A0A3Q0KQE2_SCHMA Loading...

Putative leucine-rich repeat-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQE2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 280 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	57.3	Low	75.9	Confident	189 Å²	189	90.4 Å²	90.4	93%	0.931	45%	0.445	S	S	*	.				0	-51.9	0	-79.9	-174.2	-90.2	0	0	115.5	N3 I4 N5	M1-N3 VanDerWaalsContact C-N 3.26Å; M1-N3 PolarHBondContact O-N 3.19Å; M1-N3 VanDerWaalsContact O-N 3.09Å; M1-I4 PolarHBondContact O-N 2.81Å; M1-N5 PolarHBondContact O-N 3.1Å
2	K	60	Low	76.2	Confident	197 Å²	197	89.3 Å²	89.3	86%	0.857	44%	0.441	S	S	*	.	H	α-helix	trans	-50.7	-39.1	-174.2	-71.9	-173.2	179.8	-179.7	0	114.9	S6	K2-S6 PolarHBondContact O-N 2.85Å
3	N	76.5	Confident	76.5	Confident	108 Å²	108	91 Å²	91	58%	0.578	46%	0.46	S	S	*	.	H	α-helix	trans	-67.7	-40.2	177.4	-167.2	-8.3	0	0	0	112.8	M1 N5 S6 I7	M1-N3 VanDerWaalsContact C-N 3.26Å; M1-N3 PolarHBondContact O-N 3.19Å; M1-N3 VanDerWaalsContact O-N 3.09Å; N3-N5 PolarHBondContact O-N 2.7Å; N3-S6 WeakPolarHBondContact O-CB 3.46Å; N3-S6 PolarHBondContact O-N 3.33Å; N3-I7 WeakPolarHBondContact O-CG1 3.48Å; N3-I7 PolarHBondContact O-N 2.86Å
4	I	77.5	Confident	77.1	Confident	18 Å²	18	90.1 Å²	90.1	9%	0.092	46%	0.462	C	S	.	.	H	α-helix	trans	-63.8	-43.9	-180	-65.5	142.7	0	0	0	110.9	M1 S6 I7 V8 L26 P30	M1-I4 PolarHBondContact O-N 2.81Å; I4-S6 VanDerWaalsContact C-N 3.28Å; I4-S6 PolarHBondContact O-N 3.27Å; I4-I7 PolarHBondContact O-N 3.5Å; I4-I7 VanDerWaalsContact O-N 3.16Å; I4-V8 HydrophobicContact CG2-CG2 4.48Å; I4-V8 WeakPolarHBondContact O-CG2 3.33Å; I4-V8 PolarHBondContact O-N 3.4Å; I4-L26 HydrophobicContact CD1-CD2 3.28Å; I4-L26 HydrophobicContact CD1-CG 4.44Å; I4-L26 HydrophobicContact CG1-CD2 3.88Å; I4-L26 HydrophobicContact CG2-CD2 4.14Å; I4-P30 HydrophobicContact CG2-CG 4.14Å
5	N	79	Confident	77.5	Confident	82 Å²	82	91.1 Å²	91.1	44%	0.439	46%	0.463	S	S	.	.	H	α-helix	trans	-61.1	-39.4	176.5	-70.2	-6.9	0	0	0	111.1	M1 N3 V8 L9	M1-N5 PolarHBondContact O-N 3.1Å; N3-N5 PolarHBondContact O-N 2.7Å; N5-V8 PolarHBondContact O-N 3.39Å; N5-L9 VanDerWaalsContact O-CB 3.24Å; N5-L9 WeakPolarHBondContact O-CB 3.33Å; N5-L9 WeakPolarHBondContact O-CD1 3.4Å; N5-L9 WeakPolarHBondContact O-CG 3.45Å; N5-L9 PolarHBondContact O-N 2.95Å
6	S	80.3	Confident	78	Confident	72 Å²	72	89.4 Å²	89.4	50%	0.503	45%	0.453	S	S	.	.	H	α-helix	trans	-63	-42.1	174.5	-177.4	0	0	0	0	112.6	K2 N3 I4 L9 R10	K2-S6 PolarHBondContact O-N 2.85Å; N3-S6 WeakPolarHBondContact O-CB 3.46Å; N3-S6 PolarHBondContact O-N 3.33Å; I4-S6 VanDerWaalsContact C-N 3.28Å; I4-S6 PolarHBondContact O-N 3.27Å; S6-L9 PolarHBondContact O-N 2.76Å; S6-R10 WeakPolarHBondContact O-CB 3.33Å; S6-R10 PolarHBondContact O-N 2.9Å
7	I	81.8	Confident	79	Confident	41 Å²	41	92.5 Å²	92.5	21%	0.21	46%	0.463	C	S	.	.	H	α-helix	trans	-63.1	-46.1	176.4	-64.7	165.6	0	0	0	110.8	N3 I4 R10 A11 L19 L21	N3-I7 WeakPolarHBondContact O-CG1 3.48Å; N3-I7 PolarHBondContact O-N 2.86Å; I4-I7 PolarHBondContact O-N 3.5Å; I4-I7 VanDerWaalsContact O-N 3.16Å; I7-R10 PolarHBondContact O-N 3.09Å; I7-A11 WeakPolarHBondContact O-CB 3.34Å; I7-A11 PolarHBondContact O-N 3.33Å; I7-L19 HydrophobicContact CG2-CD1 3.92Å; I7-L21 HydrophobicContact CB-CD2 4.3Å; I7-L21 HydrophobicContact CD1-CD2 4.41Å; I7-L21 HydrophobicContact CG2-CD2 3.66Å
8	V	80.3	Confident	79.8	Confident	11 Å²	11	97 Å²	97	7%	0.067	47%	0.473	C	S	.	.	H	α-helix	trans	-67.3	-41.9	179.1	174.4	0	0	0	0	111.2	I4 N5 R10 A11 I12 L19 L21 P30	I4-V8 HydrophobicContact CG2-CG2 4.48Å; I4-V8 WeakPolarHBondContact O-CG2 3.33Å; I4-V8 PolarHBondContact O-N 3.4Å; N5-V8 PolarHBondContact O-N 3.39Å; V8-R10 VanDerWaalsContact C-N 3.31Å; V8-R10 PolarHBondContact O-N 3.2Å; V8-A11 WeakPolarHBondContact O-CB 3.27Å; V8-A11 PolarHBondContact O-N 3.17Å; V8-A11 VanDerWaalsContact O-N 3.13Å; V8-I12 HydrophobicContact CG1-CD1 4.03Å; V8-I12 VanDerWaalsContact O-CG1 3.28Å; V8-I12 WeakPolarHBondContact O-CG1 3.46Å; V8-I12 PolarHBondContact O-N 3.44Å; V8-L19 HydrophobicContact CG2-CD2 4.47Å; V8-L21 HydrophobicContact CG2-CD1 4.44Å; V8-P30 HydrophobicContact CB-CG 4.44Å; V8-P30 HydrophobicContact CG1-CG 4.49Å; V8-P30 HydrophobicContact CG2-CG 3.69Å
9	L	78.7	Confident	80.6	Confident	106 Å²	106	92.2 Å²	92.2	56%	0.555	45%	0.45	S	S	*	.	H	α-helix	trans	-58.7	-43.3	173	-75.7	169.2	0	0	0	111.4	N5 S6 A11 I12 T13	N5-L9 VanDerWaalsContact O-CB 3.24Å; N5-L9 WeakPolarHBondContact O-CB 3.33Å; N5-L9 WeakPolarHBondContact O-CD1 3.4Å; N5-L9 WeakPolarHBondContact O-CG 3.45Å; N5-L9 PolarHBondContact O-N 2.95Å; S6-L9 PolarHBondContact O-N 2.76Å; L9-A11 PolarHBondContact O-N 3.22Å; L9-I12 WeakPolarHBondContact O-CB 3.4Å; L9-I12 PolarHBondContact O-N 3Å; L9-T13 WeakPolarHBondContact O-CG2 3.42Å; L9-T13 PolarHBondContact O-N 3.06Å; L9-T13 PolarHBondContact O-OG1 3.19Å
10	R	82.4	Confident	81.2	Confident	165 Å²	165	91 Å²	91	62%	0.623	45%	0.451	S	S	*	.	H	α-helix	trans	-62.6	-41.8	174.4	-176.5	179.6	177.7	-177	0.5	111.9	S6 I7 V8 I12 T13 T14	S6-R10 WeakPolarHBondContact O-CB 3.33Å; S6-R10 PolarHBondContact O-N 2.9Å; I7-R10 PolarHBondContact O-N 3.09Å; V8-R10 VanDerWaalsContact C-N 3.31Å; V8-R10 PolarHBondContact O-N 3.2Å; R10-I12 VanDerWaalsContact C-N 3.28Å; R10-I12 PolarHBondContact O-N 3.32Å; R10-T13 WeakPolarHBondContact CA-OG1 3.2Å; R10-T13 PolarHBondContact O-N 2.95Å; R10-T13 PolarHBondContact O-OG1 3.04Å; R10-T14 HydrophobicContact CG-CG2 4.46Å; R10-T14 WeakPolarHBondContact O-CB 3.46Å; R10-T14 PolarHBondContact O-N 2.82Å; R10-T14 PolarHBondContact O-OG1 3.4Å
11	A	80.9	Confident	81.7	Confident	5 Å²	5	86.6 Å²	86.6	4%	0.041	43%	0.43	C	S	.	.	H	α-helix	trans	-63.1	-37	177.1	0	0	0	0	0	111.8	I7 V8 L9 Q15 Q16 L19	I7-A11 WeakPolarHBondContact O-CB 3.34Å; I7-A11 PolarHBondContact O-N 3.33Å; V8-A11 WeakPolarHBondContact O-CB 3.27Å; V8-A11 PolarHBondContact O-N 3.17Å; V8-A11 VanDerWaalsContact O-N 3.13Å; L9-A11 PolarHBondContact O-N 3.22Å; A11-Q15 WeakPolarHBondContact O-CA 3.45Å; A11-Q15 PolarHBondContact O-N 3.22Å; A11-Q15 VanDerWaalsContact O-N 3.07Å; A11-Q16 HydrophobicContact CB-CB 4.33Å; A11-Q16 HydrophobicContact CB-CG 4.49Å; A11-Q16 PolarHBondContact O-N 2.9Å; A11-L19 HydrophobicContact CB-CD1 4.01Å
12	I	79.6	Confident	83.5	Confident	77 Å²	77	80.3 Å²	80.3	40%	0.395	40%	0.399	S	S	.	.	H	α-helix	trans	-64.3	-56.1	173	-67.3	163	0	0	0	110.4	V8 L9 R10 T14 Q15 L36	V8-I12 HydrophobicContact CG1-CD1 4.03Å; V8-I12 VanDerWaalsContact O-CG1 3.28Å; V8-I12 WeakPolarHBondContact O-CG1 3.46Å; V8-I12 PolarHBondContact O-N 3.44Å; L9-I12 WeakPolarHBondContact O-CB 3.4Å; L9-I12 PolarHBondContact O-N 3Å; R10-I12 VanDerWaalsContact C-N 3.28Å; R10-I12 PolarHBondContact O-N 3.32Å; I12-T14 PolarHBondContact O-N 3.18Å; I12-Q15 PolarHBondContact O-N 3.04Å; I12-L36 HydrophobicContact CB-CD2 4.42Å; I12-L36 HydrophobicContact CD1-CD2 4.07Å; I12-L36 HydrophobicContact CG1-CD2 3.24Å
13	T	80.7	Confident	85.1	Confident	112 Å²	112	77.7 Å²	77.7	69%	0.687	39%	0.39	S	S	*	.	H	α-helix	trans	-66.3	-26.1	-173.8	56.3	0	0	0	0	113.1	L9 R10	L9-T13 WeakPolarHBondContact O-CG2 3.42Å; L9-T13 PolarHBondContact O-N 3.06Å; L9-T13 PolarHBondContact O-OG1 3.19Å; R10-T13 WeakPolarHBondContact CA-OG1 3.2Å; R10-T13 PolarHBondContact O-N 2.95Å; R10-T13 PolarHBondContact O-OG1 3.04Å
14	T	84.7	Confident	85.9	Confident	79 Å²	79	76.4 Å²	76.4	49%	0.485	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	6.7	179.3	61.3	0	0	0	0	114.1	R10 I12 Q16	R10-T14 HydrophobicContact CG-CG2 4.46Å; R10-T14 WeakPolarHBondContact O-CB 3.46Å; R10-T14 PolarHBondContact O-N 2.82Å; R10-T14 PolarHBondContact O-OG1 3.4Å; I12-T14 PolarHBondContact O-N 3.18Å; T14-Q16 VanDerWaalsContact C-N 3.27Å; T14-Q16 PolarHBondContact O-N 3.39Å; T14-Q16 VanDerWaalsContact OG1-CG 3.23Å; T14-Q16 WeakPolarHBondContact OG1-CG 3.45Å; T14-Q16 PolarHBondContact OG1-NE2 2.98Å
15	Q	83.5	Confident	86.6	Confident	104 Å²	104	82.5 Å²	82.5	49%	0.486	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	46.8	179.4	-60.9	-177.8	-2.9	0	0	113.3	A11 I12 K17 W38	A11-Q15 WeakPolarHBondContact O-CA 3.45Å; A11-Q15 PolarHBondContact O-N 3.22Å; A11-Q15 VanDerWaalsContact O-N 3.07Å; I12-Q15 PolarHBondContact O-N 3.04Å; Q15-K17 PolarHBondContact O-N 3.02Å; Q15-W38 HydrophobicContact CB-CB 4.35Å; Q15-W38 HydrophobicContact CB-CD2 4.14Å; Q15-W38 HydrophobicContact CB-CG 3.95Å; Q15-W38 HydrophobicContact CG-CD2 3.97Å; Q15-W38 HydrophobicContact CG-CG 4.18Å; Q15-W38 HydrophobicContact CG-CZ2 4.32Å
16	Q	85.2	Confident	87.3	Confident	65 Å²	65	79 Å²	79	30%	0.304	39%	0.388	S	S	.	.			trans	-64.4	128	-175.4	-67.1	-177.4	-13.5	0	0	111.3	A11 T14 R18	A11-Q16 HydrophobicContact CB-CB 4.33Å; A11-Q16 HydrophobicContact CB-CG 4.49Å; A11-Q16 PolarHBondContact O-N 2.9Å; T14-Q16 VanDerWaalsContact C-N 3.27Å; T14-Q16 PolarHBondContact O-N 3.39Å; T14-Q16 VanDerWaalsContact OG1-CG 3.23Å; T14-Q16 WeakPolarHBondContact OG1-CG 3.45Å; T14-Q16 PolarHBondContact OG1-NE2 2.98Å; Q16-R18 PolarHBondContact O-N 3.13Å
17	K	93.8	Very high	87.9	Confident	142 Å²	142	82.4 Å²	82.4	62%	0.617	39%	0.391	S	S	*	.	S	Bend	trans	-74.2	-15.7	172	-64.4	-174.1	179	179.4	0	113.1	Q15 V40 I41	Q15-K17 PolarHBondContact O-N 3.02Å; K17-V40 HydrophobicContact CB-CB 4.48Å; K17-V40 HydrophobicContact CB-CG2 4.27Å; K17-V40 HydrophobicContact CG-CG2 4.48Å; K17-V40 WeakPolarHBondContact O-CA 3.17Å; K17-V40 PolarHBondContact O-N 2.76Å; K17-I41 PolarHBondContact O-N 3.45Å
18	R	94.9	Very high	88.4	Confident	173 Å²	173	87.3 Å²	87.3	65%	0.653	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	126.1	-178.1	-56.8	-173	168.2	79.3	1.8	109.1	Q16 I41	Q16-R18 PolarHBondContact O-N 3.13Å; R18-I41 WeakPolarHBondContact CA-O 3.15Å; R18-I41 HydrophobicContact CB-CB 4.34Å; R18-I41 HydrophobicContact CG-CB 3.99Å; R18-I41 HydrophobicContact CG-CD1 4.09Å; R18-I41 HydrophobicContact CG-CG1 4.15Å
19	L	93.6	Very high	88.9	Confident	5 Å²	5	87.1 Å²	87.1	3%	0.026	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.3	175.6	178.7	58.4	0	0	0	108.5	I7 V8 A11 L21 L36 L39 I41 L42 D43	I7-L19 HydrophobicContact CG2-CD1 3.92Å; V8-L19 HydrophobicContact CG2-CD2 4.47Å; A11-L19 HydrophobicContact CB-CD1 4.01Å; L19-L21 HydrophobicContact CD1-CD2 4.09Å; L19-L21 HydrophobicContact CD1-CG 4.25Å; L19-L21 HydrophobicContact CD2-CD1 4.34Å; L19-L21 HydrophobicContact CG-CD1 4.48Å; L19-L21 HydrophobicContact CG-CG 4.16Å; L19-L36 HydrophobicContact CD2-CD1 3.95Å; L19-L39 HydrophobicContact CB-CD1 3.49Å; L19-L39 VanDerWaalsContact CB-CD1 3.49Å; L19-L39 HydrophobicContact CB-CD2 4.17Å; L19-L39 HydrophobicContact CB-CG 4.49Å; L19-L39 HydrophobicContact CD2-CD2 4.43Å; L19-I41 PolarHBondContact N-O 3.03Å; L19-L42 HydrophobicContact CB-CD1 4.16Å; L19-L42 HydrophobicContact CD2-CD1 4.15Å; L19-L42 HydrophobicContact CG-CD1 4.15Å; L19-L42 WeakPolarHBondContact O-CA 3.23Å; L19-D43 PolarHBondContact O-N 3.22Å
20	S	92.8	Very high	88.9	Confident	68 Å²	68	83.1 Å²	83.1	48%	0.476	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.4	177.4	179	0	0	0	0	109.5	I22	S20-I22 VanDerWaalsContact OG-CD1 3.29Å; S20-I22 WeakPolarHBondContact OG-CD1 3.08Å; S20-I22 WeakPolarHBondContact OG-CG1 3.38Å
21	L	93	Very high	88.7	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	40%	0.397	C	S	.	.			trans	-121.2	44.4	176.4	-57.1	175.8	0	0	0	110	I7 V8 L19 K24 L26 D43 L44 N47	I7-L21 HydrophobicContact CB-CD2 4.3Å; I7-L21 HydrophobicContact CD1-CD2 4.41Å; I7-L21 HydrophobicContact CG2-CD2 3.66Å; V8-L21 HydrophobicContact CG2-CD1 4.44Å; L19-L21 HydrophobicContact CD1-CD2 4.09Å; L19-L21 HydrophobicContact CD1-CG 4.25Å; L19-L21 HydrophobicContact CD2-CD1 4.34Å; L19-L21 HydrophobicContact CG-CD1 4.48Å; L19-L21 HydrophobicContact CG-CG 4.16Å; L21-K24 HydrophobicContact CB-CG 4.17Å; L21-K24 WeakPolarHBondContact O-CG 3.34Å; L21-L26 HydrophobicContact CB-CD1 3.89Å; L21-L26 HydrophobicContact CD1-CD1 4.14Å; L21-D43 PolarHBondContact N-O 3.08Å; L21-L44 HydrophobicContact CB-CD2 3.88Å; L21-L44 HydrophobicContact CD1-CD2 3.96Å; L21-L44 HydrophobicContact CG-CD2 4.29Å; L21-N47 PolarHBondContact O-ND2 2.78Å
22	I	94.4	Very high	88.7	Confident	56 Å²	56	86.7 Å²	86.7	29%	0.287	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	141.4	179.5	-55.6	166.4	0	0	0	110.1	S20 K24 D43 R45	S20-I22 VanDerWaalsContact OG-CD1 3.29Å; S20-I22 WeakPolarHBondContact OG-CD1 3.08Å; S20-I22 WeakPolarHBondContact OG-CG1 3.38Å; I22-K24 PolarHBondContact O-N 3.04Å; I22-D43 WeakPolarHBondContact CD1-OD2 3.18Å; I22-D43 HydrophobicContact CG1-CB 4.38Å; I22-R45 VanDerWaalsContact CA-O 3.26Å; I22-R45 WeakPolarHBondContact CA-O 3.33Å; I22-R45 HydrophobicContact CG1-CB 4.35Å; I22-R45 HydrophobicContact CG2-CB 4.33Å; I22-R45 WeakPolarHBondContact CG2-O 3.28Å
23	H	93.1	Very high	89.1	Confident	143 Å²	143	83.1 Å²	83.1	66%	0.662	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	45.9	172.5	-122.8	84.1	0	0	0	112.8	R45 S46	H23-R45 PolarHBondContact N-O 2.86Å; H23-S46 WeakPolarHBondContact CA-O 3.36Å; H23-S46 PolarHBondContact N-O 2.9Å; H23-S46 VanDerWaalsContact ND1-CB 3.34Å; H23-S46 WeakPolarHBondContact ND1-CB 3.18Å
