4.33Å
218	K	88.3	Confident	91.2	Very high	99 Å²	99	45.3 Å²	45.3	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-70.5	-23.7	179.2	-75.1	-179.7	176.1	-174.4	0	113.6	L214 G215 V216 T264	L214-K218 WeakPolarHBondContact O-CG 3.48Å; L214-K218 PolarHBondContact O-N 2.89Å; G215-K218 PolarHBondContact O-N 3.47Å; V216-K218 VanDerWaalsContact C-N 3.27Å; V216-K218 PolarHBondContact O-N 3.3Å; K218-T264 HydrophobicContact CB-CG2 3.94Å
219	E	87.4	Confident	91.5	Very high	11 Å²	11	44.1 Å²	44.1	5%	0.051	26%	0.259	C	S	.	.	H	α-helix	trans	-93.4	-6.4	177.7	-63.5	-176.4	-172.2	0	0	112.6	G215 V216 L217 T264 H323 I324 R327	G215-E219 PolarHBondContact O-N 3.25Å; V216-E219 PolarHBondContact O-N 3.01Å; V216-E219 VanDerWaalsContact O-N 3.1Å; L217-E219 VanDerWaalsContact C-N 3.29Å; L217-E219 PolarHBondContact O-N 2.85Å; E219-T264 HydrophobicContact CG-CG2 3.44Å; E219-T264 VanDerWaalsContact CG-CG2 3.44Å; E219-T264 WeakPolarHBondContact OE1-CB 3.07Å; E219-T264 WeakPolarHBondContact OE1-CG2 3.46Å; E219-T264 PolarHBondContact OE1-OG1 2.64Å; E219-H323 IonicContact OE2-CD2 2.74Å; E219-H323 IonicContact OE2-CG 3.49Å; E219-I324 WeakPolarHBondContact OE2-CA 3.39Å; E219-I324 WeakPolarHBondContact OE2-CB 3.21Å; E219-I324 VanDerWaalsContact OE2-CG2 3.27Å; E219-I324 WeakPolarHBondContact OE2-CG2 3.15Å; E219-I324 PolarHBondContact OE2-N 3.04Å; E219-R327 IonicContact OE1-CZ 3.39Å; E219-R327 IonicContact OE1-NH2 2.73Å; E219-R327 PolarHBondContact OE1-NH2 3.16Å
220	C	90	Very high	92	Very high	39 Å²	39	43.2 Å²	43.2	26%	0.264	25%	0.253	S	S	.	.			trans	-64.6	140.9	174.1	-71.9	0	0	0	0	111.8	T205 V207 V216 L217	T205-C220 CarbonylContact O-C 3.53Å; T205-C220 WeakPolarHBondContact O-CA 3.32Å; T205-C220 WeakPolarHBondContact O-CB 3.12Å; V207-C220 HydrophobicContact CG2-CB 4.24Å; V207-C220 WeakPolarHBondContact CG2-SG 3.23Å; V216-C220 PolarHBondContact O-N 2.89Å; V216-C220 PolarHBondContact O-SG 3.31Å; L217-C220 WeakPolarHBondContact O-CB 3.4Å; L217-C220 PolarHBondContact O-N 2.78Å
221	G	91.9	Very high	92.5	Very high	38 Å²	38	38.3 Å²	38.3	39%	0.392	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	132.4	-178.7	-174.5	0	0	0	0	0	112.8	E204 T205	E204-G221 WeakPolarHBondContact CA-O 3.32Å; T205-G221 PolarHBondContact N-O 3.48Å; T205-G221 PolarHBondContact O-N 2.84Å
222	S	93.1	Very high	92.9	Very high	54 Å²	54	37.6 Å²	37.6	38%	0.378	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.2	179.8	-47	0	0	0	0	111	R203 E204 P260	R203-S222 CarbonylContact O-C 3.6Å; R203-S222 WeakPolarHBondContact O-CA 3.39Å; E204-S222 PolarHBondContact OE1-OG 2.84Å; S222-P260 WeakPolarHBondContact O-CD 3.3Å
223	A	92.3	Very high	93.2	Very high	8 Å²	8	39.8 Å²	39.8	7%	0.066	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.3	172.4	0	0	0	0	0	111	R203 I258 T259	R203-A223 HydrophobicContact CG-CB 4.03Å; R203-A223 VanDerWaalsContact CG-O 3.3Å; R203-A223 WeakPolarHBondContact CG-O 3.48Å; R203-A223 PolarHBondContact N-O 3.14Å; R203-A223 PolarHBondContact O-N 2.76Å; A223-I258 HydrophobicContact CB-CG2 4.16Å; A223-T259 CarbonylContact C-O 3.32Å; A223-T259 WeakPolarHBondContact CA-O 3.25Å
224	V	94.3	Very high	93.4	Very high	62 Å²	62	40.2 Å²	40.2	38%	0.376	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	121	173.5	-179.3	0	0	0	0	108.3	V201 W202 I258 T259	V201-V224 CarbonylContact O-C 3.48Å; V201-V224 WeakPolarHBondContact O-CA 3.25Å; W202-V224 HydrophobicContact CD2-CG2 4.39Å; W202-V224 HydrophobicContact CE3-CG2 3.46Å; W202-V224 VanDerWaalsContact CE3-CG2 3.46Å; W202-V224 HydrophobicContact CZ3-CG2 3.68Å; V224-I258 CarbonylContact O-C 3.46Å; V224-I258 VanDerWaalsContact O-CA 3.3Å; V224-I258 WeakPolarHBondContact O-CA 3.34Å; V224-T259 PolarHBondContact N-O 2.87Å; V224-T259 PolarHBondContact O-N 2.86Å
225	K	95.4	Very high	93.6	Very high	19 Å²	19	38.5 Å²	38.5	8%	0.083	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116	175.8	176	177.8	-179.8	-174	0	109.2	V201 E254 A256 S257 I258 D326	V201-K225 HydrophobicContact CB-CB 4.31Å; V201-K225 PolarHBondContact N-O 2.84Å; V201-K225 PolarHBondContact O-N 3.15Å; K225-E254 WeakPolarHBondContact CE-OE1 3.23Å; K225-E254 IonicContact NZ-OE1 2.68Å; K225-E254 PolarHBondContact NZ-OE1 2.77Å; K225-A256 HydrophobicContact CG-CB 4.3Å; K225-S257 CarbonylContact C-O 3.57Å; K225-S257 WeakPolarHBondContact CA-O 3.45Å; K225-I258 HydrophobicContact CB-CG1 4.15Å; K225-I258 HydrophobicContact CD-CD1 4.35Å; K225-I258 HydrophobicContact CD-CG1 4.48Å; K225-I258 HydrophobicContact CG-CD1 4.41Å; K225-I258 HydrophobicContact CG-CG1 4Å; K225-D326 IonicContact NZ-OD1 3.69Å; K225-D326 PolarHBondContact NZ-OD1 2.8Å
226	S	95.9	Very high	93.9	Very high	50 Å²	50	40.4 Å²	40.4	35%	0.35	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.9	166.8	178.3	0	0	0	0	108.1	D199 A256 S257	D199-S226 CarbonylContact O-C 3.59Å; D199-S226 VanDerWaalsContact O-CA 3.31Å; D199-S226 WeakPolarHBondContact O-CA 3.01Å; S226-A256 CarbonylContact O-C 3.43Å; S226-A256 WeakPolarHBondContact O-CA 3.46Å; S226-S257 PolarHBondContact N-O 3.11Å; S226-S257 PolarHBondContact O-N 2.73Å
227	S	96.7	Very high	93.9	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.028	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.3	178.6	66.3	0	0	0	0	113.9	W198 D199 E254 I255	W198-S227 WeakPolarHBondContact CA-O 3.41Å; D199-S227 PolarHBondContact N-O 2.95Å; D199-S227 PolarHBondContact O-N 2.83Å; S227-E254 WeakPolarHBondContact CB-OE1 3.28Å; S227-E254 PolarHBondContact OG-OE1 2.77Å; S227-E254 VanDerWaalsContact OG-OE1 3.11Å; S227-I255 CarbonylContact C-O 3.57Å; S227-I255 VanDerWaalsContact CA-O 3.23Å; S227-I255 WeakPolarHBondContact CA-O 3.43Å; S227-I255 WeakPolarHBondContact CB-O 3.28Å
228	L	98.2	Very high	93.8	Very high	100 Å²	100	42.8 Å²	42.8	52%	0.524	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	116.8	170.7	-177.2	68	0	0	0	107.5	Q197 W198 E254 I255	Q197-L228 CarbonylContact O-C 3.53Å; W198-L228 HydrophobicContact CB-CD1 4.31Å; L228-E254 VanDerWaalsContact O-CA 3.32Å; L228-E254 WeakPolarHBondContact O-CA 3.49Å; L228-I255 PolarHBondContact N-O 3.34Å; L228-I255 PolarHBondContact O-N 2.76Å
229	R	97.6	Very high	93.7	Very high	52 Å²	52	39.5 Å²	39.5	20%	0.196	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130	-177.6	-174.1	-172	-59.6	-79	-7.6	110.2	F196 Q197 V231 Q253 E254	F196-R229 CarbonylContact C-O 3.51Å; F196-R229 WeakPolarHBondContact CA-O 3.37Å; Q197-R229 HydrophobicContact CB-CB 4.36Å; Q197-R229 PolarHBondContact N-O 2.79Å; Q197-R229 PolarHBondContact O-N 2.9Å; R229-V231 HydrophobicContact CG-CG2 3.9Å; R229-Q253 CarbonylContact C-O 3.52Å; R229-Q253 VanDerWaalsContact CA-O 3.26Å; R229-Q253 WeakPolarHBondContact CA-O 3.46Å; R229-E254 HydrophobicContact CB-CB 4.42Å; R229-E254 HydrophobicContact CG-CB 4.39Å; R229-E254 IonicContact CZ-OE2 3.4Å; R229-E254 VanDerWaalsContact CZ-OE2 3.24Å; R229-E254 IonicContact NH1-OE2 3.98Å; R229-E254 PolarHBondContact NH1-OE2 2.81Å; R229-E254 IonicContact NH2-OE1 3.99Å; R229-E254 PolarHBondContact NH2-OE1 3.4Å; R229-E254 VanDerWaalsContact NH2-OE1 3.11Å; R229-E254 IonicContact NH2-OE2 3.83Å; R229-E254 PolarHBondContact NH2-OE2 2.82Å
230	H	98	Very high	93.6	Very high	41 Å²	41	42 Å²	42	19%	0.19	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.9	168.3	175.7	-122.4	0	0	0	109.1	H194 K195 F196 S252 Q253	H194-H230 AromaticContact ND1-NE2 3.56Å; K195-H230 CarbonylContact O-C 3.55Å; K195-H230 WeakPolarHBondContact O-CA 3.49Å; F196-H230 HydrophobicContact CD1-CB 4.16Å; F196-H230 AromaticContact CD1-CD2 3.46Å; F196-H230 VanDerWaalsContact CD1-CD2 3.46Å; F196-H230 WeakPolarHBondContact CD1-CD2 3.33Å; F196-H230 HydrophobicContact CE1-CB 4.23Å; F196-H230 AromaticContact CE1-CD2 3.12Å; F196-H230 WeakPolarHBondContact CE1-CD2 3.12Å; F196-H230 AromaticContact CE1-CG 3.69Å; F196-H230 AromaticContact CE1-NE2 3.68Å; F196-H230 AromaticContact CZ-CD2 3.43Å; F196-H230 VanDerWaalsContact CZ-CD2 3.43Å; F196-H230 WeakPolarHBondContact CZ-CD2 3.42Å; F196-H230 AromaticContact CZ-NE2 3.54Å; H230-S252 CarbonylContact O-C 3.54Å; H230-S252 WeakPolarHBondContact O-CA 3.43Å; H230-Q253 PolarHBondContact N-O 2.91Å; H230-Q253 PolarHBondContact O-N 2.86Å
231	V	97.7	Very high	93.3	Very high	16 Å²	16	40.1 Å²	40.1	10%	0.097	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	119.2	175.1	-173.6	0	0	0	0	108.7	H194 K195 R229 K250 I251	H194-V231 CarbonylContact C-O 3.48Å; K195-V231 HydrophobicContact CB-CB 4.26Å; K195-V231 PolarHBondContact N-O 2.95Å; K195-V231 PolarHBondContact O-N 2.86Å; R229-V231 HydrophobicContact CG-CG2 3.9Å; V231-K250 HydrophobicContact CG1-CD 4.5Å; V231-K250 HydrophobicContact CG1-CG 4.09Å; V231-I251 CarbonylContact C-O 3.6Å; V231-I251 WeakPolarHBondContact CA-O 3.23Å
232	F	97.6	Very high	93	Very high	34 Å²	34	38.8 Å²	38.8	15%	0.149	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.6	168.6	174.7	-107.5	0	0	0	109	V191 L193 H194 K250 I251	V191-F232 HydrophobicContact CG1-CE2 4.47Å; V191-F232 HydrophobicContact CG1-CZ 3.98Å; L193-F232 CarbonylContact O-C 3.52Å; L193-F232 WeakPolarHBondContact O-CA 3.45Å; H194-F232 AromaticContact CE1-CD2 3.45Å; H194-F232 VanDerWaalsContact CE1-CD2 3.45Å; H194-F232 WeakPolarHBondContact CE1-CD2 3.41Å; H194-F232 AromaticContact CE1-CE2 3.78Å; H194-F232 AromaticContact ND1-CD2 3.77Å; H194-F232 AromaticContact NE2-CD2 3.71Å; H194-F232 AromaticContact NE2-CE2 3.68Å; F232-K250 CarbonylContact O-C 3.48Å; F232-K250 VanDerWaalsContact O-CA 3.29Å; F232-K250 WeakPolarHBondContact O-CA 3.05Å; F232-I251 PolarHBondContact N-O 3.13Å; F232-I251 PolarHBondContact O-N 2.89Å
233	E	95.6	Very high	92.8	Very high	45 Å²	45	36.3 Å²	36.3	21%	0.21	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	116.9	-178.2	-174.7	-179.6	157.2	0	0	109.3	L193 K195 L248 C249	L193-E233 HydrophobicContact CB-CB 4.41Å; L193-E233 PolarHBondContact N-O 3.15Å; L193-E233 PolarHBondContact O-N 3.08Å; K195-E233 IonicContact NZ-OE2 3.21Å; K195-E233 PolarHBondContact NZ-OE2 3.02Å; E233-L248 HydrophobicContact CG-CD1 4.48Å; E233-C249 WeakPolarHBondContact CA-O 3.32Å
234	S	95.3	Very high	92.6	Very high	9 Å²	9	38.7 Å²	38.7	6%	0.063	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	113.2	175.7	-172.7	0	0	0	0	108.3	V191 Y247 L248 C249	V191-S234 WeakPolarHBondContact O-CB 3.45Å; V191-S234 PolarHBondContact O-OG 3.31Å; S234-Y247 PolarHBondContact OG-OH 2.77Å; S234-L248 WeakPolarHBondContact O-CA 3.47Å; S234-C249 PolarHBondContact N-O 2.91Å; S234-C249 PolarHBondContact O-N 2.82Å
235	D	93	Very high	92.4	Very high	56 Å²	56	38.4 Å²	38.4	30%	0.299	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	114.7	179.4	-165.5	-8.4	0	0	0	109.1	R237 L248	D235-R237 VanDerWaalsContact OD1-CB 3.3Å; D235-R237 WeakPolarHBondContact OD1-CB 3.29Å; D235-R237 WeakPolarHBondContact OD1-CG 3.5Å; D235-R237 IonicContact OD1-CZ 2.77Å; D235-R237 PolarHBondContact OD1-N 2.78Å; D235-R237 IonicContact OD1-NE 3.43Å; D235-R237 PolarHBondContact OD1-NE 2.88Å; D235-R237 IonicContact OD1-NH2 3.88Å; D235-R237 IonicContact OD2-CZ 3.85Å; D235-R237 IonicContact OD2-NE 3.8Å; D235-R237 PolarHBondContact OD2-NE 2.86Å; D235-R237 IonicContact OD2-NH2 3.23Å; D235-R237 PolarHBondContact OD2-NH2 2.81Å; D235-L248 HydrophobicContact CB-CD1 3.82Å
236	A	92.5	Very high	92.3	Very high	52 Å²	52	38.9 Å²	38.9	43%	0.43	23%	0.226	S	C	.	.			trans	-110.2	12.5	178.3	0	0	0	0	0	112.1	Y247	A236-Y247 HydrophobicContact CB-CD1 3.89Å; A236-Y247 HydrophobicContact CB-CE1 3.62Å; A236-Y247 PolarHBondContact N-O 2.79Å
237	R	91.3	Very high	92.2	Very high	18 Å²	18	41.4 Å²	41.4	7%	0.068	23%	0.229	C	C	.	.			trans	-77	137.1	-178.8	-62.3	173.2	-60.1	169.2	2.9	110.5	D235 D239 P243 P296 Y505	D235-R237 VanDerWaalsContact OD1-CB 3.3Å; D235-R237 WeakPolarHBondContact OD1-CB 3.29Å; D235-R237 WeakPolarHBondContact OD1-CG 3.5Å; D235-R237 IonicContact OD1-CZ 2.77Å; D235-R237 PolarHBondContact OD1-N 2.78Å; D235-R237 IonicContact OD1-NE 3.43Å; D235-R237 PolarHBondContact OD1-NE 2.88Å; D235-R237 IonicContact OD1-NH2 3.88Å; D235-R237 IonicContact OD2-CZ 3.85Å; D235-R237 IonicContact OD2-NE 3.8Å; D235-R237 PolarHBondContact OD2-NE 2.86Å; D235-R237 IonicContact OD2-NH2 3.23Å; D235-R237 PolarHBondContact OD2-NH2 2.81Å; R237-D239 VanDerWaalsContact C-N 3.28Å; R237-D239 PolarHBondContact O-N 2.87Å; R237-P243 HydrophobicContact CB-CB 4.09Å; R237-P243 HydrophobicContact CG-CB 4.01Å; R237-P296 HydrophobicContact CG-CG 4.47Å; R237-Y505 VanDerWaalsContact NH2-CD1 3.33Å; R237-Y505 VanDerWaalsContact NH2-CE1 3.29Å
238	P	87.2	Confident	92.1	Very high	91 Å²	91	41.6 Å²	41.6	59%	0.591	23%	0.229	S	C	*	.	S	Bend	trans	-72.5	-24.7	175.6	29.1	-33.5	0	0	0	112.4	D244 S245	P238-D244 WeakPolarHBondContact CG-OD1 3.41Å; P238-S245 WeakPolarHBondContact CD-O 3.39Å
239	D	87.1	Confident	92	Very high	31 Å²	31	38.3 Å²	38.3	17%	0.166	21%	0.214	C	C	.	.			trans	-134.6	135.7	-178.7	-171.4	-5.1	0	0	0	110.6	R237 V241 F242 P243 R471	R237-D239 VanDerWaalsContact C-N 3.28Å; R237-D239 PolarHBondContact O-N 2.87Å; D239-V241 PolarHBondContact OD1-N 2.79Å; D239-F242 PolarHBondContact OD2-N 3.03Å; D239-P243 WeakPolarHBondContact O-CB 3.45Å; D239-R471 VanDerWaalsContact CG-NH2 3.25Å; D239-R471 IonicContact OD1-CZ 3.86Å; D239-R471 IonicContact OD1-NH1 3.73Å; D239-R471 IonicContact OD1-NH2 2.91Å; D239-R471 PolarHBondContact OD1-NH2 3.28Å; D239-R471 IonicContact OD2-CZ 2.7Å; D239-R471 VanDerWaalsContact OD2-CZ 3.24Å; D239-R471 IonicContact OD2-NH1 2.82Å; D239-R471 PolarHBondContact OD2-NH1 2.96Å; D239-R471 IonicContact OD2-NH2 3.23Å; D239-R471 PolarHBondContact OD2-NH2 3.45Å
240	L	84.2	Confident	91.9	Very high	63 Å²	63	39.8 Å²	39.8	33%	0.33	22%	0.222	S	C	.	.	S	Bend	trans	-79.4	-33.4	178.1	-51.5	176.7	0	0	0	112.2	Y505	L240-Y505 HydrophobicContact CB-CE1 4.16Å; L240-Y505 HydrophobicContact CD2-CE1 3.9Å; L240-Y505 HydrophobicContact CG-CE1 4.39Å
241	V	84.6	Confident	91.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-91.2	-44.1	-173.6	-179.6	0	0	0	0	111.6	D239 R471 G474 R477	D239-V241 PolarHBondContact OD1-N 2.79Å; V241-R471 HydrophobicContact CB-CG 4.24Å; V241-R471 HydrophobicContact CG1-CB 3.89Å; V241-R471 HydrophobicContact CG1-CG 3.88Å; V241-R471 HydrophobicContact CG2-CG 4.33Å; V241-G474 WeakPolarHBondContact CG2-O 3.18Å; V241-R477 HydrophobicContact CG1-CB 3.97Å; V241-R477 HydrophobicContact CG1-CG 4.05Å; V241-R477 PolarHBondContact O-NE 3.25Å; V241-R477 PolarHBondContact O-NH2 3.01Å
242	F	86.3	Confident	91.9	Very high	9 Å²	9	41 Å²	41	4%	0.039	23%	0.23	C	C	.	.	S	Bend	trans	-130.5	71.5	179.2	-67	-49.2	0	0	0	111.1	D239 D244 R417 V469 R471	D239-F242 PolarHBondContact OD2-N 3.03Å; F242-D244 PolarHBondContact O-N 2.73Å; F242-R417 HydrophobicContact CD1-CG 4.33Å; F242-R417 HydrophobicContact CE1-CB 4.1Å; F242-R417 HydrophobicContact CE1-CG 3.93Å; F242-R417 HydrophobicContact CE2-CG 4.23Å; F242-R417 HydrophobicContact CZ-CB 4.24Å; F242-R417 HydrophobicContact CZ-CG 3.88Å; F242-V469 HydrophobicContact CE1-CB 3.9Å; F242-V469 HydrophobicContact CE1-CG1 3.48Å; F242-V469 VanDerWaalsContact CE1-CG1 3.48Å; F242-V469 HydrophobicContact CZ-CB 4.26Å; F242-V469 HydrophobicContact CZ-CG1 3.85Å; F242-R471 HydrophobicContact CD2-CB 4.26Å; F242-R471 HydrophobicContact CE2-CB 3.57Å; F242-R471 HydrophobicContact CZ-CB 4.2Å
243	P	88.2	Confident	91.9	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.019	24%	0.244	C	C	.	.			trans	-67	135	-180	31.9	-36.6	0	0	0	110.3	R237 D239 P296	R237-P243 HydrophobicContact CB-CB 4.09Å; R237-P243 HydrophobicContact CG-CB 4.01Å; D239-P243 WeakPolarHBondContact O-CB 3.45Å; P243-P296 HydrophobicContact CB-CB 4.08Å; P243-P296 HydrophobicContact CB-CG 3.79Å; P243-P296 HydrophobicContact CG-CB 4.07Å; P243-P296 HydrophobicContact CG-CG 4.1Å
244	D	87.8	Confident	92	Very high	57 Å²	57	41.9 Å²	41.9	31%	0.305	23%	0.234	S	C	.	.			trans	-103	-19.3	177.2	55.6	1.3	0	0	0	112.5	P238 F242 R298	P238-D244 WeakPolarHBondContact CG-OD1 3.41Å; F242-D244 PolarHBondContact O-N 2.73Å; D244-R298 PolarHBondContact O-N 2.76Å
245	S	90.1	Very high	92.1	Very high	57 Å²	57	46.2 Å²	46.2	40%	0.399	26%	0.256	S	S	.	.	S	Bend	trans	-159.7	173.3	-173.7	61.5	0	0	0	0	110.9	P238 P296	P238-S245 WeakPolarHBondContact CD-O 3.39Å; S245-P296 WeakPolarHBondContact O-CG 3.35Å
246	G	93.3	Very high	92.2	Very high	29 Å²	29	43.8 Å²	43.8	30%	0.299	24%	0.243	S	C	.	.			trans	87.2	-156.8	-179.1	0	0	0	0	0	112.7	P296	G246-P296 WeakPolarHBondContact O-CD 3.49Å
247	Y	93.9	Very high	92.3	Very high	102 Å²	102	42.9 Å²	42.9	40%	0.4	23%	0.234	S	C	.	.			trans	-158	157.4	-179.7	63.9	-87.2	0	0	0	110.3	S234 A236 C249 Q294	S234-Y247 PolarHBondContact OG-OH 2.77Å; A236-Y247 HydrophobicContact CB-CD1 3.89Å; A236-Y247 HydrophobicContact CB-CE1 3.62Å; A236-Y247 PolarHBondContact N-O 2.79Å; Y247-C249 HydrophobicContact CD2-CB 4.22Å; Y247-C249 HydrophobicContact CE2-CB 4.43Å; Y247-Q294 CarbonylContact C-O 3.55Å; Y247-Q294 WeakPolarHBondContact CA-O 3.39Å
248	L	94.1	Very high	92.3	Very high	8 Å²	8	42 Å²	42	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.9	163.7	168.2	71.2	0	0	0	107.8	E233 S234 D235 L292 L293 Q294	E233-L248 HydrophobicContact CG-CD1 4.48Å; S234-L248 WeakPolarHBondContact O-CA 3.47Å; D235-L248 HydrophobicContact CB-CD1 3.82Å; L248-L292 HydrophobicContact CD2-CD2 4.18Å; L248-L293 CarbonylContact O-C 3.53Å; L248-L293 WeakPolarHBondContact O-CA 3.35Å; L248-Q294 HydrophobicContact CB-CB 4.22Å; L248-Q294 PolarHBondContact N-O 2.83Å; L248-Q294 PolarHBondContact O-N 2.82Å
249	C	95.9	Very high	92.5	Very high	31 Å²	31	39.7 Å²	39.7	21%	0.209	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.6	172.9	-178.5	0	0	0	0	108.7	E233 S234 Y247 L292 L293	E233-C249 WeakPolarHBondContact CA-O 3.32Å; S234-C249 PolarHBondContact N-O 2.91Å; S234-C249 PolarHBondContact O-N 2.82Å; Y247-C249 HydrophobicContact CD2-CB 4.22Å; Y247-C249 HydrophobicContact CE2-CB 4.43Å; C249-L292 WeakPolarHBondContact CA-O 3.36Å; C249-L293 HydrophobicContact CB-CD1 4.39Å
250	K	96.5	Very high	92.6	Very high	84 Å²	84	41.4 Å²	41.4	37%	0.365	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.2	175.4	-175.1	-179.7	-179.3	-179.9	0	109.4	V231 F232 G291 L292	V231-K250 HydrophobicContact CG1-CD 4.5Å; V231-K250 HydrophobicContact CG1-CG 4.09Å; F232-K250 CarbonylContact O-C 3.48Å; F232-K250 VanDerWaalsContact O-CA 3.29Å; F232-K250 WeakPolarHBondContact O-CA 3.05Å; K250-G291 CarbonylContact O-C 3.56Å; K250-G291 WeakPolarHBondContact O-CA 3.2Å; K250-L292 HydrophobicContact CB-CB 4.28Å; K250-L292 PolarHBondContact N-O 2.83Å; K250-L292 PolarHBondContact O-N 2.9Å
251	I	97.4	Very high	92.4	Very high	70 Å²	70	38.6 Å²	38.6	36%	0.359	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124.6	179.2	-59.4	172.5	0	0	0	107.2	V231 F232 Q253 E290	V231-I251 CarbonylContact C-O 3.6Å; V231-I251 WeakPolarHBondContact CA-O 3.23Å; F232-I251 PolarHBondContact N-O 3.13Å; F232-I251 PolarHBondContact O-N 2.89Å; I251-Q253 HydrophobicContact CG2-CG 4.39Å; I251-E290 WeakPolarHBondContact CA-O 3.32Å
252	S	97.8	Very high	92.1	Very high	11 Å²	11	39 Å²	39	8%	0.077	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.4	177.5	174.5	0	0	0	0	109.8	H230 L289 E290	H230-S252 CarbonylContact O-C 3.54Å; H230-S252 WeakPolarHBondContact O-CA 3.43Å; S252-L289 CarbonylContact O-C 3.52Å; S252-L289 WeakPolarHBondContact O-CA 3.45Å; S252-E290 PolarHBondContact N-O 2.77Å; S252-E290 PolarHBondContact O-N 2.81Å
253	Q	97.6	Very high	91.2	Very high	95 Å²	95	45.4 Å²	45.4	44%	0.444	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.4	177.2	-52.2	176.4	30.2	0	0	107.8	R229 H230 I251 K288 L289	R229-Q253 CarbonylContact C-O 3.52Å; R229-Q253 VanDerWaalsContact CA-O 3.26Å; R229-Q253 WeakPolarHBondContact CA-O 3.46Å; H230-Q253 PolarHBondContact N-O 2.91Å; H230-Q253 PolarHBondContact O-N 2.86Å; I251-Q253 HydrophobicContact CG2-CG 4.39Å; Q253-K288 CarbonylContact C-O 3.58Å; Q253-L289 HydrophobicContact CB-CD2 4.01Å; Q253-L289 HydrophobicContact CG-CD2 3.83Å
254	E	97.5	Very high	89.7	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.019	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	127.9	179.7	172.6	-175.2	-165.9	0	0	109.6	K225 S227 L228 R229 L287 K288	K225-E254 WeakPolarHBondContact CE-OE1 3.23Å; K225-E254 IonicContact NZ-OE1 2.68Å; K225-E254 PolarHBondContact NZ-OE1 2.77Å; S227-E254 WeakPolarHBondContact CB-OE1 3.28Å; S227-E254 PolarHBondContact OG-OE1 2.77Å; S227-E254 VanDerWaalsContact OG-OE1 3.11Å; L228-E254 VanDerWaalsContact O-CA 3.32Å; L228-E254 WeakPolarHBondContact O-CA 3.49Å; R229-E254 HydrophobicContact CB-CB 4.42Å; R229-E254 HydrophobicContact CG-CB 4.39Å; R229-E254 IonicContact CZ-OE2 3.4Å; R229-E254 VanDerWaalsContact CZ-OE2 3.24Å; R229-E254 IonicContact NH1-OE2 3.98Å; R229-E254 PolarHBondContact NH1-OE2 2.81Å; R229-E254 IonicContact NH2-OE1 3.99Å; R229-E254 PolarHBondContact NH2-OE1 3.4Å; R229-E254 VanDerWaalsContact NH2-OE1 3.11Å; R229-E254 IonicContact NH2-OE2 3.83Å; R229-E254 PolarHBondContact NH2-OE2 2.82Å; E254-L287 CarbonylContact O-C 3.48Å; E254-L287 WeakPolarHBondContact O-CA 3.47Å; E254-K288 HydrophobicContact CB-CB 4.18Å; E254-K288 PolarHBondContact N-O 3.35Å; E254-K288 PolarHBondContact O-N 2.96Å; E254-K288 WeakPolarHBondContact OE2-CD 3.23Å
255	I	97.3	Very high	87.6	Confident	100 Å²	100	45.9 Å²	45.9	51%	0.513	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.1	169.1	-61.1	170	0	0	0	106.8	S227 L228 L287	S227-I255 CarbonylContact C-O 3.57Å; S227-I255 VanDerWaalsContact CA-O 3.23Å; S227-I255 WeakPolarHBondContact CA-O 3.43Å; S227-I255 WeakPolarHBondContact CB-O 3.28Å; L228-I255 PolarHBondContact N-O 3.34Å; L228-I255 PolarHBondContact O-N 2.76Å; I255-L287 HydrophobicContact CG1-CD1 3.7Å
256	A	95.7	Very high	85.1	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.033	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.8	-175.6	0	0	0	0	0	112	K225 S226 L285 Q286	K225-A256 HydrophobicContact CG-CB 4.3Å; S226-A256 CarbonylContact O-C 3.43Å; S226-A256 WeakPolarHBondContact O-CA 3.46Å; A256-L285 WeakPolarHBondContact O-CA 3.32Å; A256-Q286 PolarHBondContact N-O 2.85Å; A256-Q286 PolarHBondContact O-N 3.42Å
257	S	94.2	Very high	82.2	Confident	33 Å²	33	54.9 Å²	54.9	23%	0.231	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.4	166.6	-173.6	0	0	0	0	109.3	K225 S226 A284	K225-S257 CarbonylContact C-O 3.57Å; K225-S257 WeakPolarHBondContact CA-O 3.45Å; S226-S257 PolarHBondContact N-O 3.11Å; S226-S257 PolarHBondContact O-N 2.73Å; S257-A284 CarbonylContact C-O 3.49Å; S257-A284 WeakPolarHBondContact CA-O 3.48Å
258	I	92.6	Very high	79.5	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133	-174.5	-55	-178.5	0	0	0	108.8	R203 A223 V224 K225 A284	R203-I258 VanDerWaalsContact NH2-CG2 3.31Å; A223-I258 HydrophobicContact CB-CG2 4.16Å; V224-I258 CarbonylContact O-C 3.46Å; V224-I258 VanDerWaalsContact O-CA 3.3Å; V224-I258 WeakPolarHBondContact O-CA 3.34Å; K225-I258 HydrophobicContact CB-CG1 4.15Å; K225-I258 HydrophobicContact CD-CD1 4.35Å; K225-I258 HydrophobicContact CD-CG1 4.48Å; K225-I258 HydrophobicContact CG-CD1 4.41Å; K225-I258 HydrophobicContact CG-CG1 4Å; I258-A284 HydrophobicContact CB-CB 4.35Å; I258-A284 PolarHBondContact N-O 2.84Å; I258-A284 PolarHBondContact O-N 3Å
259	T	91.3	Very high	76.8	Confident	42 Å²	42	60.5 Å²	60.5	26%	0.258	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	126.7	-179.9	-54.3	0	0	0	0	110.8	A223 V224 V281	A223-T259 CarbonylContact C-O 3.32Å; A223-T259 WeakPolarHBondContact CA-O 3.25Å; V224-T259 PolarHBondContact N-O 2.87Å; V224-T259 PolarHBondContact O-N 2.86Å; T259-V281 HydrophobicContact CG2-CG1 3.47Å; T259-V281 VanDerWaalsContact CG2-CG1 3.47Å
260	P	87.4	Confident	73.9	Confident	66 Å²	66	62.7 Å²	62.7	43%	0.429	35%	0.353	S	S	.	.	S	Bend	cis	-64.9	161.4	-10.5	29.7	-34.6	0	0	0	111.9	S222 D282	S222-P260 WeakPolarHBondContact O-CD 3.3Å; P260-D282 CarbonylContact C-O 3.54Å; P260-D282 WeakPolarHBondContact CA-O 3.31Å
261	G	81.4	Confident	71.2	Confident	5 Å²	5	64.3 Å²	64.3	5%	0.052	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-66.3	155.8	168.6	0	0	0	0	0	111.2	D282	G261-D282 PolarHBondContact N-O 3.45Å; G261-D282 VanDerWaalsContact N-O 3.08Å; G261-D282 PolarHBondContact N-OD2 2.79Å
262	S	77	Confident	68.6	Low	9 Å²	9	67.6 Å²	67.6	6%	0.063	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-67.5	137.9	173.3	19	0	0	0	0	110.7	H320 P321	S262-H320 PolarHBondContact O-ND1 2.68Å; S262-P321 WeakPolarHBondContact O-CD 3.37Å; S262-P321 PolarHBondContact OG-O 3.42Å
263	Q	68.4	Low	65.8	Low	142 Å²	142	71.8 Å²	71.8	66%	0.664	41%	0.412	S	S	*	.			trans	-103.1	51.5	177.4	-60.5	-174	35.4	0	0	111.5	G265	Q263-G265 PolarHBondContact O-N 2.81Å
264	T	56.6	Low	63	Low	27 Å²	27	70.7 Å²	70.7	17%	0.166	42%	0.415	C	S	.	.			trans	-99	79.1	171.3	38.8	0	0	0	0	111.4	G215 K218 E219 P321	G215-T264 WeakPolarHBondContact O-CG2 3.47Å; K218-T264 HydrophobicContact CB-CG2 3.94Å; E219-T264 HydrophobicContact CG-CG2 3.44Å; E219-T264 VanDerWaalsContact CG-CG2 3.44Å; E219-T264 WeakPolarHBondContact OE1-CB 3.07Å; E219-T264 WeakPolarHBondContact OE1-CG2 3.46Å; E219-T264 PolarHBondContact OE1-OG1 2.64Å; T264-P321 WeakPolarHBondContact O-CG 3.46Å; T264-P321 VanDerWaalsContact OG1-CB 3.29Å; T264-P321 WeakPolarHBondContact OG1-CB 3.42Å; T264-P321 WeakPolarHBondContact OG1-CG 3.34Å
265	G	42.8	Very low	60.2	Low	43 Å²	43	75.6 Å²	75.6	44%	0.443	45%	0.45	S	S	.	.	S	Bend	trans	-153.4	159.7	170.3	0	0	0	0	0	110.2	Q263	Q263-G265 PolarHBondContact O-N 2.81Å
266	Q	37.5	Very low	57.7	Low	175 Å²	175	77.4 Å²	77.4	82%	0.818	46%	0.461	S	S	*	.			trans	-52.4	130.5	153.7	-72.9	179.7	-30.3	0	0	106.4	N268	Q266-N268 PolarHBondContact O-N 3.2Å
267	P	33.7	Very low	55.2	Low	101 Å²	101	83.3 Å²	83.3	66%	0.656	50%	0.502	S	S	*	.			trans	-57.4	111.3	167.8	24.5	-30.2	0	0	0	105.3	V269	P267-V269 PolarHBondContact O-N 3.18Å
268	N	36.7	Very low	52.8	Low	118 Å²	118	83.9 Å²	83.9	63%	0.631	51%	0.513	S	S	*	.			trans	-59.7	102.3	162.6	-80.6	-18.4	0	0	0	104.5	Q266 S270 N271	Q266-N268 PolarHBondContact O-N 3.2Å; N268-S270 PolarHBondContact O-N 3.35Å; N268-N271 PolarHBondContact O-N 2.89Å
269	V	36.8	Very low	50.6	Low	109 Å²	109	89.5 Å²	89.5	66%	0.661	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-53.9	-16.3	178.8	176	0	0	0	0	110.8	P267 N271 I272	P267-V269 PolarHBondContact O-N 3.18Å; V269-N271 VanDerWaalsContact C-N 3.26Å; V269-N271 PolarHBondContact O-N 2.89Å; V269-I272 PolarHBondContact O-N 2.79Å
270	S	35.5	Very low	48.9	Very low	77 Å²	77	94.8 Å²	94.8	54%	0.538	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-62.8	-18.1	172.3	66.6	0	0	0	0	115.8	N268 S273	N268-S270 PolarHBondContact O-N 3.35Å; S270-S273 PolarHBondContact O-OG 2.84Å; S270-S273 VanDerWaalsContact O-OG 3.14Å
271	N	40.3	Very low	47.9	Very low	119 Å²	119	95.1 Å²	95.1	64%	0.636	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-94.3	-6	177.3	-85.2	20.9	0	0	0	113.9	N268 V269 S273	N268-N271 PolarHBondContact O-N 2.89Å; V269-N271 VanDerWaalsContact C-N 3.26Å; V269-N271 PolarHBondContact O-N 2.89Å; N271-S273 PolarHBondContact O-N 2.91Å
272	I	41.5	Very low	47.9	Very low	139 Å²	139	97.8 Å²	97.8	71%	0.713	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-21.9	171.4	-60.1	175.5	0	0	0	110.2	V269	V269-I272 PolarHBondContact O-N 2.79Å
273	S	39.5	Very low	48.3	Very low	98 Å²	98	104.9 Å²	104.9	69%	0.685	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-0.8	179.5	58.4	0	0	0	0	115.9	S270 N271 S275	S270-S273 PolarHBondContact O-OG 2.84Å; S270-S273 VanDerWaalsContact O-OG 3.14Å; N271-S273 PolarHBondContact O-N 2.91Å; S273-S275 PolarHBondContact O-N 3.33Å
274	S	38.6	Very low	49.3	Very low	72 Å²	72	98.1 Å²	98.1	50%	0.503	59%	0.586	S	S	.	*			trans	-99.7	75	169.6	61	0	0	0	0	109.3	D276	S274-D276 PolarHBondContact O-N 3.31Å
275	S	40.3	Very low	51	Low	108 Å²	108	100.7 Å²	100.7	76%	0.755	60%	0.598	S	S	*	*			trans	-64.2	53.5	158.9	55.2	0	0	0	0	110.7	S273 S277	S273-S275 PolarHBondContact O-N 3.33Å; S275-S277 PolarHBondContact O-N 3.24Å
276	D	45	Very low	53.4	Low	138 Å²	138	98.8 Å²	98.8	74%	0.738	58%	0.578	S	S	*	*			trans	-87.1	111.2	174.3	-140.4	12.9	0	0	0	107.3	S274 G278	S274-D276 PolarHBondContact O-N 3.31Å; D276-G278 PolarHBondContact O-N 3.18Å
277	S	42.6	Very low	56.2	Low	127 Å²	127	93.1 Å²	93.1	89%	0.888	55%	0.553	S	S	*	*			trans	-76.6	31.3	-164.5	-21.9	0	0	0	0	113	S275	S275-S277 PolarHBondContact O-N 3.24Å
278	G	43.1	Very low	59.2	Low	45 Å²	45	89.9 Å²	89.9	46%	0.464	53%	0.528	S	S	.	.	S	Bend	trans	-98.7	127.3	174.2	0	0	0	0	0	109.5	D276 L280	D276-G278 PolarHBondContact O-N 3.18Å; G278-L280 PolarHBondContact O-N 3.2Å
279	S	47.2	Very low	62.1	Low	120 Å²	120	87.4 Å²	87.4	84%	0.839	52%	0.515	S	S	*	.			trans	-60	70.3	169	171.4	0	0	0	0	111.1	V281	S279-V281 PolarHBondContact O-N 2.89Å; S279-V281 VanDerWaalsContact O-N 3.11Å
280	L	56	Low	65	Low	152 Å²	152	85 Å²	85	80%	0.796	50%	0.496	S	S	*	.			trans	-75.2	98.8	175.3	-67.5	175.1	0	0	0	106.9	G278 D282	G278-L280 PolarHBondContact O-N 3.2Å; L280-D282 PolarHBondContact O-N 3.29Å; L280-D282 VanDerWaalsContact O-N 3.13Å
281	V	65.1	Low	67.9	Low	74 Å²	74	82.6 Å²	82.6	45%	0.448	48%	0.484	S	S	.	.			trans	-54.6	119.5	170.7	-177.2	0	0	0	0	107.8	T259 S279 R283	T259-V281 HydrophobicContact CG2-CG1 3.47Å; T259-V281 VanDerWaalsContact CG2-CG1 3.47Å; S279-V281 PolarHBondContact O-N 2.89Å; S279-V281 VanDerWaalsContact O-N 3.11Å; V281-R283 HydrophobicContact CB-CG 4.18Å; V281-R283 HydrophobicContact CG1-CG 3.72Å; V281-R283 PolarHBondContact O-N 2.72Å
282	D	80.8	Confident	70.5	Confident	61 Å²	61	77.7 Å²	77.7	33%	0.326	46%	0.457	S	S	.	.			trans	-68.6	94.2	179.8	-168.6	39.9	0	0	0	109.9	P260 G261 L280 H320	P260-D282 CarbonylContact C-O 3.54Å; P260-D282 WeakPolarHBondContact CA-O 3.31Å; G261-D282 PolarHBondContact N-O 3.45Å; G261-D282 VanDerWaalsContact N-O 3.08Å; G261-D282 PolarHBondContact N-OD2 2.79Å; L280-D282 PolarHBondContact O-N 3.29Å; L280-D282 VanDerWaalsContact O-N 3.13Å; D282-H320 IonicContact OD1-CE1 2.87Å; D282-H320 PolarHBondContact OD1-CE1 3.07Å; D282-H320 IonicContact OD1-NE2 3.06Å; D282-H320 PolarHBondContact OD1-NE2 2.83Å; D282-H320 IonicContact OD2-CE1 3.49Å; D282-H320 PolarHBondContact OD2-CE1 2.84Å
283	R	85.7	Confident	73.1	Confident	157 Å²	157	74.7 Å²	74.7	59%	0.592	44%	0.442	S	S	*	.			trans	-112.1	117.4	-172.6	-71	-173.7	166.6	165.5	-1.8	110.7	V281	V281-R283 HydrophobicContact CB-CG 4.18Å; V281-R283 HydrophobicContact CG1-CG 3.72Å; V281-R283 PolarHBondContact O-N 2.72Å
284	A	89.6	Confident	75.7	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	134.4	168.7	0	0	0	0	0	110.6	S257 I258 S318 H320	S257-A284 CarbonylContact C-O 3.49Å; S257-A284 WeakPolarHBondContact CA-O 3.48Å; I258-A284 HydrophobicContact CB-CB 4.35Å; I258-A284 PolarHBondContact N-O 2.84Å; I258-A284 PolarHBondContact O-N 3Å; A284-S318 VanDerWaalsContact CA-OG 3.31Å; A284-S318 WeakPolarHBondContact CA-OG 3.37Å; A284-H320 HydrophobicContact CB-CB 3.72Å
285	L	92.9	Very high	78.4	Confident	82 Å²	82	72.7 Å²	72.7	43%	0.429	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.7	173.2	-69.9	175	0	0	0	109	A256 S316 L317 S318	A256-L285 WeakPolarHBondContact O-CA 3.32Å; L285-S316 CarbonylContact O-C 3.59Å; L285-S316 WeakPolarHBondContact O-CA 3.43Å; L285-S316 PolarHBondContact O-OG 2.78Å; L285-L317 HydrophobicContact CB-CB 4.09Å; L285-L317 PolarHBondContact O-N 2.84Å; L285-S318 PolarHBondContact N-OG 3.27Å; L285-S318 PolarHBondContact O-N 2.81Å
286	Q	93.9	Very high	81	Confident	3 Å²	3	67.8 Å²	67.8	1%	0.014	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.5	-176.9	-64	177.2	3.3	0	0	110.7	A256 H315	A256-Q286 PolarHBondContact N-O 2.85Å; A256-Q286 PolarHBondContact O-N 3.42Å; Q286-H315 CarbonylContact C-O 3.56Å; Q286-H315 WeakPolarHBondContact CA-O 3.3Å
287	L	95.4	Very high	83.3	Confident	56 Å²	56	64.8 Å²	64.8	29%	0.293	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.2	170.3	176.2	68.9	0	0	0	108.2	E254 I255 L289 I314 H315 L317	E254-L287 CarbonylContact O-C 3.48Å; E254-L287 WeakPolarHBondContact O-CA 3.47Å; I255-L287 HydrophobicContact CG1-CD1 3.7Å; L287-L289 HydrophobicContact CD1-CD2 4.45Å; L287-L289 HydrophobicContact CG-CG 4.44Å; L287-I314 CarbonylContact O-C 3.5Å; L287-I314 WeakPolarHBondContact O-CA 3.35Å; L287-H315 PolarHBondContact N-O 2.82Å; L287-H315 PolarHBondContact O-N 2.79Å; L287-L317 HydrophobicContact CB-CD1 4.24Å; L287-L317 HydrophobicContact CB-CG 4.43Å
288	K	97	Very high	85.6	Confident	32 Å²	32	65 Å²	65	14%	0.139	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.1	177.9	-171.2	-174.4	-158	-157.2	0	109.9	Q253 E254 E290 L313 I314 F328	Q253-K288 CarbonylContact C-O 3.58Å; E254-K288 HydrophobicContact CB-CB 4.18Å; E254-K288 PolarHBondContact N-O 3.35Å; E254-K288 PolarHBondContact O-N 2.96Å; E254-K288 WeakPolarHBondContact OE2-CD 3.23Å; K288-E290 WeakPolarHBondContact CE-OE1 3.36Å; K288-E290 IonicContact NZ-OE1 3.41Å; K288-E290 PolarHBondContact NZ-OE1 3.1Å; K288-L313 CarbonylContact C-O 3.5Å; K288-L313 WeakPolarHBondContact CA-O 3.47Å; K288-I314 HydrophobicContact CB-CB 4.41Å; K288-I314 HydrophobicContact CB-CD1 4.16Å; K288-I314 HydrophobicContact CB-CG1 4.2Å; K288-I314 HydrophobicContact CD-CD1 4.29Å; K288-I314 HydrophobicContact CG-CB 4.19Å; K288-I314 HydrophobicContact CG-CD1 4.23Å; K288-I314 HydrophobicContact CG-CG1 4.41Å; K288-F328 HydrophobicContact CD-CZ 4.36Å; K288-F328 VanDerWaalsContact CE-CE1 3.49Å; K288-F328 HydrophobicContact CG-CZ 4.11Å
289	L	97.5	Very high	87.8	Confident	67 Å²	67	67.1 Å²	67.1	35%	0.351	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.7	179.5	-61.5	174.8	0	0	0	108.2	S252 Q253 L287 G312 L313	S252-L289 CarbonylContact O-C 3.52Å; S252-L289 WeakPolarHBondContact O-CA 3.45Å; Q253-L289 HydrophobicContact CB-CD2 4.01Å; Q253-L289 HydrophobicContact CG-CD2 3.83Å; L287-L289 HydrophobicContact CD1-CD2 4.45Å; L287-L289 HydrophobicContact CG-CG 4.44Å; L289-G312 CarbonylContact O-C 3.57Å; L289-G312 VanDerWaalsContact O-CA 3.32Å; L289-G312 WeakPolarHBondContact O-CA 3.14Å; L289-L313 PolarHBondContact N-O 2.95Å; L289-L313 PolarHBondContact O-N 3.11Å
290	E	97	Very high	89.8	Confident	59 Å²	59	64.4 Å²	64.4	28%	0.276	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.8	175.2	-64	174.8	-148.5	0	0	109.5	I251 S252 K288 S311 F328	I251-E290 WeakPolarHBondContact CA-O 3.32Å; S252-E290 PolarHBondContact N-O 2.77Å; S252-E290 PolarHBondContact O-N 2.81Å; K288-E290 WeakPolarHBondContact CE-OE1 3.36Å; K288-E290 IonicContact NZ-OE1 3.41Å; K288-E290 PolarHBondContact NZ-OE1 3.1Å; E290-S311 CarbonylContact C-O 3.55Å; E290-S311 WeakPolarHBondContact CA-O 3.26Å; E290-F328 HydrophobicContact CG-CE1 3.91Å; E290-F328 HydrophobicContact CG-CZ 3.9Å
291	G	96.9	Very high	91.1	Very high	26 Å²	26	63.5 Å²	63.5	27%	0.268	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136	178.5	0	0	0	0	0	110.6	K250 S310 S311	K250-G291 CarbonylContact O-C 3.56Å; K250-G291 WeakPolarHBondContact O-CA 3.2Å; G291-S310 CarbonylContact O-C 3.57Å; G291-S310 WeakPolarHBondContact O-CA 3.44Å; G291-S311 PolarHBondContact N-O 2.85Å; G291-S311 PolarHBondContact O-N 3.17Å
292	L	95.5	Very high	92.1	Very high	15 Å²	15	67.2 Å²	67.2	8%	0.079	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.8	171.9	176.3	67.7	0	0	0	108.8	L248 C249 K250 F309 M507	L248-L292 HydrophobicContact CD2-CD2 4.18Å; C249-L292 WeakPolarHBondContact CA-O 3.36Å; K250-L292 HydrophobicContact CB-CB 4.28Å; K250-L292 PolarHBondContact N-O 2.83Å; K250-L292 PolarHBondContact O-N 2.9Å; L292-F309 CarbonylContact C-O 3.59Å; L292-F309 WeakPolarHBondContact CA-O 3.49Å; L292-M507 HydrophobicContact CB-CE 4.36Å; L292-M507 HydrophobicContact CD1-CB 4.08Å; L292-M507 HydrophobicContact CD1-CE 4.28Å; L292-M507 HydrophobicContact CD1-CG 3.6Å; L292-M507 HydrophobicContact CD1-SD 4.13Å; L292-M507 HydrophobicContact CD2-CE 3.92Å; L292-M507 HydrophobicContact CD2-CG 4.09Å; L292-M507 HydrophobicContact CG-CE 4.41Å; L292-M507 HydrophobicContact CG-CG 4.46Å
293	L	95.9	Very high	92.6	Very high	77 Å²	77	65.9 Å²	65.9	40%	0.403	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.4	175.6	178.7	65.9	0	0	0	109	L248 C249 T308 F309	L248-L293 CarbonylContact O-C 3.53Å; L248-L293 WeakPolarHBondContact O-CA 3.35Å; C249-L293 HydrophobicContact CB-CD1 4.39Å; L293-T308 CarbonylContact O-C 3.54Å; L293-T308 WeakPolarHBondContact O-CA 3.38Å; L293-F309 HydrophobicContact CB-CB 4.38Å; L293-F309 PolarHBondContact N-O 2.73Å; L293-F309 PolarHBondContact O-N 2.78Å
294	Q	94.3	Very high	93	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.8	172.3	176.4	-177	5.6	0	0	108.3	Y247 L248 E306 T308	Y247-Q294 CarbonylContact C-O 3.55Å; Y247-Q294 WeakPolarHBondContact CA-O 3.39Å; L248-Q294 HydrophobicContact CB-CB 4.22Å; L248-Q294 PolarHBondContact N-O 2.83Å; L248-Q294 PolarHBondContact O-N 2.82Å; Q294-E306 HydrophobicContact CG-CG 3.92Å; Q294-E306 PolarHBondContact NE2-OE1 2.9Å; Q294-E306 PolarHBondContact NE2-OE2 3.36Å; Q294-T308 HydrophobicContact CG-CG2 4.19Å
295	K	95.1	Very high	93.2	Very high	126 Å²	126	58.7 Å²	58.7	55%	0.548	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	96.4	-179.6	-172.3	171.7	-179.1	172.3	0	110.6	F297 V307	K295-F297 WeakPolarHBondContact O-CD1 3.36Å; K295-V307 PolarHBondContact N-O 3.12Å; K295-V307 PolarHBondContact O-N 3.17Å
296	P	94.1	Very high	93.3	Very high	5 Å²	5	54.9 Å²	54.9	3%	0.032	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	144.8	168.9	32.5	-35.8	0	0	0	110.8	R237 P243 S245 G246 G305	R237-P296 HydrophobicContact CG-CG 4.47Å; P243-P296 HydrophobicContact CB-CB 4.08Å; P243-P296 HydrophobicContact CB-CG 3.79Å; P243-P296 HydrophobicContact CG-CB 4.07Å; P243-P296 HydrophobicContact CG-CG 4.1Å; S245-P296 WeakPolarHBondContact O-CG 3.35Å; G246-P296 WeakPolarHBondContact O-CD 3.49Å; P296-G305 CarbonylContact C-O 3.58Å; P296-G305 WeakPolarHBondContact CA-O 3.28Å
297	F	93	Very high	93.3	Very high	76 Å²	76	57.8 Å²	57.8	33%	0.333	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	128.7	174.6	52.3	-85.3	0	0	0	110	K295 L299 G305 V307	K295-F297 WeakPolarHBondContact O-CD1 3.36Å; F297-L299 HydrophobicContact CD2-CD2 3.87Å; F297-L299 HydrophobicContact CD2-CG 3.81Å; F297-L299 HydrophobicContact CE2-CD1 3.98Å; F297-L299 HydrophobicContact CE2-CD2 3.71Å; F297-L299 HydrophobicContact CE2-CG 3.71Å; F297-L299 PolarHBondContact O-N 2.82Å; F297-G305 PolarHBondContact N-O 2.78Å; F297-G305 PolarHBondContact O-N 2.77Å; F297-G305 VanDerWaalsContact O-O 3.11Å; F297-V307 HydrophobicContact CE1-CB 4.5Å; F297-V307 HydrophobicContact CE1-CG2 3.85Å; F297-V307 HydrophobicContact CZ-CG2 4.34Å