24	K	92.9	Very high	89.4	Confident	81 Å²	81	80.9 Å²	80.9	35%	0.352	39%	0.386	S	S	.	.	S	Bend	trans	-109.1	8.3	-177.9	-65.4	-53.8	178.5	-165.6	0	113.5	L21 I22 L26 N47	L21-K24 HydrophobicContact CB-CG 4.17Å; L21-K24 WeakPolarHBondContact O-CG 3.34Å; I22-K24 PolarHBondContact O-N 3.04Å; K24-L26 HydrophobicContact CB-CD1 3.92Å; K24-L26 HydrophobicContact CB-CD2 4.24Å; K24-L26 HydrophobicContact CB-CG 3.65Å; K24-L26 PolarHBondContact O-N 2.8Å; K24-L26 VanDerWaalsContact O-N 3.13Å; K24-N47 WeakPolarHBondContact CA-OD1 3.4Å; K24-N47 WeakPolarHBondContact CB-OD1 2.89Å; K24-N47 PolarHBondContact N-OD1 3.48Å
25	E	92.8	Very high	89.5	Confident	146 Å²	146	83 Å²	83	68%	0.682	39%	0.388	S	S	*	.			trans	51.4	34.4	-177.6	-60.7	168.9	-151.7	0	0	111.6	Y27 N47	E25-Y27 VanDerWaalsContact O-CD2 3.27Å; E25-Y27 WeakPolarHBondContact O-CD2 3.01Å; E25-Y27 WeakPolarHBondContact O-CE2 3.13Å; E25-Y27 PolarHBondContact O-N 3.11Å; E25-N47 PolarHBondContact N-OD1 3.29Å; E25-N47 VanDerWaalsContact N-OD1 3.15Å
26	L	93.3	Very high	89.8	Confident	9 Å²	9	78.4 Å²	78.4	5%	0.047	37%	0.368	C	S	.	.			trans	-74.3	123.3	-176.2	-64.4	170.1	0	0	0	110.2	I4 L21 K24 L29 N47 N48 L49	I4-L26 HydrophobicContact CD1-CD2 3.28Å; I4-L26 HydrophobicContact CD1-CG 4.44Å; I4-L26 HydrophobicContact CG1-CD2 3.88Å; I4-L26 HydrophobicContact CG2-CD2 4.14Å; L21-L26 HydrophobicContact CB-CD1 3.89Å; L21-L26 HydrophobicContact CD1-CD1 4.14Å; K24-L26 HydrophobicContact CB-CD1 3.92Å; K24-L26 HydrophobicContact CB-CD2 4.24Å; K24-L26 HydrophobicContact CB-CG 3.65Å; K24-L26 PolarHBondContact O-N 2.8Å; K24-L26 VanDerWaalsContact O-N 3.13Å; L26-L29 HydrophobicContact CD1-CD2 4.17Å; L26-N47 HydrophobicContact CB-CB 4.01Å; L26-N47 WeakPolarHBondContact CB-OD1 3.33Å; L26-N47 WeakPolarHBondContact CG-OD1 3.15Å; L26-N47 PolarHBondContact N-OD1 3.26Å; L26-N48 CarbonylContact O-C 3.1Å; L26-N48 VanDerWaalsContact O-CA 3.25Å; L26-N48 WeakPolarHBondContact O-CA 3.46Å; L26-N48 PolarHBondContact O-N 3.3Å; L26-L49 HydrophobicContact CB-CD2 4.03Å; L26-L49 HydrophobicContact CB-CG 4.41Å; L26-L49 PolarHBondContact O-N 2.91Å
27	Y	94.6	Very high	89.8	Confident	142 Å²	142	79.4 Å²	79.4	56%	0.557	38%	0.375	S	S	*	.	S	Bend	trans	-90.9	-26.5	166.7	-64.2	-90.6	0	0	0	111.6	E25 N48	E25-Y27 VanDerWaalsContact O-CD2 3.27Å; E25-Y27 WeakPolarHBondContact O-CD2 3.01Å; E25-Y27 WeakPolarHBondContact O-CE2 3.13Å; E25-Y27 PolarHBondContact O-N 3.11Å; Y27-N48 HydrophobicContact CD1-CB 3.61Å; Y27-N48 HydrophobicContact CD2-CB 4.45Å; Y27-N48 HydrophobicContact CE1-CB 3.52Å; Y27-N48 HydrophobicContact CE2-CB 4.38Å; Y27-N48 HydrophobicContact CG-CB 4.1Å; Y27-N48 VanDerWaalsContact CZ-ND2 3.26Å; Y27-N48 PolarHBondContact OH-ND2 2.97Å
28	H	91.8	Very high	89.7	Confident	144 Å²	144	78.8 Å²	78.8	67%	0.667	37%	0.369	S	S	*	.	S	Bend	trans	-141.6	153.4	175.7	-51.8	-64.3	0	0	0	109.7
29	L	89.3	Confident	89.6	Confident	8 Å²	8	70.7 Å²	70.7	4%	0.042	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-77.6	149.5	166.3	-65.7	-176.2	0	0	0	110.4	L26 I33 L44 L49 L52 P53 L55	L26-L29 HydrophobicContact CD1-CD2 4.17Å; L29-I33 HydrophobicContact CD1-CD1 3.8Å; L29-I33 HydrophobicContact CD1-CG2 4.42Å; L29-L44 HydrophobicContact CD1-CD1 3.66Å; L29-L44 HydrophobicContact CD2-CD1 3.8Å; L29-L44 HydrophobicContact CD2-CD2 3.52Å; L29-L44 HydrophobicContact CD2-CG 4.26Å; L29-L44 HydrophobicContact CG-CD1 4.22Å; L29-L49 HydrophobicContact CD2-CD1 4.31Å; L29-L49 HydrophobicContact CD2-CD2 4.47Å; L29-L49 HydrophobicContact CG-CD2 4.48Å; L29-L52 HydrophobicContact CD1-CD2 3.6Å; L29-L52 HydrophobicContact CG-CD2 3.99Å; L29-P53 HydrophobicContact CB-CG 3.97Å; L29-P53 HydrophobicContact CD1-CG 4.39Å; L29-L55 HydrophobicContact CD1-CD2 3.96Å
30	P	80.5	Confident	89.8	Confident	21 Å²	21	72.1 Å²	72.1	14%	0.136	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-61.1	145.5	173	24.1	-30.2	0	0	0	110.5	I4 V8	I4-P30 HydrophobicContact CG2-CG 4.14Å; V8-P30 HydrophobicContact CB-CG 4.44Å; V8-P30 HydrophobicContact CG1-CG 4.49Å; V8-P30 HydrophobicContact CG2-CG 3.69Å
31	N	77.2	Confident	90	Very high	139 Å²	139	71.1 Å²	71.1	74%	0.743	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	158.8	174.8	-65.1	-13.4	0	0	0	110.8	I33	N31-I33 PolarHBondContact O-N 2.76Å
32	N	81.9	Confident	90.1	Very high	107 Å²	107	71.1 Å²	71.1	57%	0.572	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	7.7	175	-57.7	-21.2	0	0	0	115	E34 F35	N32-E34 PolarHBondContact O-N 2.81Å; N32-E34 VanDerWaalsContact O-N 3.17Å; N32-F35 HydrophobicContact CB-CD2 3.7Å; N32-F35 HydrophobicContact CB-CE2 4.03Å; N32-F35 PolarHBondContact O-N 2.95Å; N32-F35 VanDerWaalsContact O-N 3.09Å
33	I	87.2	Confident	90.3	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.01	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-58	-29.2	174.8	-159.3	176.8	0	0	0	111.8	L29 N31 F35 L36 L42 P53 L55 P56	L29-I33 HydrophobicContact CD1-CD1 3.8Å; L29-I33 HydrophobicContact CD1-CG2 4.42Å; N31-I33 PolarHBondContact O-N 2.76Å; I33-F35 PolarHBondContact O-N 2.81Å; I33-F35 VanDerWaalsContact O-N 3.15Å; I33-L36 HydrophobicContact CG1-CD1 3.68Å; I33-L36 HydrophobicContact CG1-CG 4.3Å; I33-L36 WeakPolarHBondContact O-CB 3.08Å; I33-L36 VanDerWaalsContact O-CG 3.3Å; I33-L36 WeakPolarHBondContact O-CG 3.32Å; I33-L36 PolarHBondContact O-N 3.13Å; I33-L36 VanDerWaalsContact O-N 3.1Å; I33-L42 HydrophobicContact CD1-CD1 4.47Å; I33-L42 HydrophobicContact CD1-CD2 4.02Å; I33-P53 HydrophobicContact CG2-CG 4.02Å; I33-L55 HydrophobicContact CG2-CD2 4.37Å; I33-P56 WeakPolarHBondContact O-CD 3.33Å; I33-P56 WeakPolarHBondContact O-CG 3.49Å
34	E	87.6	Confident	90.5	Very high	64 Å²	64	62.8 Å²	62.8	30%	0.299	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-55.7	-26.8	175.8	64.3	-175.9	-179.5	0	0	114.3	N32 L36 I54	N32-E34 PolarHBondContact O-N 2.81Å; N32-E34 VanDerWaalsContact O-N 3.17Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 2.93Å; E34-I54 HydrophobicContact CB-CB 4.2Å; E34-I54 HydrophobicContact CB-CG2 3.93Å; E34-I54 WeakPolarHBondContact CB-O 3.39Å; E34-I54 VanDerWaalsContact OE2-CB 3.26Å; E34-I54 WeakPolarHBondContact OE2-CB 3.07Å; E34-I54 WeakPolarHBondContact OE2-CG2 3.16Å
35	F	87.1	Confident	90.7	Very high	123 Å²	123	62.6 Å²	62.6	54%	0.539	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-85.1	-0.3	-179	-55.9	-59.4	0	0	0	113.8	N32 I33 N37	N32-F35 HydrophobicContact CB-CD2 3.7Å; N32-F35 HydrophobicContact CB-CE2 4.03Å; N32-F35 PolarHBondContact O-N 2.95Å; N32-F35 VanDerWaalsContact O-N 3.09Å; I33-F35 PolarHBondContact O-N 2.81Å; I33-F35 VanDerWaalsContact O-N 3.15Å; F35-N37 PolarHBondContact O-N 3.49Å
36	L	87.9	Confident	91	Very high	9 Å²	9	57.3 Å²	57.3	5%	0.047	27%	0.273	C	S	.	.			trans	-74.2	61.4	174.2	-55.7	-175.7	0	0	0	111	I12 L19 I33 E34 W38 L39 P56	I12-L36 HydrophobicContact CB-CD2 4.42Å; I12-L36 HydrophobicContact CD1-CD2 4.07Å; I12-L36 HydrophobicContact CG1-CD2 3.24Å; L19-L36 HydrophobicContact CD2-CD1 3.95Å; I33-L36 HydrophobicContact CG1-CD1 3.68Å; I33-L36 HydrophobicContact CG1-CG 4.3Å; I33-L36 WeakPolarHBondContact O-CB 3.08Å; I33-L36 VanDerWaalsContact O-CG 3.3Å; I33-L36 WeakPolarHBondContact O-CG 3.32Å; I33-L36 PolarHBondContact O-N 3.13Å; I33-L36 VanDerWaalsContact O-N 3.1Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 2.93Å; L36-W38 PolarHBondContact O-N 3.2Å; L36-L39 HydrophobicContact CB-CB 3.96Å; L36-L39 HydrophobicContact CB-CD2 4.38Å; L36-L39 HydrophobicContact CD1-CD2 4.16Å; L36-L39 WeakPolarHBondContact O-CB 3.26Å; L36-L39 PolarHBondContact O-N 3.23Å; L36-P56 HydrophobicContact CB-CG 3.92Å; L36-P56 WeakPolarHBondContact O-CB 3.13Å
37	N	86.9	Confident	91.1	Very high	86 Å²	86	57 Å²	57	46%	0.46	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-20	-172.4	-68.2	-31.6	0	0	0	114.2	F35 L39 N58	F35-N37 PolarHBondContact O-N 3.49Å; N37-L39 VanDerWaalsContact C-N 3.33Å; N37-N58 PolarHBondContact O-ND2 2.65Å
38	W	90.5	Very high	91.3	Very high	129 Å²	129	52.4 Å²	52.4	49%	0.489	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.4	176.5	-25.2	92.6	0	0	0	112.8	Q15 L36 V40	Q15-W38 HydrophobicContact CB-CB 4.35Å; Q15-W38 HydrophobicContact CB-CD2 4.14Å; Q15-W38 HydrophobicContact CB-CG 3.95Å; Q15-W38 HydrophobicContact CG-CD2 3.97Å; Q15-W38 HydrophobicContact CG-CG 4.18Å; Q15-W38 HydrophobicContact CG-CZ2 4.32Å; L36-W38 PolarHBondContact O-N 3.2Å; W38-V40 PolarHBondContact O-N 3.37Å
39	L	94	Very high	91.6	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	23%	0.225	C	C	.	.			trans	-74	124.3	-171.4	-167.8	66.3	0	0	0	110.6	L19 L36 N37 I41 L42 P56 N58 L59	L19-L39 HydrophobicContact CB-CD1 3.49Å; L19-L39 VanDerWaalsContact CB-CD1 3.49Å; L19-L39 HydrophobicContact CB-CD2 4.17Å; L19-L39 HydrophobicContact CB-CG 4.49Å; L19-L39 HydrophobicContact CD2-CD2 4.43Å; L36-L39 HydrophobicContact CB-CB 3.96Å; L36-L39 HydrophobicContact CB-CD2 4.38Å; L36-L39 HydrophobicContact CD1-CD2 4.16Å; L36-L39 WeakPolarHBondContact O-CB 3.26Å; L36-L39 PolarHBondContact O-N 3.23Å; N37-L39 VanDerWaalsContact C-N 3.33Å; L39-I41 WeakPolarHBondContact CD1-O 2.91Å; L39-L42 HydrophobicContact CD2-CB 4.05Å; L39-L42 HydrophobicContact CD2-CD1 4.19Å; L39-L42 HydrophobicContact CD2-CD2 4.35Å; L39-L42 HydrophobicContact CD2-CG 4.43Å; L39-P56 HydrophobicContact CB-CG 4.4Å; L39-P56 HydrophobicContact CD2-CG 4.27Å; L39-N58 CarbonylContact O-C 3.58Å; L39-L59 HydrophobicContact CB-CD2 4.38Å; L39-L59 HydrophobicContact CD2-CD2 4Å; L39-L59 HydrophobicContact CG-CD2 3.83Å
40	V	96.3	Very high	91.9	Very high	35 Å²	35	48.4 Å²	48.4	21%	0.212	25%	0.245	C	C	.	.			trans	-110.3	-34.6	-179	179.2	0	0	0	0	110.8	K17 W38 Q60 S61	K17-V40 HydrophobicContact CB-CB 4.48Å; K17-V40 HydrophobicContact CB-CG2 4.27Å; K17-V40 HydrophobicContact CG-CG2 4.48Å; K17-V40 WeakPolarHBondContact O-CA 3.17Å; K17-V40 PolarHBondContact O-N 2.76Å; W38-V40 PolarHBondContact O-N 3.37Å; V40-Q60 HydrophobicContact CG1-CB 3.8Å; V40-Q60 HydrophobicContact CG1-CG 3.84Å; V40-Q60 PolarHBondContact O-N 2.9Å; V40-S61 PolarHBondContact O-N 2.72Å
41	I	97.4	Very high	92.6	Very high	48 Å²	48	52.1 Å²	52.1	25%	0.246	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.9	-179.2	-51.4	-170.6	0	0	0	109.5	K17 R18 L19 L39 S61	K17-I41 PolarHBondContact O-N 3.45Å; R18-I41 WeakPolarHBondContact CA-O 3.15Å; R18-I41 HydrophobicContact CB-CB 4.34Å; R18-I41 HydrophobicContact CG-CB 3.99Å; R18-I41 HydrophobicContact CG-CD1 4.09Å; R18-I41 HydrophobicContact CG-CG1 4.15Å; L19-I41 PolarHBondContact N-O 3.03Å; L39-I41 WeakPolarHBondContact CD1-O 2.91Å; I41-S61 WeakPolarHBondContact CA-O 3.27Å
42	L	96.5	Very high	93.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.9	175.1	179.3	55.3	0	0	0	109.7	L19 I33 L39 L44 L55 L59 S61 L62 N63	L19-L42 HydrophobicContact CB-CD1 4.16Å; L19-L42 HydrophobicContact CD2-CD1 4.15Å; L19-L42 HydrophobicContact CG-CD1 4.15Å; L19-L42 WeakPolarHBondContact O-CA 3.23Å; I33-L42 HydrophobicContact CD1-CD1 4.47Å; I33-L42 HydrophobicContact CD1-CD2 4.02Å; L39-L42 HydrophobicContact CD2-CB 4.05Å; L39-L42 HydrophobicContact CD2-CD1 4.19Å; L39-L42 HydrophobicContact CD2-CD2 4.35Å; L39-L42 HydrophobicContact CD2-CG 4.43Å; L42-L44 HydrophobicContact CD1-CD1 4.37Å; L42-L44 HydrophobicContact CD1-CD2 3.74Å; L42-L44 HydrophobicContact CD1-CG 3.94Å; L42-L44 HydrophobicContact CD2-CD1 3.93Å; L42-L44 HydrophobicContact CD2-CG 4.36Å; L42-L44 HydrophobicContact CG-CD1 3.96Å; L42-L44 HydrophobicContact CG-CD2 4.23Å; L42-L44 HydrophobicContact CG-CG 3.86Å; L42-L55 HydrophobicContact CD2-CD2 4.03Å; L42-L59 HydrophobicContact CB-CD1 4.24Å; L42-L59 HydrophobicContact CB-CD2 3.71Å; L42-L59 HydrophobicContact CD2-CD1 4.14Å; L42-S61 PolarHBondContact N-O 2.89Å; L42-L62 HydrophobicContact CB-CD1 3.94Å; L42-L62 HydrophobicContact CD2-CD1 3.97Å; L42-L62 HydrophobicContact CG-CD1 3.94Å; L42-L62 WeakPolarHBondContact O-CA 3.29Å; L42-N63 PolarHBondContact O-N 3.13Å
43	D	97	Very high	93.9	Very high	23 Å²	23	43.5 Å²	43.5	12%	0.123	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	113.7	177.9	-165.6	-17.6	0	0	0	109.9	L19 L21 I22 R45	L19-D43 PolarHBondContact O-N 3.22Å; L21-D43 PolarHBondContact N-O 3.08Å; I22-D43 WeakPolarHBondContact CD1-OD2 3.18Å; I22-D43 HydrophobicContact CG1-CB 4.38Å; D43-R45 WeakPolarHBondContact OD1-CB 3.28Å; D43-R45 VanDerWaalsContact OD1-CG 3.24Å; D43-R45 WeakPolarHBondContact OD1-CG 3.33Å; D43-R45 IonicContact OD1-CZ 3.88Å; D43-R45 PolarHBondContact OD1-N 3.43Å; D43-R45 VanDerWaalsContact OD1-N 3.17Å; D43-R45 IonicContact OD1-NE 2.93Å; D43-R45 PolarHBondContact OD1-NE 2.83Å; D43-R45 IonicContact OD1-NH2 3.96Å; D43-R45 IonicContact OD2-CZ 3.27Å; D43-R45 VanDerWaalsContact OD2-CZ 3.27Å; D43-R45 IonicContact OD2-NE 3.07Å; D43-R45 PolarHBondContact OD2-NE 3.4Å; D43-R45 VanDerWaalsContact OD2-NE 3.07Å; D43-R45 IonicContact OD2-NH2 2.68Å; D43-R45 PolarHBondContact OD2-NH2 2.94Å
44	L	97.3	Very high	94.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.243	C	C	.	.			trans	-121	21.8	-176.7	-59.2	172	0	0	0	111.1	L21 L29 L42 N47 L49 L52 N63 L64 N67	L21-L44 HydrophobicContact CB-CD2 3.88Å; L21-L44 HydrophobicContact CD1-CD2 3.96Å; L21-L44 HydrophobicContact CG-CD2 4.29Å; L29-L44 HydrophobicContact CD1-CD1 3.66Å; L29-L44 HydrophobicContact CD2-CD1 3.8Å; L29-L44 HydrophobicContact CD2-CD2 3.52Å; L29-L44 HydrophobicContact CD2-CG 4.26Å; L29-L44 HydrophobicContact CG-CD1 4.22Å; L42-L44 HydrophobicContact CD1-CD1 4.37Å; L42-L44 HydrophobicContact CD1-CD2 3.74Å; L42-L44 HydrophobicContact CD1-CG 3.94Å; L42-L44 HydrophobicContact CD2-CD1 3.93Å; L42-L44 HydrophobicContact CD2-CG 4.36Å; L42-L44 HydrophobicContact CG-CD1 3.96Å; L42-L44 HydrophobicContact CG-CD2 4.23Å; L42-L44 HydrophobicContact CG-CG 3.86Å; L44-N47 PolarHBondContact O-ND2 3.08Å; L44-L49 HydrophobicContact CB-CD1 3.9Å; L44-L49 HydrophobicContact CD1-CD1 4.09Å; L44-L49 HydrophobicContact CG-CD1 4.48Å; L44-L52 HydrophobicContact CD1-CD2 4.12Å; L44-N63 WeakPolarHBondContact CA-O 3Å; L44-N63 PolarHBondContact N-O 2.74Å; L44-L64 HydrophobicContact CB-CD2 4.06Å; L44-L64 HydrophobicContact CD1-CD2 3.71Å; L44-L64 HydrophobicContact CG-CD2 4.4Å; L44-N67 PolarHBondContact O-ND2 3.32Å
45	R	97.9	Very high	94.5	Very high	78 Å²	78	45 Å²	45	29%	0.294	23%	0.23	S	C	.	.			trans	-59.9	152.2	-177.1	-76.1	179.6	-74	168.1	4.7	113.1	I22 H23 D43 N47 N63 G65 Y88	I22-R45 VanDerWaalsContact CA-O 3.26Å; I22-R45 WeakPolarHBondContact CA-O 3.33Å; I22-R45 HydrophobicContact CG1-CB 4.35Å; I22-R45 HydrophobicContact CG2-CB 4.33Å; I22-R45 WeakPolarHBondContact CG2-O 3.28Å; H23-R45 PolarHBondContact N-O 2.86Å; D43-R45 WeakPolarHBondContact OD1-CB 3.28Å; D43-R45 VanDerWaalsContact OD1-CG 3.24Å; D43-R45 WeakPolarHBondContact OD1-CG 3.33Å; D43-R45 IonicContact OD1-CZ 3.88Å; D43-R45 PolarHBondContact OD1-N 3.43Å; D43-R45 VanDerWaalsContact OD1-N 3.17Å; D43-R45 IonicContact OD1-NE 2.93Å; D43-R45 PolarHBondContact OD1-NE 2.83Å; D43-R45 IonicContact OD1-NH2 3.96Å; D43-R45 IonicContact OD2-CZ 3.27Å; D43-R45 VanDerWaalsContact OD2-CZ 3.27Å; D43-R45 IonicContact OD2-NE 3.07Å; D43-R45 PolarHBondContact OD2-NE 3.4Å; D43-R45 VanDerWaalsContact OD2-NE 3.07Å; D43-R45 IonicContact OD2-NH2 2.68Å; D43-R45 PolarHBondContact OD2-NH2 2.94Å; R45-N47 PolarHBondContact O-ND2 2.95Å; R45-N63 WeakPolarHBondContact CD-ND2 3.4Å; R45-N63 WeakPolarHBondContact CD-OD1 3.14Å; R45-N63 HydrophobicContact CG-CB 4.07Å; R45-N63 WeakPolarHBondContact CG-OD1 3.43Å; R45-N63 PolarHBondContact NE-ND2 2.62Å; R45-G65 CarbonylContact C-O 3.47Å; R45-G65 WeakPolarHBondContact CA-O 3.48Å; R45-Y88 VanDerWaalsContact CD-OH 3.22Å; R45-Y88 WeakPolarHBondContact CD-OH 3.21Å
46	S	97.9	Very high	94.7	Very high	34 Å²	34	39.1 Å²	39.1	24%	0.238	20%	0.204	C	C	.	.	S	Bend	trans	56.8	55.3	173.6	-60.5	0	0	0	0	111.7	H23 G65 N66	H23-S46 WeakPolarHBondContact CA-O 3.36Å; H23-S46 PolarHBondContact N-O 2.9Å; H23-S46 VanDerWaalsContact ND1-CB 3.34Å; H23-S46 WeakPolarHBondContact ND1-CB 3.18Å; S46-G65 PolarHBondContact N-O 2.72Å; S46-N66 WeakPolarHBondContact CA-O 3.41Å; S46-N66 PolarHBondContact N-O 3.14Å; S46-N66 VanDerWaalsContact N-O 3.16Å; S46-N66 PolarHBondContact OG-ND2 3.38Å
47	N	97.2	Very high	94.8	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	23%	0.233	C	C	.	.	S	Bend	trans	-125.8	-172.5	171.3	-77	-68.3	0	0	0	109.2	L21 K24 E25 L26 L44 R45 L49 N66 N67	L21-N47 PolarHBondContact O-ND2 2.78Å; K24-N47 WeakPolarHBondContact CA-OD1 3.4Å; K24-N47 WeakPolarHBondContact CB-OD1 2.89Å; K24-N47 PolarHBondContact N-OD1 3.48Å; E25-N47 PolarHBondContact N-OD1 3.29Å; E25-N47 VanDerWaalsContact N-OD1 3.15Å; L26-N47 HydrophobicContact CB-CB 4.01Å; L26-N47 WeakPolarHBondContact CB-OD1 3.33Å; L26-N47 WeakPolarHBondContact CG-OD1 3.15Å; L26-N47 PolarHBondContact N-OD1 3.26Å; L44-N47 PolarHBondContact O-ND2 3.08Å; R45-N47 PolarHBondContact O-ND2 2.95Å; N47-L49 HydrophobicContact CB-CD1 4.26Å; N47-L49 HydrophobicContact CB-CG 4.03Å; N47-N66 PolarHBondContact N-O 3.47Å; N47-N67 WeakPolarHBondContact CA-OD1 3.27Å; N47-N67 VanDerWaalsContact CB-OD1 3.23Å; N47-N67 WeakPolarHBondContact CB-OD1 3.3Å; N47-N67 PolarHBondContact N-OD1 3.23Å; N47-N67 PolarHBondContact O-OD1 3.05Å; N47-N67 VanDerWaalsContact O-OD1 3.09Å
48	N	97.6	Very high	95.1	Very high	44 Å²	44	45.6 Å²	45.6	24%	0.235	23%	0.232	C	C	.	.			trans	-108.2	32	178.4	-61.2	-27.9	0	0	0	111.4	L26 Y27 W68	L26-N48 CarbonylContact O-C 3.1Å; L26-N48 VanDerWaalsContact O-CA 3.25Å; L26-N48 WeakPolarHBondContact O-CA 3.46Å; L26-N48 PolarHBondContact O-N 3.3Å; Y27-N48 HydrophobicContact CD1-CB 3.61Å; Y27-N48 HydrophobicContact CD2-CB 4.45Å; Y27-N48 HydrophobicContact CE1-CB 3.52Å; Y27-N48 HydrophobicContact CE2-CB 4.38Å; Y27-N48 HydrophobicContact CG-CB 4.1Å; Y27-N48 VanDerWaalsContact CZ-ND2 3.26Å; Y27-N48 PolarHBondContact OH-ND2 2.97Å; N48-W68 PolarHBondContact OD1-NE1 2.85Å
49	L	97.7	Very high	95.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.			trans	-77.3	133.5	-176.4	-59.9	168.2	0	0	0	110.1	L26 L29 L44 N47 L52 N67 W68 F69	L26-L49 HydrophobicContact CB-CD2 4.03Å; L26-L49 HydrophobicContact CB-CG 4.41Å; L26-L49 PolarHBondContact O-N 2.91Å; L29-L49 HydrophobicContact CD2-CD1 4.31Å; L29-L49 HydrophobicContact CD2-CD2 4.47Å; L29-L49 HydrophobicContact CG-CD2 4.48Å; L44-L49 HydrophobicContact CB-CD1 3.9Å; L44-L49 HydrophobicContact CD1-CD1 4.09Å; L44-L49 HydrophobicContact CG-CD1 4.48Å; N47-L49 HydrophobicContact CB-CD1 4.26Å; N47-L49 HydrophobicContact CB-CG 4.03Å; L49-L52 HydrophobicContact CD1-CD2 4.11Å; L49-N67 HydrophobicContact CB-CB 4.45Å; L49-N67 VanDerWaalsContact CB-OD1 3.32Å; L49-N67 WeakPolarHBondContact CB-OD1 3.31Å; L49-N67 PolarHBondContact N-OD1 3.25Å; L49-N67 WeakPolarHBondContact O-CB 3.45Å; L49-W68 CarbonylContact O-C 3.59Å; L49-W68 WeakPolarHBondContact O-CA 3.4Å; L49-W68 PolarHBondContact O-N 3.2Å; L49-F69 HydrophobicContact CB-CE2 3.82Å; L49-F69 HydrophobicContact CB-CZ 3.62Å
50	S	96.9	Very high	95.4	Very high	68 Å²	68	43.2 Å²	43.2	48%	0.476	23%	0.226	S	C	.	.	S	Bend	trans	-120.4	-11.7	171.6	55.9	0	0	0	0	113.1	F69	S50-F69 VanDerWaalsContact C-CD1 3.47Å; S50-F69 VanDerWaalsContact C-CE1 3.47Å; S50-F69 VanDerWaalsContact O-CD1 3.27Å; S50-F69 WeakPolarHBondContact O-CD1 3.32Å
51	D	95.2	Very high	95.5	Very high	99 Å²	99	42.9 Å²	42.9	53%	0.529	23%	0.226	S	C	.	.			trans	-149.6	168.4	173.4	-164.1	13.5	0	0	0	110.5
52	L	93.9	Very high	95.5	Very high	9 Å²	9	40.6 Å²	40.6	5%	0.047	21%	0.214	C	C	.	.			trans	-135.5	135.6	-179.8	-68.2	174.5	0	0	0	111.9	L29 L44 L49 L55 L64 F69 P73 S75 V76	L29-L52 HydrophobicContact CD1-CD2 3.6Å; L29-L52 HydrophobicContact CG-CD2 3.99Å; L44-L52 HydrophobicContact CD1-CD2 4.12Å; L49-L52 HydrophobicContact CD1-CD2 4.11Å; L52-L55 HydrophobicContact CD1-CD1 4.08Å; L52-L64 HydrophobicContact CD1-CD1 3.55Å; L52-L64 HydrophobicContact CD1-CD2 3.64Å; L52-L64 HydrophobicContact CD1-CG 4.24Å; L52-L64 HydrophobicContact CD2-CD2 4.4Å; L52-F69 HydrophobicContact CD1-CE1 4.28Å; L52-F69 HydrophobicContact CD1-CZ 3.96Å; L52-F69 HydrophobicContact CD2-CZ 4.01Å; L52-F69 HydrophobicContact CG-CE1 3.86Å; L52-F69 HydrophobicContact CG-CZ 3.66Å; L52-P73 HydrophobicContact CB-CB 4.32Å; L52-P73 HydrophobicContact CB-CG 4.42Å; L52-P73 HydrophobicContact CD1-CG 4.32Å; L52-P73 HydrophobicContact CG-CG 4.33Å; L52-S75 WeakPolarHBondContact CB-OG 3.33Å; L52-S75 PolarHBondContact O-OG 3.23Å; L52-V76 HydrophobicContact CD1-CG2 4.02Å
53	P	93	Very high	95.6	Very high	56 Å²	56	41.9 Å²	41.9	36%	0.364	22%	0.221	S	C	.	.			trans	-64.8	176.9	167.3	33.1	-37	0	0	0	110.4	L29 I33 L55 S75	L29-P53 HydrophobicContact CB-CG 3.97Å; L29-P53 HydrophobicContact CD1-CG 4.39Å; I33-P53 HydrophobicContact CG2-CG 4.02Å; P53-L55 PolarHBondContact O-N 3.04Å; P53-S75 WeakPolarHBondContact O-CB 3.25Å; P53-S75 PolarHBondContact O-OG 3.4Å
54	I	91.9	Very high	95.7	Very high	92 Å²	92	40.8 Å²	40.8	47%	0.472	22%	0.215	S	C	.	.			trans	-54	134.1	171.5	-60.5	172.5	0	0	0	109.3	E34	E34-I54 HydrophobicContact CB-CB 4.2Å; E34-I54 HydrophobicContact CB-CG2 3.93Å; E34-I54 WeakPolarHBondContact CB-O 3.39Å; E34-I54 VanDerWaalsContact OE2-CB 3.26Å; E34-I54 WeakPolarHBondContact OE2-CB 3.07Å; E34-I54 WeakPolarHBondContact OE2-CG2 3.16Å
55	L	93.5	Very high	95.8	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.026	22%	0.215	C	C	.	.			trans	-105.5	157.6	-177.8	-66.1	178.2	0	0	0	110.9	L29 I33 L42 L52 P53 K57 L59 L62 V76 L79	L29-L55 HydrophobicContact CD1-CD2 3.96Å; I33-L55 HydrophobicContact CG2-CD2 4.37Å; L42-L55 HydrophobicContact CD2-CD2 4.03Å; L52-L55 HydrophobicContact CD1-CD1 4.08Å; P53-L55 PolarHBondContact O-N 3.04Å; L55-K57 PolarHBondContact O-N 3.44Å; L55-L59 HydrophobicContact CB-CD1 4.03Å; L55-L59 HydrophobicContact CD1-CD1 4.36Å; L55-L62 HydrophobicContact CD1-CD1 4.43Å; L55-L62 HydrophobicContact CD1-CD2 3.71Å; L55-V76 HydrophobicContact CD1-CG2 4.49Å; L55-L79 HydrophobicContact CB-CD2 3.93Å; L55-L79 HydrophobicContact CD1-CD1 3.95Å
56	P	92.3	Very high	95.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.213	C	C	.	.			trans	-56.1	128.5	175	-26	33.3	0	0	0	113.1	I33 L36 L39 N58 L59 L79	I33-P56 WeakPolarHBondContact O-CD 3.33Å; I33-P56 WeakPolarHBondContact O-CG 3.49Å; L36-P56 HydrophobicContact CB-CG 3.92Å; L36-P56 WeakPolarHBondContact O-CB 3.13Å; L39-P56 HydrophobicContact CB-CG 4.4Å; L39-P56 HydrophobicContact CD2-CG 4.27Å; P56-N58 PolarHBondContact O-N 3.38Å; P56-N58 VanDerWaalsContact O-N 3.11Å; P56-L59 HydrophobicContact CB-CG 4.25Å; P56-L59 WeakPolarHBondContact O-CG 3.42Å; P56-L59 PolarHBondContact O-N 3.23Å; P56-L79 VanDerWaalsContact O-CD2 3.31Å; P56-L79 WeakPolarHBondContact O-CD2 3.49Å
57	K	90.5	Very high	95.8	Very high	151 Å²	151	38.1 Å²	38.1	66%	0.657	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.8	-175.2	-63.2	-177.3	-175.5	-179.6	0	114.5	L55	L55-K57 PolarHBondContact O-N 3.44Å
58	N	92.8	Very high	95.9	Very high	80 Å²	80	44.6 Å²	44.6	43%	0.428	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	2	-176.7	-68	-28.6	0	0	0	114.1	N37 L39 P56 Q60	N37-N58 PolarHBondContact O-ND2 2.65Å; L39-N58 CarbonylContact O-C 3.58Å; P56-N58 PolarHBondContact O-N 3.38Å; P56-N58 VanDerWaalsContact O-N 3.11Å; N58-Q60 PolarHBondContact O-N 2.91Å
59	L	94.9	Very high	95.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.			trans	-57.5	132	176	-76.5	175.4	0	0	0	111.1	L39 L42 L55 P56 L79 S81 L82	L39-L59 HydrophobicContact CB-CD2 4.38Å; L39-L59 HydrophobicContact CD2-CD2 4Å; L39-L59 HydrophobicContact CG-CD2 3.83Å; L42-L59 HydrophobicContact CB-CD1 4.24Å; L42-L59 HydrophobicContact CB-CD2 3.71Å; L42-L59 HydrophobicContact CD2-CD1 4.14Å; L55-L59 HydrophobicContact CB-CD1 4.03Å; L55-L59 HydrophobicContact CD1-CD1 4.36Å; P56-L59 HydrophobicContact CB-CG 4.25Å; P56-L59 WeakPolarHBondContact O-CG 3.42Å; P56-L59 PolarHBondContact O-N 3.23Å; L59-L79 HydrophobicContact CB-CD1 4.37Å; L59-L79 HydrophobicContact CB-CD2 4.29Å; L59-L79 HydrophobicContact CD1-CD1 4.15Å; L59-L79 HydrophobicContact CD1-CD2 4.28Å; L59-S81 CarbonylContact O-C 3.5Å; L59-L82 HydrophobicContact CB-CD1 4.34Å; L59-L82 WeakPolarHBondContact O-CA 3.3Å; L59-L82 PolarHBondContact O-N 3.1Å
60	Q	96.4	Very high	95.9	Very high	81 Å²	81	45.5 Å²	45.5	38%	0.379	24%	0.235	S	C	.	.	S	Bend	trans	-112.2	-24.7	174.9	-62	-177.6	26.4	0	0	111.8	V40 N58 K83 S84	V40-Q60 HydrophobicContact CG1-CB 3.8Å; V40-Q60 HydrophobicContact CG1-CG 3.84Å; V40-Q60 PolarHBondContact O-N 2.9Å; N58-Q60 PolarHBondContact O-N 2.91Å; Q60-K83 PolarHBondContact O-N 3.22Å; Q60-S84 PolarHBondContact O-N 3Å
61	S	97.9	Very high	95.8	Very high	29 Å²	29	46.2 Å²	46.2	20%	0.203	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	126.7	175.6	-174.8	0	0	0	0	111	V40 I41 L42 S84	V40-S61 PolarHBondContact O-N 2.72Å; I41-S61 WeakPolarHBondContact CA-O 3.27Å; L42-S61 PolarHBondContact N-O 2.89Å; S61-S84 WeakPolarHBondContact CA-O 3.32Å
62	L	97.8	Very high	95.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	125.1	178.8	179.5	62	0	0	0	109.7	L42 L55 L64 V76 L79 L82 S84 L85 S86	L42-L62 HydrophobicContact CB-CD1 3.94Å; L42-L62 HydrophobicContact CD2-CD1 3.97Å; L42-L62 HydrophobicContact CG-CD1 3.94Å; L42-L62 WeakPolarHBondContact O-CA 3.29Å; L55-L62 HydrophobicContact CD1-CD1 4.43Å; L55-L62 HydrophobicContact CD1-CD2 3.71Å; L62-L64 HydrophobicContact CD1-CD2 3.93Å; L62-L64 HydrophobicContact CD1-CG 4.27Å; L62-L64 HydrophobicContact CD2-CD1 3.99Å; L62-L64 HydrophobicContact CD2-CD2 4.46Å; L62-L64 HydrophobicContact CD2-CG 4.21Å; L62-L64 HydrophobicContact CG-CD1 4.3Å; L62-L64 HydrophobicContact CG-CD2 4.18Å; L62-L64 HydrophobicContact CG-CG 3.96Å; L62-V76 HydrophobicContact CD2-CG1 4.29Å; L62-V76 HydrophobicContact CD2-CG2 3.9Å; L62-L79 HydrophobicContact CD2-CD1 3.84Å; L62-L82 HydrophobicContact CB-CD1 3.83Å; L62-S84 PolarHBondContact N-O 3.08Å; L62-L85 HydrophobicContact CB-CD1 4.2Å; L62-L85 HydrophobicContact CD2-CD1 4.1Å; L62-L85 HydrophobicContact CG-CD1 4.23Å; L62-S86 PolarHBondContact O-N 2.88Å
63	N	98.4	Very high	95.7	Very high	27 Å²	27	41.6 Å²	41.6	14%	0.144	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	114.8	176.3	-156.8	-21.5	0	0	0	111.2	L42 L44 R45 G65 S86	L42-N63 PolarHBondContact O-N 3.13Å; L44-N63 WeakPolarHBondContact CA-O 3Å; L44-N63 PolarHBondContact N-O 2.74Å; R45-N63 WeakPolarHBondContact CD-ND2 3.4Å; R45-N63 WeakPolarHBondContact CD-OD1 3.14Å; R45-N63 HydrophobicContact CG-CB 4.07Å; R45-N63 WeakPolarHBondContact CG-OD1 3.43Å; R45-N63 PolarHBondContact NE-ND2 2.62Å; N63-G65 PolarHBondContact OD1-N 3.22Å; N63-G65 VanDerWaalsContact OD1-N 3.15Å; N63-S86 WeakPolarHBondContact OD1-CB 3.44Å; N63-S86 PolarHBondContact OD1-OG 3.07Å