298	R	91.7	Very high	93.3	Very high	132 Å²	132	55.1 Å²	55.1	50%	0.498	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	116.7	173.1	-170.8	176.1	177.9	115.5	-6.8	109.6	D244 C300 D301	D244-R298 PolarHBondContact O-N 2.76Å; R298-C300 VanDerWaalsContact CG-O 3.27Å; R298-C300 WeakPolarHBondContact CG-O 3.36Å; R298-D301 IonicContact CZ-OD1 3.7Å; R298-D301 IonicContact NE-OD1 2.62Å; R298-D301 VanDerWaalsContact NH2-CA 3.26Å; R298-D301 PolarHBondContact NH2-O 2.79Å; R298-D301 IonicContact NH2-OD1 3.35Å; R298-D301 PolarHBondContact NH2-OD1 2.8Å
299	L	89.6	Confident	93.2	Very high	89 Å²	89	57.7 Å²	57.7	47%	0.466	28%	0.284	S	S	.	.	S	Bend	trans	-86.1	-45.4	178.1	-77.4	167.4	0	0	0	111.4	F297 L303 L398	F297-L299 HydrophobicContact CD2-CD2 3.87Å; F297-L299 HydrophobicContact CD2-CG 3.81Å; F297-L299 HydrophobicContact CE2-CD1 3.98Å; F297-L299 HydrophobicContact CE2-CD2 3.71Å; F297-L299 HydrophobicContact CE2-CG 3.71Å; F297-L299 PolarHBondContact O-N 2.82Å; L299-L303 HydrophobicContact CB-CB 4.4Å; L299-L303 HydrophobicContact CB-CD2 4.17Å; L299-L303 HydrophobicContact CB-CG 4.24Å; L299-L303 HydrophobicContact CD1-CD2 3.9Å; L299-L303 HydrophobicContact CD1-CG 4.14Å; L299-L303 PolarHBondContact N-O 3.11Å; L299-L398 HydrophobicContact CD1-CD2 3.7Å
300	C	88.5	Confident	93.1	Very high	63 Å²	63	54.7 Å²	54.7	43%	0.426	27%	0.268	S	S	.	.	S	Bend	trans	-140.7	173.9	176.3	-64.2	0	0	0	0	108.5	R298 W302 L303	R298-C300 VanDerWaalsContact CG-O 3.27Å; R298-C300 WeakPolarHBondContact CG-O 3.36Å; C300-W302 PolarHBondContact O-N 2.99Å; C300-W302 VanDerWaalsContact O-N 3.08Å; C300-L303 HydrophobicContact CB-CB 4.08Å; C300-L303 PolarHBondContact N-O 2.93Å; C300-L303 VanDerWaalsContact N-O 3.13Å; C300-L303 PolarHBondContact O-N 2.83Å; C300-L303 VanDerWaalsContact O-N 3.15Å; C300-L303 VanDerWaalsContact O-O 3.08Å
301	D	84.6	Confident	93	Very high	133 Å²	133	53.8 Å²	53.8	71%	0.711	27%	0.268	S	S	*	.	S	Bend	trans	-59.3	-27.5	-177.8	-77.4	-40.7	0	0	0	115	R298	R298-D301 IonicContact CZ-OD1 3.7Å; R298-D301 IonicContact NE-OD1 2.62Å; R298-D301 VanDerWaalsContact NH2-CA 3.26Å; R298-D301 PolarHBondContact NH2-O 2.79Å; R298-D301 IonicContact NH2-OD1 3.35Å; R298-D301 PolarHBondContact NH2-OD1 2.8Å
302	W	85.8	Confident	93	Very high	151 Å²	151	52.6 Å²	52.6	57%	0.572	26%	0.256	S	S	*	.	S	Bend	trans	-107.9	-13	178.8	57.7	-90.8	0	0	0	113	C300 P401	C300-W302 PolarHBondContact O-N 2.99Å; C300-W302 VanDerWaalsContact O-N 3.08Å; W302-P401 HydrophobicContact CB-CG 4.05Å; W302-P401 WeakPolarHBondContact O-CD 3.32Å
303	L	90.7	Very high	93	Very high	33 Å²	33	54.3 Å²	54.3	17%	0.173	27%	0.265	C	S	.	.			trans	-114	122.6	-173	-174.5	65.9	0	0	0	111.1	L299 C300 L398	L299-L303 HydrophobicContact CB-CB 4.4Å; L299-L303 HydrophobicContact CB-CD2 4.17Å; L299-L303 HydrophobicContact CB-CG 4.24Å; L299-L303 HydrophobicContact CD1-CD2 3.9Å; L299-L303 HydrophobicContact CD1-CG 4.14Å; L299-L303 PolarHBondContact N-O 3.11Å; C300-L303 HydrophobicContact CB-CB 4.08Å; C300-L303 PolarHBondContact N-O 2.93Å; C300-L303 VanDerWaalsContact N-O 3.13Å; C300-L303 PolarHBondContact O-N 2.83Å; C300-L303 VanDerWaalsContact O-N 3.15Å; C300-L303 VanDerWaalsContact O-O 3.08Å; L303-L398 HydrophobicContact CD1-CB 4.47Å
304	V	93.1	Very high	92.9	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123	176.2	-179.2	0	0	0	0	109.3	L398 Y399	V304-L398 CarbonylContact O-C 3.57Å; V304-Y399 PolarHBondContact N-O 3.29Å; V304-Y399 PolarHBondContact O-N 2.85Å
305	G	94.8	Very high	92.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	151.1	168.9	0	0	0	0	0	111.1	P296 F297 H397	P296-G305 CarbonylContact C-O 3.58Å; P296-G305 WeakPolarHBondContact CA-O 3.28Å; F297-G305 PolarHBondContact N-O 2.78Å; F297-G305 PolarHBondContact O-N 2.77Å; F297-G305 VanDerWaalsContact O-O 3.11Å; G305-H397 CarbonylContact C-O 3.43Å; G305-H397 WeakPolarHBondContact CA-O 3.27Å
306	E	94	Very high	92.6	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	131.4	174.1	-178.7	-176.3	126.1	0	0	109.2	Q294 T308 H397 Y399	Q294-E306 HydrophobicContact CG-CG 3.92Å; Q294-E306 PolarHBondContact NE2-OE1 2.9Å; Q294-E306 PolarHBondContact NE2-OE2 3.36Å; E306-T308 HydrophobicContact CG-CG2 4.18Å; E306-T308 VanDerWaalsContact OE1-CG2 3.32Å; E306-T308 WeakPolarHBondContact OE1-CG2 3.42Å; E306-H397 HydrophobicContact CB-CB 4.25Å; E306-H397 PolarHBondContact N-O 3.07Å; E306-H397 PolarHBondContact O-N 3.19Å; E306-Y399 HydrophobicContact CB-CE2 3.94Å
307	V	95.5	Very high	92.3	Very high	64 Å²	64	51.5 Å²	51.5	39%	0.388	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.4	171.4	170	0	0	0	0	108.2	K295 F297 G395	K295-V307 PolarHBondContact N-O 3.12Å; K295-V307 PolarHBondContact O-N 3.17Å; F297-V307 HydrophobicContact CE1-CB 4.5Å; F297-V307 HydrophobicContact CE1-CG2 3.85Å; F297-V307 HydrophobicContact CZ-CG2 4.34Å; V307-G395 CarbonylContact C-O 3.58Å; V307-G395 WeakPolarHBondContact CA-O 3.29Å
308	T	94.4	Very high	91.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.7	174.6	71	0	0	0	0	110	L293 Q294 E306 T394 G395 M507	L293-T308 CarbonylContact O-C 3.54Å; L293-T308 WeakPolarHBondContact O-CA 3.38Å; Q294-T308 HydrophobicContact CG-CG2 4.19Å; E306-T308 HydrophobicContact CG-CG2 4.18Å; E306-T308 VanDerWaalsContact OE1-CG2 3.32Å; E306-T308 WeakPolarHBondContact OE1-CG2 3.42Å; T308-T394 CarbonylContact O-C 3.53Å; T308-T394 WeakPolarHBondContact O-CA 3.16Å; T308-T394 PolarHBondContact O-OG1 2.78Å; T308-G395 PolarHBondContact N-O 3.29Å; T308-G395 PolarHBondContact O-N 2.78Å; T308-G395 WeakPolarHBondContact OG1-CA 3.31Å; T308-M507 WeakPolarHBondContact CB-OXT 3.5Å; T308-M507 PolarHBondContact OG1-OXT 3.41Å
309	F	95.6	Very high	91.2	Very high	86 Å²	86	53 Å²	53	38%	0.377	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	124.3	175.6	178	-101.3	0	0	0	108.8	L292 L293 L393	L292-F309 CarbonylContact C-O 3.59Å; L292-F309 WeakPolarHBondContact CA-O 3.49Å; L293-F309 HydrophobicContact CB-CB 4.38Å; L293-F309 PolarHBondContact N-O 2.73Å; L293-F309 PolarHBondContact O-N 2.78Å; F309-L393 CarbonylContact C-O 3.55Å; F309-L393 WeakPolarHBondContact CA-O 3.46Å
310	S	95.2	Very high	91	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.5	177.5	-176.4	0	0	0	0	109.1	G291 F391 W392 L393 M507	G291-S310 CarbonylContact O-C 3.57Å; G291-S310 WeakPolarHBondContact O-CA 3.44Å; S310-F391 WeakPolarHBondContact OG-CE2 3.48Å; S310-W392 CarbonylContact O-C 3.53Å; S310-W392 WeakPolarHBondContact O-CA 3.19Å; S310-L393 PolarHBondContact N-O 3.32Å; S310-L393 PolarHBondContact O-N 3.08Å; S310-L393 VanDerWaalsContact O-O 3.13Å; S310-M507 PolarHBondContact OG-SD 2.72Å; S310-M507 VanDerWaalsContact OG-SD 3.35Å
311	S	94.9	Very high	90.9	Very high	40 Å²	40	48.9 Å²	48.9	28%	0.28	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	143.6	176.7	-175	0	0	0	0	110.6	E290 G291 F391	E290-S311 CarbonylContact C-O 3.55Å; E290-S311 WeakPolarHBondContact CA-O 3.26Å; G291-S311 PolarHBondContact N-O 2.85Å; G291-S311 PolarHBondContact O-N 3.17Å; S311-F391 VanDerWaalsContact CA-O 3.32Å; S311-F391 WeakPolarHBondContact CA-O 3.39Å; S311-F391 PolarHBondContact OG-O 2.79Å
312	G	96	Very high	91.2	Very high	2 Å²	2	42.6 Å²	42.6	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144.5	174.7	0	0	0	0	0	110.6	L289 A390 F391	L289-G312 CarbonylContact O-C 3.57Å; L289-G312 VanDerWaalsContact O-CA 3.32Å; L289-G312 WeakPolarHBondContact O-CA 3.14Å; G312-A390 CarbonylContact O-C 3.6Å; G312-A390 WeakPolarHBondContact O-CA 2.96Å; G312-A390 WeakPolarHBondContact O-CB 3.35Å; G312-F391 VanDerWaalsContact CA-CE1 3.47Å; G312-F391 PolarHBondContact N-O 3.13Å; G312-F391 PolarHBondContact O-N 3.24Å
313	L	95.4	Very high	91.4	Very high	51 Å²	51	35.8 Å²	35.8	27%	0.267	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	126.1	177	172.7	65.3	0	0	0	108.5	K288 L289 D389 A390 P431 I432	K288-L313 CarbonylContact C-O 3.5Å; K288-L313 WeakPolarHBondContact CA-O 3.47Å; L289-L313 PolarHBondContact N-O 2.95Å; L289-L313 PolarHBondContact O-N 3.11Å; L313-D389 CarbonylContact C-O 3.52Å; L313-A390 HydrophobicContact CB-CB 4.35Å; L313-A390 HydrophobicContact CD1-CB 3.64Å; L313-P431 HydrophobicContact CD1-CG 3.92Å; L313-I432 HydrophobicContact CD1-CD1 4.05Å; L313-I432 HydrophobicContact CD2-CD1 3.86Å; L313-I432 HydrophobicContact CG-CD1 4.3Å
314	I	95.3	Very high	91.4	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.7	169.5	-173	158.4	0	0	0	108.5	L287 K288 V322 D326 F328 D389	L287-I314 CarbonylContact O-C 3.5Å; L287-I314 WeakPolarHBondContact O-CA 3.35Å; K288-I314 HydrophobicContact CB-CB 4.41Å; K288-I314 HydrophobicContact CB-CD1 4.16Å; K288-I314 HydrophobicContact CB-CG1 4.2Å; K288-I314 HydrophobicContact CD-CD1 4.29Å; K288-I314 HydrophobicContact CG-CB 4.19Å; K288-I314 HydrophobicContact CG-CD1 4.23Å; K288-I314 HydrophobicContact CG-CG1 4.41Å; I314-V322 HydrophobicContact CD1-CG1 3.69Å; I314-V322 HydrophobicContact CG1-CG1 4.05Å; I314-V322 HydrophobicContact CG1-CG2 4.12Å; I314-V322 HydrophobicContact CG2-CG1 3.97Å; I314-V322 HydrophobicContact CG2-CG2 4.19Å; I314-D326 HydrophobicContact CD1-CB 3.74Å; I314-F328 HydrophobicContact CB-CE2 4.09Å; I314-F328 HydrophobicContact CG2-CD2 4.21Å; I314-F328 HydrophobicContact CG2-CE2 3.9Å; I314-D389 HydrophobicContact CG2-CB 4.07Å; I314-D389 WeakPolarHBondContact CG2-O 3.5Å; I314-D389 PolarHBondContact N-O 2.84Å
315	H	92	Very high	91.3	Very high	32 Å²	32	34.8 Å²	34.8	15%	0.148	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	126.1	178.7	178.9	49.3	0	0	0	109	Q286 L287 L317 I432	Q286-H315 CarbonylContact C-O 3.56Å; Q286-H315 WeakPolarHBondContact CA-O 3.3Å; L287-H315 PolarHBondContact N-O 2.82Å; L287-H315 PolarHBondContact O-N 2.79Å; H315-L317 PolarHBondContact O-N 2.98Å; H315-I432 HydrophobicContact CB-CD1 3.79Å; H315-I432 WeakPolarHBondContact CE1-CG2 3.43Å
316	S	89.9	Confident	91.2	Very high	10 Å²	10	35.2 Å²	35.2	7%	0.07	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	116.7	167.7	-168.2	0	0	0	0	109.1	L285 S318 H320	L285-S316 CarbonylContact O-C 3.59Å; L285-S316 WeakPolarHBondContact O-CA 3.43Å; L285-S316 PolarHBondContact O-OG 2.78Å; S316-S318 PolarHBondContact OG-O 2.8Å; S316-S318 PolarHBondContact OG-OG 2.94Å; S316-H320 WeakPolarHBondContact CB-O 3.38Å; S316-H320 PolarHBondContact OG-O 3.49Å
317	L	88.1	Confident	91.2	Very high	104 Å²	104	36.3 Å²	36.3	55%	0.545	19%	0.186	S	C	.	.	S	Bend	trans	-74.5	-17.7	173.1	-64.5	167.2	0	0	0	111.5	L285 L287 H315	L285-L317 HydrophobicContact CB-CB 4.09Å; L285-L317 PolarHBondContact O-N 2.84Å; L287-L317 HydrophobicContact CB-CD1 4.24Å; L287-L317 HydrophobicContact CB-CG 4.43Å; H315-L317 PolarHBondContact O-N 2.98Å
318	S	83.9	Confident	91.1	Very high	24 Å²	24	34.1 Å²	34.1	17%	0.168	17%	0.171	C	C	.	.	S	Bend	trans	-95.8	166.4	173.4	65	0	0	0	0	111.2	A284 L285 S316 H320	A284-S318 VanDerWaalsContact CA-OG 3.31Å; A284-S318 WeakPolarHBondContact CA-OG 3.37Å; L285-S318 PolarHBondContact N-OG 3.27Å; L285-S318 PolarHBondContact O-N 2.81Å; S316-S318 PolarHBondContact OG-O 2.8Å; S316-S318 PolarHBondContact OG-OG 2.94Å; S318-H320 PolarHBondContact O-N 3.35Å
319	K	78.5	Confident	91.1	Very high	214 Å²	214	34.9 Å²	34.9	93%	0.93	18%	0.175	S	C	*	.	S	Bend	trans	-68.5	-1.4	174.9	-66.6	-175.3	178.6	-179.7	0	114
320	H	85.2	Confident	90.9	Very high	40 Å²	40	30.9 Å²	30.9	19%	0.185	16%	0.157	C	C	.	.	S	Bend	trans	-76.7	140.8	177.5	-64.1	-77.7	0	0	0	111.3	S262 D282 A284 S316 S318	S262-H320 PolarHBondContact O-ND1 2.68Å; D282-H320 IonicContact OD1-CE1 2.87Å; D282-H320 PolarHBondContact OD1-CE1 3.07Å; D282-H320 IonicContact OD1-NE2 3.06Å; D282-H320 PolarHBondContact OD1-NE2 2.83Å; D282-H320 IonicContact OD2-CE1 3.49Å; D282-H320 PolarHBondContact OD2-CE1 2.84Å; A284-H320 HydrophobicContact CB-CB 3.72Å; S316-H320 WeakPolarHBondContact CB-O 3.38Å; S316-H320 PolarHBondContact OG-O 3.49Å; S318-H320 PolarHBondContact O-N 3.35Å
321	P	86.9	Confident	90.7	Very high	26 Å²	26	30.8 Å²	30.8	17%	0.169	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-62.2	154.8	168.5	29.3	-38.5	0	0	0	111.4	S262 T264 H323	S262-P321 WeakPolarHBondContact O-CD 3.37Å; S262-P321 PolarHBondContact OG-O 3.42Å; T264-P321 WeakPolarHBondContact O-CG 3.46Å; T264-P321 VanDerWaalsContact OG1-CB 3.29Å; T264-P321 WeakPolarHBondContact OG1-CB 3.42Å; T264-P321 WeakPolarHBondContact OG1-CG 3.34Å; P321-H323 PolarHBondContact O-N 2.81Å
322	V	90.6	Very high	90.4	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.012	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-68.3	132	172.1	179.8	0	0	0	0	109.7	I314 D326 R327	I314-V322 HydrophobicContact CD1-CG1 3.69Å; I314-V322 HydrophobicContact CG1-CG1 4.05Å; I314-V322 HydrophobicContact CG1-CG2 4.12Å; I314-V322 HydrophobicContact CG2-CG1 3.97Å; I314-V322 HydrophobicContact CG2-CG2 4.19Å; V322-D326 HydrophobicContact CG1-CB 4.13Å; V322-R327 HydrophobicContact CB-CG 4.4Å; V322-R327 HydrophobicContact CG1-CG 3.93Å; V322-R327 VanDerWaalsContact O-CZ 3.32Å; V322-R327 PolarHBondContact O-NE 3.41Å; V322-R327 PolarHBondContact O-NH2 2.86Å
323	H	90	Very high	89.9	Confident	8 Å²	8	29.5 Å²	29.5	4%	0.037	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-66.6	140.9	176.9	-174.3	-90.3	0	0	0	111.8	R203 T205 E219 P321 S325 D326 R327	R203-H323 PolarHBondContact NH1-ND1 2.86Å; R203-H323 PolarHBondContact NH2-CD2 3.39Å; R203-H323 VanDerWaalsContact NH2-CD2 3.29Å; R203-H323 PolarHBondContact NH2-ND1 2.63Å; T205-H323 PolarHBondContact OG1-CE1 2.82Å; T205-H323 PolarHBondContact OG1-NE2 2.84Å; E219-H323 IonicContact OE2-CD2 2.74Å; E219-H323 IonicContact OE2-CG 3.49Å; P321-H323 PolarHBondContact O-N 2.81Å; H323-S325 VanDerWaalsContact C-N 3.26Å; H323-S325 PolarHBondContact CE1-OG 2.89Å; H323-S325 PolarHBondContact ND1-N 2.97Å; H323-S325 PolarHBondContact ND1-OG 3.1Å; H323-S325 PolarHBondContact O-N 3.45Å; H323-S325 VanDerWaalsContact O-N 3.15Å; H323-D326 PolarHBondContact O-N 2.82Å; H323-R327 PolarHBondContact O-N 3.18Å
324	I	90.1	Very high	89.3	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-55.6	-36.9	-172	-170.1	164.4	0	0	0	113.5	A172 F174 V216 E219 D326 R327 F329 V386	A172-I324 HydrophobicContact CB-CD1 4.49Å; F174-I324 HydrophobicContact CD1-CD1 3.93Å; F174-I324 HydrophobicContact CD1-CG1 4.46Å; F174-I324 HydrophobicContact CE1-CD1 3.64Å; F174-I324 HydrophobicContact CE1-CG1 3.74Å; F174-I324 HydrophobicContact CE1-CG2 4.18Å; F174-I324 HydrophobicContact CE2-CG2 4.48Å; F174-I324 HydrophobicContact CZ-CG1 4.19Å; F174-I324 HydrophobicContact CZ-CG2 4.14Å; V216-I324 HydrophobicContact CG2-CD1 3.7Å; E219-I324 WeakPolarHBondContact OE2-CA 3.39Å; E219-I324 WeakPolarHBondContact OE2-CB 3.21Å; E219-I324 VanDerWaalsContact OE2-CG2 3.27Å; E219-I324 WeakPolarHBondContact OE2-CG2 3.15Å; E219-I324 PolarHBondContact OE2-N 3.04Å; I324-D326 PolarHBondContact O-N 3.46Å; I324-R327 PolarHBondContact O-N 2.93Å; I324-F329 HydrophobicContact CG1-CZ 4.19Å; I324-V386 HydrophobicContact CD1-CB 4.41Å
325	S	90.4	Very high	88.9	Confident	16 Å²	16	30.4 Å²	30.4	11%	0.112	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-66.3	-21.9	178.1	-46.6	0	0	0	0	114.3	H323	H323-S325 VanDerWaalsContact C-N 3.26Å; H323-S325 PolarHBondContact CE1-OG 2.89Å; H323-S325 PolarHBondContact ND1-N 2.97Å; H323-S325 PolarHBondContact ND1-OG 3.1Å; H323-S325 PolarHBondContact O-N 3.45Å; H323-S325 VanDerWaalsContact O-N 3.15Å
326	D	93	Very high	88.8	Confident	9 Å²	9	28.9 Å²	28.9	5%	0.048	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-95.9	-11.5	179.2	-63.4	-56.7	0	0	0	112.8	R203 K225 I314 V322 H323 I324	R203-D326 IonicContact CZ-OD2 2.78Å; R203-D326 IonicContact NH1-OD1 2.68Å; R203-D326 IonicContact NH1-OD2 3.24Å; R203-D326 PolarHBondContact NH1-OD2 3.1Å; R203-D326 IonicContact NH2-OD2 3.75Å; K225-D326 IonicContact NZ-OD1 3.69Å; K225-D326 PolarHBondContact NZ-OD1 2.8Å; I314-D326 HydrophobicContact CD1-CB 3.74Å; V322-D326 HydrophobicContact CG1-CB 4.13Å; H323-D326 PolarHBondContact O-N 2.82Å; I324-D326 PolarHBondContact O-N 3.46Å
327	R	94.1	Very high	88.8	Confident	26 Å²	26	28.4 Å²	28.4	10%	0.098	14%	0.14	C	C	.	.	S	Bend	trans	-69.7	155.7	179.6	-65.5	179.4	-167.2	166.8	7.9	111.6	E219 V322 H323 I324 F329 V386	E219-R327 IonicContact OE1-CZ 3.39Å; E219-R327 IonicContact OE1-NH2 2.73Å; E219-R327 PolarHBondContact OE1-NH2 3.16Å; V322-R327 HydrophobicContact CB-CG 4.4Å; V322-R327 HydrophobicContact CG1-CG 3.93Å; V322-R327 VanDerWaalsContact O-CZ 3.32Å; V322-R327 PolarHBondContact O-NE 3.41Å; V322-R327 PolarHBondContact O-NH2 2.86Å; H323-R327 PolarHBondContact O-N 3.18Å; I324-R327 PolarHBondContact O-N 2.93Å; R327-F329 HydrophobicContact CB-CE2 4.31Å; R327-F329 WeakPolarHBondContact O-CD2 3.33Å; R327-V386 WeakPolarHBondContact CD-O 3.38Å; R327-V386 PolarHBondContact NH1-O 3.22Å; R327-V386 VanDerWaalsContact NH1-O 3.11Å
328	F	94.8	Very high	88.9	Confident	18 Å²	18	23.7 Å²	23.7	8%	0.079	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-89.7	140.2	178.1	-60.4	-72.9	0	0	0	111.4	K288 E290 I314 G387 A388 F391	K288-F328 HydrophobicContact CD-CZ 4.36Å; K288-F328 VanDerWaalsContact CE-CE1 3.49Å; K288-F328 HydrophobicContact CG-CZ 4.11Å; E290-F328 HydrophobicContact CG-CE1 3.91Å; E290-F328 HydrophobicContact CG-CZ 3.9Å; I314-F328 HydrophobicContact CB-CE2 4.09Å; I314-F328 HydrophobicContact CG2-CD2 4.21Å; I314-F328 HydrophobicContact CG2-CE2 3.9Å; F328-G387 CarbonylContact O-C 3.54Å; F328-G387 VanDerWaalsContact O-CA 3.27Å; F328-G387 WeakPolarHBondContact O-CA 3.44Å; F328-A388 PolarHBondContact N-O 2.94Å; F328-A388 PolarHBondContact O-N 2.8Å; F328-F391 HydrophobicContact CB-CD1 3.59Å; F328-F391 HydrophobicContact CB-CE1 4.24Å; F328-F391 HydrophobicContact CB-CG 4.42Å; F328-F391 AromaticContact CD1-CD1 3.59Å; F328-F391 HydrophobicContact CD1-CD1 3.59Å; F328-F391 AromaticContact CD1-CE1 3.39Å; F328-F391 HydrophobicContact CD1-CE1 3.39Å; F328-F391 AromaticContact CD2-CD1 3.93Å; F328-F391 HydrophobicContact CD2-CD1 3.93Å; F328-F391 HydrophobicContact CD2-CE1 4.42Å; F328-F391 HydrophobicContact CE1-CD1 4.16Å; F328-F391 AromaticContact CE1-CE1 3.69Å; F328-F391 HydrophobicContact CE1-CE1 3.69Å; F328-F391 HydrophobicContact CE2-CD1 4.46Å; F328-F391 AromaticContact CG-CD1 3.43Å; F328-F391 HydrophobicContact CG-CD1 3.43Å; F328-F391 VanDerWaalsContact CG-CD1 3.43Å; F328-F391 AromaticContact CG-CE1 3.79Å; F328-F391 HydrophobicContact CG-CE1 3.79Å; F328-F391 HydrophobicContact CZ-CE1 4.3Å
329	F	93.2	Very high	89.3	Confident	16 Å²	16	22.8 Å²	22.8	7%	0.07	11%	0.109	C	C	.	.			trans	-128.4	129.7	174.7	-62.4	-100.8	0	0	0	107.4	W171 A172 I324 R327 R342 G387	W171-F329 AromaticContact NE1-CD1 3.68Å; W171-F329 AromaticContact NE1-CE1 3.74Å; A172-F329 HydrophobicContact CB-CE1 4.41Å; I324-F329 HydrophobicContact CG1-CZ 4.19Å; R327-F329 HydrophobicContact CB-CE2 4.31Å; R327-F329 WeakPolarHBondContact O-CD2 3.33Å; F329-R342 HydrophobicContact CB-CB 3.6Å; F329-R342 HydrophobicContact CB-CG 3.7Å; F329-R342 HydrophobicContact CD1-CB 4.41Å; F329-R342 HydrophobicContact CG-CB 4.24Å; F329-G387 VanDerWaalsContact CE1-CA 3.45Å