64	L	98.5	Very high	95.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.			trans	-117.4	14.9	179.7	-55.3	174.3	0	0	0	111.3	L44 L52 L62 N67 F69 V76 S86 M87 N90	L44-L64 HydrophobicContact CB-CD2 4.06Å; L44-L64 HydrophobicContact CD1-CD2 3.71Å; L44-L64 HydrophobicContact CG-CD2 4.4Å; L52-L64 HydrophobicContact CD1-CD1 3.55Å; L52-L64 HydrophobicContact CD1-CD2 3.64Å; L52-L64 HydrophobicContact CD1-CG 4.24Å; L52-L64 HydrophobicContact CD2-CD2 4.4Å; L62-L64 HydrophobicContact CD1-CD2 3.93Å; L62-L64 HydrophobicContact CD1-CG 4.27Å; L62-L64 HydrophobicContact CD2-CD1 3.99Å; L62-L64 HydrophobicContact CD2-CD2 4.46Å; L62-L64 HydrophobicContact CD2-CG 4.21Å; L62-L64 HydrophobicContact CG-CD1 4.3Å; L62-L64 HydrophobicContact CG-CD2 4.18Å; L62-L64 HydrophobicContact CG-CG 3.96Å; L64-N67 WeakPolarHBondContact O-CB 3.36Å; L64-N67 PolarHBondContact O-ND2 2.97Å; L64-F69 HydrophobicContact CB-CD2 4.29Å; L64-F69 HydrophobicContact CB-CE2 3.9Å; L64-F69 HydrophobicContact CD1-CE2 4.18Å; L64-F69 HydrophobicContact CD1-CZ 4.33Å; L64-F69 HydrophobicContact CD2-CE2 4.27Å; L64-F69 HydrophobicContact CD2-CZ 4.43Å; L64-F69 HydrophobicContact CG-CE2 4.34Å; L64-V76 HydrophobicContact CD1-CG2 4.06Å; L64-S86 PolarHBondContact N-O 2.99Å; L64-M87 HydrophobicContact CB-CG 4.13Å; L64-M87 HydrophobicContact CD1-CE 3.85Å; L64-M87 HydrophobicContact CD1-CG 4.09Å; L64-M87 HydrophobicContact CD1-SD 4.1Å; L64-N90 PolarHBondContact O-ND2 3.14Å
65	G	98.6	Very high	95.5	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.			trans	-62.4	153.9	-177.5	0	0	0	0	0	113.3	R45 S46 N63 N67 S86 Y88	R45-G65 CarbonylContact C-O 3.47Å; R45-G65 WeakPolarHBondContact CA-O 3.48Å; S46-G65 PolarHBondContact N-O 2.72Å; N63-G65 PolarHBondContact OD1-N 3.22Å; N63-G65 VanDerWaalsContact OD1-N 3.15Å; G65-N67 PolarHBondContact O-ND2 3.06Å; G65-S86 PolarHBondContact N-O 2.93Å; G65-Y88 CarbonylContact C-O 3.38Å; G65-Y88 WeakPolarHBondContact CA-O 3.4Å
66	N	98.7	Very high	95.4	Very high	47 Å²	47	40.8 Å²	40.8	25%	0.251	21%	0.206	S	C	.	.	S	Bend	trans	55.2	59.5	-174.9	-56.7	-44.3	0	0	0	112.1	S46 N47 Y88 N89	S46-N66 WeakPolarHBondContact CA-O 3.41Å; S46-N66 PolarHBondContact N-O 3.14Å; S46-N66 VanDerWaalsContact N-O 3.16Å; S46-N66 PolarHBondContact OG-ND2 3.38Å; N47-N66 PolarHBondContact N-O 3.47Å; N66-Y88 PolarHBondContact N-O 3.05Å; N66-Y88 PolarHBondContact ND2-OH 3.4Å; N66-Y88 WeakPolarHBondContact OD1-CE2 3.49Å; N66-N89 VanDerWaalsContact CA-O 3.23Å; N66-N89 WeakPolarHBondContact CA-O 3.21Å; N66-N89 PolarHBondContact N-O 2.87Å; N66-N89 VanDerWaalsContact OD1-CB 3.29Å; N66-N89 WeakPolarHBondContact OD1-CB 3.19Å; N66-N89 PolarHBondContact OD1-ND2 3.2Å
67	N	98.7	Very high	95.2	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.043	21%	0.211	C	C	.	.	S	Bend	trans	-135	-164	174.4	-83.8	-77.7	0	0	0	108.8	L44 N47 L49 L64 G65 F69 N89 N90	L44-N67 PolarHBondContact O-ND2 3.32Å; N47-N67 WeakPolarHBondContact CA-OD1 3.27Å; N47-N67 VanDerWaalsContact CB-OD1 3.23Å; N47-N67 WeakPolarHBondContact CB-OD1 3.3Å; N47-N67 PolarHBondContact N-OD1 3.23Å; N47-N67 PolarHBondContact O-OD1 3.05Å; N47-N67 VanDerWaalsContact O-OD1 3.09Å; L49-N67 HydrophobicContact CB-CB 4.45Å; L49-N67 VanDerWaalsContact CB-OD1 3.32Å; L49-N67 WeakPolarHBondContact CB-OD1 3.31Å; L49-N67 PolarHBondContact N-OD1 3.25Å; L49-N67 WeakPolarHBondContact O-CB 3.45Å; L64-N67 WeakPolarHBondContact O-CB 3.36Å; L64-N67 PolarHBondContact O-ND2 2.97Å; G65-N67 PolarHBondContact O-ND2 3.06Å; N67-F69 HydrophobicContact CB-CD2 3.64Å; N67-F69 HydrophobicContact CB-CE2 3.67Å; N67-N89 PolarHBondContact N-O 3Å; N67-N90 VanDerWaalsContact CA-OD1 3.3Å; N67-N90 WeakPolarHBondContact CA-OD1 3.21Å; N67-N90 VanDerWaalsContact CB-OD1 3.22Å; N67-N90 WeakPolarHBondContact CB-OD1 3.35Å; N67-N90 PolarHBondContact N-OD1 2.85Å; N67-N90 PolarHBondContact O-OD1 2.75Å; N67-N90 VanDerWaalsContact O-OD1 3.07Å
68	W	98.2	Very high	95.1	Very high	140 Å²	140	39.7 Å²	39.7	53%	0.53	21%	0.207	S	C	.	.			trans	-119.7	27.5	-173.2	-60.8	69.3	0	0	0	112	N48 L49 T70 N90	N48-W68 PolarHBondContact OD1-NE1 2.85Å; L49-W68 CarbonylContact O-C 3.59Å; L49-W68 WeakPolarHBondContact O-CA 3.4Å; L49-W68 PolarHBondContact O-N 3.2Å; W68-T70 PolarHBondContact O-N 2.69Å; W68-N90 PolarHBondContact N-OD1 3.21Å
69	F	98.4	Very high	95.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.			trans	-69.5	124.1	178.5	-67.6	-77.9	0	0	0	110.7	L49 S50 L52 L64 N67 P73 M87 N90 Q91 L92	L49-F69 HydrophobicContact CB-CE2 3.82Å; L49-F69 HydrophobicContact CB-CZ 3.62Å; S50-F69 VanDerWaalsContact C-CD1 3.47Å; S50-F69 VanDerWaalsContact C-CE1 3.47Å; S50-F69 VanDerWaalsContact O-CD1 3.27Å; S50-F69 WeakPolarHBondContact O-CD1 3.32Å; L52-F69 HydrophobicContact CD1-CE1 4.28Å; L52-F69 HydrophobicContact CD1-CZ 3.96Å; L52-F69 HydrophobicContact CD2-CZ 4.01Å; L52-F69 HydrophobicContact CG-CE1 3.86Å; L52-F69 HydrophobicContact CG-CZ 3.66Å; L64-F69 HydrophobicContact CB-CD2 4.29Å; L64-F69 HydrophobicContact CB-CE2 3.9Å; L64-F69 HydrophobicContact CD1-CE2 4.18Å; L64-F69 HydrophobicContact CD1-CZ 4.33Å; L64-F69 HydrophobicContact CD2-CE2 4.27Å; L64-F69 HydrophobicContact CD2-CZ 4.43Å; L64-F69 HydrophobicContact CG-CE2 4.34Å; N67-F69 HydrophobicContact CB-CD2 3.64Å; N67-F69 HydrophobicContact CB-CE2 3.67Å; F69-P73 HydrophobicContact CD1-CG 3.52Å; F69-P73 HydrophobicContact CE1-CG 3.4Å; F69-P73 HydrophobicContact CZ-CG 4.45Å; F69-M87 HydrophobicContact CB-CE 3.86Å; F69-M87 HydrophobicContact CD1-CE 4.38Å; F69-M87 HydrophobicContact CD2-CE 4.01Å; F69-M87 HydrophobicContact CG-CE 3.83Å; F69-N90 HydrophobicContact CB-CB 4.35Å; F69-N90 VanDerWaalsContact CD2-OD1 3.3Å; F69-N90 WeakPolarHBondContact CD2-OD1 3.35Å; F69-N90 PolarHBondContact N-OD1 2.94Å; F69-Q91 CarbonylContact O-C 3.44Å; F69-Q91 VanDerWaalsContact O-C 3.28Å; F69-Q91 WeakPolarHBondContact O-CA 3.47Å; F69-Q91 PolarHBondContact O-N 3.24Å; F69-L92 HydrophobicContact CB-CD2 4.02Å; F69-L92 PolarHBondContact O-N 2.99Å
70	T	97.7	Very high	94.8	Very high	63 Å²	63	38.7 Å²	38.7	39%	0.387	20%	0.204	S	C	.	.	S	Bend	trans	-94.5	-19	172.8	57.4	0	0	0	0	112.6	W68 Q91 L92 Q93	W68-T70 PolarHBondContact O-N 2.69Å; T70-Q91 WeakPolarHBondContact CA-O 3.37Å; T70-Q91 HydrophobicContact CG2-CB 4.12Å; T70-L92 WeakPolarHBondContact O-CA 3.11Å; T70-Q93 PolarHBondContact O-N 3.13Å
71	V	95.5	Very high	94.6	Very high	83 Å²	83	36 Å²	36	50%	0.503	19%	0.194	S	C	.	.	S	Bend	trans	-139	159.7	174.5	-62.6	0	0	0	0	110	P73 L92	V71-P73 VanDerWaalsContact O-CD 3.31Å; V71-P73 WeakPolarHBondContact O-CD 3.09Å; V71-L92 WeakPolarHBondContact O-CD2 3.31Å
72	I	94.2	Very high	94.4	Very high	7 Å²	7	34.7 Å²	34.7	4%	0.036	18%	0.184	C	C	.	.			trans	-73.9	118.8	170.2	-59.2	-175.8	0	0	0	107.8	V76 L77 M87 L92 I95 P96 L99	I72-V76 HydrophobicContact CG2-CB 4.06Å; I72-V76 HydrophobicContact CG2-CG1 4.14Å; I72-L77 HydrophobicContact CG2-CD2 3.85Å; I72-M87 HydrophobicContact CB-SD 4.38Å; I72-M87 HydrophobicContact CD1-SD 4.37Å; I72-M87 HydrophobicContact CG1-CE 4.43Å; I72-M87 HydrophobicContact CG1-SD 3.88Å; I72-M87 HydrophobicContact CG2-SD 4.11Å; I72-L92 HydrophobicContact CG1-CD1 4.13Å; I72-L92 HydrophobicContact CG1-CD2 4.16Å; I72-I95 HydrophobicContact CD1-CG2 4.3Å; I72-P96 HydrophobicContact CB-CG 4.36Å; I72-L99 HydrophobicContact CD1-CD1 3.88Å
73	P	92.5	Very high	94.4	Very high	4 Å²	4	38.9 Å²	38.9	3%	0.026	20%	0.203	C	C	.	.			trans	-61.9	144.7	-178.1	-24.3	34.3	0	0	0	112.8	L52 F69 V71 S75 V76	L52-P73 HydrophobicContact CB-CB 4.32Å; L52-P73 HydrophobicContact CB-CG 4.42Å; L52-P73 HydrophobicContact CD1-CG 4.32Å; L52-P73 HydrophobicContact CG-CG 4.33Å; F69-P73 HydrophobicContact CD1-CG 3.52Å; F69-P73 HydrophobicContact CE1-CG 3.4Å; F69-P73 HydrophobicContact CZ-CG 4.45Å; V71-P73 VanDerWaalsContact O-CD 3.31Å; V71-P73 WeakPolarHBondContact O-CD 3.09Å; P73-S75 PolarHBondContact O-N 3.36Å; P73-S75 VanDerWaalsContact O-N 3.15Å; P73-V76 HydrophobicContact CB-CG2 4.31Å; P73-V76 HydrophobicContact CG-CG2 4.39Å; P73-V76 WeakPolarHBondContact O-CB 3.13Å; P73-V76 PolarHBondContact O-N 3.11Å
74	N	89.3	Confident	94.3	Very high	126 Å²	126	39 Å²	39	67%	0.674	21%	0.205	S	C	*	.	H	α-helix	trans	-56.9	-32.9	177.6	-74.2	-18.6	0	0	0	112.7	V76 L77 L78	N74-V76 PolarHBondContact O-N 3.17Å; N74-L77 VanDerWaalsContact O-CB 3.32Å; N74-L77 WeakPolarHBondContact O-CB 3.25Å; N74-L77 PolarHBondContact O-N 3.31Å; N74-L78 WeakPolarHBondContact O-CG 3.46Å; N74-L78 PolarHBondContact O-N 2.82Å
75	S	90.3	Very high	94.3	Very high	10 Å²	10	39 Å²	39	7%	0.07	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-30.7	176.2	50.5	0	0	0	0	113.4	L52 P53 P73	L52-S75 WeakPolarHBondContact CB-OG 3.33Å; L52-S75 PolarHBondContact O-OG 3.23Å; P53-S75 WeakPolarHBondContact O-CB 3.25Å; P53-S75 PolarHBondContact O-OG 3.4Å; P73-S75 PolarHBondContact O-N 3.36Å; P73-S75 VanDerWaalsContact O-N 3.15Å
76	V	92.3	Very high	94.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-70.8	-37.7	173.6	-179.3	0	0	0	0	110.7	L52 L55 L62 L64 I72 P73 N74 L78 L79 L82 L85	L52-V76 HydrophobicContact CD1-CG2 4.02Å; L55-V76 HydrophobicContact CD1-CG2 4.49Å; L62-V76 HydrophobicContact CD2-CG1 4.29Å; L62-V76 HydrophobicContact CD2-CG2 3.9Å; L64-V76 HydrophobicContact CD1-CG2 4.06Å; I72-V76 HydrophobicContact CG2-CB 4.06Å; I72-V76 HydrophobicContact CG2-CG1 4.14Å; P73-V76 HydrophobicContact CB-CG2 4.31Å; P73-V76 HydrophobicContact CG-CG2 4.39Å; P73-V76 WeakPolarHBondContact O-CB 3.13Å; P73-V76 PolarHBondContact O-N 3.11Å; N74-V76 PolarHBondContact O-N 3.17Å; V76-L78 PolarHBondContact O-N 2.84Å; V76-L79 WeakPolarHBondContact O-CB 3.23Å; V76-L79 WeakPolarHBondContact O-CG 3.42Å; V76-L79 PolarHBondContact O-N 2.96Å; V76-L79 VanDerWaalsContact O-N 3.12Å; V76-L82 HydrophobicContact CG1-CD2 4.44Å; V76-L85 HydrophobicContact CG1-CD1 3.97Å; V76-L85 HydrophobicContact CG1-CD2 3.8Å
77	L	87.7	Confident	94.2	Very high	19 Å²	19	37 Å²	37	10%	0.099	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-22.1	-179.3	-48.1	-177	0	0	0	112.8	I72 N74 L79 P96 I98 L99	I72-L77 HydrophobicContact CG2-CD2 3.85Å; N74-L77 VanDerWaalsContact O-CB 3.32Å; N74-L77 WeakPolarHBondContact O-CB 3.25Å; N74-L77 PolarHBondContact O-N 3.31Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-P96 HydrophobicContact CD1-CG 4.39Å; L77-P96 HydrophobicContact CD2-CG 4.28Å; L77-I98 HydrophobicContact CD1-CG2 3.67Å; L77-L99 HydrophobicContact CD2-CD1 4.12Å; L77-L99 HydrophobicContact CD2-CD2 3.23Å; L77-L99 HydrophobicContact CD2-CG 3.48Å; L77-L99 VanDerWaalsContact CD2-CG 3.48Å
78	L	88.8	Confident	94.2	Very high	110 Å²	110	38.9 Å²	38.9	58%	0.576	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.9	178.1	-61.7	175	0	0	0	113.5	N74 V76 T80	N74-L78 WeakPolarHBondContact O-CG 3.46Å; N74-L78 PolarHBondContact O-N 2.82Å; V76-L78 PolarHBondContact O-N 2.84Å; L78-T80 WeakPolarHBondContact O-CG2 3.36Å; L78-T80 PolarHBondContact O-N 3.32Å
79	L	91.5	Very high	94.3	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	20%	0.197	C	C	.	.			trans	-80.2	81.2	-175.1	-62.8	179.9	0	0	0	112.5	L55 P56 L59 L62 V76 L77 S81 L82	L55-L79 HydrophobicContact CB-CD2 3.93Å; L55-L79 HydrophobicContact CD1-CD1 3.95Å; P56-L79 VanDerWaalsContact O-CD2 3.31Å; P56-L79 WeakPolarHBondContact O-CD2 3.49Å; L59-L79 HydrophobicContact CB-CD1 4.37Å; L59-L79 HydrophobicContact CB-CD2 4.29Å; L59-L79 HydrophobicContact CD1-CD1 4.15Å; L59-L79 HydrophobicContact CD1-CD2 4.28Å; L62-L79 HydrophobicContact CD2-CD1 3.84Å; V76-L79 WeakPolarHBondContact O-CB 3.23Å; V76-L79 WeakPolarHBondContact O-CG 3.42Å; V76-L79 PolarHBondContact O-N 2.96Å; V76-L79 VanDerWaalsContact O-N 3.12Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L79-S81 PolarHBondContact O-N 3.32Å; L79-L82 HydrophobicContact CB-CB 3.9Å; L79-L82 HydrophobicContact CB-CD2 4.38Å; L79-L82 HydrophobicContact CD1-CD1 4.08Å; L79-L82 HydrophobicContact CD1-CD2 4.19Å; L79-L82 WeakPolarHBondContact O-CB 3.26Å; L79-L82 PolarHBondContact O-N 2.78Å; L79-L82 VanDerWaalsContact O-N 3.14Å
80	T	89.3	Confident	94.3	Very high	57 Å²	57	36.2 Å²	36.2	35%	0.35	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-12.8	-175.6	76.5	0	0	0	0	115.4	L78 S105 K109	L78-T80 WeakPolarHBondContact O-CG2 3.36Å; L78-T80 PolarHBondContact O-N 3.32Å; T80-S105 VanDerWaalsContact CA-OG 3.29Å; T80-S105 WeakPolarHBondContact CA-OG 2.78Å; T80-S105 WeakPolarHBondContact CB-OG 3.49Å; T80-S105 WeakPolarHBondContact CG2-OG 3.45Å; T80-K109 VanDerWaalsContact O-CD 3.26Å; T80-K109 WeakPolarHBondContact O-CD 3.4Å; T80-K109 WeakPolarHBondContact O-CE 3.2Å; T80-K109 PolarHBondContact O-NZ 3.1Å
81	S	92.4	Very high	94.3	Very high	25 Å²	25	36.6 Å²	36.6	18%	0.175	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-0.3	-179.6	-66.9	0	0	0	0	113.5	L59 L79 K83	L59-S81 CarbonylContact O-C 3.5Å; L79-S81 PolarHBondContact O-N 3.32Å; S81-K83 PolarHBondContact O-N 3.03Å
82	L	94.4	Very high	94.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.			trans	-68.6	128.6	-172.9	-158.1	70.7	0	0	0	111.4	L59 L62 V76 L79 L85 M106 K109 L110	L59-L82 HydrophobicContact CB-CD1 4.34Å; L59-L82 WeakPolarHBondContact O-CA 3.3Å; L59-L82 PolarHBondContact O-N 3.1Å; L62-L82 HydrophobicContact CB-CD1 3.83Å; V76-L82 HydrophobicContact CG1-CD2 4.44Å; L79-L82 HydrophobicContact CB-CB 3.9Å; L79-L82 HydrophobicContact CB-CD2 4.38Å; L79-L82 HydrophobicContact CD1-CD1 4.08Å; L79-L82 HydrophobicContact CD1-CD2 4.19Å; L79-L82 WeakPolarHBondContact O-CB 3.26Å; L79-L82 PolarHBondContact O-N 2.78Å; L79-L82 VanDerWaalsContact O-N 3.14Å; L82-L85 HydrophobicContact CD2-CB 3.86Å; L82-L85 HydrophobicContact CD2-CD1 4.21Å; L82-L85 HydrophobicContact CD2-CD2 4.46Å; L82-L85 HydrophobicContact CD2-CG 4.39Å; L82-M106 HydrophobicContact CB-CG 4.08Å; L82-M106 HydrophobicContact CB-SD 4.16Å; L82-M106 HydrophobicContact CD2-SD 3.66Å; L82-K109 CarbonylContact O-C 3.6Å; L82-K109 WeakPolarHBondContact O-CB 3.39Å; L82-L110 HydrophobicContact CD2-CD1 4.24Å; L82-L110 HydrophobicContact CG-CD1 4.25Å
83	K	96.3	Very high	94.5	Very high	88 Å²	88	38 Å²	38	38%	0.383	20%	0.197	S	C	.	.			trans	-111.5	-28.3	176.2	-65.4	-177.2	177.4	-177	0	112.5	Q60 S81 E111 Y112	Q60-K83 PolarHBondContact O-N 3.22Å; S81-K83 PolarHBondContact O-N 3.03Å; K83-E111 PolarHBondContact O-N 3.01Å; K83-Y112 PolarHBondContact O-N 2.89Å
84	S	97.6	Very high	94.6	Very high	29 Å²	29	40.7 Å²	40.7	20%	0.203	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	119.4	-178	173.2	0	0	0	0	110.4	Q60 S61 L62 Y112	Q60-S84 PolarHBondContact O-N 3Å; S61-S84 WeakPolarHBondContact CA-O 3.32Å; L62-S84 PolarHBondContact N-O 3.08Å; S84-Y112 WeakPolarHBondContact CA-O 3.14Å; S84-Y112 WeakPolarHBondContact OG-CD1 3.03Å
85	L	97.1	Very high	94.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.2	172.7	179.8	59.6	0	0	0	110	L62 V76 L82 M87 L110 Y112 L113 N114	L62-L85 HydrophobicContact CB-CD1 4.2Å; L62-L85 HydrophobicContact CD2-CD1 4.1Å; L62-L85 HydrophobicContact CG-CD1 4.23Å; V76-L85 HydrophobicContact CG1-CD1 3.97Å; V76-L85 HydrophobicContact CG1-CD2 3.8Å; L82-L85 HydrophobicContact CD2-CB 3.86Å; L82-L85 HydrophobicContact CD2-CD1 4.21Å; L82-L85 HydrophobicContact CD2-CD2 4.46Å; L82-L85 HydrophobicContact CD2-CG 4.39Å; L85-M87 HydrophobicContact CD1-CG 3.91Å; L85-M87 HydrophobicContact CD1-SD 4.32Å; L85-M87 HydrophobicContact CD2-CG 4.5Å; L85-M87 HydrophobicContact CD2-SD 4.31Å; L85-M87 HydrophobicContact CG-CG 4.11Å; L85-L110 HydrophobicContact CB-CD1 4.01Å; L85-Y112 PolarHBondContact N-O 2.71Å; L85-L113 HydrophobicContact CB-CD1 4.06Å; L85-L113 HydrophobicContact CD2-CD1 4.01Å; L85-L113 HydrophobicContact CG-CD1 4.12Å; L85-L113 WeakPolarHBondContact O-CA 3.26Å; L85-N114 PolarHBondContact O-N 2.77Å
86	S	98.4	Very high	94.4	Very high	5 Å²	5	36.3 Å²	36.3	4%	0.035	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	118.1	176.3	169.1	0	0	0	0	109.2	L62 N63 L64 G65 Y88 N114	L62-S86 PolarHBondContact O-N 2.88Å; N63-S86 WeakPolarHBondContact OD1-CB 3.44Å; N63-S86 PolarHBondContact OD1-OG 3.07Å; L64-S86 PolarHBondContact N-O 2.99Å; G65-S86 PolarHBondContact N-O 2.93Å; S86-Y88 WeakPolarHBondContact OG-CD1 3.44Å; S86-N114 CarbonylContact C-O 3.05Å; S86-N114 WeakPolarHBondContact CA-O 3.38Å
87	M	98.4	Very high	93.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.214	C	C	.	.			trans	-131.1	33.1	174.7	-51.6	-173	62.1	0	0	110.7	L64 F69 I72 L85 N90 L92 N114 L115 N118	L64-M87 HydrophobicContact CB-CG 4.13Å; L64-M87 HydrophobicContact CD1-CE 3.85Å; L64-M87 HydrophobicContact CD1-CG 4.09Å; L64-M87 HydrophobicContact CD1-SD 4.1Å; F69-M87 HydrophobicContact CB-CE 3.86Å; F69-M87 HydrophobicContact CD1-CE 4.38Å; F69-M87 HydrophobicContact CD2-CE 4.01Å; F69-M87 HydrophobicContact CG-CE 3.83Å; I72-M87 HydrophobicContact CB-SD 4.38Å; I72-M87 HydrophobicContact CD1-SD 4.37Å; I72-M87 HydrophobicContact CG1-CE 4.43Å; I72-M87 HydrophobicContact CG1-SD 3.88Å; I72-M87 HydrophobicContact CG2-SD 4.11Å; L85-M87 HydrophobicContact CD1-CG 3.91Å; L85-M87 HydrophobicContact CD1-SD 4.32Å; L85-M87 HydrophobicContact CD2-CG 4.5Å; L85-M87 HydrophobicContact CD2-SD 4.31Å; L85-M87 HydrophobicContact CG-CG 4.11Å; M87-N90 PolarHBondContact O-ND2 3.02Å; M87-L92 HydrophobicContact CB-CD1 3.94Å; M87-L92 HydrophobicContact CE-CD1 4.16Å; M87-L92 HydrophobicContact CE-CD2 4.13Å; M87-L92 HydrophobicContact SD-CD1 4.25Å; M87-N114 PolarHBondContact N-O 2.83Å; M87-L115 HydrophobicContact CB-CD2 3.84Å; M87-L115 HydrophobicContact CG-CD2 4.28Å; M87-N118 PolarHBondContact O-ND2 3.3Å
88	Y	98.7	Very high	93	Very high	47 Å²	47	42.2 Å²	42.2	18%	0.184	23%	0.229	C	C	.	.			trans	-61.7	154.7	179	72.9	-91.5	0	0	0	111.9	R45 G65 N66 S86 N90 N114 G116	R45-Y88 VanDerWaalsContact CD-OH 3.22Å; R45-Y88 WeakPolarHBondContact CD-OH 3.21Å; G65-Y88 CarbonylContact C-O 3.38Å; G65-Y88 WeakPolarHBondContact CA-O 3.4Å; N66-Y88 PolarHBondContact N-O 3.05Å; N66-Y88 PolarHBondContact ND2-OH 3.4Å; N66-Y88 WeakPolarHBondContact OD1-CE2 3.49Å; S86-Y88 WeakPolarHBondContact OG-CD1 3.44Å; Y88-N90 PolarHBondContact O-ND2 3.08Å; Y88-N114 PolarHBondContact N-O 3.42Å; Y88-G116 CarbonylContact C-O 3.47Å; Y88-G116 WeakPolarHBondContact CA-O 3.43Å; Y88-G116 WeakPolarHBondContact CB-O 3.45Å
89	N	98.7	Very high	92	Very high	77 Å²	77	37.5 Å²	37.5	41%	0.412	20%	0.204	S	C	.	.	S	Bend	trans	51.3	60	179.1	-162.6	37.4	0	0	0	112.1	N66 N67 G116 Y117	N66-N89 VanDerWaalsContact CA-O 3.23Å; N66-N89 WeakPolarHBondContact CA-O 3.21Å; N66-N89 PolarHBondContact N-O 2.87Å; N66-N89 VanDerWaalsContact OD1-CB 3.29Å; N66-N89 WeakPolarHBondContact OD1-CB 3.19Å; N66-N89 PolarHBondContact OD1-ND2 3.2Å; N67-N89 PolarHBondContact N-O 3Å; N89-G116 PolarHBondContact N-O 3.21Å; N89-Y117 WeakPolarHBondContact CA-O 3.09Å; N89-Y117 PolarHBondContact N-O 3.05Å; N89-Y117 VanDerWaalsContact N-O 3.12Å
90	N	98.7	Very high	90.8	Very high	7 Å²	7	37.6 Å²	37.6	4%	0.037	21%	0.205	C	C	.	.	S	Bend	trans	-127.9	-164.1	171.4	-84.6	-82	0	0	0	107.6	L64 N67 W68 F69 M87 Y88 L92 Y117 N118	L64-N90 PolarHBondContact O-ND2 3.14Å; N67-N90 VanDerWaalsContact CA-OD1 3.3Å; N67-N90 WeakPolarHBondContact CA-OD1 3.21Å; N67-N90 VanDerWaalsContact CB-OD1 3.22Å; N67-N90 WeakPolarHBondContact CB-OD1 3.35Å; N67-N90 PolarHBondContact N-OD1 2.85Å; N67-N90 PolarHBondContact O-OD1 2.75Å; N67-N90 VanDerWaalsContact O-OD1 3.07Å; W68-N90 PolarHBondContact N-OD1 3.21Å; F69-N90 HydrophobicContact CB-CB 4.35Å; F69-N90 VanDerWaalsContact CD2-OD1 3.3Å; F69-N90 WeakPolarHBondContact CD2-OD1 3.35Å; F69-N90 PolarHBondContact N-OD1 2.94Å; M87-N90 PolarHBondContact O-ND2 3.02Å; Y88-N90 PolarHBondContact O-ND2 3.08Å; N90-L92 HydrophobicContact CB-CG 4.22Å; N90-Y117 PolarHBondContact N-O 3.42Å; N90-N118 WeakPolarHBondContact CA-OD1 3.35Å; N90-N118 WeakPolarHBondContact CB-OD1 3.33Å; N90-N118 PolarHBondContact N-OD1 2.79Å; N90-N118 PolarHBondContact O-OD1 2.98Å
91	Q	98.4	Very high	89.8	Confident	72 Å²	72	39 Å²	39	34%	0.336	21%	0.207	S	C	.	.			trans	-117.4	28.4	-179.2	-60.4	174.5	32.4	0	0	111.3	F69 T70 Q93 N118	F69-Q91 CarbonylContact O-C 3.44Å; F69-Q91 VanDerWaalsContact O-C 3.28Å; F69-Q91 WeakPolarHBondContact O-CA 3.47Å; F69-Q91 PolarHBondContact O-N 3.24Å; T70-Q91 WeakPolarHBondContact CA-O 3.37Å; T70-Q91 HydrophobicContact CG2-CB 4.12Å; Q91-Q93 PolarHBondContact O-N 2.88Å; Q91-N118 PolarHBondContact N-OD1 2.95Å
92	L	98.3	Very high	88.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.			trans	-63.3	122.3	-175.7	-60.9	176.2	0	0	0	110.5	F69 T70 V71 I72 M87 N90 L115 N118 H119 I120	F69-L92 HydrophobicContact CB-CD2 4.02Å; F69-L92 PolarHBondContact O-N 2.99Å; T70-L92 WeakPolarHBondContact O-CA 3.11Å; V71-L92 WeakPolarHBondContact O-CD2 3.31Å; I72-L92 HydrophobicContact CG1-CD1 4.13Å; I72-L92 HydrophobicContact CG1-CD2 4.16Å; M87-L92 HydrophobicContact CB-CD1 3.94Å; M87-L92 HydrophobicContact CE-CD1 4.16Å; M87-L92 HydrophobicContact CE-CD2 4.13Å; M87-L92 HydrophobicContact SD-CD1 4.25Å; N90-L92 HydrophobicContact CB-CG 4.22Å; L92-L115 HydrophobicContact CD1-CD2 3.85Å; L92-N118 HydrophobicContact CB-CB 4.11Å; L92-N118 VanDerWaalsContact CB-OD1 3.26Å; L92-N118 WeakPolarHBondContact CB-OD1 3.45Å; L92-N118 VanDerWaalsContact CG-OD1 3.27Å; L92-N118 WeakPolarHBondContact CG-OD1 3.35Å; L92-N118 PolarHBondContact N-OD1 3.1Å; L92-H119 CarbonylContact O-C 3.22Å; L92-H119 VanDerWaalsContact O-CA 3.24Å; L92-H119 WeakPolarHBondContact O-CA 3.37Å; L92-H119 PolarHBondContact O-N 3.42Å; L92-I120 HydrophobicContact CB-CG1 4.33Å; L92-I120 WeakPolarHBondContact O-CG1 3.42Å; L92-I120 PolarHBondContact O-N 3.21Å; L92-I120 VanDerWaalsContact O-N 3.14Å
93	Q	96.5	Very high	86.4	Confident	118 Å²	118	52 Å²	52	55%	0.551	28%	0.281	S	S	*	.			trans	-94.9	-23.7	179.6	-62.8	-179.4	33.3	0	0	113.2	T70 Q91 H119 I120 L121	T70-Q93 PolarHBondContact O-N 3.13Å; Q91-Q93 PolarHBondContact O-N 2.88Å; Q93-H119 HydrophobicContact CG-CB 4.28Å; Q93-I120 WeakPolarHBondContact O-CA 3.49Å; Q93-L121 PolarHBondContact O-N 3.41Å
94	S	93.6	Very high	84.5	Confident	61 Å²	61	48.4 Å²	48.4	43%	0.427	27%	0.267	S	S	.	.			trans	-150.6	160.5	-179.1	65.6	0	0	0	0	111.4
95	I	90	Very high	82.7	Confident	9 Å²	9	49.2 Å²	49.2	5%	0.046	27%	0.272	C	S	.	.			trans	-103.9	120	168.5	-54.9	178.3	0	0	0	106	I72 S97 L99 F100 L115 I120 L123 F127	I72-I95 HydrophobicContact CD1-CG2 4.3Å; I95-S97 PolarHBondContact O-N 3.46Å; I95-L99 HydrophobicContact CG2-CD1 3.37Å; I95-F100 HydrophobicContact CG2-CE2 3.65Å; I95-F100 HydrophobicContact CG2-CZ 3.94Å; I95-L115 HydrophobicContact CD1-CD1 3.43Å; I95-L115 VanDerWaalsContact CD1-CD1 3.43Å; I95-L115 HydrophobicContact CG1-CD1 3.83Å; I95-I120 HydrophobicContact CD1-CD1 4.2Å; I95-I120 HydrophobicContact CG1-CD1 3.98Å; I95-I120 HydrophobicContact CG1-CG2 4.4Å; I95-L123 HydrophobicContact CD1-CD2 3.6Å; I95-F127 HydrophobicContact CD1-CE2 3.76Å
96	P	84.4	Confident	81.5	Confident	35 Å²	35	49.4 Å²	49.4	23%	0.227	27%	0.273	C	S	.	.			trans	-63.8	134.8	-174	26.2	-35	0	0	0	110.7	I72 L77 I98 L99	I72-P96 HydrophobicContact CB-CG 4.36Å; L77-P96 HydrophobicContact CD1-CG 4.39Å; L77-P96 HydrophobicContact CD2-CG 4.28Å; P96-I98 HydrophobicContact CB-CG2 4.1Å; P96-I98 PolarHBondContact O-N 3.07Å; P96-L99 HydrophobicContact CG-CD1 3.76Å; P96-L99 HydrophobicContact CG-CG 3.97Å; P96-L99 VanDerWaalsContact O-CB 3.26Å; P96-L99 WeakPolarHBondContact O-CB 3.45Å; P96-L99 PolarHBondContact O-N 3.47Å; P96-L99 VanDerWaalsContact O-N 3.1Å
97	S	77.5	Confident	80	Confident	62 Å²	62	49.6 Å²	49.6	43%	0.434	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-62.4	-26.2	-179.3	55.8	0	0	0	0	113	I95 L99 F100	I95-S97 PolarHBondContact O-N 3.46Å; S97-L99 PolarHBondContact O-N 2.89Å; S97-F100 WeakPolarHBondContact O-CA 3.31Å; S97-F100 WeakPolarHBondContact O-CB 3.37Å; S97-F100 PolarHBondContact O-N 3.31Å
98	I	73.5	Confident	78.9	Confident	82 Å²	82	54.3 Å²	54.3	42%	0.421	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-61.2	-25.2	177.3	-159.9	162.3	0	0	0	112.2	L77 P96 F100 E101 C104	L77-I98 HydrophobicContact CD1-CG2 3.67Å; P96-I98 HydrophobicContact CB-CG2 4.1Å; P96-I98 PolarHBondContact O-N 3.07Å; I98-F100 PolarHBondContact O-N 3.25Å; I98-E101 WeakPolarHBondContact CA-OE1 3.36Å; I98-E101 PolarHBondContact O-N 3.44Å; I98-C104 WeakPolarHBondContact O-CB 3.28Å
99	L	68.4	Low	78.4	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.052	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-52.7	-30.6	170.5	-86.1	167	0	0	0	111	I72 L77 I95 P96 S97 C104 M106 L107	I72-L99 HydrophobicContact CD1-CD1 3.88Å; L77-L99 HydrophobicContact CD2-CD1 4.12Å; L77-L99 HydrophobicContact CD2-CD2 3.23Å; L77-L99 HydrophobicContact CD2-CG 3.48Å; L77-L99 VanDerWaalsContact CD2-CG 3.48Å; I95-L99 HydrophobicContact CG2-CD1 3.37Å; P96-L99 HydrophobicContact CG-CD1 3.76Å; P96-L99 HydrophobicContact CG-CG 3.97Å; P96-L99 VanDerWaalsContact O-CB 3.26Å; P96-L99 WeakPolarHBondContact O-CB 3.45Å; P96-L99 PolarHBondContact O-N 3.47Å; P96-L99 VanDerWaalsContact O-N 3.1Å; S97-L99 PolarHBondContact O-N 2.89Å; L99-C104 WeakPolarHBondContact O-CB 2.84Å; L99-C104 PolarHBondContact O-SG 3.45Å; L99-C104 VanDerWaalsContact O-SG 3.42Å; L99-M106 HydrophobicContact CD2-CE 3.06Å; L99-L107 WeakPolarHBondContact O-CD1 3.26Å; L99-L107 WeakPolarHBondContact O-CD2 3.12Å; L99-L107 WeakPolarHBondContact O-CG 3.39Å
100	F	66	Low	78.2	Confident	5 Å²	5	52.8 Å²	52.8	2%	0.022	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-109.2	9.6	-170.4	-52	-87.9	0	0	0	113.6	I95 S97 I98 L107 P124 N126 F127 L129 L130	I95-F100 HydrophobicContact CG2-CE2 3.65Å; I95-F100 HydrophobicContact CG2-CZ 3.94Å; S97-F100 WeakPolarHBondContact O-CA 3.31Å; S97-F100 WeakPolarHBondContact O-CB 3.37Å; S97-F100 PolarHBondContact O-N 3.31Å; I98-F100 PolarHBondContact O-N 3.25Å; F100-L107 VanDerWaalsContact C-CD1 3.46Å; F100-L107 HydrophobicContact CB-CD2 4.38Å; F100-L107 HydrophobicContact CD1-CD2 3.66Å; F100-L107 HydrophobicContact CE1-CD2 4.23Å; F100-L107 HydrophobicContact CG-CD2 4.2Å; F100-P124 HydrophobicContact CD2-CB 4.24Å; F100-P124 HydrophobicContact CD2-CG 3.43Å; F100-P124 VanDerWaalsContact CD2-CG 3.43Å; F100-P124 HydrophobicContact CE2-CB 4.39Å; F100-P124 HydrophobicContact CE2-CG 3.17Å; F100-P124 HydrophobicContact CG-CG 4.34Å; F100-P124 HydrophobicContact CZ-CG 3.89Å; F100-N126 HydrophobicContact CB-CB 3.98Å; F100-N126 WeakPolarHBondContact CB-ND2 3.47Å; F100-N126 WeakPolarHBondContact CB-OD1 3.35Å; F100-N126 WeakPolarHBondContact CD1-O 3.29Å; F100-N126 PolarHBondContact O-ND2 3.26Å; F100-F127 HydrophobicContact CE1-CB 4.26Å; F100-F127 AromaticContact CE1-CD2 3.56Å; F100-F127 HydrophobicContact CE1-CD2 3.56Å; F100-F127 HydrophobicContact CE1-CE2 4.06Å; F100-F127 AromaticContact CE1-CG 4Å; F100-F127 HydrophobicContact CE1-CG 4Å; F100-F127 HydrophobicContact CE2-CD2 4.14Å; F100-F127 AromaticContact CZ-CD2 3.25Å; F100-F127 HydrophobicContact CZ-CD2 3.25Å; F100-F127 AromaticContact CZ-CE2 3.61Å; F100-F127 HydrophobicContact CZ-CE2 3.61Å; F100-F127 HydrophobicContact CZ-CG 4.14Å; F100-L129 WeakPolarHBondContact O-CD1 3.42Å; F100-L130 HydrophobicContact CD1-CD1 4.49Å; F100-L130 HydrophobicContact CD1-CG 4.21Å; F100-L130 HydrophobicContact CE1-CD1 3.54Å; F100-L130 HydrophobicContact CE1-CD2 4.33Å; F100-L130 HydrophobicContact CE1-CG 3.72Å; F100-L130 HydrophobicContact CZ-CD1 4.28Å