330	L	92.3	Very high	89.8	Confident	2 Å²	2	16.8 Å²	16.8	1%	0.01	8%	0.084	C	C	.	.	B	Isolated β-bridge	trans	-101.1	158.1	173.4	-70.4	-176.7	0	0	0	110.8	R342 T343 V344 F391 T427	L330-R342 CarbonylContact O-C 3.51Å; L330-R342 VanDerWaalsContact O-CA 3.25Å; L330-R342 WeakPolarHBondContact O-CA 3.38Å; L330-T343 PolarHBondContact O-N 2.86Å; L330-V344 HydrophobicContact CB-CB 3.85Å; L330-V344 HydrophobicContact CB-CG1 4.15Å; L330-V344 WeakPolarHBondContact CB-O 3.32Å; L330-V344 PolarHBondContact N-O 3.09Å; L330-V344 VanDerWaalsContact N-O 3.09Å; L330-V344 WeakPolarHBondContact O-CA 3.33Å; L330-V344 WeakPolarHBondContact O-CB 3.25Å; L330-V344 PolarHBondContact O-N 2.8Å; L330-F391 HydrophobicContact CD1-CB 4.06Å; L330-F391 HydrophobicContact CD1-CD2 4.35Å; L330-F391 HydrophobicContact CD2-CB 4.36Å; L330-F391 HydrophobicContact CD2-CD2 3.64Å; L330-F391 HydrophobicContact CD2-CE2 4.11Å; L330-F391 HydrophobicContact CD2-CG 4.06Å; L330-F391 HydrophobicContact CG-CB 4.16Å; L330-F391 HydrophobicContact CG-CD2 4.32Å; L330-F391 HydrophobicContact CG-CG 4.4Å; L330-T427 HydrophobicContact CB-CG2 4.2Å; L330-T427 HydrophobicContact CD1-CG2 3.77Å; L330-T427 HydrophobicContact CG-CG2 3.82Å
331	G	90	Very high	90	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.081	C	C	.	.			trans	115.6	136.5	173.3	0	0	0	0	0	111.8	Q340 W341 R342	G331-Q340 CarbonylContact C-O 3.49Å; G331-W341 WeakPolarHBondContact O-CA 3.5Å; G331-R342 PolarHBondContact O-N 2.78Å
332	G	88.4	Confident	90.2	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.01	9%	0.086	C	C	.	.	S	Bend	trans	144.3	167.4	-176.6	0	0	0	0	0	111.6	L334 L336 R337	G332-L334 VanDerWaalsContact C-N 3.29Å; G332-L334 PolarHBondContact O-N 3.41Å; G332-L336 PolarHBondContact N-O 3.03Å; G332-L336 CarbonylContact O-C 3.52Å; G332-L336 VanDerWaalsContact O-C 3.24Å; G332-L336 VanDerWaalsContact O-O 3.09Å; G332-R337 WeakPolarHBondContact O-CA 3.43Å; G332-R337 PolarHBondContact O-N 2.92Å
333	P	85.2	Confident	90.2	Very high	14 Å²	14	18.9 Å²	18.9	9%	0.091	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-12	-174.9	29.9	-38	0	0	0	115.2	T106 R337 A499 F500	T106-P333 HydrophobicContact CG2-CG 3.69Å; T106-P333 WeakPolarHBondContact O-CD 3.33Å; T106-P333 WeakPolarHBondContact O-CG 3.47Å; P333-R337 WeakPolarHBondContact O-CG 3.39Å; P333-R337 PolarHBondContact O-NE 2.85Å; P333-A499 HydrophobicContact CB-CB 4.25Å; P333-F500 WeakPolarHBondContact CB-O 3.23Å; P333-F500 WeakPolarHBondContact CG-O 3.34Å
334	L	83.4	Confident	90.2	Very high	30 Å²	30	18.5 Å²	18.5	16%	0.157	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-4.5	177.8	-73.5	-176.2	0	0	0	115.9	T106 G332 F502 Y506	T106-L334 HydrophobicContact CG2-CB 3.95Å; T106-L334 HydrophobicContact CG2-CD1 3.36Å; T106-L334 HydrophobicContact CG2-CG 3.36Å; G332-L334 VanDerWaalsContact C-N 3.29Å; G332-L334 PolarHBondContact O-N 3.41Å; L334-F502 WeakPolarHBondContact CD1-O 3.27Å; L334-Y506 VanDerWaalsContact C-CZ 3.4Å; L334-Y506 VanDerWaalsContact CA-CE2 3.44Å; L334-Y506 HydrophobicContact CB-CD2 4.5Å; L334-Y506 HydrophobicContact CB-CE2 4.13Å; L334-Y506 HydrophobicContact CD2-CD2 3.62Å; L334-Y506 HydrophobicContact CD2-CE2 3.63Å; L334-Y506 HydrophobicContact CG-CE2 4.45Å; L334-Y506 VanDerWaalsContact O-CE2 3.23Å; L334-Y506 WeakPolarHBondContact O-CE2 3.29Å; L334-Y506 PolarHBondContact O-OH 2.78Å
335	E	86.5	Confident	90.2	Very high	45 Å²	45	18.6 Å²	18.6	21%	0.21	9%	0.087	C	C	.	.	S	Bend	trans	-118.8	-108.5	177.5	-64.5	174.2	-173.6	0	0	106.9	R337 L393 L423 Y506	E335-R337 PolarHBondContact O-N 3.38Å; E335-L393 HydrophobicContact CB-CD2 4.16Å; E335-L423 VanDerWaalsContact O-CD1 3.32Å; E335-L423 WeakPolarHBondContact O-CD1 3.46Å; E335-Y506 PolarHBondContact O-OH 2.83Å
336	L	90.4	Very high	90.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	-83.3	91.4	172.9	-172.1	66.2	0	0	0	110.9	G332 F339 V344 L393 L423 R461 V463	G332-L336 PolarHBondContact N-O 3.03Å; G332-L336 CarbonylContact O-C 3.52Å; G332-L336 VanDerWaalsContact O-C 3.24Å; G332-L336 VanDerWaalsContact O-O 3.09Å; L336-F339 HydrophobicContact CD1-CE2 4.44Å; L336-F339 HydrophobicContact CD2-CD2 3.78Å; L336-F339 HydrophobicContact CD2-CE2 3.84Å; L336-F339 HydrophobicContact CG-CD2 3.7Å; L336-F339 HydrophobicContact CG-CE2 3.94Å; L336-V344 HydrophobicContact CD2-CB 4.22Å; L336-V344 HydrophobicContact CD2-CG1 3.96Å; L336-V344 HydrophobicContact CD2-CG2 3.96Å; L336-L393 HydrophobicContact CB-CD1 4.13Å; L336-L393 HydrophobicContact CD1-CD1 3.78Å; L336-L423 HydrophobicContact CD1-CB 4.22Å; L336-R461 HydrophobicContact CD2-CB 3.77Å; L336-R461 HydrophobicContact CD2-CG 4.44Å; L336-V463 HydrophobicContact CD1-CG2 4.5Å
337	R	89.9	Confident	90.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	157.5	-179.4	-58.9	-172.4	-176	108.1	-13.3	112.6	G332 P333 E335 F339 H397 F421 L423 V463 E479 N481 Y506	G332-R337 WeakPolarHBondContact O-CA 3.43Å; G332-R337 PolarHBondContact O-N 2.92Å; P333-R337 WeakPolarHBondContact O-CG 3.39Å; P333-R337 PolarHBondContact O-NE 2.85Å; E335-R337 PolarHBondContact O-N 3.38Å; R337-F339 PolarHBondContact O-N 2.8Å; R337-H397 PolarHBondContact NH1-CE1 3.38Å; R337-H397 VanDerWaalsContact NH1-CE1 3.27Å; R337-F421 HydrophobicContact CB-CE2 4.14Å; R337-F421 HydrophobicContact CB-CZ 4.44Å; R337-F421 VanDerWaalsContact CD-CZ 3.41Å; R337-F421 HydrophobicContact CG-CE2 4.41Å; R337-L423 HydrophobicContact CB-CD1 3.89Å; R337-L423 HydrophobicContact CG-CD1 3.73Å; R337-V463 WeakPolarHBondContact O-CG1 3.24Å; R337-V463 WeakPolarHBondContact O-CG2 3.24Å; R337-E479 IonicContact CZ-OE2 2.64Å; R337-E479 IonicContact NE-OE2 2.81Å; R337-E479 IonicContact NH2-OE1 3.4Å; R337-E479 IonicContact NH2-OE2 3.24Å; R337-E479 PolarHBondContact NH2-OE2 3.41Å; R337-N481 PolarHBondContact NE-ND2 3Å; R337-N481 VanDerWaalsContact NE-ND2 3.15Å; R337-Y506 WeakPolarHBondContact CG-OH 3.39Å; R337-Y506 VanDerWaalsContact CZ-CE2 3.42Å; R337-Y506 PolarHBondContact NE-OH 3.19Å; R337-Y506 PolarHBondContact NH1-OH 2.81Å; R337-Y506 PolarHBondContact NH2-OH 2.75Å
338	G	90.4	Very high	89.8	Confident	4 Å²	4	21.7 Å²	21.7	4%	0.041	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	0.5	178.4	0	0	0	0	0	115.1	P485 K495	G338-P485 WeakPolarHBondContact O-CG 3.4Å; G338-K495 CarbonylContact C-O 3.55Å; G338-K495 WeakPolarHBondContact CA-O 3.16Å; G338-K495 CarbonylContact O-C 3.57Å; G338-K495 VanDerWaalsContact O-C 3.31Å; G338-K495 WeakPolarHBondContact O-CA 3.31Å; G338-K495 PolarHBondContact O-N 3.29Å
339	F	91.8	Very high	89.6	Confident	6 Å²	6	23.9 Å²	23.9	3%	0.026	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-113.1	155.3	169.2	-65.2	-90.7	0	0	0	110.2	L336 R337 V344 R461 V463 P485 D492 V494	L336-F339 HydrophobicContact CD1-CE2 4.44Å; L336-F339 HydrophobicContact CD2-CD2 3.78Å; L336-F339 HydrophobicContact CD2-CE2 3.84Å; L336-F339 HydrophobicContact CG-CD2 3.7Å; L336-F339 HydrophobicContact CG-CE2 3.94Å; R337-F339 PolarHBondContact O-N 2.8Å; F339-V344 HydrophobicContact CB-CG2 3.59Å; F339-V344 HydrophobicContact CD1-CG2 3.41Å; F339-V344 VanDerWaalsContact CD1-CG2 3.41Å; F339-V344 HydrophobicContact CD2-CG2 4.05Å; F339-V344 HydrophobicContact CE1-CG2 4.05Å; F339-V344 HydrophobicContact CG-CG2 3.4Å; F339-R461 HydrophobicContact CE1-CG 4.03Å; F339-R461 HydrophobicContact CE2-CB 3.89Å; F339-R461 HydrophobicContact CE2-CG 4.18Å; F339-R461 HydrophobicContact CZ-CB 3.69Å; F339-R461 HydrophobicContact CZ-CG 3.55Å; F339-V463 HydrophobicContact CD2-CG2 3.95Å; F339-V463 HydrophobicContact CE2-CG2 3.42Å; F339-V463 VanDerWaalsContact CE2-CG2 3.42Å; F339-V463 HydrophobicContact CZ-CG2 4.4Å; F339-P485 HydrophobicContact CZ-CB 4.45Å; F339-D492 HydrophobicContact CD1-CB 4.21Å; F339-D492 HydrophobicContact CE1-CB 4.04Å; F339-V494 HydrophobicContact CD1-CG2 4.31Å; F339-V494 HydrophobicContact CE1-CG2 4.04Å
340	Q	89.9	Confident	89.4	Confident	87 Å²	87	24.5 Å²	24.5	41%	0.407	13%	0.127	S	C	.	.			trans	-64.8	156.6	172.1	-171.5	170.1	9.5	0	0	110.4	G331 R342 T343 Q493	G331-Q340 CarbonylContact C-O 3.49Å; Q340-R342 PolarHBondContact O-N 3.37Å; Q340-R342 VanDerWaalsContact O-N 3.16Å; Q340-T343 HydrophobicContact CB-CG2 3.72Å; Q340-T343 HydrophobicContact CG-CG2 3.94Å; Q340-T343 PolarHBondContact O-N 2.83Å; Q340-T343 PolarHBondContact O-OG1 3.04Å; Q340-Q493 HydrophobicContact CB-CB 3.91Å; Q340-Q493 PolarHBondContact N-O 3.44Å
341	W	89.1	Confident	89	Confident	31 Å²	31	27.5 Å²	27.5	12%	0.117	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	120	-178.3	-175.5	-105.7	0	0	0	111.5	T106 D107 W171 G331 T343	T106-W341 VanDerWaalsContact CB-CZ3 3.47Å; T106-W341 WeakPolarHBondContact OG1-CH2 3.38Å; T106-W341 WeakPolarHBondContact OG1-CZ3 3.41Å; D107-W341 HydrophobicContact CB-CD2 3.8Å; D107-W341 HydrophobicContact CB-CE3 4.43Å; D107-W341 HydrophobicContact CB-CG 3.86Å; D107-W341 HydrophobicContact CB-CZ2 4.41Å; W171-W341 AromaticContact CE3-CD1 3.68Å; W171-W341 AromaticContact CH2-NE1 3.92Å; W171-W341 AromaticContact CZ3-CD1 3.69Å; W171-W341 AromaticContact CZ3-NE1 3.62Å; G331-W341 WeakPolarHBondContact O-CA 3.5Å; W341-T343 WeakPolarHBondContact O-CG2 3.44Å; W341-T343 PolarHBondContact O-N 2.84Å
342	R	91.2	Very high	88.5	Confident	73 Å²	73	32.2 Å²	32.2	28%	0.275	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	28.9	174	-68.1	-175.1	174.9	-155.1	0.9	115.5	W171 F329 L330 G331 Q340	W171-R342 HydrophobicContact CD2-CB 3.93Å; W171-R342 VanDerWaalsContact CE2-CD 3.48Å; W171-R342 HydrophobicContact CG-CB 4.01Å; W171-R342 HydrophobicContact CZ2-CB 4.33Å; W171-R342 HydrophobicContact CZ2-CG 4.37Å; F329-R342 HydrophobicContact CB-CB 3.6Å; F329-R342 HydrophobicContact CB-CG 3.7Å; F329-R342 HydrophobicContact CD1-CB 4.41Å; F329-R342 HydrophobicContact CG-CB 4.24Å; L330-R342 CarbonylContact O-C 3.51Å; L330-R342 VanDerWaalsContact O-CA 3.25Å; L330-R342 WeakPolarHBondContact O-CA 3.38Å; G331-R342 PolarHBondContact O-N 2.78Å; Q340-R342 PolarHBondContact O-N 3.37Å; Q340-R342 VanDerWaalsContact O-N 3.16Å
343	T	89.4	Confident	87.5	Confident	8 Å²	8	37 Å²	37	5%	0.049	20%	0.202	C	C	.	.			trans	-98.3	-9.2	179.5	60.9	0	0	0	0	114.4	L330 Q340 W341 S345 Q493	L330-T343 PolarHBondContact O-N 2.86Å; Q340-T343 HydrophobicContact CB-CG2 3.72Å; Q340-T343 HydrophobicContact CG-CG2 3.94Å; Q340-T343 PolarHBondContact O-N 2.83Å; Q340-T343 PolarHBondContact O-OG1 3.04Å; W341-T343 WeakPolarHBondContact O-CG2 3.44Å; W341-T343 PolarHBondContact O-N 2.84Å; T343-S345 PolarHBondContact O-N 2.88Å; T343-Q493 HydrophobicContact CG2-CB 3.91Å; T343-Q493 HydrophobicContact CG2-CG 4.01Å; T343-Q493 PolarHBondContact OG1-O 3.31Å
344	V	91	Very high	86.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-89.2	87.2	176.7	-177.2	0	0	0	0	107.9	L330 L336 F339 T427 R461	L330-V344 HydrophobicContact CB-CB 3.85Å; L330-V344 HydrophobicContact CB-CG1 4.15Å; L330-V344 WeakPolarHBondContact CB-O 3.32Å; L330-V344 PolarHBondContact N-O 3.09Å; L330-V344 VanDerWaalsContact N-O 3.09Å; L330-V344 WeakPolarHBondContact O-CA 3.33Å; L330-V344 WeakPolarHBondContact O-CB 3.25Å; L330-V344 PolarHBondContact O-N 2.8Å; L336-V344 HydrophobicContact CD2-CB 4.22Å; L336-V344 HydrophobicContact CD2-CG1 3.96Å; L336-V344 HydrophobicContact CD2-CG2 3.96Å; F339-V344 HydrophobicContact CB-CG2 3.59Å; F339-V344 HydrophobicContact CD1-CG2 3.41Å; F339-V344 VanDerWaalsContact CD1-CG2 3.41Å; F339-V344 HydrophobicContact CD2-CG2 4.05Å; F339-V344 HydrophobicContact CE1-CG2 4.05Å; F339-V344 HydrophobicContact CG-CG2 3.4Å; V344-T427 VanDerWaalsContact O-CG2 3.27Å; V344-T427 WeakPolarHBondContact O-CG2 3.36Å; V344-R461 HydrophobicContact CG1-CG 4.03Å
345	S	90.7	Very high	85.2	Confident	4 Å²	4	47.8 Å²	47.8	3%	0.028	27%	0.269	C	S	.	.	S	Bend	trans	-167.1	166.4	176.5	67.9	0	0	0	0	109.6	T343 S347 P385 G387	T343-S345 PolarHBondContact O-N 2.88Å; S345-S347 PolarHBondContact O-N 2.82Å; S345-S347 PolarHBondContact O-OG 2.93Å; S345-P385 WeakPolarHBondContact OG-CB 3.45Å; S345-G387 PolarHBondContact OG-N 2.95Å
346	P	90	Very high	83.8	Confident	18 Å²	18	47.8 Å²	47.8	12%	0.117	28%	0.281	C	S	.	.			trans	-47.4	139.4	168	-29.5	37.9	0	0	0	111.6	P385 V386 A388 E429	P346-P385 CarbonylContact O-C 3.57Å; P346-P385 WeakPolarHBondContact O-CA 3.34Å; P346-V386 HydrophobicContact CB-CG2 4.32Å; P346-V386 WeakPolarHBondContact O-CG2 3.37Å; P346-V386 PolarHBondContact O-N 2.7Å; P346-A388 HydrophobicContact CG-CB 4.12Å; P346-E429 HydrophobicContact CB-CG 3.93Å; P346-E429 VanDerWaalsContact CB-OE1 3.24Å; P346-E429 WeakPolarHBondContact CB-OE1 3.49Å; P346-E429 HydrophobicContact CG-CG 3.21Å; P346-E429 VanDerWaalsContact CG-OE1 3.24Å; P346-E429 WeakPolarHBondContact CG-OE1 3.17Å
347	S	89.5	Confident	82	Confident	42 Å²	42	52.5 Å²	52.5	29%	0.294	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	139.5	-179.1	-61.9	0	0	0	0	111	S345 S384	S345-S347 PolarHBondContact O-N 2.82Å; S345-S347 PolarHBondContact O-OG 2.93Å; S347-S384 CarbonylContact C-O 3.59Å; S347-S384 WeakPolarHBondContact CA-O 3.3Å; S347-S384 WeakPolarHBondContact CB-O 3.36Å
348	E	89.7	Confident	80.6	Confident	56 Å²	56	58.1 Å²	58.1	26%	0.262	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	147.7	174	-74.6	-179.6	-170.1	0	0	110.5	P213 G215 S383 S384 V386	P213-E348 HydrophobicContact CB-CB 3.68Å; P213-E348 HydrophobicContact CG-CB 4.11Å; G215-E348 WeakPolarHBondContact CA-OE2 3.42Å; G215-E348 PolarHBondContact N-OE2 3.36Å; E348-S383 CarbonylContact O-C 3.59Å; E348-S383 WeakPolarHBondContact O-CA 3.42Å; E348-S383 VanDerWaalsContact O-CB 3.29Å; E348-S383 WeakPolarHBondContact O-CB 3.45Å; E348-S384 PolarHBondContact N-O 3.24Å; E348-S384 PolarHBondContact O-N 3.17Å; E348-V386 HydrophobicContact CB-CG1 3.83Å; E348-V386 HydrophobicContact CG-CB 4.43Å; E348-V386 HydrophobicContact CG-CG1 3.79Å; E348-V386 HydrophobicContact CG-CG2 3.86Å
349	P	89	Confident	79.1	Confident	64 Å²	64	63.2 Å²	63.2	42%	0.416	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	140.2	177.3	27.7	-34.3	0	0	0	110.9	V377	P349-V377 HydrophobicContact CB-CG1 4.25Å
350	L	89.3	Confident	77.5	Confident	29 Å²	29	66 Å²	66	15%	0.152	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-68.1	151.3	173	-64.5	-179.3	0	0	0	110.7	K173 T211 P213 V352 P382	K173-L350 HydrophobicContact CD-CD2 3.77Å; K173-L350 VanDerWaalsContact NZ-CD2 3.28Å; T211-L350 WeakPolarHBondContact O-CB 3.03Å; T211-L350 VanDerWaalsContact O-CD2 3.32Å; T211-L350 WeakPolarHBondContact O-CD2 3.33Å; P213-L350 HydrophobicContact CG-CD2 4.22Å; L350-V352 PolarHBondContact O-N 3.38Å; L350-P382 HydrophobicContact CB-CG 4.46Å; L350-P382 WeakPolarHBondContact CB-O 3.47Å; L350-P382 HydrophobicContact CD1-CB 3.84Å; L350-P382 HydrophobicContact CD1-CG 4.02Å; L350-P382 HydrophobicContact CG-CB 4.49Å; L350-P382 WeakPolarHBondContact CG-O 2.96Å; L350-P382 PolarHBondContact N-O 2.92Å
351	L	85.2	Confident	75.8	Confident	66 Å²	66	69.1 Å²	69.1	35%	0.346	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-70.6	118.2	169.5	-68.8	175.5	0	0	0	109.3	T211 A212 L214 L217	T211-L351 PolarHBondContact O-N 2.98Å; T211-L351 VanDerWaalsContact O-N 3.1Å; A212-L351 VanDerWaalsContact O-CD1 3.27Å; A212-L351 WeakPolarHBondContact O-CD1 3.49Å; A212-L351 VanDerWaalsContact O-CG 3.27Å; A212-L351 WeakPolarHBondContact O-CG 3.44Å; L214-L351 HydrophobicContact CB-CD2 4.3Å; L217-L351 HydrophobicContact CD1-CD1 3.35Å; L217-L351 HydrophobicContact CG-CD1 4.33Å
352	V	78.7	Confident	74.1	Confident	99 Å²	99	73 Å²	73	60%	0.6	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-89.8	122.7	171.4	-177.4	0	0	0	0	107.3	L350 T354	L350-V352 PolarHBondContact O-N 3.38Å; V352-T354 PolarHBondContact O-N 2.86Å
353	P	67.2	Low	72.3	Confident	101 Å²	101	72 Å²	72	66%	0.656	42%	0.42	S	S	*	.			trans	-61.4	111.3	172.3	23.2	-29.9	0	0	0	108.6	V355	P353-V355 PolarHBondContact O-N 3.29Å
354	T	63.1	Low	70.6	Confident	135 Å²	135	76 Å²	76	83%	0.828	44%	0.444	S	S	*	.			trans	-70	98.3	171.9	-49	0	0	0	0	107.8	V352 G356	V352-T354 PolarHBondContact O-N 2.86Å; T354-G356 PolarHBondContact O-N 2.84Å
355	V	58	Low	68.8	Low	136 Å²	136	80.9 Å²	80.9	82%	0.824	47%	0.47	S	S	*	.			trans	-74	80	164.2	-174.8	0	0	0	0	106.7	P353 T357	P353-V355 PolarHBondContact O-N 3.29Å; V355-T357 PolarHBondContact O-N 3.28Å
356	G	56.4	Low	67	Low	45 Å²	45	87.1 Å²	87.1	46%	0.464	50%	0.503	S	S	.	.			trans	-73.1	116.2	168.7	0	0	0	0	0	108.7	T354	T354-G356 PolarHBondContact O-N 2.84Å
357	T	53	Low	64.9	Low	99 Å²	99	91.1 Å²	91.1	61%	0.607	52%	0.523	S	S	*	.			trans	-60.4	140.7	161	-24.7	0	0	0	0	107.6	V355 D359 S360	V355-T357 PolarHBondContact O-N 3.28Å; T357-D359 PolarHBondContact O-N 3.48Å; T357-S360 PolarHBondContact O-N 3.2Å; T357-S360 PolarHBondContact O-OG 3.37Å
358	L	60.4	Low	62.7	Low	117 Å²	117	96.5 Å²	96.5	61%	0.613	55%	0.549	S	S	*	.	H	α-helix	trans	-47.5	-30.1	-178.6	-173.9	69.7	0	0	0	113.6	Y361 K362	L358-Y361 PolarHBondContact O-N 2.68Å; L358-K362 PolarHBondContact O-N 3.26Å
359	D	59.2	Low	60.3	Low	112 Å²	112	100 Å²	100	60%	0.599	57%	0.569	S	S	*	*	H	α-helix	trans	-66.9	-33.2	178.8	-59.7	-32.7	0	0	0	114	T357 Y361 K362 A363	T357-D359 PolarHBondContact O-N 3.48Å; D359-Y361 VanDerWaalsContact C-N 3.32Å; D359-Y361 PolarHBondContact O-N 2.79Å; D359-K362 PolarHBondContact O-N 3.28Å; D359-A363 PolarHBondContact O-N 3.29Å; D359-A363 VanDerWaalsContact O-N 3.1Å
360	S	57	Low	57.9	Low	63 Å²	63	106.5 Å²	106.5	44%	0.441	59%	0.594	S	S	.	*	H	α-helix	trans	-70.5	-31.6	177	64	0	0	0	0	111.9	T357 T364	T357-S360 PolarHBondContact O-N 3.2Å; T357-S360 PolarHBondContact O-OG 3.37Å; S360-T364 PolarHBondContact O-N 2.93Å; S360-T364 PolarHBondContact O-OG1 2.69Å
361	Y	53.7	Low	55.2	Low	153 Å²	153	113.3 Å²	113.3	60%	0.6	63%	0.625	S	S	*	*	H	α-helix	trans	-72.5	-38.9	175.8	-171.6	-108.3	0	0	0	112.3	L358 D359 T364 L365	L358-Y361 PolarHBondContact O-N 2.68Å; D359-Y361 VanDerWaalsContact C-N 3.32Å; D359-Y361 PolarHBondContact O-N 2.79Å; Y361-T364 WeakPolarHBondContact CA-OG1 3.24Å; Y361-T364 PolarHBondContact O-N 2.77Å; Y361-T364 PolarHBondContact O-OG1 3.15Å; Y361-L365 HydrophobicContact CD1-CD1 3.56Å; Y361-L365 HydrophobicContact CE1-CD1 3.16Å; Y361-L365 HydrophobicContact CE2-CD1 4.41Å; Y361-L365 HydrophobicContact CG-CD1 4.35Å; Y361-L365 PolarHBondContact O-N 2.97Å; Y361-L365 VanDerWaalsContact O-N 3.15Å
362	K	54.3	Low	52.8	Low	114 Å²	114	114.5 Å²	114.5	50%	0.496	64%	0.639	S	S	.	*	H	α-helix	trans	-63.6	-43.6	174.1	-72.6	179.9	179.4	174.9	0	111.9	L358 D359 T364 L365 D366	L358-K362 PolarHBondContact O-N 3.26Å; D359-K362 PolarHBondContact O-N 3.28Å; K362-T364 PolarHBondContact O-N 2.8Å; K362-L365 PolarHBondContact O-N 2.89Å; K362-D366 PolarHBondContact O-N 3.1Å; K362-D366 VanDerWaalsContact O-N 3.07Å
363	A	54.4	Low	50.9	Low	52 Å²	52	118 Å²	118	43%	0.43	65%	0.653	S	S	.	*	H	α-helix	trans	-61.3	-30.2	177	0	0	0	0	0	113.2	D359 N367	D359-A363 PolarHBondContact O-N 3.29Å; D359-A363 VanDerWaalsContact O-N 3.1Å; A363-N367 PolarHBondContact O-N 3.03Å; A363-N367 PolarHBondContact O-ND2 3.45Å
364	T	52.9	Low	49.4	Very low	90 Å²	90	117.1 Å²	117.1	55%	0.552	65%	0.65	S	S	*	*	H	α-helix	trans	-80.1	-23.4	174.1	50.7	0	0	0	0	114.2	S360 Y361 K362	S360-T364 PolarHBondContact O-N 2.93Å; S360-T364 PolarHBondContact O-OG1 2.69Å; Y361-T364 WeakPolarHBondContact CA-OG1 3.24Å; Y361-T364 PolarHBondContact O-N 2.77Å; Y361-T364 PolarHBondContact O-OG1 3.15Å; K362-T364 PolarHBondContact O-N 2.8Å
365	L	52.2	Low	48.2	Very low	103 Å²	103	116.1 Å²	116.1	54%	0.539	64%	0.643	S	S	.	*	H	α-helix	trans	-79.4	-34.8	175.8	-99.9	141.4	0	0	0	112.2	Y361 K362 N367	Y361-L365 HydrophobicContact CD1-CD1 3.56Å; Y361-L365 HydrophobicContact CE1-CD1 3.16Å; Y361-L365 HydrophobicContact CE2-CD1 4.41Å; Y361-L365 HydrophobicContact CG-CD1 4.35Å; Y361-L365 PolarHBondContact O-N 2.97Å; Y361-L365 VanDerWaalsContact O-N 3.15Å; K362-L365 PolarHBondContact O-N 2.89Å; L365-N367 VanDerWaalsContact C-N 3.34Å