101	E	69	Low	78.1	Confident	87 Å²	87	55.2 Å²	55.2	41%	0.407	30%	0.301	S	S	.	.	S	Bend	trans	-77.8	148.1	170.9	-72.5	174	-150.2	0	0	110.7	I98 M103 C104 L107	I98-E101 WeakPolarHBondContact CA-OE1 3.36Å; I98-E101 PolarHBondContact O-N 3.44Å; E101-M103 PolarHBondContact O-N 3.2Å; E101-C104 WeakPolarHBondContact O-CB 3.16Å; E101-C104 PolarHBondContact O-N 2.8Å; E101-L107 VanDerWaalsContact O-CD1 3.28Å; E101-L107 WeakPolarHBondContact O-CD1 3.2Å
102	S	58.6	Low	78.1	Confident	122 Å²	122	55.4 Å²	55.4	85%	0.853	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.4	-177.3	53.4	0	0	0	0	113.6
103	M	55.6	Low	78	Confident	174 Å²	174	55.7 Å²	55.7	86%	0.857	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-16.7	175.4	-63.1	-174.6	67.1	0	0	113.5	E101 S105	E101-M103 PolarHBondContact O-N 3.2Å; M103-S105 PolarHBondContact O-N 3.15Å; M103-S105 VanDerWaalsContact O-N 3.11Å
104	C	57	Low	78.1	Confident	14 Å²	14	51 Å²	51	10%	0.095	28%	0.279	C	S	.	.			trans	-80.8	94.1	178.7	-164.7	0	0	0	0	110.8	I98 L99 E101 M106 L107	I98-C104 WeakPolarHBondContact O-CB 3.28Å; L99-C104 WeakPolarHBondContact O-CB 2.84Å; L99-C104 PolarHBondContact O-SG 3.45Å; L99-C104 VanDerWaalsContact O-SG 3.42Å; E101-C104 WeakPolarHBondContact O-CB 3.16Å; E101-C104 PolarHBondContact O-N 2.8Å; C104-M106 PolarHBondContact O-N 3.36Å; C104-M106 VanDerWaalsContact O-N 3.11Å; C104-L107 HydrophobicContact CB-CD1 4.24Å; C104-L107 HydrophobicContact CB-CG 4.38Å; C104-L107 WeakPolarHBondContact O-CB 3.42Å; C104-L107 WeakPolarHBondContact O-CG 3.39Å; C104-L107 PolarHBondContact O-N 3.08Å
105	S	60.6	Low	78.3	Confident	45 Å²	45	48 Å²	48	32%	0.315	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-57.1	-24.4	-179.1	61	0	0	0	0	115.3	T80 M103 L107 N108	T80-S105 VanDerWaalsContact CA-OG 3.29Å; T80-S105 WeakPolarHBondContact CA-OG 2.78Å; T80-S105 WeakPolarHBondContact CB-OG 3.49Å; T80-S105 WeakPolarHBondContact CG2-OG 3.45Å; M103-S105 PolarHBondContact O-N 3.15Å; M103-S105 VanDerWaalsContact O-N 3.11Å; S105-L107 PolarHBondContact O-N 3.45Å; S105-N108 PolarHBondContact O-N 3.4Å
106	M	71	Confident	78.7	Confident	6 Å²	6	47.6 Å²	47.6	3%	0.03	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-62.6	-31.1	-178.9	-165.8	178.3	72.9	0	0	112.2	L82 L99 C104 N108 K109 L110	L82-M106 HydrophobicContact CB-CG 4.08Å; L82-M106 HydrophobicContact CB-SD 4.16Å; L82-M106 HydrophobicContact CD2-SD 3.66Å; L99-M106 HydrophobicContact CD2-CE 3.06Å; C104-M106 PolarHBondContact O-N 3.36Å; C104-M106 VanDerWaalsContact O-N 3.11Å; M106-N108 PolarHBondContact O-N 3.34Å; M106-N108 VanDerWaalsContact O-N 3.14Å; M106-K109 PolarHBondContact O-N 3.44Å; M106-K109 VanDerWaalsContact O-N 3.11Å; M106-L110 HydrophobicContact CE-CD2 4.32Å; M106-L110 PolarHBondContact O-N 3Å
107	L	66.3	Low	79.4	Confident	9 Å²	9	51.9 Å²	51.9	5%	0.047	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-53.8	-36.3	-179.9	-72.2	171.8	0	0	0	114.6	L99 F100 E101 C104 S105 K109 L130	L99-L107 WeakPolarHBondContact O-CD1 3.26Å; L99-L107 WeakPolarHBondContact O-CD2 3.12Å; L99-L107 WeakPolarHBondContact O-CG 3.39Å; F100-L107 VanDerWaalsContact C-CD1 3.46Å; F100-L107 HydrophobicContact CB-CD2 4.38Å; F100-L107 HydrophobicContact CD1-CD2 3.66Å; F100-L107 HydrophobicContact CE1-CD2 4.23Å; F100-L107 HydrophobicContact CG-CD2 4.2Å; E101-L107 VanDerWaalsContact O-CD1 3.28Å; E101-L107 WeakPolarHBondContact O-CD1 3.2Å; C104-L107 HydrophobicContact CB-CD1 4.24Å; C104-L107 HydrophobicContact CB-CG 4.38Å; C104-L107 WeakPolarHBondContact O-CB 3.42Å; C104-L107 WeakPolarHBondContact O-CG 3.39Å; C104-L107 PolarHBondContact O-N 3.08Å; S105-L107 PolarHBondContact O-N 3.45Å; L107-K109 VanDerWaalsContact C-N 3.27Å; L107-K109 PolarHBondContact O-N 2.68Å; L107-L130 HydrophobicContact CD2-CD2 3.42Å; L107-L130 VanDerWaalsContact CD2-CD2 3.42Å; L107-L130 HydrophobicContact CD2-CG 4.05Å
108	N	75.3	Confident	80.4	Confident	99 Å²	99	49.1 Å²	49.1	53%	0.529	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-83.7	-4.2	-172.3	-67.3	-39	0	0	0	112.3	S105 M106 N132	S105-N108 PolarHBondContact O-N 3.4Å; M106-N108 PolarHBondContact O-N 3.34Å; M106-N108 VanDerWaalsContact O-N 3.14Å; N108-N132 PolarHBondContact O-ND2 3.14Å
109	K	89.7	Confident	81.6	Confident	87 Å²	87	49 Å²	49	38%	0.378	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-16.4	-177.4	-65.4	-168.7	-167.6	158.1	0	114.8	T80 L82 M106 L107 E111	T80-K109 VanDerWaalsContact O-CD 3.26Å; T80-K109 WeakPolarHBondContact O-CD 3.4Å; T80-K109 WeakPolarHBondContact O-CE 3.2Å; T80-K109 PolarHBondContact O-NZ 3.1Å; L82-K109 CarbonylContact O-C 3.6Å; L82-K109 WeakPolarHBondContact O-CB 3.39Å; M106-K109 PolarHBondContact O-N 3.44Å; M106-K109 VanDerWaalsContact O-N 3.11Å; L107-K109 VanDerWaalsContact C-N 3.27Å; L107-K109 PolarHBondContact O-N 2.68Å; K109-E111 PolarHBondContact O-N 3.14Å
110	L	93.5	Very high	83	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	25%	0.245	C	C	.	.			trans	-67.6	119.8	-177.5	-157.8	69.9	0	0	0	110.8	L82 L85 M106 L113 L130 N132 M133	L82-L110 HydrophobicContact CD2-CD1 4.24Å; L82-L110 HydrophobicContact CG-CD1 4.25Å; L85-L110 HydrophobicContact CB-CD1 4.01Å; M106-L110 HydrophobicContact CE-CD2 4.32Å; M106-L110 PolarHBondContact O-N 3Å; L110-L113 HydrophobicContact CD2-CB 4.16Å; L110-L113 HydrophobicContact CD2-CD1 4.33Å; L110-L113 HydrophobicContact CD2-CD2 4.39Å; L110-L130 HydrophobicContact CB-CD2 4.44Å; L110-N132 CarbonylContact O-C 3.21Å; L110-M133 HydrophobicContact CB-CE 4.25Å; L110-M133 HydrophobicContact CD2-CE 3.75Å; L110-M133 HydrophobicContact CG-CE 3.93Å; L110-M133 PolarHBondContact O-N 3.26Å
111	E	96.9	Very high	84.5	Confident	58 Å²	58	53.3 Å²	53.3	27%	0.271	27%	0.27	S	S	.	.			trans	-109.8	-27.3	-178.8	-64.6	179.7	-152.9	0	0	112	K83 K109 N132 K134 T135	K83-E111 PolarHBondContact O-N 3.01Å; K109-E111 PolarHBondContact O-N 3.14Å; E111-N132 WeakPolarHBondContact CA-O 3.32Å; E111-K134 HydrophobicContact CB-CD 4.28Å; E111-K134 HydrophobicContact CB-CG 4.45Å; E111-K134 HydrophobicContact CG-CD 4.45Å; E111-K134 WeakPolarHBondContact O-CA 3.1Å; E111-K134 WeakPolarHBondContact O-CB 3.44Å; E111-K134 PolarHBondContact O-N 2.69Å; E111-K134 IonicContact OE1-NZ 3.94Å; E111-K134 WeakPolarHBondContact OE2-CE 3.39Å; E111-K134 IonicContact OE2-NZ 2.69Å; E111-K134 PolarHBondContact OE2-NZ 2.82Å; E111-T135 PolarHBondContact O-N 3.33Å
112	Y	97.9	Very high	85.7	Confident	76 Å²	76	51.3 Å²	51.3	30%	0.298	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.7	-179.9	177.3	-81.4	0	0	0	110	K83 S84 L85 N114 T135	K83-Y112 PolarHBondContact O-N 2.89Å; S84-Y112 WeakPolarHBondContact CA-O 3.14Å; S84-Y112 WeakPolarHBondContact OG-CD1 3.03Å; L85-Y112 PolarHBondContact N-O 2.71Å; Y112-N114 HydrophobicContact CE1-CB 3.65Å; Y112-N114 PolarHBondContact OH-ND2 3.03Å; Y112-T135 WeakPolarHBondContact CA-O 3.31Å; Y112-T135 HydrophobicContact CD2-CG2 3.57Å; Y112-T135 HydrophobicContact CE2-CG2 3.63Å
113	L	96.9	Very high	87.3	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.037	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	119.4	174	179.1	59.4	0	0	0	110	L85 L110 L115 F127 M133 T135 L136 I137	L85-L113 HydrophobicContact CB-CD1 4.06Å; L85-L113 HydrophobicContact CD2-CD1 4.01Å; L85-L113 HydrophobicContact CG-CD1 4.12Å; L85-L113 WeakPolarHBondContact O-CA 3.26Å; L110-L113 HydrophobicContact CD2-CB 4.16Å; L110-L113 HydrophobicContact CD2-CD1 4.33Å; L110-L113 HydrophobicContact CD2-CD2 4.39Å; L113-L115 HydrophobicContact CD1-CD1 4.09Å; L113-L115 HydrophobicContact CD1-CD2 3.86Å; L113-L115 HydrophobicContact CD1-CG 3.76Å; L113-L115 HydrophobicContact CD2-CD1 3.98Å; L113-L115 HydrophobicContact CD2-CG 4.39Å; L113-L115 HydrophobicContact CG-CD1 4.09Å; L113-L115 HydrophobicContact CG-CG 3.94Å; L113-F127 HydrophobicContact CD2-CZ 4.41Å; L113-M133 HydrophobicContact CB-CE 3.57Å; L113-M133 HydrophobicContact CB-SD 3.95Å; L113-M133 HydrophobicContact CD2-CE 4.23Å; L113-T135 PolarHBondContact N-O 3.06Å; L113-L136 HydrophobicContact CB-CD1 3.97Å; L113-L136 HydrophobicContact CD2-CD1 3.88Å; L113-L136 HydrophobicContact CG-CD1 4.04Å; L113-L136 WeakPolarHBondContact O-CA 3.48Å; L113-I137 PolarHBondContact O-N 3.4Å
114	N	98.6	Very high	89	Confident	18 Å²	18	38.8 Å²	38.8	10%	0.096	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	113.3	172.4	-175.7	-7.7	0	0	0	111	L85 S86 M87 Y88 Y112 G116 I137	L85-N114 PolarHBondContact O-N 2.77Å; S86-N114 CarbonylContact C-O 3.05Å; S86-N114 WeakPolarHBondContact CA-O 3.38Å; M87-N114 PolarHBondContact N-O 2.83Å; Y88-N114 PolarHBondContact N-O 3.42Å; Y112-N114 HydrophobicContact CE1-CB 3.65Å; Y112-N114 PolarHBondContact OH-ND2 3.03Å; N114-G116 PolarHBondContact OD1-N 2.84Å; N114-I137 HydrophobicContact CB-CB 4Å; N114-I137 HydrophobicContact CB-CG1 4.36Å; N114-I137 WeakPolarHBondContact OD1-CG2 3.27Å
115	L	98.4	Very high	90.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.			trans	-124.1	23.7	175.4	-54.5	175.1	0	0	0	110.8	M87 L92 I95 L113 N118 I120 I137 L138 N141	M87-L115 HydrophobicContact CB-CD2 3.84Å; M87-L115 HydrophobicContact CG-CD2 4.28Å; L92-L115 HydrophobicContact CD1-CD2 3.85Å; I95-L115 HydrophobicContact CD1-CD1 3.43Å; I95-L115 VanDerWaalsContact CD1-CD1 3.43Å; I95-L115 HydrophobicContact CG1-CD1 3.83Å; L113-L115 HydrophobicContact CD1-CD1 4.09Å; L113-L115 HydrophobicContact CD1-CD2 3.86Å; L113-L115 HydrophobicContact CD1-CG 3.76Å; L113-L115 HydrophobicContact CD2-CD1 3.98Å; L113-L115 HydrophobicContact CD2-CG 4.39Å; L113-L115 HydrophobicContact CG-CD1 4.09Å; L113-L115 HydrophobicContact CG-CG 3.94Å; L115-N118 PolarHBondContact O-ND2 3.04Å; L115-I120 HydrophobicContact CB-CD1 3.8Å; L115-I120 HydrophobicContact CD1-CD1 3.86Å; L115-I120 HydrophobicContact CG-CD1 4.43Å; L115-I137 PolarHBondContact N-O 2.92Å; L115-L138 HydrophobicContact CB-CD2 4.04Å; L115-L138 HydrophobicContact CD1-CD2 4.22Å; L115-N141 PolarHBondContact O-ND2 3.3Å
116	G	98.6	Very high	91.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.			trans	-61.5	156.5	178.1	0	0	0	0	0	112.4	Y88 N89 N114 N118 I137 H139	Y88-G116 CarbonylContact C-O 3.47Å; Y88-G116 WeakPolarHBondContact CA-O 3.43Å; Y88-G116 WeakPolarHBondContact CB-O 3.45Å; N89-G116 PolarHBondContact N-O 3.21Å; N114-G116 PolarHBondContact OD1-N 2.84Å; G116-N118 PolarHBondContact O-ND2 3.45Å; G116-I137 PolarHBondContact N-O 3.24Å; G116-H139 CarbonylContact C-O 3.44Å; G116-H139 WeakPolarHBondContact CA-O 3.28Å
117	Y	98.6	Very high	92.6	Very high	124 Å²	124	44 Å²	44	49%	0.486	21%	0.212	S	C	.	.	S	Bend	trans	53.2	61.5	-175.9	-67.8	-88.8	0	0	0	112.3	N89 N90 H139 K140	N89-Y117 WeakPolarHBondContact CA-O 3.09Å; N89-Y117 PolarHBondContact N-O 3.05Å; N89-Y117 VanDerWaalsContact N-O 3.12Å; N90-Y117 PolarHBondContact N-O 3.42Å; Y117-H139 AromaticContact CD2-CD2 3.5Å; Y117-H139 AromaticContact CD2-NE2 3.2Å; Y117-H139 WeakPolarHBondContact CD2-NE2 3.24Å; Y117-H139 AromaticContact CE2-CD2 3.44Å; Y117-H139 VanDerWaalsContact CE2-CD2 3.44Å; Y117-H139 WeakPolarHBondContact CE2-CD2 3.33Å; Y117-H139 AromaticContact CE2-NE2 3.16Å; Y117-H139 WeakPolarHBondContact CE2-NE2 3.07Å; Y117-H139 PolarHBondContact N-O 3.06Å; Y117-K140 VanDerWaalsContact CA-O 3.26Å; Y117-K140 WeakPolarHBondContact CA-O 3.48Å; Y117-K140 HydrophobicContact CD1-CB 3.8Å; Y117-K140 HydrophobicContact CD1-CG 4.09Å; Y117-K140 HydrophobicContact CD2-CB 4.34Å; Y117-K140 HydrophobicContact CD2-CG 4.48Å; Y117-K140 HydrophobicContact CE1-CB 4.01Å; Y117-K140 HydrophobicContact CE1-CG 3.76Å; Y117-K140 HydrophobicContact CE2-CG 4.16Å; Y117-K140 HydrophobicContact CG-CB 3.98Å; Y117-K140 HydrophobicContact CG-CG 4.44Å; Y117-K140 PolarHBondContact N-O 2.86Å
118	N	98.8	Very high	93.7	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	21%	0.21	C	C	.	.	S	Bend	trans	-134.5	-165.1	174.4	-86	-78.2	0	0	0	109	M87 N90 Q91 L92 L115 G116 I120 K140 N141	M87-N118 PolarHBondContact O-ND2 3.3Å; N90-N118 WeakPolarHBondContact CA-OD1 3.35Å; N90-N118 WeakPolarHBondContact CB-OD1 3.33Å; N90-N118 PolarHBondContact N-OD1 2.79Å; N90-N118 PolarHBondContact O-OD1 2.98Å; Q91-N118 PolarHBondContact N-OD1 2.95Å; L92-N118 HydrophobicContact CB-CB 4.11Å; L92-N118 VanDerWaalsContact CB-OD1 3.26Å; L92-N118 WeakPolarHBondContact CB-OD1 3.45Å; L92-N118 VanDerWaalsContact CG-OD1 3.27Å; L92-N118 WeakPolarHBondContact CG-OD1 3.35Å; L92-N118 PolarHBondContact N-OD1 3.1Å; L115-N118 PolarHBondContact O-ND2 3.04Å; G116-N118 PolarHBondContact O-ND2 3.45Å; N118-I120 HydrophobicContact CB-CD1 4.33Å; N118-I120 HydrophobicContact CB-CG1 4.2Å; N118-K140 PolarHBondContact N-O 2.79Å; N118-N141 WeakPolarHBondContact CA-OD1 3.26Å; N118-N141 WeakPolarHBondContact CB-OD1 3.44Å; N118-N141 PolarHBondContact O-OD1 3.43Å
119	H	98.3	Very high	94.3	Very high	81 Å²	81	42.1 Å²	42.1	38%	0.375	20%	0.202	S	C	.	.			trans	-117.2	28.2	180	-57.7	-31.3	0	0	0	112.2	L92 Q93 L121 N141 F142	L92-H119 CarbonylContact O-C 3.22Å; L92-H119 VanDerWaalsContact O-CA 3.24Å; L92-H119 WeakPolarHBondContact O-CA 3.37Å; L92-H119 PolarHBondContact O-N 3.42Å; Q93-H119 HydrophobicContact CG-CB 4.28Å; H119-L121 PolarHBondContact O-N 3.48Å; H119-N141 PolarHBondContact N-OD1 3.11Å; H119-F142 HydrophobicContact CB-CD2 4.19Å; H119-F142 HydrophobicContact CB-CE2 4.15Å; H119-F142 AromaticContact ND1-CE2 3.51Å
120	I	98.3	Very high	94.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.			trans	-69.4	123.2	-174.1	-59.9	167.9	0	0	0	109.8	L92 Q93 I95 L115 N118 A122 L123 L138 N141 F142 I143	L92-I120 HydrophobicContact CB-CG1 4.33Å; L92-I120 WeakPolarHBondContact O-CG1 3.42Å; L92-I120 PolarHBondContact O-N 3.21Å; L92-I120 VanDerWaalsContact O-N 3.14Å; Q93-I120 WeakPolarHBondContact O-CA 3.49Å; I95-I120 HydrophobicContact CD1-CD1 4.2Å; I95-I120 HydrophobicContact CG1-CD1 3.98Å; I95-I120 HydrophobicContact CG1-CG2 4.4Å; L115-I120 HydrophobicContact CB-CD1 3.8Å; L115-I120 HydrophobicContact CD1-CD1 3.86Å; L115-I120 HydrophobicContact CG-CD1 4.43Å; N118-I120 HydrophobicContact CB-CD1 4.33Å; N118-I120 HydrophobicContact CB-CG1 4.2Å; I120-A122 WeakPolarHBondContact CG2-O 2.94Å; I120-L123 HydrophobicContact CG2-CD2 4.41Å; I120-L138 HydrophobicContact CD1-CD2 4.47Å; I120-N141 HydrophobicContact CB-CB 4.28Å; I120-N141 VanDerWaalsContact CB-OD1 3.28Å; I120-N141 WeakPolarHBondContact CB-OD1 3.47Å; I120-N141 WeakPolarHBondContact CG1-OD1 3.41Å; I120-N141 PolarHBondContact N-OD1 3.14Å; I120-F142 CarbonylContact O-C 3.43Å; I120-F142 VanDerWaalsContact O-C 3.22Å; I120-F142 WeakPolarHBondContact O-CA 3.5Å; I120-F142 PolarHBondContact O-N 3.26Å; I120-I143 HydrophobicContact CG2-CD1 4.47Å; I120-I143 HydrophobicContact CG2-CG1 4.18Å; I120-I143 PolarHBondContact O-N 2.99Å
121	L	96.3	Very high	94.1	Very high	104 Å²	104	44.7 Å²	44.7	55%	0.545	21%	0.214	S	C	.	.			trans	-91	-31.5	-178.2	-64.9	168.5	0	0	0	113.5	Q93 H119 F142 I143 T144	Q93-L121 PolarHBondContact O-N 3.41Å; H119-L121 PolarHBondContact O-N 3.48Å; L121-F142 HydrophobicContact CD2-CB 3.78Å; L121-I143 WeakPolarHBondContact O-CA 3.4Å; L121-T144 PolarHBondContact O-N 3.45Å
122	A	94.4	Very high	93.9	Very high	46 Å²	46	45.4 Å²	45.4	38%	0.38	22%	0.219	S	C	.	.			trans	-155.7	153.6	-177.8	0	0	0	0	0	111	I120	I120-A122 WeakPolarHBondContact CG2-O 2.94Å
123	L	93.4	Very high	93.8	Very high	14 Å²	14	41.8 Å²	41.8	7%	0.073	21%	0.205	C	C	.	.			trans	-92.6	144.7	166.8	-51.6	178.4	0	0	0	109.2	I95 I120 F127 L138 I143 L146 P147 F150	I95-L123 HydrophobicContact CD1-CD2 3.6Å; I120-L123 HydrophobicContact CG2-CD2 4.41Å; L123-F127 HydrophobicContact CB-CB 4.25Å; L123-F127 HydrophobicContact CB-CD2 3.92Å; L123-F127 HydrophobicContact CB-CE2 4.49Å; L123-F127 HydrophobicContact CB-CG 4.07Å; L123-F127 HydrophobicContact CD1-CD1 4.09Å; L123-F127 HydrophobicContact CD1-CD2 4.34Å; L123-F127 HydrophobicContact CD1-CE1 4.16Å; L123-F127 HydrophobicContact CD1-CE2 4.39Å; L123-F127 HydrophobicContact CD1-CG 4.19Å; L123-F127 HydrophobicContact CD1-CZ 4.3Å; L123-F127 HydrophobicContact CD2-CD2 4.25Å; L123-F127 HydrophobicContact CD2-CE2 3.97Å; L123-F127 HydrophobicContact CD2-CZ 4.38Å; L123-F127 HydrophobicContact CG-CD2 4.4Å; L123-L138 HydrophobicContact CD1-CD1 3.92Å; L123-L138 HydrophobicContact CD2-CD1 4Å; L123-L138 HydrophobicContact CD2-CD2 4.21Å; L123-I143 HydrophobicContact CD2-CD1 4.02Å; L123-I143 HydrophobicContact CG-CD1 4.33Å; L123-L146 HydrophobicContact CD1-CD2 3.87Å; L123-P147 HydrophobicContact CB-CG 4.32Å; L123-F150 HydrophobicContact CD1-CD2 3.99Å; L123-F150 HydrophobicContact CD1-CE2 3.6Å
124	P	91.3	Very high	93.8	Very high	19 Å²	19	45.9 Å²	45.9	12%	0.123	22%	0.223	C	C	.	.			trans	-63.8	153.2	177.8	24.9	-33.7	0	0	0	112.3	F100 N126 F127	F100-P124 HydrophobicContact CD2-CB 4.24Å; F100-P124 HydrophobicContact CD2-CG 3.43Å; F100-P124 VanDerWaalsContact CD2-CG 3.43Å; F100-P124 HydrophobicContact CE2-CB 4.39Å; F100-P124 HydrophobicContact CE2-CG 3.17Å; F100-P124 HydrophobicContact CG-CG 4.34Å; F100-P124 HydrophobicContact CZ-CG 3.89Å; P124-N126 PolarHBondContact O-N 2.96Å; P124-N126 VanDerWaalsContact O-N 3.08Å; P124-F127 HydrophobicContact CG-CD2 4.19Å; P124-F127 VanDerWaalsContact O-CB 3.25Å; P124-F127 WeakPolarHBondContact O-CB 3.45Å; P124-F127 PolarHBondContact O-N 2.99Å
125	F	87.5	Confident	93.8	Very high	156 Å²	156	46.6 Å²	46.6	68%	0.684	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.1	-172.7	74.8	-87.3	0	0	0	113.9	T149	F125-T149 WeakPolarHBondContact O-CB 3.45Å; F125-T149 WeakPolarHBondContact O-CG2 3.37Å; F125-T149 PolarHBondContact O-OG1 2.73Å
126	N	87	Confident	93.8	Very high	17 Å²	17	46.6 Å²	46.6	9%	0.091	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	15.2	180	53.3	-8.7	0	0	0	113.2	F100 P124 G128 L129	F100-N126 HydrophobicContact CB-CB 3.98Å; F100-N126 WeakPolarHBondContact CB-ND2 3.47Å; F100-N126 WeakPolarHBondContact CB-OD1 3.35Å; F100-N126 WeakPolarHBondContact CD1-O 3.29Å; F100-N126 PolarHBondContact O-ND2 3.26Å; P124-N126 PolarHBondContact O-N 2.96Å; P124-N126 VanDerWaalsContact O-N 3.08Å; N126-G128 PolarHBondContact O-N 2.92Å; N126-G128 VanDerWaalsContact O-N 3.14Å; N126-L129 HydrophobicContact CB-CD1 3.87Å; N126-L129 HydrophobicContact CB-CG 4.28Å; N126-L129 WeakPolarHBondContact O-CB 3.39Å; N126-L129 WeakPolarHBondContact O-CG 3.19Å; N126-L129 PolarHBondContact O-N 2.8Å
127	F	89	Confident	93.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-56.4	-31.2	178	-161.2	-88.9	0	0	0	113.5	I95 F100 L113 L123 P124 L129 L130 L136 P147 F150 L153	I95-F127 HydrophobicContact CD1-CE2 3.76Å; F100-F127 HydrophobicContact CE1-CB 4.26Å; F100-F127 AromaticContact CE1-CD2 3.56Å; F100-F127 HydrophobicContact CE1-CD2 3.56Å; F100-F127 HydrophobicContact CE1-CE2 4.06Å; F100-F127 AromaticContact CE1-CG 4Å; F100-F127 HydrophobicContact CE1-CG 4Å; F100-F127 HydrophobicContact CE2-CD2 4.14Å; F100-F127 AromaticContact CZ-CD2 3.25Å; F100-F127 HydrophobicContact CZ-CD2 3.25Å; F100-F127 AromaticContact CZ-CE2 3.61Å; F100-F127 HydrophobicContact CZ-CE2 3.61Å; F100-F127 HydrophobicContact CZ-CG 4.14Å; L113-F127 HydrophobicContact CD2-CZ 4.41Å; L123-F127 HydrophobicContact CB-CB 4.25Å; L123-F127 HydrophobicContact CB-CD2 3.92Å; L123-F127 HydrophobicContact CB-CE2 4.49Å; L123-F127 HydrophobicContact CB-CG 4.07Å; L123-F127 HydrophobicContact CD1-CD1 4.09Å; L123-F127 HydrophobicContact CD1-CD2 4.34Å; L123-F127 HydrophobicContact CD1-CE1 4.16Å; L123-F127 HydrophobicContact CD1-CE2 4.39Å; L123-F127 HydrophobicContact CD1-CG 4.19Å; L123-F127 HydrophobicContact CD1-CZ 4.3Å; L123-F127 HydrophobicContact CD2-CD2 4.25Å; L123-F127 HydrophobicContact CD2-CE2 3.97Å; L123-F127 HydrophobicContact CD2-CZ 4.38Å; L123-F127 HydrophobicContact CG-CD2 4.4Å; P124-F127 HydrophobicContact CG-CD2 4.19Å; P124-F127 VanDerWaalsContact O-CB 3.25Å; P124-F127 WeakPolarHBondContact O-CB 3.45Å; P124-F127 PolarHBondContact O-N 2.99Å; F127-L129 PolarHBondContact O-N 2.79Å; F127-L130 HydrophobicContact CD1-CD1 4.42Å; F127-L130 HydrophobicContact CE1-CD1 4.05Å; F127-L130 HydrophobicContact CE2-CD1 4.28Å; F127-L130 HydrophobicContact CZ-CD1 3.98Å; F127-L130 PolarHBondContact O-N 2.95Å; F127-L136 HydrophobicContact CE1-CD1 4.35Å; F127-L136 HydrophobicContact CE1-CD2 3.48Å; F127-L136 VanDerWaalsContact CE1-CD2 3.48Å; F127-L136 HydrophobicContact CZ-CD1 3.91Å; F127-L136 HydrophobicContact CZ-CD2 3.85Å; F127-P147 HydrophobicContact CB-CG 3.92Å; F127-F150 AromaticContact CD1-CD2 4Å; F127-F150 HydrophobicContact CD1-CD2 4Å; F127-F150 AromaticContact CD1-CE2 3.91Å; F127-F150 HydrophobicContact CD1-CE2 3.91Å; F127-F150 AromaticContact CE1-CE2 3.98Å; F127-F150 HydrophobicContact CE1-CE2 3.98Å; F127-L153 HydrophobicContact CD1-CD1 4.19Å; F127-L153 HydrophobicContact CE1-CD1 4.2Å
128	G	89	Confident	93.8	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.01	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-61.6	-9.6	175.6	0	0	0	0	0	115.9	N126 L130 T149	N126-G128 PolarHBondContact O-N 2.92Å; N126-G128 VanDerWaalsContact O-N 3.14Å; G128-L130 VanDerWaalsContact C-N 3.27Å; G128-L130 PolarHBondContact O-N 2.92Å; G128-T149 VanDerWaalsContact CA-O 3.31Å; G128-T149 WeakPolarHBondContact CA-O 3.35Å; G128-T149 PolarHBondContact N-OG1 2.83Å
129	L	87.7	Confident	93.7	Very high	68 Å²	68	43 Å²	43	36%	0.356	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-75.5	-9.3	179.3	-64.1	-178.6	0	0	0	114.2	F100 N126 F127 K131	F100-L129 WeakPolarHBondContact O-CD1 3.42Å; N126-L129 HydrophobicContact CB-CD1 3.87Å; N126-L129 HydrophobicContact CB-CG 4.28Å; N126-L129 WeakPolarHBondContact O-CB 3.39Å; N126-L129 WeakPolarHBondContact O-CG 3.19Å; N126-L129 PolarHBondContact O-N 2.8Å; F127-L129 PolarHBondContact O-N 2.79Å; L129-K131 PolarHBondContact O-N 2.93Å
130	L	90.1	Very high	93.7	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.026	22%	0.218	C	C	.	.			trans	-73.4	67.5	175.7	-67.8	166.1	0	0	0	112.1	F100 L107 L110 F127 G128 N132 M133 L153	F100-L130 HydrophobicContact CD1-CD1 4.49Å; F100-L130 HydrophobicContact CD1-CG 4.21Å; F100-L130 HydrophobicContact CE1-CD1 3.54Å; F100-L130 HydrophobicContact CE1-CD2 4.33Å; F100-L130 HydrophobicContact CE1-CG 3.72Å; F100-L130 HydrophobicContact CZ-CD1 4.28Å; L107-L130 HydrophobicContact CD2-CD2 3.42Å; L107-L130 VanDerWaalsContact CD2-CD2 3.42Å; L107-L130 HydrophobicContact CD2-CG 4.05Å; L110-L130 HydrophobicContact CB-CD2 4.44Å; F127-L130 HydrophobicContact CD1-CD1 4.42Å; F127-L130 HydrophobicContact CE1-CD1 4.05Å; F127-L130 HydrophobicContact CE2-CD1 4.28Å; F127-L130 HydrophobicContact CZ-CD1 3.98Å; F127-L130 PolarHBondContact O-N 2.95Å; G128-L130 VanDerWaalsContact C-N 3.27Å; G128-L130 PolarHBondContact O-N 2.92Å; L130-N132 PolarHBondContact O-N 3.39Å; L130-N132 VanDerWaalsContact O-N 3.1Å; L130-M133 HydrophobicContact CB-CB 4Å; L130-M133 HydrophobicContact CB-CE 4.38Å; L130-M133 HydrophobicContact CD1-CE 3.7Å; L130-M133 HydrophobicContact CD2-CE 4.25Å; L130-M133 HydrophobicContact CG-CE 4.36Å; L130-M133 VanDerWaalsContact O-CB 3.31Å; L130-M133 WeakPolarHBondContact O-CB 3.26Å; L130-M133 PolarHBondContact O-N 3.37Å; L130-L153 HydrophobicContact CB-CD2 3.74Å; L130-L153 WeakPolarHBondContact O-CD2 3.38Å
131	K	88.8	Confident	93.7	Very high	141 Å²	141	44.1 Å²	44.1	61%	0.613	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.8	-170.9	-66.4	-179.1	-177.1	178.5	0	114.6	L129 S155	L129-K131 PolarHBondContact O-N 2.93Å; K131-S155 WeakPolarHBondContact O-CB 3.15Å; K131-S155 PolarHBondContact O-OG 2.88Å
132	N	93.8	Very high	93.8	Very high	72 Å²	72	43.7 Å²	43.7	39%	0.385	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	0.5	-179.5	-72.8	-39.9	0	0	0	113.9	N108 L110 E111 L130 K134	N108-N132 PolarHBondContact O-ND2 3.14Å; L110-N132 CarbonylContact O-C 3.21Å; E111-N132 WeakPolarHBondContact CA-O 3.32Å; L130-N132 PolarHBondContact O-N 3.39Å; L130-N132 VanDerWaalsContact O-N 3.1Å; N132-K134 PolarHBondContact O-N 3.42Å
133	M	95.4	Very high	93.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.195	C	C	.	.			trans	-62.2	123.2	179.2	-168.6	59.1	69.5	0	0	110.6	L110 L113 L130 L136 L153 S155 L156	L110-M133 HydrophobicContact CB-CE 4.25Å; L110-M133 HydrophobicContact CD2-CE 3.75Å; L110-M133 HydrophobicContact CG-CE 3.93Å; L110-M133 PolarHBondContact O-N 3.26Å; L113-M133 HydrophobicContact CB-CE 3.57Å; L113-M133 HydrophobicContact CB-SD 3.95Å; L113-M133 HydrophobicContact CD2-CE 4.23Å; L130-M133 HydrophobicContact CB-CB 4Å; L130-M133 HydrophobicContact CB-CE 4.38Å; L130-M133 HydrophobicContact CD1-CE 3.7Å; L130-M133 HydrophobicContact CD2-CE 4.25Å; L130-M133 HydrophobicContact CG-CE 4.36Å; L130-M133 VanDerWaalsContact O-CB 3.31Å; L130-M133 WeakPolarHBondContact O-CB 3.26Å; L130-M133 PolarHBondContact O-N 3.37Å; M133-L136 HydrophobicContact CG-CB 4.24Å; M133-L153 HydrophobicContact CB-CD2 4.41Å; M133-S155 CarbonylContact O-C 3.09Å; M133-S155 WeakPolarHBondContact O-CB 3.36Å; M133-L156 HydrophobicContact CG-CD1 3.84Å; M133-L156 WeakPolarHBondContact O-CA 3.07Å; M133-L156 PolarHBondContact O-N 3.38Å
134	K	97.6	Very high	93.8	Very high	94 Å²	94	44.2 Å²	44.2	41%	0.409	21%	0.213	S	C	.	.			trans	-108.3	-38.2	178.8	-64.8	175.3	-174.8	167.4	0	111.5	E111 N132 K157 V158	E111-K134 HydrophobicContact CB-CD 4.28Å; E111-K134 HydrophobicContact CB-CG 4.45Å; E111-K134 HydrophobicContact CG-CD 4.45Å; E111-K134 WeakPolarHBondContact O-CA 3.1Å; E111-K134 WeakPolarHBondContact O-CB 3.44Å; E111-K134 PolarHBondContact O-N 2.69Å; E111-K134 IonicContact OE1-NZ 3.94Å; E111-K134 WeakPolarHBondContact OE2-CE 3.39Å; E111-K134 IonicContact OE2-NZ 2.69Å; E111-K134 PolarHBondContact OE2-NZ 2.82Å; N132-K134 PolarHBondContact O-N 3.42Å; K134-K157 PolarHBondContact O-N 3.41Å; K134-V158 PolarHBondContact O-N 3.22Å
135	T	98.4	Very high	93.7	Very high	32 Å²	32	52 Å²	52	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	120.8	-178.2	-60.3	0	0	0	0	110	E111 Y112 L113 I137 V158	E111-T135 PolarHBondContact O-N 3.33Å; Y112-T135 WeakPolarHBondContact CA-O 3.31Å; Y112-T135 HydrophobicContact CD2-CG2 3.57Å; Y112-T135 HydrophobicContact CE2-CG2 3.63Å; L113-T135 PolarHBondContact N-O 3.06Å; T135-I137 HydrophobicContact CG2-CD1 3.9Å; T135-I137 HydrophobicContact CG2-CG1 4.01Å; T135-V158 WeakPolarHBondContact CA-O 3.2Å; T135-V158 HydrophobicContact CG2-CB 4.05Å; T135-V158 HydrophobicContact CG2-CG1 4.19Å