366	D	54	Low	47.3	Very low	135 Å²	135	115.4 Å²	115.4	72%	0.722	64%	0.642	S	S	*	*	H	α-helix	trans	-73.8	-28.6	177.4	-73.8	-19.3	0	0	0	112.1	K362 N368	K362-D366 PolarHBondContact O-N 3.1Å; K362-D366 VanDerWaalsContact O-N 3.07Å; D366-N368 PolarHBondContact O-N 2.81Å
367	N	45.8	Very low	47	Very low	103 Å²	103	117.6 Å²	117.6	55%	0.551	65%	0.646	S	S	*	*			trans	-92.4	94.8	175.8	-67.1	-27.3	0	0	0	109.9	A363 L365 D369	A363-N367 PolarHBondContact O-N 3.03Å; A363-N367 PolarHBondContact O-ND2 3.45Å; L365-N367 VanDerWaalsContact C-N 3.34Å; N367-D369 PolarHBondContact O-N 3.35Å
368	N	43.2	Very low	46.7	Very low	154 Å²	154	116.7 Å²	116.7	82%	0.824	64%	0.643	S	S	*	*			trans	-62	19.4	171	-91.5	-32	0	0	0	114.8	D366 Q370	D366-N368 PolarHBondContact O-N 2.81Å; N368-Q370 PolarHBondContact O-N 3.48Å
369	D	40.4	Very low	46.4	Very low	131 Å²	131	118.1 Å²	118.1	70%	0.701	66%	0.657	S	S	*	*			trans	-79.3	109	175.4	-71.9	-31.7	0	0	0	108.6	N367 Q371	N367-D369 PolarHBondContact O-N 3.35Å; D369-Q371 PolarHBondContact O-N 2.83Å
370	Q	36.9	Very low	46.5	Very low	200 Å²	200	119.9 Å²	119.9	94%	0.935	67%	0.666	S	S	*	*			trans	-64.9	42.7	166	-64.2	-176.2	-15.1	0	0	112	N368 S372	N368-Q370 PolarHBondContact O-N 3.48Å; Q370-S372 VanDerWaalsContact C-N 3.32Å; Q370-S372 PolarHBondContact O-N 2.81Å
371	Q	33	Very low	47.1	Very low	171 Å²	171	118.4 Å²	118.4	80%	0.799	66%	0.656	S	S	*	*			trans	-75.2	96.4	161.7	-96.5	-178.6	5.9	0	0	107.5	D369 L373	D369-Q371 PolarHBondContact O-N 2.83Å; Q371-L373 PolarHBondContact O-N 2.82Å
372	S	34.2	Very low	48.6	Very low	91 Å²	91	114.8 Å²	114.8	64%	0.636	65%	0.651	S	S	*	*			trans	-11.9	118.2	155.2	52.2	0	0	0	0	112.7	Q370 S374	Q370-S372 VanDerWaalsContact C-N 3.32Å; Q370-S372 PolarHBondContact O-N 2.81Å; S372-S374 PolarHBondContact O-N 2.99Å
373	L	40.4	Very low	50.2	Low	172 Å²	172	111.7 Å²	111.7	90%	0.901	64%	0.644	S	S	*	*	S	Bend	trans	-61.1	70.4	169.1	-165.3	88.5	0	0	0	110.1	Q371	Q371-L373 PolarHBondContact O-N 2.82Å
374	S	36	Very low	51.9	Low	84 Å²	84	109.4 Å²	109.4	59%	0.587	63%	0.625	S	S	*	*			trans	-118.9	72	167.7	62.9	0	0	0	0	106.5	S372 P376	S372-S374 PolarHBondContact O-N 2.99Å; S374-P376 VanDerWaalsContact O-CD 3.28Å; S374-P376 WeakPolarHBondContact O-CD 3.4Å; S374-P376 VanDerWaalsContact O-N 3.1Å
375	T	37.6	Very low	53.8	Low	113 Å²	113	105.8 Å²	105.8	69%	0.693	60%	0.603	S	S	*	*			trans	-52.6	118.6	155.3	46.6	0	0	0	0	106	V377	T375-V377 PolarHBondContact O-N 2.97Å
376	P	39.3	Very low	55.6	Low	122 Å²	122	101.1 Å²	101.1	79%	0.792	58%	0.579	S	S	*	*			trans	-59.1	113.6	177.4	22.3	-30.1	0	0	0	106.8	S374 S378	S374-P376 VanDerWaalsContact O-CD 3.28Å; S374-P376 WeakPolarHBondContact O-CD 3.4Å; S374-P376 VanDerWaalsContact O-N 3.1Å; P376-S378 PolarHBondContact O-N 2.89Å
377	V	49.6	Very low	57.4	Low	91 Å²	91	94.9 Å²	94.9	55%	0.552	55%	0.546	S	S	*	.			trans	-52.5	116.1	171.9	175.7	0	0	0	0	105.6	P349 T375 V379 S381	P349-V377 HydrophobicContact CB-CG1 4.25Å; T375-V377 PolarHBondContact O-N 2.97Å; V377-V379 PolarHBondContact O-N 3.23Å; V377-S381 WeakPolarHBondContact CG1-OG 3.43Å
378	S	46.9	Very low	59.7	Low	79 Å²	79	90 Å²	90	55%	0.552	52%	0.52	S	S	*	.			trans	-56.7	139.6	179.8	57	0	0	0	0	108.6	P376 N380 S381	P376-S378 PolarHBondContact O-N 2.89Å; S378-N380 PolarHBondContact O-N 2.84Å; S378-S381 WeakPolarHBondContact O-CB 3.5Å; S378-S381 PolarHBondContact O-N 3.03Å; S378-S381 PolarHBondContact O-OG 2.77Å
379	V	54.6	Low	62	Low	147 Å²	147	83.5 Å²	83.5	89%	0.891	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-16.7	-176.6	179.5	0	0	0	0	112.9	V377	V377-V379 PolarHBondContact O-N 3.23Å
380	N	61	Low	64.6	Low	150 Å²	150	77.6 Å²	77.6	80%	0.802	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	13.8	179.2	-64.8	-12.5	0	0	0	114.1	S378	S378-N380 PolarHBondContact O-N 2.84Å
381	S	69.7	Low	67.4	Low	31 Å²	31	69 Å²	69	22%	0.217	41%	0.414	C	S	.	.			trans	-60.2	136.3	175	61.6	0	0	0	0	110.3	V377 S378 S383	V377-S381 WeakPolarHBondContact CG1-OG 3.43Å; S378-S381 WeakPolarHBondContact O-CB 3.5Å; S378-S381 PolarHBondContact O-N 3.03Å; S378-S381 PolarHBondContact O-OG 2.77Å; S381-S383 PolarHBondContact O-N 3.46Å
382	P	84.5	Confident	70.3	Confident	77 Å²	77	62.7 Å²	62.7	50%	0.5	38%	0.383	S	S	.	.			trans	-63	136	178.3	30.1	-36.2	0	0	0	109.7	L350	L350-P382 HydrophobicContact CB-CG 4.46Å; L350-P382 WeakPolarHBondContact CB-O 3.47Å; L350-P382 HydrophobicContact CD1-CB 3.84Å; L350-P382 HydrophobicContact CD1-CG 4.02Å; L350-P382 HydrophobicContact CG-CB 4.49Å; L350-P382 WeakPolarHBondContact CG-O 2.96Å; L350-P382 PolarHBondContact N-O 2.92Å
383	S	87.8	Confident	73.2	Confident	49 Å²	49	58.4 Å²	58.4	34%	0.343	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	162.9	-177.4	61.7	0	0	0	0	111.4	E348 S381	E348-S383 CarbonylContact O-C 3.59Å; E348-S383 WeakPolarHBondContact O-CA 3.42Å; E348-S383 VanDerWaalsContact O-CB 3.29Å; E348-S383 WeakPolarHBondContact O-CB 3.45Å; S381-S383 PolarHBondContact O-N 3.46Å
384	S	90.5	Very high	75.8	Confident	4 Å²	4	52.6 Å²	52.6	3%	0.028	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138	178.4	-175.5	0	0	0	0	110.5	W171 S347 E348 V386	W171-S384 PolarHBondContact O-OG 2.88Å; W171-S384 VanDerWaalsContact O-OG 3.1Å; S347-S384 CarbonylContact C-O 3.59Å; S347-S384 WeakPolarHBondContact CA-O 3.3Å; S347-S384 WeakPolarHBondContact CB-O 3.36Å; E348-S384 PolarHBondContact N-O 3.24Å; E348-S384 PolarHBondContact O-N 3.17Å; S384-V386 PolarHBondContact O-N 2.8Å
385	P	92.1	Very high	78.6	Confident	14 Å²	14	48.8 Å²	48.8	9%	0.091	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	133.5	174.3	26.2	-35	0	0	0	111	W171 A172 S345 P346	W171-P385 HydrophobicContact CB-CG 4.36Å; W171-P385 VanDerWaalsContact O-CD 3.32Å; W171-P385 WeakPolarHBondContact O-CD 3.41Å; W171-P385 WeakPolarHBondContact O-CG 3.1Å; A172-P385 WeakPolarHBondContact CB-O 3.35Å; S345-P385 WeakPolarHBondContact OG-CB 3.45Å; P346-P385 CarbonylContact O-C 3.57Å; P346-P385 WeakPolarHBondContact O-CA 3.34Å
386	V	90.3	Very high	81.4	Confident	6 Å²	6	45.6 Å²	45.6	4%	0.036	28%	0.284	C	S	.	.			trans	-118.6	4.4	179.5	-64.6	0	0	0	0	113.4	P213 V216 I324 R327 P346 E348 S384	P213-V386 HydrophobicContact CG-CG1 4.44Å; V216-V386 HydrophobicContact CG2-CG1 4.37Å; I324-V386 HydrophobicContact CD1-CB 4.41Å; R327-V386 WeakPolarHBondContact CD-O 3.38Å; R327-V386 PolarHBondContact NH1-O 3.22Å; R327-V386 VanDerWaalsContact NH1-O 3.11Å; P346-V386 HydrophobicContact CB-CG2 4.32Å; P346-V386 WeakPolarHBondContact O-CG2 3.37Å; P346-V386 PolarHBondContact O-N 2.7Å; E348-V386 HydrophobicContact CB-CG1 3.83Å; E348-V386 HydrophobicContact CG-CB 4.43Å; E348-V386 HydrophobicContact CG-CG1 3.79Å; E348-V386 HydrophobicContact CG-CG2 3.86Å; S384-V386 PolarHBondContact O-N 2.8Å
387	G	92.2	Very high	84	Confident	4 Å²	4	39.9 Å²	39.9	4%	0.041	25%	0.247	C	C	.	.			trans	80.7	167.8	177	0	0	0	0	0	113.4	F328 F329 S345	F328-G387 CarbonylContact O-C 3.54Å; F328-G387 VanDerWaalsContact O-CA 3.27Å; F328-G387 WeakPolarHBondContact O-CA 3.44Å; F329-G387 VanDerWaalsContact CE1-CA 3.45Å; S345-G387 PolarHBondContact OG-N 2.95Å
388	A	92.8	Very high	86.2	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-126.3	161.2	-178.2	0	0	0	0	0	112.2	F328 P346 T427	F328-A388 PolarHBondContact N-O 2.94Å; F328-A388 PolarHBondContact O-N 2.8Å; P346-A388 HydrophobicContact CG-CB 4.12Å; A388-T427 HydrophobicContact CB-CG2 4.16Å
389	D	93.5	Very high	88.4	Confident	16 Å²	16	36.1 Å²	36.1	9%	0.086	22%	0.217	C	C	.	.	S	Bend	trans	-85.1	-19.5	179.1	-72.9	5.5	0	0	0	112.1	L313 I314 L428 R430	L313-D389 CarbonylContact C-O 3.52Å; I314-D389 HydrophobicContact CG2-CB 4.07Å; I314-D389 WeakPolarHBondContact CG2-O 3.5Å; I314-D389 PolarHBondContact N-O 2.84Å; D389-L428 PolarHBondContact N-O 3.4Å; D389-R430 WeakPolarHBondContact OD2-CA 3.27Å; D389-R430 VanDerWaalsContact OD2-CG 3.3Å; D389-R430 WeakPolarHBondContact OD2-CG 3.17Å
390	A	94.4	Very high	90.1	Very high	7 Å²	7	30.9 Å²	30.9	6%	0.058	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	157.9	171.9	0	0	0	0	0	111.7	G312 L313 T427 L428 P431	G312-A390 CarbonylContact O-C 3.6Å; G312-A390 WeakPolarHBondContact O-CA 2.96Å; G312-A390 WeakPolarHBondContact O-CB 3.35Å; L313-A390 HydrophobicContact CB-CB 4.35Å; L313-A390 HydrophobicContact CD1-CB 3.64Å; A390-T427 CarbonylContact O-C 3.48Å; A390-T427 WeakPolarHBondContact O-CA 3.48Å; A390-L428 HydrophobicContact CB-CB 4.21Å; A390-L428 PolarHBondContact N-O 2.8Å; A390-L428 PolarHBondContact O-N 3.28Å; A390-P431 HydrophobicContact CB-CG 3.85Å
391	F	94.6	Very high	91.3	Very high	19 Å²	19	26.6 Å²	26.6	8%	0.083	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159.2	171.3	80.2	-86.8	0	0	0	111	S310 S311 G312 F328 L330 S426 T427	S310-F391 WeakPolarHBondContact OG-CE2 3.48Å; S311-F391 VanDerWaalsContact CA-O 3.32Å; S311-F391 WeakPolarHBondContact CA-O 3.39Å; S311-F391 PolarHBondContact OG-O 2.79Å; G312-F391 VanDerWaalsContact CA-CE1 3.47Å; G312-F391 PolarHBondContact N-O 3.13Å; G312-F391 PolarHBondContact O-N 3.24Å; F328-F391 HydrophobicContact CB-CD1 3.59Å; F328-F391 HydrophobicContact CB-CE1 4.24Å; F328-F391 HydrophobicContact CB-CG 4.42Å; F328-F391 AromaticContact CD1-CD1 3.59Å; F328-F391 HydrophobicContact CD1-CD1 3.59Å; F328-F391 AromaticContact CD1-CE1 3.39Å; F328-F391 HydrophobicContact CD1-CE1 3.39Å; F328-F391 AromaticContact CD2-CD1 3.93Å; F328-F391 HydrophobicContact CD2-CD1 3.93Å; F328-F391 HydrophobicContact CD2-CE1 4.42Å; F328-F391 HydrophobicContact CE1-CD1 4.16Å; F328-F391 AromaticContact CE1-CE1 3.69Å; F328-F391 HydrophobicContact CE1-CE1 3.69Å; F328-F391 HydrophobicContact CE2-CD1 4.46Å; F328-F391 AromaticContact CG-CD1 3.43Å; F328-F391 HydrophobicContact CG-CD1 3.43Å; F328-F391 VanDerWaalsContact CG-CD1 3.43Å; F328-F391 AromaticContact CG-CE1 3.79Å; F328-F391 HydrophobicContact CG-CE1 3.79Å; F328-F391 HydrophobicContact CZ-CE1 4.3Å; L330-F391 HydrophobicContact CD1-CB 4.06Å; L330-F391 HydrophobicContact CD1-CD2 4.35Å; L330-F391 HydrophobicContact CD2-CB 4.36Å; L330-F391 HydrophobicContact CD2-CD2 3.64Å; L330-F391 HydrophobicContact CD2-CE2 4.11Å; L330-F391 HydrophobicContact CD2-CG 4.06Å; L330-F391 HydrophobicContact CG-CB 4.16Å; L330-F391 HydrophobicContact CG-CD2 4.32Å; L330-F391 HydrophobicContact CG-CG 4.4Å; F391-S426 VanDerWaalsContact CA-O 3.31Å; F391-S426 WeakPolarHBondContact CA-O 3.45Å; F391-T427 HydrophobicContact CB-CG2 4.33Å
392	W	94.5	Very high	92	Very high	39 Å²	39	26.8 Å²	26.8	15%	0.148	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.3	162.9	65.5	-85.6	0	0	0	108.8	S310 T394 A424 G425 S426 L456 P460	S310-W392 CarbonylContact O-C 3.53Å; S310-W392 WeakPolarHBondContact O-CA 3.19Å; W392-T394 HydrophobicContact CE3-CG2 4.45Å; W392-T394 HydrophobicContact CZ3-CG2 3.84Å; W392-A424 HydrophobicContact CH2-CB 4.48Å; W392-A424 HydrophobicContact CZ3-CB 4.42Å; W392-A424 WeakPolarHBondContact CZ3-O 3.08Å; W392-G425 CarbonylContact O-C 3.59Å; W392-G425 WeakPolarHBondContact O-CA 3.42Å; W392-S426 PolarHBondContact N-O 3.31Å; W392-S426 PolarHBondContact O-N 2.95Å; W392-L456 HydrophobicContact CG-CD2 3.97Å; W392-L456 WeakPolarHBondContact CZ2-O 3.47Å; W392-P460 HydrophobicContact CH2-CB 4Å; W392-P460 HydrophobicContact CZ2-CB 3.94Å
393	L	95.1	Very high	91.4	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	131.8	178.2	179.1	66	0	0	0	107.2	F309 S310 E335 L336 A424	F309-L393 CarbonylContact C-O 3.55Å; F309-L393 WeakPolarHBondContact CA-O 3.46Å; S310-L393 PolarHBondContact N-O 3.32Å; S310-L393 PolarHBondContact O-N 3.08Å; S310-L393 VanDerWaalsContact O-O 3.13Å; E335-L393 HydrophobicContact CB-CD2 4.16Å; L336-L393 HydrophobicContact CB-CD1 4.13Å; L336-L393 HydrophobicContact CD1-CD1 3.78Å; L393-A424 CarbonylContact C-O 3.58Å; L393-A424 WeakPolarHBondContact CA-O 3.37Å
394	T	95.3	Very high	90.4	Very high	50 Å²	50	35.1 Å²	35.1	31%	0.307	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141.1	174.3	-166.8	0	0	0	0	109.1	T308 W392 L423 A424	T308-T394 CarbonylContact O-C 3.53Å; T308-T394 WeakPolarHBondContact O-CA 3.16Å; T308-T394 PolarHBondContact O-OG1 2.78Å; W392-T394 HydrophobicContact CE3-CG2 4.45Å; W392-T394 HydrophobicContact CZ3-CG2 3.84Å; T394-L423 WeakPolarHBondContact O-CA 3.32Å; T394-A424 HydrophobicContact CG2-CB 4.06Å; T394-A424 PolarHBondContact N-O 2.88Å; T394-A424 PolarHBondContact O-N 3.38Å
395	G	95.5	Very high	89	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.3	-177.6	0	0	0	0	0	111.4	V307 T308 L422	V307-G395 CarbonylContact C-O 3.58Å; V307-G395 WeakPolarHBondContact CA-O 3.29Å; T308-G395 PolarHBondContact N-O 3.29Å; T308-G395 PolarHBondContact O-N 2.78Å; T308-G395 WeakPolarHBondContact OG1-CA 3.31Å; G395-L422 CarbonylContact C-O 3.5Å; G395-L422 WeakPolarHBondContact CA-O 3.39Å
396	A	95.9	Very high	87.2	Confident	47 Å²	47	45.1 Å²	45.1	39%	0.388	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	122.9	166.1	0	0	0	0	0	108.2	F421 L422	A396-F421 CarbonylContact O-C 3.55Å; A396-F421 VanDerWaalsContact O-CA 3.25Å; A396-F421 WeakPolarHBondContact O-CA 3.32Å; A396-L422 PolarHBondContact N-O 3.11Å; A396-L422 PolarHBondContact O-N 3.47Å
397	H	94.3	Very high	85.5	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.009	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.3	-177.9	-57.4	-118.8	0	0	0	109.4	G305 E306 R337 Y399 G420 Y506	G305-H397 CarbonylContact C-O 3.43Å; G305-H397 WeakPolarHBondContact CA-O 3.27Å; E306-H397 HydrophobicContact CB-CB 4.25Å; E306-H397 PolarHBondContact N-O 3.07Å; E306-H397 PolarHBondContact O-N 3.19Å; R337-H397 PolarHBondContact NH1-CE1 3.38Å; R337-H397 VanDerWaalsContact NH1-CE1 3.27Å; H397-Y399 HydrophobicContact CB-CD2 4.46Å; H397-Y399 HydrophobicContact CB-CE2 3.69Å; H397-G420 CarbonylContact C-O 3.55Å; H397-G420 WeakPolarHBondContact CA-O 3.23Å; H397-Y506 AromaticContact CE1-CD1 3.87Å; H397-Y506 AromaticContact CE1-CE1 3.58Å; H397-Y506 AromaticContact NE2-CE1 3.95Å
398	L	95.1	Very high	83.9	Confident	87 Å²	87	57.1 Å²	57.1	46%	0.455	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.2	174.8	-69.5	172	0	0	0	107.9	L299 L303 V304 H419 G420	L299-L398 HydrophobicContact CD1-CD2 3.7Å; L303-L398 HydrophobicContact CD1-CB 4.47Å; V304-L398 CarbonylContact O-C 3.57Å; L398-H419 CarbonylContact O-C 3.59Å; L398-H419 WeakPolarHBondContact O-CA 3.15Å; L398-H419 VanDerWaalsContact O-CB 3.23Å; L398-H419 WeakPolarHBondContact O-CB 3.19Å; L398-G420 PolarHBondContact N-O 2.87Å; L398-G420 PolarHBondContact O-N 2.84Å
399	Y	92.7	Very high	82.3	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.016	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.5	179.7	-59	-89.3	0	0	0	110.4	V304 E306 H397 L418 H419 V469 R477	V304-Y399 PolarHBondContact N-O 3.29Å; V304-Y399 PolarHBondContact O-N 2.85Å; E306-Y399 HydrophobicContact CB-CE2 3.94Å; H397-Y399 HydrophobicContact CB-CD2 4.46Å; H397-Y399 HydrophobicContact CB-CE2 3.69Å; Y399-L418 WeakPolarHBondContact CA-O 3.43Å; Y399-H419 HydrophobicContact CD1-CB 3.41Å; Y399-H419 VanDerWaalsContact CD1-CB 3.41Å; Y399-H419 HydrophobicContact CE1-CB 3.66Å; Y399-H419 AromaticContact CE1-CG 3.95Å; Y399-H419 HydrophobicContact CG-CB 4.12Å; Y399-V469 HydrophobicContact CD1-CG2 4.41Å; Y399-V469 HydrophobicContact CE1-CG2 3.99Å; Y399-R477 PolarHBondContact OH-NH1 2.91Å
400	T	91.2	Very high	80.9	Confident	36 Å²	36	69.7 Å²	69.7	22%	0.221	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.5	175.6	173.8	0	0	0	0	109.7	R417 L418	T400-R417 CarbonylContact O-C 3.56Å; T400-R417 WeakPolarHBondContact O-CA 3.34Å; T400-L418 HydrophobicContact CG2-CB 3.76Å; T400-L418 PolarHBondContact N-O 3.28Å; T400-L418 PolarHBondContact O-N 3.23Å
401	P	86.5	Confident	79.7	Confident	60 Å²	60	71.5 Å²	71.5	39%	0.39	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	162	165.4	29.8	-35.4	0	0	0	109.9	W302	W302-P401 HydrophobicContact CB-CG 4.05Å; W302-P401 WeakPolarHBondContact O-CD 3.32Å
402	L	82.5	Confident	78.6	Confident	36 Å²	36	76.7 Å²	76.7	19%	0.188	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-62.5	132.5	175.3	-76.9	162.5	0	0	0	110.2	Y404 L416 L418	L402-Y404 PolarHBondContact O-N 3.47Å; L402-L416 HydrophobicContact CD1-CB 3.63Å; L402-L416 HydrophobicContact CD1-CD1 3.91Å; L402-L416 HydrophobicContact CD1-CG 4.4Å; L402-L416 HydrophobicContact CG-CB 4.39Å; L402-L418 HydrophobicContact CD2-CD1 4.19Å; L402-L418 HydrophobicContact CD2-CD2 3.69Å; L402-L418 HydrophobicContact CD2-CG 3.81Å
403	P	72.4	Confident	77.5	Confident	71 Å²	71	75.6 Å²	75.6	46%	0.461	43%	0.425	S	S	.	.	S	Bend	trans	-67.4	132.2	173.9	27.8	-32.2	0	0	0	109.5	W405 L418	P403-W405 PolarHBondContact O-N 3.35Å; P403-L418 HydrophobicContact CG-CD1 4.48Å
404	Y	67.9	Low	76.6	Confident	230 Å²	230	78.1 Å²	78.1	90%	0.902	45%	0.446	S	S	*	.	S	Bend	trans	75.7	-14.1	172.5	-46.9	-76.1	0	0	0	119	L402	L402-Y404 PolarHBondContact O-N 3.47Å
405	W	60.2	Low	76	Confident	195 Å²	195	79.3 Å²	79.3	74%	0.739	45%	0.448	S	S	*	.	S	Bend	trans	-113.2	115.5	178.4	-68.2	-52.2	0	0	0	113.3	P403 A413	P403-W405 PolarHBondContact O-N 3.35Å; W405-A413 WeakPolarHBondContact O-CB 3.33Å
406	G	53.8	Low	75.6	Confident	33 Å²	33	81.4 Å²	81.4	34%	0.34	46%	0.459	S	S	.	.			trans	75.5	63.9	152.1	0	0	0	0	0	117.5	E408	G406-E408 PolarHBondContact O-N 3.1Å
407	A	54.7	Low	75.3	Confident	111 Å²	111	81.9 Å²	81.9	92%	0.917	45%	0.45	S	S	*	.			trans	-73.3	7.5	160.1	0	0	0	0	0	113.4
408	E	59.3	Low	75.2	Confident	151 Å²	151	84.3 Å²	84.3	71%	0.706	46%	0.463	S	S	*	.	S	Bend	trans	-79.5	124.3	178.3	-70	-178.1	171.9	0	0	110.9	G406 G410 S411	G406-E408 PolarHBondContact O-N 3.1Å; E408-G410 PolarHBondContact O-N 2.69Å; E408-S411 PolarHBondContact O-N 2.63Å; E408-S411 VanDerWaalsContact O-N 3.16Å
409	E	58.6	Low	75.1	Confident	206 Å²	206	80.4 Å²	80.4	96%	0.963	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	108.8	174.3	-67.6	-177.9	171.7	0	0	109.9
410	G	65.3	Low	75.2	Confident	74 Å²	74	81.6 Å²	81.6	76%	0.763	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.8	-8.9	178.8	0	0	0	0	0	115.7	E408	E408-G410 PolarHBondContact O-N 2.69Å
411	S	69.2	Low	75.4	Confident	45 Å²	45	80.1 Å²	80.1	32%	0.315	45%	0.446	S	S	.	.			trans	-69.6	149.3	174.2	-177.5	0	0	0	0	112.2	E408 A413 A414	E408-S411 PolarHBondContact O-N 2.63Å; E408-S411 VanDerWaalsContact O-N 3.16Å; S411-A413 PolarHBondContact O-N 2.84Å; S411-A413 VanDerWaalsContact O-N 3.12Å; S411-A413 PolarHBondContact OG-N 3.48Å; S411-A414 WeakPolarHBondContact O-CB 3.13Å; S411-A414 PolarHBondContact O-N 2.82Å
412	L	70.8	Confident	75.9	Confident	129 Å²	129	81.4 Å²	81.4	68%	0.675	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-54.2	-29.3	170.8	-71.1	174.3	0	0	0	111.9	A414 Q415	L412-A414 VanDerWaalsContact C-N 3.33Å; L412-A414 PolarHBondContact O-N 3.31Å; L412-Q415 PolarHBondContact O-N 3.22Å
413	A	71.9	Confident	76.5	Confident	15 Å²	15	79.7 Å²	79.7	12%	0.124	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-65	-32.8	176.4	0	0	0	0	0	113.1	W405 S411 Q415 L416	W405-A413 WeakPolarHBondContact O-CB 3.33Å; S411-A413 PolarHBondContact O-N 2.84Å; S411-A413 VanDerWaalsContact O-N 3.12Å; S411-A413 PolarHBondContact OG-N 3.48Å; A413-Q415 PolarHBondContact O-N 3.46Å; A413-L416 PolarHBondContact O-N 3.08Å
414	A	75.4	Confident	77.6	Confident	55 Å²	55	77.2 Å²	77.2	46%	0.455	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-68.1	-18.7	178.5	0	0	0	0	0	112.8	S411 L412	S411-A414 WeakPolarHBondContact O-CB 3.13Å; S411-A414 PolarHBondContact O-N 2.82Å; L412-A414 VanDerWaalsContact C-N 3.33Å; L412-A414 PolarHBondContact O-N 3.31Å
415	Q	82.9	Confident	78.8	Confident	75 Å²	75	66.3 Å²	66.3	35%	0.35	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-88.2	-6.4	175.9	-61.9	178.3	-3.4	0	0	112.8	L412 A413 F470 R471	L412-Q415 PolarHBondContact O-N 3.22Å; A413-Q415 PolarHBondContact O-N 3.46Å; Q415-F470 HydrophobicContact CB-CD2 4.04Å; Q415-F470 HydrophobicContact CB-CE2 3.71Å; Q415-F470 WeakPolarHBondContact O-CA 3.41Å; Q415-R471 HydrophobicContact CB-CB 4.35Å; Q415-R471 PolarHBondContact O-N 3.44Å
416	L	87.5	Confident	80.3	Confident	48 Å²	48	57.2 Å²	57.2	25%	0.251	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.2	-178.3	-71.7	164.9	0	0	0	110.9	L402 A413 I468 V469 F470	L402-L416 HydrophobicContact CD1-CB 3.63Å; L402-L416 HydrophobicContact CD1-CD1 3.91Å; L402-L416 HydrophobicContact CD1-CG 4.4Å; L402-L416 HydrophobicContact CG-CB 4.39Å; A413-L416 PolarHBondContact O-N 3.08Å; L416-I468 HydrophobicContact CD2-CG2 3.94Å; L416-V469 CarbonylContact C-O 3.53Å; L416-V469 WeakPolarHBondContact CA-O 3.03Å; L416-F470 HydrophobicContact CD2-CB 3.68Å; L416-F470 HydrophobicContact CD2-CD2 3.47Å; L416-F470 VanDerWaalsContact CD2-CD2 3.47Å; L416-F470 HydrophobicContact CD2-CE2 4.47Å; L416-F470 HydrophobicContact CD2-CG 3.95Å; L416-F470 HydrophobicContact CG-CD2 3.78Å; L416-F470 HydrophobicContact CG-CE2 4.46Å
417	R	89.1	Confident	82.2	Confident	57 Å²	57	56.5 Å²	56.5	22%	0.215	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.5	170.7	-64	-168.3	-178.2	-168.4	1.3	110.1	F242 T400 I468 V469	F242-R417 HydrophobicContact CD1-CG 4.33Å; F242-R417 HydrophobicContact CE1-CB 4.1Å; F242-R417 HydrophobicContact CE1-CG 3.93Å; F242-R417 HydrophobicContact CE2-CG 4.23Å; F242-R417 HydrophobicContact CZ-CB 4.24Å; F242-R417 HydrophobicContact CZ-CG 3.88Å; T400-R417 CarbonylContact O-C 3.56Å; T400-R417 WeakPolarHBondContact O-CA 3.34Å; R417-I468 CarbonylContact O-C 3.56Å; R417-I468 WeakPolarHBondContact O-CA 3.5Å; R417-V469 PolarHBondContact N-O 3.03Å; R417-V469 PolarHBondContact O-N 2.94Å
418	L	92.2	Very high	83.9	Confident	52 Å²	52	51.7 Å²	51.7	27%	0.272	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	146.5	162.9	-56.9	177.3	0	0	0	107.9	Y399 T400 L402 P403 I468	Y399-L418 WeakPolarHBondContact CA-O 3.43Å; T400-L418 HydrophobicContact CG2-CB 3.76Å; T400-L418 PolarHBondContact N-O 3.28Å; T400-L418 PolarHBondContact O-N 3.23Å; L402-L418 HydrophobicContact CD2-CD1 4.19Å; L402-L418 HydrophobicContact CD2-CD2 3.69Å; L402-L418 HydrophobicContact CD2-CG 3.81Å; P403-L418 HydrophobicContact CG-CD1 4.48Å; L418-I468 HydrophobicContact CD2-CD1 4.09Å; L418-I468 HydrophobicContact CD2-CG1 3.74Å
419	H	92.9	Very high	85.2	Confident	6 Å²	6	49 Å²	49	3%	0.028	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	148	171.3	75.2	-61.1	0	0	0	113.1	L398 Y399 F421 M466 G467 V469 N481	L398-H419 CarbonylContact O-C 3.59Å; L398-H419 WeakPolarHBondContact O-CA 3.15Å; L398-H419 VanDerWaalsContact O-CB 3.23Å; L398-H419 WeakPolarHBondContact O-CB 3.19Å; Y399-H419 HydrophobicContact CD1-CB 3.41Å; Y399-H419 VanDerWaalsContact CD1-CB 3.41Å; Y399-H419 HydrophobicContact CE1-CB 3.66Å; Y399-H419 AromaticContact CE1-CG 3.95Å; Y399-H419 HydrophobicContact CG-CB 4.12Å; H419-F421 AromaticContact CD2-CD1 3.72Å; H419-F421 AromaticContact NE2-CD1 3.57Å; H419-F421 AromaticContact NE2-CE1 3.91Å; H419-M466 CarbonylContact O-C 3.52Å; H419-M466 VanDerWaalsContact O-CA 3.25Å; H419-M466 WeakPolarHBondContact O-CA 3.33Å; H419-G467 PolarHBondContact N-O 2.91Å; H419-G467 PolarHBondContact ND1-O 2.89Å; H419-G467 PolarHBondContact O-N 3.22Å; H419-V469 HydrophobicContact CB-CG2 4.44Å; H419-V469 WeakPolarHBondContact CE1-CG2 3.05Å; H419-V469 WeakPolarHBondContact ND1-CG2 3.37Å; H419-N481 PolarHBondContact CE1-OD1 2.89Å; H419-N481 PolarHBondContact NE2-OD1 2.8Å; H419-N481 VanDerWaalsContact NE2-OD1 3.14Å
420	G	95.3	Very high	86.5	Confident	28 Å²	28	44.7 Å²	44.7	29%	0.289	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	146.4	166.4	0	0	0	0	0	109.2	H397 L398 G465	H397-G420 CarbonylContact C-O 3.55Å; H397-G420 WeakPolarHBondContact CA-O 3.23Å; L398-G420 PolarHBondContact N-O 2.87Å; L398-G420 PolarHBondContact O-N 2.84Å; G420-G465 WeakPolarHBondContact CA-O 3.37Å
421	F	95.4	Very high	87.5	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.026	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.9	177.6	58.7	-96.6	0	0	0	112.2	R337 A396 H419 L423 V463 I464 G465 N481	R337-F421 HydrophobicContact CB-CE2 4.14Å; R337-F421 HydrophobicContact CB-CZ 4.44Å; R337-F421 VanDerWaalsContact CD-CZ 3.41Å; R337-F421 HydrophobicContact CG-CE2 4.41Å; A396-F421 CarbonylContact O-C 3.55Å; A396-F421 VanDerWaalsContact O-CA 3.25Å; A396-F421 WeakPolarHBondContact O-CA 3.32Å; H419-F421 AromaticContact CD2-CD1 3.72Å; H419-F421 AromaticContact NE2-CD1 3.57Å; H419-F421 AromaticContact NE2-CE1 3.91Å; F421-L423 HydrophobicContact CD2-CD1 4.13Å; F421-L423 HydrophobicContact CD2-CG 4Å; F421-L423 HydrophobicContact CE2-CD1 4.42Å; F421-V463 HydrophobicContact CE2-CG1 4.39Å; F421-I464 WeakPolarHBondContact O-CA 3.42Å; F421-G465 PolarHBondContact N-O 3.5Å; F421-G465 PolarHBondContact O-N 3.38Å; F421-N481 HydrophobicContact CE1-CB 3.95Å; F421-N481 HydrophobicContact CZ-CB 4.08Å
422	L	96.5	Very high	88.3	Confident	86 Å²	86	41.2 Å²	41.2	45%	0.45	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.5	168.3	177.4	69.1	0	0	0	107.4	G395 A396 T462 V463 I464	G395-L422 CarbonylContact C-O 3.5Å; G395-L422 WeakPolarHBondContact CA-O 3.39Å; A396-L422 PolarHBondContact N-O 3.11Å; A396-L422 PolarHBondContact O-N 3.47Å; L422-T462 HydrophobicContact CD1-CG2 3.81Å; L422-V463 WeakPolarHBondContact CA-O 3.29Å; L422-I464 HydrophobicContact CD1-CB 4.16Å; L422-I464 HydrophobicContact CD1-CG1 4.45Å
423	L	95.5	Very high	88.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.3	179.5	-58.2	176.9	0	0	0	109.2	E335 L336 R337 T394 F421 T462 V463	E335-L423 VanDerWaalsContact O-CD1 3.32Å; E335-L423 WeakPolarHBondContact O-CD1 3.46Å; L336-L423 HydrophobicContact CD1-CB 4.22Å; R337-L423 HydrophobicContact CB-CD1 3.89Å; R337-L423 HydrophobicContact CG-CD1 3.73Å; T394-L423 WeakPolarHBondContact O-CA 3.32Å; F421-L423 HydrophobicContact CD2-CD1 4.13Å; F421-L423 HydrophobicContact CD2-CG 4Å; F421-L423 HydrophobicContact CE2-CD1 4.42Å; L423-T462 CarbonylContact O-C 3.54Å; L423-T462 VanDerWaalsContact O-CA 3.24Å; L423-T462 WeakPolarHBondContact O-CA 3.27Å; L423-T462 WeakPolarHBondContact O-CG2 3.31Å; L423-V463 PolarHBondContact N-O 2.93Å; L423-V463 PolarHBondContact O-N 2.88Å
424	A	94.6	Very high	89.4	Confident	20 Å²	20	40.8 Å²	40.8	17%	0.165	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133.3	170.8	0	0	0	0	0	109.7	W392 L393 T394 R461	W392-A424 HydrophobicContact CH2-CB 4.48Å; W392-A424 HydrophobicContact CZ3-CB 4.42Å; W392-A424 WeakPolarHBondContact CZ3-O 3.08Å; L393-A424 CarbonylContact C-O 3.58Å; L393-A424 WeakPolarHBondContact CA-O 3.37Å; T394-A424 HydrophobicContact CG2-CB 4.06Å; T394-A424 PolarHBondContact N-O 2.88Å; T394-A424 PolarHBondContact O-N 3.38Å; A424-R461 CarbonylContact C-O 3.57Å; A424-R461 VanDerWaalsContact CA-O 3.3Å; A424-R461 WeakPolarHBondContact CA-O 3.2Å
425	G	94	Very high	89.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	163.3	177.5	0	0	0	0	0	113	W392 R461	W392-G425 CarbonylContact O-C 3.59Å; W392-G425 WeakPolarHBondContact O-CA 3.42Å; G425-R461 PolarHBondContact N-O 2.74Å; G425-R461 PolarHBondContact O-N 2.99Å
426	S	92.5	Very high	89.7	Confident	4 Å²	4	40.7 Å²	40.7	3%	0.028	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.1	175.2	-158	0	0	0	0	111.1	F391 W392 G458	F391-S426 VanDerWaalsContact CA-O 3.31Å; F391-S426 WeakPolarHBondContact CA-O 3.45Å; W392-S426 PolarHBondContact N-O 3.31Å; W392-S426 PolarHBondContact O-N 2.95Å; S426-G458 PolarHBondContact OG-O 3.18Å
427	T	92	Very high	89.4	Confident	18 Å²	18	43.8 Å²	43.8	11%	0.11	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.9	171.9	54.8	0	0	0	0	109.8	L330 V344 A388 A390 F391	L330-T427 HydrophobicContact CB-CG2 4.2Å; L330-T427 HydrophobicContact CD1-CG2 3.77Å; L330-T427 HydrophobicContact CG-CG2 3.82Å; V344-T427 VanDerWaalsContact O-CG2 3.27Å; V344-T427 WeakPolarHBondContact O-CG2 3.36Å; A388-T427 HydrophobicContact CB-CG2 4.16Å; A390-T427 CarbonylContact O-C 3.48Å; A390-T427 WeakPolarHBondContact O-CA 3.48Å; F391-T427 HydrophobicContact CB-CG2 4.33Å
428	L	90.6	Very high	89	Confident	11 Å²	11	43.5 Å²	43.5	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.4	-177.6	-63.4	74.6	0	0	0	110.2	D389 A390 P431 E455 L456	D389-L428 PolarHBondContact N-O 3.4Å; A390-L428 HydrophobicContact CB-CB 4.21Å; A390-L428 PolarHBondContact N-O 2.8Å; A390-L428 PolarHBondContact O-N 3.28Å; L428-P431 HydrophobicContact CB-CB 4.35Å; L428-P431 HydrophobicContact CB-CG 4.24Å; L428-P431 HydrophobicContact CD2-CB 4.17Å; L428-E455 HydrophobicContact CD2-CB 4.19Å; L428-E455 HydrophobicContact CD2-CG 3.41Å; L428-E455 VanDerWaalsContact CD2-CG 3.41Å; L428-E455 HydrophobicContact CG-CG 4Å; L428-L456 HydrophobicContact CD2-CD2 4.46Å
429	E	87	Confident	88.1	Confident	95 Å²	95	45.8 Å²	45.8	44%	0.444	25%	0.245	S	C	.	.	S	Bend	trans	-83.1	115.9	174.6	-72.6	176.9	-150.8	0	0	110.8	P346 K434	P346-E429 HydrophobicContact CB-CG 3.93Å; P346-E429 VanDerWaalsContact CB-OE1 3.24Å; P346-E429 WeakPolarHBondContact CB-OE1 3.49Å; P346-E429 HydrophobicContact CG-CG 3.21Å; P346-E429 VanDerWaalsContact CG-OE1 3.24Å; P346-E429 WeakPolarHBondContact CG-OE1 3.17Å; E429-K434 WeakPolarHBondContact O-CE 3.5Å; E429-K434 PolarHBondContact O-NZ 2.99Å
430	R	85.4	Confident	87.2	Confident	115 Å²	115	49.8 Å²	49.8	43%	0.434	27%	0.274	S	S	.	.	S	Bend	trans	40	53.8	173	-36	-163.5	-171.4	81.4	5.4	114.3	D389 I432 Q433 K434	D389-R430 WeakPolarHBondContact OD2-CA 3.27Å; D389-R430 VanDerWaalsContact OD2-CG 3.3Å; D389-R430 WeakPolarHBondContact OD2-CG 3.17Å; R430-I432 VanDerWaalsContact C-N 3.27Å; R430-I432 PolarHBondContact O-N 3.26Å; R430-Q433 HydrophobicContact CB-CB 3.81Å; R430-Q433 PolarHBondContact O-N 2.91Å; R430-K434 PolarHBondContact O-N 3.32Å
431	P	86.2	Confident	86	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.019	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-36.2	-169.2	23.6	-34.4	0	0	0	113.3	L313 A390 L428 Y451	L313-P431 HydrophobicContact CD1-CG 3.92Å; A390-P431 HydrophobicContact CB-CG 3.85Å; L428-P431 HydrophobicContact CB-CB 4.35Å; L428-P431 HydrophobicContact CB-CG 4.24Å; L428-P431 HydrophobicContact CD2-CB 4.17Å; P431-Y451 PolarHBondContact O-OH 3.4Å
432	I	86.3	Confident	84.9	Confident	43 Å²	43	52.6 Å²	52.6	22%	0.221	29%	0.286	C	S	.	.	H	α-helix	trans	-75.5	-40.6	177.1	-65.1	169.3	0	0	0	111.3	L313 H315 R430 K434 L435 I436	L313-I432 HydrophobicContact CD1-CD1 4.05Å; L313-I432 HydrophobicContact CD2-CD1 3.86Å; L313-I432 HydrophobicContact CG-CD1 4.3Å; H315-I432 HydrophobicContact CB-CD1 3.79Å; H315-I432 WeakPolarHBondContact CE1-CG2 3.43Å; R430-I432 VanDerWaalsContact C-N 3.27Å; R430-I432 PolarHBondContact O-N 3.26Å; I432-K434 PolarHBondContact O-N 3.11Å; I432-L435 WeakPolarHBondContact O-CB 3.34Å; I432-L435 PolarHBondContact O-N 3.42Å; I432-L435 VanDerWaalsContact O-N 3.16Å; I432-I436 HydrophobicContact CG2-CD1 3.84Å; I432-I436 HydrophobicContact CG2-CG1 4.32Å; I432-I436 WeakPolarHBondContact O-CG1 3.3Å; I432-I436 PolarHBondContact O-N 3.34Å
433	Q	83	Confident	84	Confident	56 Å²	56	58.3 Å²	58.3	26%	0.262	30%	0.302	S	S	.	.	H	α-helix	trans	-65.3	-42.5	-179	-169.3	59.3	48.7	0	0	111.3	R430 L435 I436 D437	R430-Q433 HydrophobicContact CB-CB 3.81Å; R430-Q433 PolarHBondContact O-N 2.91Å; Q433-L435 PolarHBondContact O-N 3.29Å; Q433-I436 PolarHBondContact O-N 3.46Å; Q433-I436 VanDerWaalsContact O-N 3.09Å; Q433-D437 PolarHBondContact NE2-OD1 3.42Å; Q433-D437 WeakPolarHBondContact O-CB 3.46Å; Q433-D437 VanDerWaalsContact O-CG 3.23Å; Q433-D437 PolarHBondContact O-N 3.48Å
434	K	83.4	Confident	83.4	Confident	79 Å²	79	62 Å²	62	34%	0.343	33%	0.325	S	S	.	.	H	α-helix	trans	-55.3	-37.1	173.6	-73.4	178	-178.9	172.4	0	112.4	E429 R430 I432 S438 Y451 E455	E429-K434 WeakPolarHBondContact O-CE 3.5Å; E429-K434 PolarHBondContact O-NZ 2.99Å; R430-K434 PolarHBondContact O-N 3.32Å; I432-K434 PolarHBondContact O-N 3.11Å; K434-S438 WeakPolarHBondContact O-CB 3.34Å; K434-S438 PolarHBondContact O-N 2.72Å; K434-S438 VanDerWaalsContact O-N 3.17Å; K434-S438 PolarHBondContact O-OG 3.35Å; K434-Y451 VanDerWaalsContact CB-OH 3.32Å; K434-Y451 WeakPolarHBondContact CB-OH 3.35Å; K434-E455 IonicContact NZ-OE1 2.9Å; K434-E455 PolarHBondContact NZ-OE1 3.48Å
435	L	82.6	Confident	82.9	Confident	34 Å²	34	66.4 Å²	66.4	18%	0.178	35%	0.349	C	S	.	.	H	α-helix	trans	-70.8	-42.4	176.7	-177	68	0	0	0	111.9	I432 Q433 S438 C442 F448 Y451 F452	I432-L435 WeakPolarHBondContact O-CB 3.34Å; I432-L435 PolarHBondContact O-N 3.42Å; I432-L435 VanDerWaalsContact O-N 3.16Å; Q433-L435 PolarHBondContact O-N 3.29Å; L435-S438 CarbonylContact O-C 3.31Å; L435-S438 VanDerWaalsContact O-C 3.31Å; L435-S438 PolarHBondContact O-N 2.67Å; L435-C442 HydrophobicContact CD1-CB 3.86Å; L435-C442 VanDerWaalsContact CD1-SG 3.53Å; L435-F448 HydrophobicContact CD2-CD2 3.88Å; L435-F448 HydrophobicContact CD2-CE2 3.62Å; L435-Y451 HydrophobicContact CB-CE1 4.22Å; L435-Y451 HydrophobicContact CD1-CD1 4.26Å; L435-Y451 HydrophobicContact CD1-CE1 4.33Å; L435-F452 HydrophobicContact CD2-CE2 4.26Å
436	I	81.3	Confident	82.6	Confident	94 Å²	94	72 Å²	72	48%	0.482	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-42.5	176.3	-67.8	169.2	0	0	0	110.9	I432 Q433 S438	I432-I436 HydrophobicContact CG2-CD1 3.84Å; I432-I436 HydrophobicContact CG2-CG1 4.32Å; I432-I436 WeakPolarHBondContact O-CG1 3.3Å; I432-I436 PolarHBondContact O-N 3.34Å; Q433-I436 PolarHBondContact O-N 3.46Å; Q433-I436 VanDerWaalsContact O-N 3.09Å; I436-S438 VanDerWaalsContact C-N 3.25Å; I436-S438 PolarHBondContact O-N 3.11Å
437	D	81.5	Confident	82.3	Confident	112 Å²	112	75.4 Å²	75.4	60%	0.599	40%	0.395	S	S	*	.	H	α-helix	trans	-70.7	-23.9	-179.5	-64.7	-18	0	0	0	112.2	Q433 P439	Q433-D437 PolarHBondContact NE2-OD1 3.42Å; Q433-D437 WeakPolarHBondContact O-CB 3.46Å; Q433-D437 VanDerWaalsContact O-CG 3.23Å; Q433-D437 PolarHBondContact O-N 3.48Å; D437-P439 VanDerWaalsContact O-CD 3.23Å; D437-P439 WeakPolarHBondContact O-CD 3.42Å
438	S	81.8	Confident	81.9	Confident	51 Å²	51	78.9 Å²	78.9	36%	0.357	41%	0.408	S	S	.	.			trans	-117.8	66.6	179.8	-54.1	0	0	0	0	112.1	K434 L435 I436 S440 T441	K434-S438 WeakPolarHBondContact O-CB 3.34Å; K434-S438 PolarHBondContact O-N 2.72Å; K434-S438 VanDerWaalsContact O-N 3.17Å; K434-S438 PolarHBondContact O-OG 3.35Å; L435-S438 CarbonylContact O-C 3.31Å; L435-S438 VanDerWaalsContact O-C 3.31Å; L435-S438 PolarHBondContact O-N 2.67Å; I436-S438 VanDerWaalsContact C-N 3.25Å; I436-S438 PolarHBondContact O-N 3.11Å; S438-S440 PolarHBondContact O-N 3.49Å; S438-S440 VanDerWaalsContact O-N 3.14Å; S438-T441 VanDerWaalsContact CB-OG1 3.27Å; S438-T441 WeakPolarHBondContact CB-OG1 3.31Å; S438-T441 WeakPolarHBondContact O-CB 3.38Å; S438-T441 PolarHBondContact O-N 2.87Å; S438-T441 VanDerWaalsContact O-N 3.09Å; S438-T441 PolarHBondContact O-OG1 3.06Å; S438-T441 VanDerWaalsContact O-OG1 3.09Å
439	P	73.3	Confident	81.6	Confident	100 Å²	100	80.8 Å²	80.8	65%	0.649	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.3	-174.6	26.3	-34.5	0	0	0	113.6	D437 T441	D437-P439 VanDerWaalsContact O-CD 3.23Å; D437-P439 WeakPolarHBondContact O-CD 3.42Å; P439-T441 VanDerWaalsContact C-N 3.27Å; P439-T441 PolarHBondContact O-N 3.05Å
440	S	73	Confident	81.6	Confident	90 Å²	90	81.2 Å²	81.2	63%	0.629	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.6	176.5	51.1	0	0	0	0	114	S438	S438-S440 PolarHBondContact O-N 3.49Å; S438-S440 VanDerWaalsContact O-N 3.14Å
441	T	69.3	Low	81.6	Confident	66 Å²	66	77.4 Å²	77.4	41%	0.405	41%	0.411	S	S	.	.	S	Bend	trans	-75.9	-31.4	-173.2	-53	0	0	0	0	113.3	S438 P439 Y451	S438-T441 VanDerWaalsContact CB-OG1 3.27Å; S438-T441 WeakPolarHBondContact CB-OG1 3.31Å; S438-T441 WeakPolarHBondContact O-CB 3.38Å; S438-T441 PolarHBondContact O-N 2.87Å; S438-T441 VanDerWaalsContact O-N 3.09Å; S438-T441 PolarHBondContact O-OG1 3.06Å; S438-T441 VanDerWaalsContact O-OG1 3.09Å; P439-T441 VanDerWaalsContact C-N 3.27Å; P439-T441 PolarHBondContact O-N 3.05Å; T441-Y451 HydrophobicContact CG2-CD2 4.18Å
442	C	74	Confident	81.5	Confident	27 Å²	27	79.8 Å²	79.8	18%	0.182	42%	0.421	C	S	.	.			trans	-138.2	93.3	-175.2	-58.3	0	0	0	0	111.3	L435 E447 F448 Y451	L435-C442 HydrophobicContact CD1-CB 3.86Å; L435-C442 VanDerWaalsContact CD1-SG 3.53Å; C442-E447 HydrophobicContact CB-CB 4.44Å; C442-F448 HydrophobicContact CB-CB 4.2Å; C442-Y451 VanDerWaalsContact SG-CB 3.6Å
443	R	77.7	Confident	81.5	Confident	207 Å²	207	81.7 Å²	81.7	78%	0.781	43%	0.431	S	S	*	.	S	Bend	trans	-95.8	-26.4	173.3	-69.4	-176.9	-84.8	-168.3	-6.3	112.3	E447	R443-E447 WeakPolarHBondContact CA-OE2 3.47Å; R443-E447 WeakPolarHBondContact CB-OE2 3.18Å; R443-E447 PolarHBondContact N-OE2 2.62Å
444	T	82.9	Confident	81.6	Confident	78 Å²	78	83.5 Å²	83.5	48%	0.479	44%	0.443	S	S	.	.	S	Bend	trans	-114.2	151.7	-179.9	-45.7	0	0	0	0	111.3	N446 E447 F448	T444-N446 HydrophobicContact CG2-CB 4.41Å; T444-N446 PolarHBondContact O-N 3.48Å; T444-E447 PolarHBondContact N-OE2 3.03Å; T444-E447 WeakPolarHBondContact O-CB 3.34Å; T444-E447 PolarHBondContact O-N 3.01Å; T444-F448 PolarHBondContact O-N 3.07Å
445	V	83.8	Confident	81.6	Confident	111 Å²	111	81.9 Å²	81.9	67%	0.673	44%	0.436	S	S	*	.	H	α-helix	trans	-53.8	-35.5	173.6	179	0	0	0	0	112.3	S449	V445-S449 WeakPolarHBondContact O-CB 3.43Å; V445-S449 PolarHBondContact O-N 3.4Å; V445-S449 PolarHBondContact O-OG 3.43Å
446	N	87.3	Confident	81.6	Confident	119 Å²	119	83.4 Å²	83.4	64%	0.636	44%	0.444	S	S	*	.	H	α-helix	trans	-66.1	-41.8	175.8	-70.5	-13.4	0	0	0	112.4	T444 S449 Q450	T444-N446 HydrophobicContact CG2-CB 4.41Å; T444-N446 PolarHBondContact O-N 3.48Å; N446-S449 PolarHBondContact O-N 2.9Å; N446-Q450 VanDerWaalsContact O-CG 3.29Å; N446-Q450 WeakPolarHBondContact O-CG 3.27Å; N446-Q450 PolarHBondContact O-N 3.11Å
447	E	85.1	Confident	81.6	Confident	75 Å²	75	85.5 Å²	85.5	35%	0.35	45%	0.45	S	S	.	.	H	α-helix	trans	-67.4	-41.2	178.2	-65.6	170.9	156.9	0	0	110.9	C442 R443 T444 S449 Q450 Y451	C442-E447 HydrophobicContact CB-CB 4.44Å; R443-E447 WeakPolarHBondContact CA-OE2 3.47Å; R443-E447 WeakPolarHBondContact CB-OE2 3.18Å; R443-E447 PolarHBondContact N-OE2 2.62Å; T444-E447 PolarHBondContact N-OE2 3.03Å; T444-E447 WeakPolarHBondContact O-CB 3.34Å; T444-E447 PolarHBondContact O-N 3.01Å; E447-S449 VanDerWaalsContact C-N 3.32Å; E447-S449 PolarHBondContact O-N 2.86Å; E447-Q450 PolarHBondContact O-N 2.89Å; E447-Y451 PolarHBondContact O-N 2.89Å
448	F	84.5	Confident	81.3	Confident	90 Å²	90	81.7 Å²	81.7	40%	0.395	44%	0.437	S	S	.	.	H	α-helix	trans	-56	-47.9	171.1	179.2	-89.4	0	0	0	111.2	L435 C442 T444 Q450 Y451 F452	L435-F448 HydrophobicContact CD2-CD2 3.88Å; L435-F448 HydrophobicContact CD2-CE2 3.62Å; C442-F448 HydrophobicContact CB-CB 4.2Å; T444-F448 PolarHBondContact O-N 3.07Å; F448-Q450 VanDerWaalsContact C-N 3.34Å; F448-Q450 PolarHBondContact O-N 3.17Å; F448-Y451 PolarHBondContact O-N 2.92Å; F448-F452 AromaticContact CD1-CD2 3.9Å; F448-F452 HydrophobicContact CD1-CD2 3.9Å; F448-F452 HydrophobicContact CD1-CE2 4.27Å; F448-F452 HydrophobicContact CD2-CD2 4.15Å; F448-F452 AromaticContact CD2-CE2 3.88Å; F448-F452 HydrophobicContact CD2-CE2 3.88Å; F448-F452 AromaticContact CE1-CD2 3.56Å; F448-F452 HydrophobicContact CE1-CD2 3.56Å; F448-F452 AromaticContact CE1-CE2 3.67Å; F448-F452 HydrophobicContact CE1-CE2 3.67Å; F448-F452 AromaticContact CE2-CD2 3.87Å; F448-F452 HydrophobicContact CE2-CD2 3.87Å; F448-F452 AromaticContact CE2-CE2 3.25Å; F448-F452 HydrophobicContact CE2-CE2 3.25Å; F448-F452 HydrophobicContact CE2-CZ 4.22Å; F448-F452 HydrophobicContact CG-CD2 4.19Å; F448-F452 HydrophobicContact CG-CE2 4.36Å; F448-F452 AromaticContact CZ-CD2 3.55Å; F448-F452 HydrophobicContact CZ-CD2 3.55Å; F448-F452 AromaticContact CZ-CE2 3.12Å; F448-F452 HydrophobicContact CZ-CE2 3.12Å; F448-F452 AromaticContact CZ-CZ 3.94Å; F448-F452 HydrophobicContact CZ-CZ 3.94Å; F448-F452 WeakPolarHBondContact O-CD2 3.38Å; F448-F452 PolarHBondContact O-N 3.25Å
449	S	85	Confident	81.2	Confident	51 Å²	51	88.1 Å²	88.1	36%	0.357	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-41.3	178.9	-56.6	0	0	0	0	111.6	V445 N446 E447 F452 L453	V445-S449 WeakPolarHBondContact O-CB 3.43Å; V445-S449 PolarHBondContact O-N 3.4Å; V445-S449 PolarHBondContact O-OG 3.43Å; N446-S449 PolarHBondContact O-N 2.9Å; E447-S449 VanDerWaalsContact C-N 3.32Å; E447-S449 PolarHBondContact O-N 2.86Å; S449-F452 PolarHBondContact O-N 3.31Å; S449-L453 VanDerWaalsContact O-CB 3.31Å; S449-L453 WeakPolarHBondContact O-CB 2.9Å; S449-L453 WeakPolarHBondContact O-CG 3.29Å; S449-L453 PolarHBondContact O-N 3.42Å
450	Q	86.1	Confident	82	Confident	104 Å²	104	85.3 Å²	85.3	49%	0.486	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-40.3	176.3	-70.2	-69	-12.9	0	0	112.5	N446 E447 F448 L453 N454	N446-Q450 VanDerWaalsContact O-CG 3.29Å; N446-Q450 WeakPolarHBondContact O-CG 3.27Å; N446-Q450 PolarHBondContact O-N 3.11Å; E447-Q450 PolarHBondContact O-N 2.89Å; F448-Q450 VanDerWaalsContact C-N 3.34Å; F448-Q450 PolarHBondContact O-N 3.17Å; Q450-L453 PolarHBondContact O-N 2.86Å; Q450-N454 VanDerWaalsContact O-CB 3.31Å; Q450-N454 WeakPolarHBondContact O-CB 3.37Å; Q450-N454 PolarHBondContact O-N 3.36Å; Q450-N454 PolarHBondContact O-ND2 3.41Å
451	Y	86.4	Confident	83	Confident	35 Å²	35	81.3 Å²	81.3	14%	0.137	41%	0.406	C	S	.	.	H	α-helix	trans	-58.9	-52.5	174.3	168.8	-98	0	0	0	111.1	P431 K434 L435 T441 C442 E447 F448 L453 N454 E455	P431-Y451 PolarHBondContact O-OH 3.4Å; K434-Y451 VanDerWaalsContact CB-OH 3.32Å; K434-Y451 WeakPolarHBondContact CB-OH 3.35Å; L435-Y451 HydrophobicContact CB-CE1 4.22Å; L435-Y451 HydrophobicContact CD1-CD1 4.26Å; L435-Y451 HydrophobicContact CD1-CE1 4.33Å; T441-Y451 HydrophobicContact CG2-CD2 4.18Å; C442-Y451 VanDerWaalsContact SG-CB 3.6Å; E447-Y451 PolarHBondContact O-N 2.89Å; F448-Y451 PolarHBondContact O-N 2.92Å; Y451-L453 VanDerWaalsContact C-N 3.35Å; Y451-L453 PolarHBondContact O-N 2.79Å; Y451-N454 PolarHBondContact O-N 3.43Å; Y451-N454 VanDerWaalsContact O-N 3.14Å; Y451-E455 PolarHBondContact O-N 3.09Å
452	F	83.3	Confident	84.2	Confident	54 Å²	54	79.7 Å²	79.7	24%	0.237	40%	0.397	C	S	.	.	H	α-helix	trans	-62.6	-41.5	178.3	-87.4	-82.7	0	0	0	112	L435 F448 S449 N454 E455 L456	L435-F452 HydrophobicContact CD2-CE2 4.26Å; F448-F452 AromaticContact CD1-CD2 3.9Å; F448-F452 HydrophobicContact CD1-CD2 3.9Å; F448-F452 HydrophobicContact CD1-CE2 4.27Å; F448-F452 HydrophobicContact CD2-CD2 4.15Å; F448-F452 AromaticContact CD2-CE2 3.88Å; F448-F452 HydrophobicContact CD2-CE2 3.88Å; F448-F452 AromaticContact CE1-CD2 3.56Å; F448-F452 HydrophobicContact CE1-CD2 3.56Å; F448-F452 AromaticContact CE1-CE2 3.67Å; F448-F452 HydrophobicContact CE1-CE2 3.67Å; F448-F452 AromaticContact CE2-CD2 3.87Å; F448-F452 HydrophobicContact CE2-CD2 3.87Å; F448-F452 AromaticContact CE2-CE2 3.25Å; F448-F452 HydrophobicContact CE2-CE2 3.25Å; F448-F452 HydrophobicContact CE2-CZ 4.22Å; F448-F452 HydrophobicContact CG-CD2 4.19Å; F448-F452 HydrophobicContact CG-CE2 4.36Å; F448-F452 AromaticContact CZ-CD2 3.55Å; F448-F452 HydrophobicContact CZ-CD2 3.55Å; F448-F452 AromaticContact CZ-CE2 3.12Å; F448-F452 HydrophobicContact CZ-CE2 3.12Å; F448-F452 AromaticContact CZ-CZ 3.94Å; F448-F452 HydrophobicContact CZ-CZ 3.94Å; F448-F452 WeakPolarHBondContact O-CD2 3.38Å; F448-F452 PolarHBondContact O-N 3.25Å; S449-F452 PolarHBondContact O-N 3.31Å; F452-N454 VanDerWaalsContact C-N 3.3Å; F452-N454 PolarHBondContact O-N 2.89Å; F452-E455 PolarHBondContact O-N 3.27Å; F452-L456 WeakPolarHBondContact O-CB 3.3Å; F452-L456 WeakPolarHBondContact O-CG 3.15Å; F452-L456 PolarHBondContact O-N 2.85Å
453	L	85.8	Confident	85.3	Confident	82 Å²	82	78.4 Å²	78.4	43%	0.429	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-36.7	175.2	-73.8	172	0	0	0	112.2	S449 Q450 Y451 K457	S449-L453 VanDerWaalsContact O-CB 3.31Å; S449-L453 WeakPolarHBondContact O-CB 2.9Å; S449-L453 WeakPolarHBondContact O-CG 3.29Å; S449-L453 PolarHBondContact O-N 3.42Å; Q450-L453 PolarHBondContact O-N 2.86Å; Y451-L453 VanDerWaalsContact C-N 3.35Å; Y451-L453 PolarHBondContact O-N 2.79Å; L453-K457 VanDerWaalsContact O-CB 3.25Å; L453-K457 WeakPolarHBondContact O-CB 3.27Å; L453-K457 WeakPolarHBondContact O-CD 3.41Å; L453-K457 WeakPolarHBondContact O-CG 3.38Å; L453-K457 PolarHBondContact O-N 3.23Å
454	N	86.1	Confident	86.1	Confident	95 Å²	95	72.1 Å²	72.1	51%	0.508	37%	0.369	S	S	.	.	H	α-helix	trans	-71.5	-40.9	177	-72.9	-21.2	0	0	0	112	Q450 Y451 F452 K457 G458	Q450-N454 VanDerWaalsContact O-CB 3.31Å; Q450-N454 WeakPolarHBondContact O-CB 3.37Å; Q450-N454 PolarHBondContact O-N 3.36Å; Q450-N454 PolarHBondContact O-ND2 3.41Å; Y451-N454 PolarHBondContact O-N 3.43Å; Y451-N454 VanDerWaalsContact O-N 3.14Å; F452-N454 VanDerWaalsContact C-N 3.3Å; F452-N454 PolarHBondContact O-N 2.89Å; N454-K457 CarbonylContact O-C 3.57Å; N454-K457 PolarHBondContact O-N 3.16Å; N454-G458 PolarHBondContact O-N 3.01Å; N454-G458 VanDerWaalsContact O-N 3.09Å
455	E	83.6	Confident	86.7	Confident	45 Å²	45	69 Å²	69	21%	0.21	35%	0.352	C	S	.	.	H	α-helix	trans	-64.6	-41.2	175	-164.3	73.3	-178	0	0	110.6	L428 K434 Y451 F452 G458	L428-E455 HydrophobicContact CD2-CB 4.19Å; L428-E455 HydrophobicContact CD2-CG 3.41Å; L428-E455 VanDerWaalsContact CD2-CG 3.41Å; L428-E455 HydrophobicContact CG-CG 4Å; K434-E455 IonicContact NZ-OE1 2.9Å; K434-E455 PolarHBondContact NZ-OE1 3.48Å; Y451-E455 PolarHBondContact O-N 3.09Å; F452-E455 PolarHBondContact O-N 3.27Å; E455-G458 PolarHBondContact O-N 2.89Å; E455-G458 VanDerWaalsContact O-N 3.11Å
456	L	82.6	Confident	87.3	Confident	65 Å²	65	70 Å²	70	34%	0.34	35%	0.351	S	S	.	.	H	α-helix	trans	-65.8	-36.2	173.8	-70.2	172.9	0	0	0	112.7	W392 L428 F452 G458	W392-L456 HydrophobicContact CG-CD2 3.97Å; W392-L456 WeakPolarHBondContact CZ2-O 3.47Å; L428-L456 HydrophobicContact CD2-CD2 4.46Å; F452-L456 WeakPolarHBondContact O-CB 3.3Å; F452-L456 WeakPolarHBondContact O-CG 3.15Å; F452-L456 PolarHBondContact O-N 2.85Å; L456-G458 PolarHBondContact O-N 2.79Å
457	K	80.8	Confident	87.6	Confident	138 Å²	138	64.9 Å²	64.9	60%	0.6	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-8.9	173.3	-77.1	169.9	-175.6	176.4	0	113.1	L453 N454 R459	L453-K457 VanDerWaalsContact O-CB 3.25Å; L453-K457 WeakPolarHBondContact O-CB 3.27Å; L453-K457 WeakPolarHBondContact O-CD 3.41Å; L453-K457 WeakPolarHBondContact O-CG 3.38Å; L453-K457 PolarHBondContact O-N 3.23Å; N454-K457 CarbonylContact O-C 3.57Å; N454-K457 PolarHBondContact O-N 3.16Å; K457-R459 PolarHBondContact O-N 3.49Å
458	G	75.7	Confident	87.9	Confident	33 Å²	33	64.8 Å²	64.8	34%	0.34	33%	0.327	S	S	.	.	S	Bend	trans	-57.2	92.6	176.9	0	0	0	0	0	111.6	S426 N454 E455 L456	S426-G458 PolarHBondContact OG-O 3.18Å; N454-G458 PolarHBondContact O-N 3.01Å; N454-G458 VanDerWaalsContact O-N 3.09Å; E455-G458 PolarHBondContact O-N 2.89Å; E455-G458 VanDerWaalsContact O-N 3.11Å; L456-G458 PolarHBondContact O-N 2.79Å
459	R	79.2	Confident	88.2	Confident	186 Å²	186	60.5 Å²	60.5	70%	0.702	31%	0.309	S	S	*	.			trans	25.6	75.7	174.8	-70.9	-177.2	-178.4	-176.9	1	113.6	K457 R461 Q489	K457-R459 PolarHBondContact O-N 3.49Å; R459-R461 PolarHBondContact O-NH1 2.86Å; R459-Q489 HydrophobicContact CB-CG 4.26Å; R459-Q489 PolarHBondContact O-NE2 3.26Å; R459-Q489 VanDerWaalsContact O-NE2 3.11Å
460	P	90.7	Very high	88.4	Confident	41 Å²	41	60.8 Å²	60.8	27%	0.266	30%	0.304	S	S	.	.			trans	-64.6	150.7	177.5	27.6	-34.9	0	0	0	111.5	W392 T487	W392-P460 HydrophobicContact CH2-CB 4Å; W392-P460 HydrophobicContact CZ2-CB 3.94Å; P460-T487 PolarHBondContact O-OG1 3.09Å
461	R	93.3	Very high	88.4	Confident	5 Å²	5	59 Å²	59	2%	0.019	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.6	173.4	-79.9	54.8	164.8	-149.9	-11.3	107.8	L336 F339 V344 A424 G425 R459 T487 Q489 D492	L336-R461 HydrophobicContact CD2-CB 3.77Å; L336-R461 HydrophobicContact CD2-CG 4.44Å; F339-R461 HydrophobicContact CE1-CG 4.03Å; F339-R461 HydrophobicContact CE2-CB 3.89Å; F339-R461 HydrophobicContact CE2-CG 4.18Å; F339-R461 HydrophobicContact CZ-CB 3.69Å; F339-R461 HydrophobicContact CZ-CG 3.55Å; V344-R461 HydrophobicContact CG1-CG 4.03Å; A424-R461 CarbonylContact C-O 3.57Å; A424-R461 VanDerWaalsContact CA-O 3.3Å; A424-R461 WeakPolarHBondContact CA-O 3.2Å; G425-R461 PolarHBondContact N-O 2.74Å; G425-R461 PolarHBondContact O-N 2.99Å; R459-R461 PolarHBondContact O-NH1 2.86Å; R461-T487 WeakPolarHBondContact CA-O 3.32Å; R461-Q489 VanDerWaalsContact CZ-OE1 3.23Å; R461-Q489 VanDerWaalsContact NH2-CB 3.27Å; R461-D492 IonicContact CZ-OD1 3.71Å; R461-D492 IonicContact CZ-OD2 2.7Å; R461-D492 IonicContact NE-OD1 2.87Å; R461-D492 IonicContact NE-OD2 2.95Å; R461-D492 PolarHBondContact NE-OD2 3.47Å; R461-D492 IonicContact NH2-OD1 3.9Å; R461-D492 PolarHBondContact NH2-OD1 3.1Å; R461-D492 IonicContact NH2-OD2 3.76Å; R461-D492 PolarHBondContact NH2-OD2 2.74Å
462	T	94.7	Very high	88.1	Confident	33 Å²	33	62.7 Å²	62.7	20%	0.202	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.2	-176.3	-53.9	0	0	0	0	108.9	L422 L423 M486 T487	L422-T462 HydrophobicContact CD1-CG2 3.81Å; L423-T462 CarbonylContact O-C 3.54Å; L423-T462 VanDerWaalsContact O-CA 3.24Å; L423-T462 WeakPolarHBondContact O-CA 3.27Å; L423-T462 WeakPolarHBondContact O-CG2 3.31Å; T462-M486 WeakPolarHBondContact O-CB 3.44Å; T462-M486 PolarHBondContact O-N 3.33Å; T462-T487 WeakPolarHBondContact CB-OG1 3.4Å; T462-T487 PolarHBondContact N-O 3.09Å; T462-T487 PolarHBondContact N-OG1 3.09Å; T462-T487 PolarHBondContact O-N 3.14Å; T462-T487 PolarHBondContact OG1-OG1 2.98Å
463	V	95.7	Very high	87.6	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	132.7	176.9	178.2	0	0	0	0	108.4	L336 R337 F339 F421 L422 L423 C483 P485	L336-V463 HydrophobicContact CD1-CG2 4.5Å; R337-V463 WeakPolarHBondContact O-CG1 3.24Å; R337-V463 WeakPolarHBondContact O-CG2 3.24Å; F339-V463 HydrophobicContact CD2-CG2 3.95Å; F339-V463 HydrophobicContact CE2-CG2 3.42Å; F339-V463 VanDerWaalsContact CE2-CG2 3.42Å; F339-V463 HydrophobicContact CZ-CG2 4.4Å; F421-V463 HydrophobicContact CE2-CG1 4.39Å; L422-V463 WeakPolarHBondContact CA-O 3.29Å; L423-V463 PolarHBondContact N-O 2.93Å; L423-V463 PolarHBondContact O-N 2.88Å; V463-C483 HydrophobicContact CG1-CB 4.12Å; V463-P485 HydrophobicContact CG2-CB 4.15Å; V463-P485 HydrophobicContact CG2-CG 4.38Å
464	I	96.2	Very high	86.9	Confident	75 Å²	75	61.9 Å²	61.9	39%	0.385	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	144.6	167.6	-167.5	168.9	0	0	0	108.5	F421 L422 F484 M486	F421-I464 WeakPolarHBondContact O-CA 3.42Å; L422-I464 HydrophobicContact CD1-CB 4.16Å; L422-I464 HydrophobicContact CD1-CG1 4.45Å; I464-F484 HydrophobicContact CG2-CB 4.06Å; I464-F484 HydrophobicContact CG2-CD1 4.16Å; I464-F484 PolarHBondContact N-O 3.41Å; I464-F484 WeakPolarHBondContact O-CA 3.48Å; I464-F484 WeakPolarHBondContact O-CB 3.48Å; I464-F484 PolarHBondContact O-N 3.15Å; I464-M486 HydrophobicContact CG2-CE 3.44Å; I464-M486 VanDerWaalsContact CG2-CE 3.44Å; I464-M486 HydrophobicContact CG2-CG 4.07Å
465	G	95.7	Very high	86.3	Confident	12 Å²	12	62.4 Å²	62.4	12%	0.124	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	172.6	176.8	0	0	0	0	0	112.9	G420 F421 Y482	G420-G465 WeakPolarHBondContact CA-O 3.37Å; F421-G465 PolarHBondContact N-O 3.5Å; F421-G465 PolarHBondContact O-N 3.38Å; G465-Y482 WeakPolarHBondContact CA-O 3.41Å
466	M	95.4	Very high	86	Confident	133 Å²	133	62.5 Å²	62.5	66%	0.655	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.7	152.3	174.8	62.1	180	68.9	0	0	109.3	H419 Y482	H419-M466 CarbonylContact O-C 3.52Å; H419-M466 VanDerWaalsContact O-CA 3.25Å; H419-M466 WeakPolarHBondContact O-CA 3.33Å; M466-Y482 PolarHBondContact N-O 3.06Å; M466-Y482 VanDerWaalsContact N-O 3.1Å; M466-Y482 PolarHBondContact O-N 2.87Å
467	G	93.4	Very high	86.1	Confident	11 Å²	11	59.9 Å²	59.9	11%	0.113	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	-178.9	-176.1	0	0	0	0	0	113.3	H419 L480	H419-G467 PolarHBondContact N-O 2.91Å; H419-G467 PolarHBondContact ND1-O 2.89Å; H419-G467 PolarHBondContact O-N 3.22Å; G467-L480 CarbonylContact C-O 3.57Å; G467-L480 WeakPolarHBondContact CA-O 3.25Å
468	I	92.4	Very high	86.4	Confident	72 Å²	72	54.5 Å²	54.5	37%	0.369	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.3	176.5	-49.5	-175.1	0	0	0	107.5	L416 R417 L418 E479 L480	L416-I468 HydrophobicContact CD2-CG2 3.94Å; R417-I468 CarbonylContact O-C 3.56Å; R417-I468 WeakPolarHBondContact O-CA 3.5Å; L418-I468 HydrophobicContact CD2-CD1 4.09Å; L418-I468 HydrophobicContact CD2-CG1 3.74Å; I468-E479 WeakPolarHBondContact O-CA 3.1Å; I468-L480 PolarHBondContact N-O 3.27Å; I468-L480 PolarHBondContact O-N 3.29Å
469	V	90.1	Very high	86.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.9	174.7	-172.7	0	0	0	0	109.4	F242 Y399 L416 R417 H419 R477 V478 E479	F242-V469 HydrophobicContact CE1-CB 3.9Å; F242-V469 HydrophobicContact CE1-CG1 3.48Å; F242-V469 VanDerWaalsContact CE1-CG1 3.48Å; F242-V469 HydrophobicContact CZ-CB 4.26Å; F242-V469 HydrophobicContact CZ-CG1 3.85Å; Y399-V469 HydrophobicContact CD1-CG2 4.41Å; Y399-V469 HydrophobicContact CE1-CG2 3.99Å; L416-V469 CarbonylContact C-O 3.53Å; L416-V469 WeakPolarHBondContact CA-O 3.03Å; R417-V469 PolarHBondContact N-O 3.03Å; R417-V469 PolarHBondContact O-N 2.94Å; H419-V469 HydrophobicContact CB-CG2 4.44Å; H419-V469 WeakPolarHBondContact CE1-CG2 3.05Å; H419-V469 WeakPolarHBondContact ND1-CG2 3.37Å; V469-R477 HydrophobicContact CG1-CG 3.25Å; V469-V478 CarbonylContact C-O 3.24Å; V469-V478 WeakPolarHBondContact CA-O 3.46Å; V469-E479 HydrophobicContact CB-CG 4.35Å; V469-E479 HydrophobicContact CG1-CG 4Å; V469-E479 HydrophobicContact CG2-CG 3.82Å
470	F	88.8	Confident	87.4	Confident	58 Å²	58	47.9 Å²	47.9	25%	0.254	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.4	176.2	178.6	-116.2	0	0	0	110.5	Q415 L416 F472 V478	Q415-F470 HydrophobicContact CB-CD2 4.04Å; Q415-F470 HydrophobicContact CB-CE2 3.71Å; Q415-F470 WeakPolarHBondContact O-CA 3.41Å; L416-F470 HydrophobicContact CD2-CB 3.68Å; L416-F470 HydrophobicContact CD2-CD2 3.47Å; L416-F470 VanDerWaalsContact CD2-CD2 3.47Å; L416-F470 HydrophobicContact CD2-CE2 4.47Å; L416-F470 HydrophobicContact CD2-CG 3.95Å; L416-F470 HydrophobicContact CG-CD2 3.78Å; L416-F470 HydrophobicContact CG-CE2 4.46Å; F470-F472 HydrophobicContact CD1-CB 4.29Å; F470-F472 HydrophobicContact CE1-CB 4.08Å; F470-F472 AromaticContact CE1-CD2 3.95Å; F470-F472 HydrophobicContact CE1-CD2 3.95Å; F470-V478 HydrophobicContact CB-CB 4.33Å; F470-V478 PolarHBondContact N-O 3.29Å; F470-V478 PolarHBondContact O-N 2.83Å
471	R	86	Confident	87.5	Confident	65 Å²	65	46 Å²	46	25%	0.245	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	116.2	172.5	177.9	177.8	-153.3	158.1	12.2	110.6	D239 V241 F242 Q415 G474	D239-R471 VanDerWaalsContact CG-NH2 3.25Å; D239-R471 IonicContact OD1-CZ 3.86Å; D239-R471 IonicContact OD1-NH1 3.73Å; D239-R471 IonicContact OD1-NH2 2.91Å; D239-R471 PolarHBondContact OD1-NH2 3.28Å; D239-R471 IonicContact OD2-CZ 2.7Å; D239-R471 VanDerWaalsContact OD2-CZ 3.24Å; D239-R471 IonicContact OD2-NH1 2.82Å; D239-R471 PolarHBondContact OD2-NH1 2.96Å; D239-R471 IonicContact OD2-NH2 3.23Å; D239-R471 PolarHBondContact OD2-NH2 3.45Å; V241-R471 HydrophobicContact CB-CG 4.24Å; V241-R471 HydrophobicContact CG1-CB 3.89Å; V241-R471 HydrophobicContact CG1-CG 3.88Å; V241-R471 HydrophobicContact CG2-CG 4.33Å; F242-R471 HydrophobicContact CD2-CB 4.26Å; F242-R471 HydrophobicContact CE2-CB 3.57Å; F242-R471 HydrophobicContact CZ-CB 4.2Å; Q415-R471 HydrophobicContact CB-CB 4.35Å; Q415-R471 PolarHBondContact O-N 3.44Å; R471-G474 PolarHBondContact NE-O 2.86Å; R471-G474 VanDerWaalsContact NE-O 3.12Å; R471-G474 PolarHBondContact NH2-O 3.25Å
472	F	80.3	Confident	87.6	Confident	113 Å²	113	51.1 Å²	51.1	50%	0.496	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.3	176.7	-174.1	-101.9	0	0	0	111.3	F470 G474 I475 L476 V478	F470-F472 HydrophobicContact CD1-CB 4.29Å; F470-F472 HydrophobicContact CE1-CB 4.08Å; F470-F472 AromaticContact CE1-CD2 3.95Å; F470-F472 HydrophobicContact CE1-CD2 3.95Å; F472-G474 PolarHBondContact O-N 2.81Å; F472-I475 PolarHBondContact O-N 2.92Å; F472-L476 HydrophobicContact CB-CB 4.16Å; F472-L476 HydrophobicContact CB-CD2 4.22Å; F472-L476 HydrophobicContact CD1-CB 4.36Å; F472-L476 HydrophobicContact CD1-CD2 3.75Å; F472-L476 HydrophobicContact CG-CD2 4.37Å; F472-L476 PolarHBondContact N-O 2.86Å; F472-L476 WeakPolarHBondContact O-CB 3.04Å; F472-L476 PolarHBondContact O-N 3.14Å; F472-V478 HydrophobicContact CB-CG2 4.13Å
473	A	72.7	Confident	87.6	Confident	82 Å²	82	49.6 Å²	49.6	68%	0.678	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	28.7	176.2	0	0	0	0	0	115.5	I475	A473-I475 PolarHBondContact O-N 3.5Å
474	G	71.7	Confident	87.5	Confident	37 Å²	37	54.8 Å²	54.8	38%	0.381	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	-27.1	177	0	0	0	0	0	115.9	V241 R471 F472	V241-G474 WeakPolarHBondContact CG2-O 3.18Å; R471-G474 PolarHBondContact NE-O 2.86Å; R471-G474 VanDerWaalsContact NE-O 3.12Å; R471-G474 PolarHBondContact NH2-O 3.25Å; F472-G474 PolarHBondContact O-N 2.81Å
475	I	73	Confident	87.4	Confident	107 Å²	107	51.9 Å²	51.9	55%	0.549	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-19.2	-172.8	60.2	172	0	0	0	114.6	F472 A473	F472-I475 PolarHBondContact O-N 2.92Å; A473-I475 PolarHBondContact O-N 3.5Å
476	L	78.3	Confident	87.3	Confident	47 Å²	47	56.2 Å²	56.2	25%	0.246	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.5	-174	-174.3	71.2	0	0	0	110.5	F472 V478	F472-L476 HydrophobicContact CB-CB 4.16Å; F472-L476 HydrophobicContact CB-CD2 4.22Å; F472-L476 HydrophobicContact CD1-CB 4.36Å; F472-L476 HydrophobicContact CD1-CD2 3.75Å; F472-L476 HydrophobicContact CG-CD2 4.37Å; F472-L476 PolarHBondContact N-O 2.86Å; F472-L476 WeakPolarHBondContact O-CB 3.04Å; F472-L476 PolarHBondContact O-N 3.14Å; L476-V478 HydrophobicContact CD2-CG2 4.22Å; L476-V478 HydrophobicContact CG-CG2 4.37Å
477	R	83.4	Confident	87.1	Confident	10 Å²	10	52.8 Å²	52.8	4%	0.038	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.8	172.2	-165.9	-170	-83.1	-167.5	-1	109.6	V241 Y399 V469 E479 F502 G503	V241-R477 HydrophobicContact CG1-CB 3.97Å; V241-R477 HydrophobicContact CG1-CG 4.05Å; V241-R477 PolarHBondContact O-NE 3.25Å; V241-R477 PolarHBondContact O-NH2 3.01Å; Y399-R477 PolarHBondContact OH-NH1 2.91Å; V469-R477 HydrophobicContact CG1-CG 3.25Å; R477-E479 WeakPolarHBondContact CD-OE1 3.32Å; R477-E479 HydrophobicContact CG-CG 4.2Å; R477-E479 IonicContact NH1-OE1 3.67Å; R477-E479 PolarHBondContact NH1-OE1 3.44Å; R477-F502 WeakPolarHBondContact O-CA 3.38Å; R477-G503 WeakPolarHBondContact CA-O 3.5Å; R477-G503 VanDerWaalsContact CB-O 3.27Å; R477-G503 WeakPolarHBondContact CB-O 3.28Å; R477-G503 PolarHBondContact N-O 3.5Å; R477-G503 PolarHBondContact O-N 3.43Å
478	V	86.7	Confident	87	Confident	24 Å²	24	59.3 Å²	59.3	15%	0.145	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.1	176.8	-174.7	0	0	0	0	108.5	V469 F470 F472 L476 F500 F502	V469-V478 CarbonylContact C-O 3.24Å; V469-V478 WeakPolarHBondContact CA-O 3.46Å; F470-V478 HydrophobicContact CB-CB 4.33Å; F470-V478 PolarHBondContact N-O 3.29Å; F470-V478 PolarHBondContact O-N 2.83Å; F472-V478 HydrophobicContact CB-CG2 4.13Å; L476-V478 HydrophobicContact CD2-CG2 4.22Å; L476-V478 HydrophobicContact CG-CG2 4.37Å; V478-F500 HydrophobicContact CG1-CE1 3.67Å; V478-F500 HydrophobicContact CG1-CE2 4.31Å; V478-F500 HydrophobicContact CG1-CZ 3.29Å; V478-F502 HydrophobicContact CB-CD1 4.31Å; V478-F502 HydrophobicContact CB-CE1 4.49Å; V478-F502 HydrophobicContact CG1-CD1 3.93Å; V478-F502 HydrophobicContact CG1-CE1 3.74Å; V478-F502 HydrophobicContact CG2-CD1 3.84Å; V478-F502 HydrophobicContact CG2-CE1 4.06Å
479	E	86.6	Confident	86.7	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.9	-176	-57.7	-172.9	173.2	0	0	111.7	R337 I468 V469 R477 N481 G501	R337-E479 IonicContact CZ-OE2 2.64Å; R337-E479 IonicContact NE-OE2 2.81Å; R337-E479 IonicContact NH2-OE1 3.4Å; R337-E479 IonicContact NH2-OE2 3.24Å; R337-E479 PolarHBondContact NH2-OE2 3.41Å; I468-E479 WeakPolarHBondContact O-CA 3.1Å; V469-E479 HydrophobicContact CB-CG 4.35Å; V469-E479 HydrophobicContact CG1-CG 4Å; V469-E479 HydrophobicContact CG2-CG 3.82Å; R477-E479 WeakPolarHBondContact CD-OE1 3.32Å; R477-E479 HydrophobicContact CG-CG 4.2Å; R477-E479 IonicContact NH1-OE1 3.67Å; R477-E479 PolarHBondContact NH1-OE1 3.44Å; E479-N481 PolarHBondContact OE2-ND2 3.14Å; E479-N481 VanDerWaalsContact OE2-ND2 3.11Å; E479-G501 PolarHBondContact N-O 3.05Å; E479-G501 PolarHBondContact O-N 3.23Å
480	L	91	Very high	86.4	Confident	78 Å²	78	64.5 Å²	64.5	41%	0.408	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	112	166.3	179.1	66.4	0	0	0	108.5	G467 I468 F498 F500	G467-L480 CarbonylContact C-O 3.57Å; G467-L480 WeakPolarHBondContact CA-O 3.25Å; I468-L480 PolarHBondContact N-O 3.27Å; I468-L480 PolarHBondContact O-N 3.29Å; L480-F498 HydrophobicContact CD1-CD1 4.17Å; L480-F498 HydrophobicContact CG-CD1 4.44Å; L480-F500 HydrophobicContact CD1-CD2 4.24Å
481	N	92.6	Very high	85.9	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138	-170.3	-65.1	-33.7	0	0	0	110.7	R337 H419 F421 E479 F498 A499	R337-N481 PolarHBondContact NE-ND2 3Å; R337-N481 VanDerWaalsContact NE-ND2 3.15Å; H419-N481 PolarHBondContact CE1-OD1 2.89Å; H419-N481 PolarHBondContact NE2-OD1 2.8Å; H419-N481 VanDerWaalsContact NE2-OD1 3.14Å; F421-N481 HydrophobicContact CE1-CB 3.95Å; F421-N481 HydrophobicContact CZ-CB 4.08Å; E479-N481 PolarHBondContact OE2-ND2 3.14Å; E479-N481 VanDerWaalsContact OE2-ND2 3.11Å; N481-F498 CarbonylContact O-C 3.56Å; N481-F498 VanDerWaalsContact O-CA 3.3Å; N481-F498 WeakPolarHBondContact O-CA 3.31Å; N481-A499 HydrophobicContact CB-CB 4.49Å; N481-A499 PolarHBondContact N-O 3.07Å; N481-A499 PolarHBondContact O-N 3.01Å
482	Y	94.4	Very high	86	Confident	114 Å²	114	60.8 Å²	60.8	45%	0.447	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.8	165.4	-169	-88.1	0	0	0	108.5	G465 M466 G497 F498	G465-Y482 WeakPolarHBondContact CA-O 3.41Å; M466-Y482 PolarHBondContact N-O 3.06Å; M466-Y482 VanDerWaalsContact N-O 3.1Å; M466-Y482 PolarHBondContact O-N 2.87Å; Y482-G497 WeakPolarHBondContact CA-O 3.43Å; Y482-F498 HydrophobicContact CD2-CD1 4.08Å; Y482-F498 HydrophobicContact CD2-CD2 4.09Å; Y482-F498 AromaticContact CD2-CE1 3.9Å; Y482-F498 HydrophobicContact CD2-CE1 3.9Å; Y482-F498 AromaticContact CD2-CE2 3.91Å; Y482-F498 HydrophobicContact CD2-CE2 3.91Å; Y482-F498 HydrophobicContact CD2-CG 4.18Å; Y482-F498 AromaticContact CD2-CZ 3.81Å; Y482-F498 HydrophobicContact CD2-CZ 3.81Å; Y482-F498 HydrophobicContact CE2-CD2 4.34Å; Y482-F498 HydrophobicContact CE2-CE2 4.07Å; Y482-F498 HydrophobicContact CE2-CZ 4.33Å
483	C	94.2	Very high	86.4	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.9	-170.8	-52.3	0	0	0	0	110.7	V463 G497	V463-C483 HydrophobicContact CG1-CB 4.12Å; C483-G497 PolarHBondContact N-O 3.18Å; C483-G497 PolarHBondContact O-N 3.02Å
484	F	94.8	Very high	87.2	Confident	110 Å²	110	58.7 Å²	58.7	48%	0.482	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	95.4	174.5	-169.7	-96.9	0	0	0	110.2	I464 M486	I464-F484 HydrophobicContact CG2-CB 4.06Å; I464-F484 HydrophobicContact CG2-CD1 4.16Å; I464-F484 PolarHBondContact N-O 3.41Å; I464-F484 WeakPolarHBondContact O-CA 3.48Å; I464-F484 WeakPolarHBondContact O-CB 3.48Å; I464-F484 PolarHBondContact O-N 3.15Å; F484-M486 HydrophobicContact CD1-CE 3.67Å; F484-M486 HydrophobicContact CD1-CG 4.08Å; F484-M486 HydrophobicContact CD1-SD 3.64Å; F484-M486 HydrophobicContact CE1-CE 3.82Å; F484-M486 HydrophobicContact CE1-CG 4.4Å; F484-M486 HydrophobicContact CE1-SD 3.47Å; F484-M486 WeakPolarHBondContact CE1-SD 3.37Å; F484-M486 PolarHBondContact O-N 3.17Å
485	P	93.6	Very high	87.9	Confident	14 Å²	14	63.1 Å²	63.1	9%	0.091	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	120.1	173.9	-22.7	36.5	0	0	0	110.5	G338 F339 V463 V494	G338-P485 WeakPolarHBondContact O-CG 3.4Å; F339-P485 HydrophobicContact CZ-CB 4.45Å; V463-P485 HydrophobicContact CG2-CB 4.15Å; V463-P485 HydrophobicContact CG2-CG 4.38Å; P485-V494 HydrophobicContact CB-CG1 3.58Å; P485-V494 HydrophobicContact CG-CG1 3.46Å; P485-V494 VanDerWaalsContact CG-CG1 3.46Å
486	M	93.1	Very high	88.7	Confident	102 Å²	102	62.2 Å²	62.2	50%	0.502	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-45.6	-177.8	-72.2	-75.5	-166.5	0	0	111.7	T462 I464 F484	T462-M486 WeakPolarHBondContact O-CB 3.44Å; T462-M486 PolarHBondContact O-N 3.33Å; I464-M486 HydrophobicContact CG2-CE 3.44Å; I464-M486 VanDerWaalsContact CG2-CE 3.44Å; I464-M486 HydrophobicContact CG2-CG 4.07Å; F484-M486 HydrophobicContact CD1-CE 3.67Å; F484-M486 HydrophobicContact CD1-CG 4.08Å; F484-M486 HydrophobicContact CD1-SD 3.64Å; F484-M486 HydrophobicContact CE1-CE 3.82Å; F484-M486 HydrophobicContact CE1-CG 4.4Å; F484-M486 HydrophobicContact CE1-SD 3.47Å; F484-M486 WeakPolarHBondContact CE1-SD 3.37Å; F484-M486 PolarHBondContact O-N 3.17Å
487	T	92.5	Very high	89.3	Confident	61 Å²	61	60.5 Å²	60.5	37%	0.374	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.1	-178.7	58.8	0	0	0	0	110.5	P460 R461 T462	P460-T487 PolarHBondContact O-OG1 3.09Å; R461-T487 WeakPolarHBondContact CA-O 3.32Å; T462-T487 WeakPolarHBondContact CB-OG1 3.4Å; T462-T487 PolarHBondContact N-O 3.09Å; T462-T487 PolarHBondContact N-OG1 3.09Å; T462-T487 PolarHBondContact O-N 3.14Å; T462-T487 PolarHBondContact OG1-OG1 2.98Å
488	Y	90.6	Very high	89.6	Confident	149 Å²	149	67.1 Å²	67.1	58%	0.584	34%	0.342	S	S	*	.			trans	-149.6	164.4	179.5	55.2	-91.2	0	0	0	110.1	V494	Y488-V494 HydrophobicContact CD1-CG2 4.1Å; Y488-V494 HydrophobicContact CD2-CG2 4.15Å; Y488-V494 HydrophobicContact CG-CG2 3.81Å
489	Q	87.2	Confident	89.5	Confident	57 Å²	57	66.8 Å²	66.8	27%	0.266	34%	0.343	S	S	.	.			trans	-110.2	160.3	175.7	-67.5	-174.6	-2.2	0	0	111.5	R459 R461 G491 D492	R459-Q489 HydrophobicContact CB-CG 4.26Å; R459-Q489 PolarHBondContact O-NE2 3.26Å; R459-Q489 VanDerWaalsContact O-NE2 3.11Å; R461-Q489 VanDerWaalsContact CZ-OE1 3.23Å; R461-Q489 VanDerWaalsContact NH2-CB 3.27Å; Q489-G491 PolarHBondContact O-N 3.31Å; Q489-D492 PolarHBondContact N-OD2 3.33Å; Q489-D492 WeakPolarHBondContact O-CB 3.46Å; Q489-D492 PolarHBondContact O-N 3.31Å
490	P	81.9	Confident	89.4	Confident	124 Å²	124	70.8 Å²	70.8	81%	0.805	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	127.8	171.6	-22	33.6	0	0	0	111.1
491	G	80.3	Confident	88.8	Confident	30 Å²	30	67.1 Å²	67.1	31%	0.309	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-23.1	-177.2	0	0	0	0	0	114.4	Q489 Q493	Q489-G491 PolarHBondContact O-N 3.31Å; G491-Q493 PolarHBondContact O-N 2.69Å
492	D	87	Confident	88.1	Confident	15 Å²	15	69.7 Å²	69.7	8%	0.08	35%	0.352	C	S	.	.			trans	-66.4	132.6	174	-61.7	-23.3	0	0	0	110.2	F339 R461 Q489 V494	F339-D492 HydrophobicContact CD1-CB 4.21Å; F339-D492 HydrophobicContact CE1-CB 4.04Å; R461-D492 IonicContact CZ-OD1 3.71Å; R461-D492 IonicContact CZ-OD2 2.7Å; R461-D492 IonicContact NE-OD1 2.87Å; R461-D492 IonicContact NE-OD2 2.95Å; R461-D492 PolarHBondContact NE-OD2 3.47Å; R461-D492 IonicContact NH2-OD1 3.9Å; R461-D492 PolarHBondContact NH2-OD1 3.1Å; R461-D492 IonicContact NH2-OD2 3.76Å; R461-D492 PolarHBondContact NH2-OD2 2.74Å; Q489-D492 PolarHBondContact N-OD2 3.33Å; Q489-D492 WeakPolarHBondContact O-CB 3.46Å; Q489-D492 PolarHBondContact O-N 3.31Å; D492-V494 PolarHBondContact O-N 3.3Å
493	Q	88.1	Confident	86.9	Confident	97 Å²	97	65 Å²	65	45%	0.453	34%	0.338	S	S	.	.			trans	-89.2	104.6	173.5	-59.1	-62.8	-31	0	0	110.1	Q340 T343 G491	Q340-Q493 HydrophobicContact CB-CB 3.91Å; Q340-Q493 PolarHBondContact N-O 3.44Å; T343-Q493 HydrophobicContact CG2-CB 3.91Å; T343-Q493 HydrophobicContact CG2-CG 4.01Å; T343-Q493 PolarHBondContact OG1-O 3.31Å; G491-Q493 PolarHBondContact O-N 2.69Å
494	V	89.9	Confident	85.4	Confident	54 Å²	54	70.1 Å²	70.1	33%	0.327	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-85.1	133.7	-177.8	-169.9	0	0	0	0	110.1	F339 P485 Y488 D492	F339-V494 HydrophobicContact CD1-CG2 4.31Å; F339-V494 HydrophobicContact CE1-CG2 4.04Å; P485-V494 HydrophobicContact CB-CG1 3.58Å; P485-V494 HydrophobicContact CG-CG1 3.46Å; P485-V494 VanDerWaalsContact CG-CG1 3.46Å; Y488-V494 HydrophobicContact CD1-CG2 4.1Å; Y488-V494 HydrophobicContact CD2-CG2 4.15Å; Y488-V494 HydrophobicContact CG-CG2 3.81Å; D492-V494 PolarHBondContact O-N 3.3Å
495	K	87.3	Confident	83.6	Confident	130 Å²	130	69.7 Å²	69.7	57%	0.565	36%	0.359	S	S	*	.			trans	-126.7	79.2	176.9	-171.6	-179.4	178	179.9	0	109.7	G338	G338-K495 CarbonylContact C-O 3.55Å; G338-K495 WeakPolarHBondContact CA-O 3.16Å; G338-K495 CarbonylContact O-C 3.57Å; G338-K495 VanDerWaalsContact O-C 3.31Å; G338-K495 WeakPolarHBondContact O-CA 3.31Å; G338-K495 PolarHBondContact O-N 3.29Å
496	P	89.7	Confident	81.7	Confident	88 Å²	88	69.2 Å²	69.2	57%	0.571	36%	0.356	S	S	*	.			trans	-70.9	155.7	177.9	31.8	-33.3	0	0	0	111.2
497	G	90.4	Very high	79.5	Confident	11 Å²	11	67.5 Å²	67.5	11%	0.113	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102	-145.6	174.8	0	0	0	0	0	113.8	Y482 C483 A499	Y482-G497 WeakPolarHBondContact CA-O 3.43Å; C483-G497 PolarHBondContact N-O 3.18Å; C483-G497 PolarHBondContact O-N 3.02Å; G497-A499 PolarHBondContact O-N 2.92Å
498	F	89.5	Confident	78.9	Confident	148 Å²	148	67.9 Å²	67.9	65%	0.649	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	128	-173.4	-67.7	-78.9	0	0	0	112.3	L480 N481 Y482	L480-F498 HydrophobicContact CD1-CD1 4.17Å; L480-F498 HydrophobicContact CG-CD1 4.44Å; N481-F498 CarbonylContact O-C 3.56Å; N481-F498 VanDerWaalsContact O-CA 3.3Å; N481-F498 WeakPolarHBondContact O-CA 3.31Å; Y482-F498 HydrophobicContact CD2-CD1 4.08Å; Y482-F498 HydrophobicContact CD2-CD2 4.09Å; Y482-F498 AromaticContact CD2-CE1 3.9Å; Y482-F498 HydrophobicContact CD2-CE1 3.9Å; Y482-F498 AromaticContact CD2-CE2 3.91Å; Y482-F498 HydrophobicContact CD2-CE2 3.91Å; Y482-F498 HydrophobicContact CD2-CG 4.18Å; Y482-F498 AromaticContact CD2-CZ 3.81Å; Y482-F498 HydrophobicContact CD2-CZ 3.81Å; Y482-F498 HydrophobicContact CE2-CD2 4.34Å; Y482-F498 HydrophobicContact CE2-CE2 4.07Å; Y482-F498 HydrophobicContact CE2-CZ 4.33Å
499	A	84.8	Confident	78.2	Confident	18 Å²	18	63.6 Å²	63.6	15%	0.149	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.5	173.7	0	0	0	0	0	108.6	P333 N481 G497	P333-A499 HydrophobicContact CB-CB 4.25Å; N481-A499 HydrophobicContact CB-CB 4.49Å; N481-A499 PolarHBondContact N-O 3.07Å; N481-A499 PolarHBondContact O-N 3.01Å; G497-A499 PolarHBondContact O-N 2.92Å
500	F	85.5	Confident	77.7	Confident	86 Å²	86	63.9 Å²	63.9	38%	0.377	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.7	177.9	-163.9	-67.3	0	0	0	108.7	P333 V478 L480 F502	P333-F500 WeakPolarHBondContact CB-O 3.23Å; P333-F500 WeakPolarHBondContact CG-O 3.34Å; V478-F500 HydrophobicContact CG1-CE1 3.67Å; V478-F500 HydrophobicContact CG1-CE2 4.31Å; V478-F500 HydrophobicContact CG1-CZ 3.29Å; L480-F500 HydrophobicContact CD1-CD2 4.24Å; F500-F502 AromaticContact CD1-CD2 3.52Å; F500-F502 HydrophobicContact CD1-CD2 3.52Å; F500-F502 HydrophobicContact CD1-CE1 4.39Å; F500-F502 AromaticContact CD1-CE2 3.15Å; F500-F502 HydrophobicContact CD1-CE2 3.15Å; F500-F502 HydrophobicContact CD1-CG 4.31Å; F500-F502 AromaticContact CD1-CZ 3.67Å; F500-F502 HydrophobicContact CD1-CZ 3.67Å; F500-F502 AromaticContact CE1-CD1 3.72Å; F500-F502 HydrophobicContact CE1-CD1 3.72Å; F500-F502 AromaticContact CE1-CD2 3.3Å; F500-F502 HydrophobicContact CE1-CD2 3.3Å; F500-F502 AromaticContact CE1-CE1 3.3Å; F500-F502 HydrophobicContact CE1-CE1 3.3Å; F500-F502 AromaticContact CE1-CE2 2.85Å; F500-F502 HydrophobicContact CE1-CE2 2.85Å; F500-F502 AromaticContact CE1-CG 3.73Å; F500-F502 HydrophobicContact CE1-CG 3.73Å; F500-F502 AromaticContact CE1-CZ 2.86Å; F500-F502 HydrophobicContact CE1-CZ 2.86Å; F500-F502 HydrophobicContact CE2-CZ 4.44Å; F500-F502 HydrophobicContact CG-CE2 4.34Å; F500-F502 HydrophobicContact CZ-CD1 4.38Å; F500-F502 HydrophobicContact CZ-CD2 4.46Å; F500-F502 AromaticContact CZ-CE1 3.62Å; F500-F502 HydrophobicContact CZ-CE1 3.62Å; F500-F502 AromaticContact CZ-CE2 3.74Å; F500-F502 HydrophobicContact CZ-CE2 3.74Å; F500-F502 AromaticContact CZ-CZ 3.28Å; F500-F502 HydrophobicContact CZ-CZ 3.28Å
501	G	77.7	Confident	77.5	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.9	177.9	0	0	0	0	0	113	E479	E479-G501 PolarHBondContact N-O 3.05Å; E479-G501 PolarHBondContact O-N 3.23Å
502	F	78.6	Confident	77.3	Confident	55 Å²	55	62.3 Å²	62.3	24%	0.241	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	122.5	174.2	-63.2	-90.6	0	0	0	109.6	Y104 L334 R477 V478 F500	Y104-F502 HydrophobicContact CD1-CD2 4.19Å; Y104-F502 AromaticContact CD1-CE2 3.78Å; Y104-F502 HydrophobicContact CD1-CE2 3.78Å; Y104-F502 AromaticContact CG-CE2 3.95Å; Y104-F502 HydrophobicContact CG-CE2 3.95Å; Y104-F502 WeakPolarHBondContact O-CD2 3.2Å; L334-F502 WeakPolarHBondContact CD1-O 3.27Å; R477-F502 WeakPolarHBondContact O-CA 3.38Å; V478-F502 HydrophobicContact CB-CD1 4.31Å; V478-F502 HydrophobicContact CB-CE1 4.49Å; V478-F502 HydrophobicContact CG1-CD1 3.93Å; V478-F502 HydrophobicContact CG1-CE1 3.74Å; V478-F502 HydrophobicContact CG2-CD1 3.84Å; V478-F502 HydrophobicContact CG2-CE1 4.06Å; F500-F502 AromaticContact CD1-CD2 3.52Å; F500-F502 HydrophobicContact CD1-CD2 3.52Å; F500-F502 HydrophobicContact CD1-CE1 4.39Å; F500-F502 AromaticContact CD1-CE2 3.15Å; F500-F502 HydrophobicContact CD1-CE2 3.15Å; F500-F502 HydrophobicContact CD1-CG 4.31Å; F500-F502 AromaticContact CD1-CZ 3.67Å; F500-F502 HydrophobicContact CD1-CZ 3.67Å; F500-F502 AromaticContact CE1-CD1 3.72Å; F500-F502 HydrophobicContact CE1-CD1 3.72Å; F500-F502 AromaticContact CE1-CD2 3.3Å; F500-F502 HydrophobicContact CE1-CD2 3.3Å; F500-F502 AromaticContact CE1-CE1 3.3Å; F500-F502 HydrophobicContact CE1-CE1 3.3Å; F500-F502 AromaticContact CE1-CE2 2.85Å; F500-F502 HydrophobicContact CE1-CE2 2.85Å; F500-F502 AromaticContact CE1-CG 3.73Å; F500-F502 HydrophobicContact CE1-CG 3.73Å; F500-F502 AromaticContact CE1-CZ 2.86Å; F500-F502 HydrophobicContact CE1-CZ 2.86Å; F500-F502 HydrophobicContact CE2-CZ 4.44Å; F500-F502 HydrophobicContact CG-CE2 4.34Å; F500-F502 HydrophobicContact CZ-CD1 4.38Å; F500-F502 HydrophobicContact CZ-CD2 4.46Å; F500-F502 AromaticContact CZ-CE1 3.62Å; F500-F502 HydrophobicContact CZ-CE1 3.62Å; F500-F502 AromaticContact CZ-CE2 3.74Å; F500-F502 HydrophobicContact CZ-CE2 3.74Å; F500-F502 AromaticContact CZ-CZ 3.28Å; F500-F502 HydrophobicContact CZ-CZ 3.28Å
503	G	68.4	Low	76.7	Confident	14 Å²	14	65.5 Å²	65.5	14%	0.144	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	160.9	-179.7	0	0	0	0	0	113.7	R477	R477-G503 WeakPolarHBondContact CA-O 3.5Å; R477-G503 VanDerWaalsContact CB-O 3.27Å; R477-G503 WeakPolarHBondContact CB-O 3.28Å; R477-G503 PolarHBondContact N-O 3.5Å; R477-G503 PolarHBondContact O-N 3.43Å
504	M	62.7	Low	75.9	Confident	108 Å²	108	63.2 Å²	63.2	53%	0.532	32%	0.316	S	S	.	.	S	Bend	trans	-89.5	-32.7	168.3	-62.3	-165.8	-50.7	0	0	111.8
505	Y	56.8	Low	74.8	Confident	101 Å²	101	63.9 Å²	63.9	40%	0.396	32%	0.315	S	S	.	.	S	Bend	trans	-136.3	149.3	178	-53.4	-70.5	0	0	0	108.4	R237 L240	R237-Y505 VanDerWaalsContact NH2-CD1 3.33Å; R237-Y505 VanDerWaalsContact NH2-CE1 3.29Å; L240-Y505 HydrophobicContact CB-CE1 4.16Å; L240-Y505 HydrophobicContact CD2-CE1 3.9Å; L240-Y505 HydrophobicContact CG-CE1 4.39Å
506	Y	53.3	Low	73.7	Confident	5 Å²	5	58.4 Å²	58.4	2%	0.02	29%	0.294	C	S	.	.			trans	-108.7	152.9	177.2	-164	-88.8	0	0	0	110.7	L334 E335 R337 H397	L334-Y506 VanDerWaalsContact C-CZ 3.4Å; L334-Y506 VanDerWaalsContact CA-CE2 3.44Å; L334-Y506 HydrophobicContact CB-CD2 4.5Å; L334-Y506 HydrophobicContact CB-CE2 4.13Å; L334-Y506 HydrophobicContact CD2-CD2 3.62Å; L334-Y506 HydrophobicContact CD2-CE2 3.63Å; L334-Y506 HydrophobicContact CG-CE2 4.45Å; L334-Y506 VanDerWaalsContact O-CE2 3.23Å; L334-Y506 WeakPolarHBondContact O-CE2 3.29Å; L334-Y506 PolarHBondContact O-OH 2.78Å; E335-Y506 PolarHBondContact O-OH 2.83Å; R337-Y506 WeakPolarHBondContact CG-OH 3.39Å; R337-Y506 VanDerWaalsContact CZ-CE2 3.42Å; R337-Y506 PolarHBondContact NE-OH 3.19Å; R337-Y506 PolarHBondContact NH1-OH 2.81Å; R337-Y506 PolarHBondContact NH2-OH 2.75Å; H397-Y506 AromaticContact CE1-CD1 3.87Å; H397-Y506 AromaticContact CE1-CE1 3.58Å; H397-Y506 AromaticContact NE2-CE1 3.95Å
507	M	47.6	Very low	72.3	Confident	66 Å²	66	55.7 Å²	55.7	33%	0.325	27%	0.269	S	S	.	.			trans	-115.1	0	169.5	-71.8	-156.5	173.1	0	0	111.9	L292 T308 S310	L292-M507 HydrophobicContact CB-CE 4.36Å; L292-M507 HydrophobicContact CD1-CB 4.08Å; L292-M507 HydrophobicContact CD1-CE 4.28Å; L292-M507 HydrophobicContact CD1-CG 3.6Å; L292-M507 HydrophobicContact CD1-SD 4.13Å; L292-M507 HydrophobicContact CD2-CE 3.92Å; L292-M507 HydrophobicContact CD2-CG 4.09Å; L292-M507 HydrophobicContact CG-CE 4.41Å; L292-M507 HydrophobicContact CG-CG 4.46Å; T308-M507 WeakPolarHBondContact CB-OXT 3.5Å; T308-M507 PolarHBondContact OG1-OXT 3.41Å; S310-M507 PolarHBondContact OG-SD 2.72Å; S310-M507 VanDerWaalsContact OG-SD 3.35Å

Retrieved 507 of 507 residues in 684.2 ms (Link to these results)

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