136	L	97.8	Very high	94	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	116.2	178.5	179.1	62.5	0	0	0	109.9	L113 F127 M133 L138 F150 L153 L156 V158 L159 D160	L113-L136 HydrophobicContact CB-CD1 3.97Å; L113-L136 HydrophobicContact CD2-CD1 3.88Å; L113-L136 HydrophobicContact CG-CD1 4.04Å; L113-L136 WeakPolarHBondContact O-CA 3.48Å; F127-L136 HydrophobicContact CE1-CD1 4.35Å; F127-L136 HydrophobicContact CE1-CD2 3.48Å; F127-L136 VanDerWaalsContact CE1-CD2 3.48Å; F127-L136 HydrophobicContact CZ-CD1 3.91Å; F127-L136 HydrophobicContact CZ-CD2 3.85Å; M133-L136 HydrophobicContact CG-CB 4.24Å; L136-L138 HydrophobicContact CD1-CD1 4Å; L136-L138 HydrophobicContact CD1-CD2 4.44Å; L136-L138 HydrophobicContact CD1-CG 3.95Å; L136-L138 HydrophobicContact CD2-CD1 3.71Å; L136-L138 HydrophobicContact CD2-CG 4.47Å; L136-L138 HydrophobicContact CG-CD1 3.76Å; L136-L138 HydrophobicContact CG-CG 3.97Å; L136-F150 HydrophobicContact CD2-CE2 4.04Å; L136-F150 HydrophobicContact CD2-CZ 3.89Å; L136-L153 HydrophobicContact CD2-CD1 4.48Å; L136-L156 HydrophobicContact CB-CD1 3.71Å; L136-V158 PolarHBondContact N-O 2.83Å; L136-L159 HydrophobicContact CB-CD1 4.16Å; L136-L159 HydrophobicContact CD2-CD1 3.94Å; L136-L159 HydrophobicContact CG-CD1 4.16Å; L136-L159 WeakPolarHBondContact O-CA 3.12Å; L136-D160 PolarHBondContact O-N 3.26Å
137	I	98.4	Very high	94.2	Very high	20 Å²	20	45 Å²	45	10%	0.103	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115.2	-178.8	-49.7	-60.4	0	0	0	108.7	L113 N114 L115 G116 T135 H139 V158 D160	L113-I137 PolarHBondContact O-N 3.4Å; N114-I137 HydrophobicContact CB-CB 4Å; N114-I137 HydrophobicContact CB-CG1 4.36Å; N114-I137 WeakPolarHBondContact OD1-CG2 3.27Å; L115-I137 PolarHBondContact N-O 2.92Å; G116-I137 PolarHBondContact N-O 3.24Å; T135-I137 HydrophobicContact CG2-CD1 3.9Å; T135-I137 HydrophobicContact CG2-CG1 4.01Å; I137-H139 WeakPolarHBondContact CG2-CE1 3.15Å; I137-H139 WeakPolarHBondContact CG2-ND1 3.26Å; I137-V158 HydrophobicContact CD1-CG1 4.32Å; I137-D160 HydrophobicContact CD1-CB 3.7Å; I137-D160 HydrophobicContact CG2-CB 4.24Å
138	L	98.3	Very high	94	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.233	C	C	.	.			trans	-133.3	14	-175.3	-71.4	169	0	0	0	111.7	L115 I120 L123 L136 N141 I143 D160 L161 N164	L115-L138 HydrophobicContact CB-CD2 4.04Å; L115-L138 HydrophobicContact CD1-CD2 4.22Å; I120-L138 HydrophobicContact CD1-CD2 4.47Å; L123-L138 HydrophobicContact CD1-CD1 3.92Å; L123-L138 HydrophobicContact CD2-CD1 4Å; L123-L138 HydrophobicContact CD2-CD2 4.21Å; L136-L138 HydrophobicContact CD1-CD1 4Å; L136-L138 HydrophobicContact CD1-CD2 4.44Å; L136-L138 HydrophobicContact CD1-CG 3.95Å; L136-L138 HydrophobicContact CD2-CD1 3.71Å; L136-L138 HydrophobicContact CD2-CG 4.47Å; L136-L138 HydrophobicContact CG-CD1 3.76Å; L136-L138 HydrophobicContact CG-CG 3.97Å; L138-N141 PolarHBondContact O-ND2 2.79Å; L138-I143 HydrophobicContact CB-CD1 4.07Å; L138-I143 HydrophobicContact CD1-CD1 4.11Å; L138-I143 HydrophobicContact CD2-CD1 4.25Å; L138-I143 HydrophobicContact CG-CD1 4.39Å; L138-D160 CarbonylContact C-O 3.46Å; L138-D160 WeakPolarHBondContact CA-O 3.33Å; L138-D160 PolarHBondContact N-O 3.12Å; L138-L161 HydrophobicContact CB-CD2 3.98Å; L138-L161 HydrophobicContact CD1-CD2 3.91Å; L138-N164 PolarHBondContact O-ND2 3.03Å
139	H	97.7	Very high	94.1	Very high	34 Å²	34	51.3 Å²	51.3	16%	0.157	24%	0.241	C	C	.	.			trans	-58.3	155.6	-179.6	61.3	-108.4	0	0	0	112.8	G116 Y117 I137 N141 D160 A162	G116-H139 CarbonylContact C-O 3.44Å; G116-H139 WeakPolarHBondContact CA-O 3.28Å; Y117-H139 AromaticContact CD2-CD2 3.5Å; Y117-H139 AromaticContact CD2-NE2 3.2Å; Y117-H139 WeakPolarHBondContact CD2-NE2 3.24Å; Y117-H139 AromaticContact CE2-CD2 3.44Å; Y117-H139 VanDerWaalsContact CE2-CD2 3.44Å; Y117-H139 WeakPolarHBondContact CE2-CD2 3.33Å; Y117-H139 AromaticContact CE2-NE2 3.16Å; Y117-H139 WeakPolarHBondContact CE2-NE2 3.07Å; Y117-H139 PolarHBondContact N-O 3.06Å; I137-H139 WeakPolarHBondContact CG2-CE1 3.15Å; I137-H139 WeakPolarHBondContact CG2-ND1 3.26Å; H139-N141 VanDerWaalsContact C-N 3.34Å; H139-N141 PolarHBondContact O-N 3.37Å; H139-N141 PolarHBondContact O-ND2 3.18Å; H139-D160 WeakPolarHBondContact CB-OD1 3.3Å; H139-D160 IonicContact CE1-OD2 3.76Å; H139-D160 IonicContact CG-OD2 3.49Å; H139-D160 PolarHBondContact N-O 3.39Å; H139-D160 IonicContact ND1-OD2 2.73Å; H139-D160 PolarHBondContact ND1-OD2 3.28Å; H139-A162 CarbonylContact C-O 3.21Å; H139-A162 WeakPolarHBondContact CA-O 3.07Å; H139-A162 HydrophobicContact CB-CB 4.08Å; H139-A162 WeakPolarHBondContact CB-O 3.27Å
140	K	98	Very high	94.3	Very high	99 Å²	99	48.1 Å²	48.1	43%	0.43	22%	0.224	S	C	.	.	S	Bend	trans	54	52.5	175.9	-55.7	-67.8	-179.7	179.9	0	111.5	Y117 N118 A162 G163	Y117-K140 VanDerWaalsContact CA-O 3.26Å; Y117-K140 WeakPolarHBondContact CA-O 3.48Å; Y117-K140 HydrophobicContact CD1-CB 3.8Å; Y117-K140 HydrophobicContact CD1-CG 4.09Å; Y117-K140 HydrophobicContact CD2-CB 4.34Å; Y117-K140 HydrophobicContact CD2-CG 4.48Å; Y117-K140 HydrophobicContact CE1-CB 4.01Å; Y117-K140 HydrophobicContact CE1-CG 3.76Å; Y117-K140 HydrophobicContact CE2-CG 4.16Å; Y117-K140 HydrophobicContact CG-CB 3.98Å; Y117-K140 HydrophobicContact CG-CG 4.44Å; Y117-K140 PolarHBondContact N-O 2.86Å; N118-K140 PolarHBondContact N-O 2.79Å; K140-A162 PolarHBondContact N-O 2.87Å; K140-G163 WeakPolarHBondContact CA-O 3.22Å; K140-G163 PolarHBondContact N-O 3.4Å
141	N	98.6	Very high	94.3	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.021	22%	0.223	C	C	.	.	S	Bend	trans	-121.6	-169.4	167.9	-83.7	-79.7	0	0	0	108.4	L115 N118 H119 I120 L138 H139 I143 N164	L115-N141 PolarHBondContact O-ND2 3.3Å; N118-N141 WeakPolarHBondContact CA-OD1 3.26Å; N118-N141 WeakPolarHBondContact CB-OD1 3.44Å; N118-N141 PolarHBondContact O-OD1 3.43Å; H119-N141 PolarHBondContact N-OD1 3.11Å; I120-N141 HydrophobicContact CB-CB 4.28Å; I120-N141 VanDerWaalsContact CB-OD1 3.28Å; I120-N141 WeakPolarHBondContact CB-OD1 3.47Å; I120-N141 WeakPolarHBondContact CG1-OD1 3.41Å; I120-N141 PolarHBondContact N-OD1 3.14Å; L138-N141 PolarHBondContact O-ND2 2.79Å; H139-N141 VanDerWaalsContact C-N 3.34Å; H139-N141 PolarHBondContact O-N 3.37Å; H139-N141 PolarHBondContact O-ND2 3.18Å; N141-I143 HydrophobicContact CB-CD1 4.31Å; N141-I143 HydrophobicContact CB-CG1 4.11Å; N141-N164 WeakPolarHBondContact CA-OD1 3.3Å; N141-N164 WeakPolarHBondContact CB-OD1 3.44Å; N141-N164 PolarHBondContact O-OD1 3.27Å
142	F	97.5	Very high	94.4	Very high	95 Å²	95	45.2 Å²	45.2	42%	0.417	21%	0.213	S	C	.	.			trans	-115	28.2	178.9	-61.2	-68.8	0	0	0	112.1	H119 I120 L121 T144 N164	H119-F142 HydrophobicContact CB-CD2 4.19Å; H119-F142 HydrophobicContact CB-CE2 4.15Å; H119-F142 AromaticContact ND1-CE2 3.51Å; I120-F142 CarbonylContact O-C 3.43Å; I120-F142 VanDerWaalsContact O-C 3.22Å; I120-F142 WeakPolarHBondContact O-CA 3.5Å; I120-F142 PolarHBondContact O-N 3.26Å; L121-F142 HydrophobicContact CD2-CB 3.78Å; F142-T144 PolarHBondContact O-N 3.11Å; F142-N164 PolarHBondContact N-OD1 3.14Å
143	I	96.9	Very high	94.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.195	C	C	.	.			trans	-65.7	123.2	-174.9	-58.8	169.4	0	0	0	109.3	I120 L121 L123 L138 N141 R145 L146 N164 N165 L166	I120-I143 HydrophobicContact CG2-CD1 4.47Å; I120-I143 HydrophobicContact CG2-CG1 4.18Å; I120-I143 PolarHBondContact O-N 2.99Å; L121-I143 WeakPolarHBondContact O-CA 3.4Å; L123-I143 HydrophobicContact CD2-CD1 4.02Å; L123-I143 HydrophobicContact CG-CD1 4.33Å; L138-I143 HydrophobicContact CB-CD1 4.07Å; L138-I143 HydrophobicContact CD1-CD1 4.11Å; L138-I143 HydrophobicContact CD2-CD1 4.25Å; L138-I143 HydrophobicContact CG-CD1 4.39Å; N141-I143 HydrophobicContact CB-CD1 4.31Å; N141-I143 HydrophobicContact CB-CG1 4.11Å; I143-R145 WeakPolarHBondContact CG2-O 3.49Å; I143-L146 HydrophobicContact CG2-CD2 4.31Å; I143-N164 HydrophobicContact CB-CB 4.35Å; I143-N164 VanDerWaalsContact CB-OD1 3.3Å; I143-N164 WeakPolarHBondContact CB-OD1 3.33Å; I143-N164 WeakPolarHBondContact CG1-OD1 3.1Å; I143-N164 PolarHBondContact N-OD1 3.23Å; I143-N165 CarbonylContact O-C 3.58Å; I143-N165 WeakPolarHBondContact O-CA 3.26Å; I143-N165 PolarHBondContact O-N 3.02Å; I143-L166 HydrophobicContact CG2-CD2 4.01Å; I143-L166 PolarHBondContact O-N 2.94Å
144	T	90.7	Very high	94.3	Very high	72 Å²	72	46.9 Å²	46.9	44%	0.442	22%	0.217	S	C	.	.			trans	-95.6	-27.4	-178.3	52.5	0	0	0	0	113.3	L121 F142 N165	L121-T144 PolarHBondContact O-N 3.45Å; F142-T144 PolarHBondContact O-N 3.11Å; T144-N165 HydrophobicContact CG2-CB 4.06Å
145	R	89.7	Confident	94.3	Very high	183 Å²	183	44.4 Å²	44.4	69%	0.691	21%	0.211	S	C	*	.			trans	-152.1	151.5	178.8	61.4	-177.5	178.9	-179.8	-0.8	111.3	I143	I143-R145 WeakPolarHBondContact CG2-O 3.49Å
146	L	92.8	Very high	94.2	Very high	9 Å²	9	42.9 Å²	42.9	5%	0.047	20%	0.202	C	C	.	.			trans	-91.5	149.3	165.8	-54.7	179.1	0	0	0	109.6	L123 I143 F150 L161 L166 L169 P170 F173	L123-L146 HydrophobicContact CD1-CD2 3.87Å; I143-L146 HydrophobicContact CG2-CD2 4.31Å; L146-F150 HydrophobicContact CB-CB 4.17Å; L146-F150 HydrophobicContact CB-CD2 4.16Å; L146-F150 HydrophobicContact CB-CG 4.07Å; L146-F150 HydrophobicContact CD1-CD1 3.79Å; L146-F150 HydrophobicContact CD1-CD2 4.36Å; L146-F150 HydrophobicContact CD1-CE1 3.83Å; L146-F150 HydrophobicContact CD1-CE2 4.39Å; L146-F150 HydrophobicContact CD1-CG 4.06Å; L146-F150 HydrophobicContact CD1-CZ 4.13Å; L146-F150 HydrophobicContact CD2-CD2 4.24Å; L146-F150 HydrophobicContact CD2-CE2 4.02Å; L146-F150 HydrophobicContact CD2-CZ 4.33Å; L146-F150 HydrophobicContact CG-CD2 4.49Å; L146-L161 HydrophobicContact CD1-CD1 3.72Å; L146-L161 HydrophobicContact CD2-CD1 4.1Å; L146-L161 HydrophobicContact CD2-CD2 4.09Å; L146-L161 HydrophobicContact CG-CD1 4.38Å; L146-L166 HydrophobicContact CD2-CD2 4.21Å; L146-L166 HydrophobicContact CG-CD2 4.03Å; L146-L169 HydrophobicContact CD1-CD2 3.74Å; L146-L169 HydrophobicContact CG-CD2 4.43Å; L146-P170 HydrophobicContact CB-CG 4.22Å; L146-F173 HydrophobicContact CD1-CD2 4Å; L146-F173 HydrophobicContact CD1-CE2 3.95Å
147	P	91.3	Very high	94.1	Very high	16 Å²	16	46.4 Å²	46.4	10%	0.104	22%	0.217	C	C	.	.			trans	-69.4	152.6	176.9	28.1	-34.5	0	0	0	111.4	L123 F127 T149 F150	L123-P147 HydrophobicContact CB-CG 4.32Å; F127-P147 HydrophobicContact CB-CG 3.92Å; P147-T149 PolarHBondContact O-N 3.11Å; P147-F150 HydrophobicContact CG-CB 4.25Å; P147-F150 HydrophobicContact CG-CD2 4.3Å; P147-F150 WeakPolarHBondContact O-CB 3.36Å; P147-F150 PolarHBondContact O-N 2.9Å
148	E	86.7	Confident	94	Very high	103 Å²	103	46.6 Å²	46.6	48%	0.481	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-13.8	176.1	-70.2	-57.5	142.5	0	0	113.4	F150 P170 N172	E148-F150 VanDerWaalsContact C-N 3.31Å; E148-P170 WeakPolarHBondContact OE2-CB 3.47Å; E148-N172 PolarHBondContact O-ND2 2.96Å; E148-N172 PolarHBondContact O-OD1 2.95Å
149	T	89.7	Confident	93.9	Very high	31 Å²	31	46.6 Å²	46.6	19%	0.19	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-7.7	172.6	61.3	0	0	0	0	113	F125 G128 P147 G151 Q152	F125-T149 WeakPolarHBondContact O-CB 3.45Å; F125-T149 WeakPolarHBondContact O-CG2 3.37Å; F125-T149 PolarHBondContact O-OG1 2.73Å; G128-T149 VanDerWaalsContact CA-O 3.31Å; G128-T149 WeakPolarHBondContact CA-O 3.35Å; G128-T149 PolarHBondContact N-OG1 2.83Å; P147-T149 PolarHBondContact O-N 3.11Å; T149-G151 VanDerWaalsContact C-N 3.29Å; T149-G151 PolarHBondContact O-N 2.87Å; T149-Q152 WeakPolarHBondContact O-CB 3.41Å; T149-Q152 VanDerWaalsContact O-CG 3.23Å; T149-Q152 WeakPolarHBondContact O-CG 3.49Å; T149-Q152 PolarHBondContact O-N 3.3Å
150	F	91.6	Very high	93.8	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-60.5	-35.7	-169.5	-161.5	-89.8	0	0	0	113.3	L123 F127 L136 L146 P147 E148 Q152 L153 L156 L159 P170 F173 L176	L123-F150 HydrophobicContact CD1-CD2 3.99Å; L123-F150 HydrophobicContact CD1-CE2 3.6Å; F127-F150 AromaticContact CD1-CD2 4Å; F127-F150 HydrophobicContact CD1-CD2 4Å; F127-F150 AromaticContact CD1-CE2 3.91Å; F127-F150 HydrophobicContact CD1-CE2 3.91Å; F127-F150 AromaticContact CE1-CE2 3.98Å; F127-F150 HydrophobicContact CE1-CE2 3.98Å; L136-F150 HydrophobicContact CD2-CE2 4.04Å; L136-F150 HydrophobicContact CD2-CZ 3.89Å; L146-F150 HydrophobicContact CB-CB 4.17Å; L146-F150 HydrophobicContact CB-CD2 4.16Å; L146-F150 HydrophobicContact CB-CG 4.07Å; L146-F150 HydrophobicContact CD1-CD1 3.79Å; L146-F150 HydrophobicContact CD1-CD2 4.36Å; L146-F150 HydrophobicContact CD1-CE1 3.83Å; L146-F150 HydrophobicContact CD1-CE2 4.39Å; L146-F150 HydrophobicContact CD1-CG 4.06Å; L146-F150 HydrophobicContact CD1-CZ 4.13Å; L146-F150 HydrophobicContact CD2-CD2 4.24Å; L146-F150 HydrophobicContact CD2-CE2 4.02Å; L146-F150 HydrophobicContact CD2-CZ 4.33Å; L146-F150 HydrophobicContact CG-CD2 4.49Å; P147-F150 HydrophobicContact CG-CB 4.25Å; P147-F150 HydrophobicContact CG-CD2 4.3Å; P147-F150 WeakPolarHBondContact O-CB 3.36Å; P147-F150 PolarHBondContact O-N 2.9Å; E148-F150 VanDerWaalsContact C-N 3.31Å; F150-Q152 PolarHBondContact O-N 3.43Å; F150-L153 HydrophobicContact CD1-CD1 4.33Å; F150-L153 HydrophobicContact CD2-CD1 4.13Å; F150-L153 HydrophobicContact CE1-CD1 4.15Å; F150-L153 HydrophobicContact CE2-CD1 3.95Å; F150-L153 HydrophobicContact CG-CD1 4.32Å; F150-L153 HydrophobicContact CZ-CD1 3.97Å; F150-L153 WeakPolarHBondContact O-CG 3.49Å; F150-L153 PolarHBondContact O-N 2.95Å; F150-L156 HydrophobicContact CE1-CD2 4.39Å; F150-L159 HydrophobicContact CE1-CD1 4.4Å; F150-L159 HydrophobicContact CE1-CD2 3.67Å; F150-L159 HydrophobicContact CZ-CD1 3.91Å; F150-L159 HydrophobicContact CZ-CD2 4.03Å; F150-P170 HydrophobicContact CB-CG 4.32Å; F150-F173 HydrophobicContact CD1-CD2 4.12Å; F150-F173 HydrophobicContact CD1-CE2 4.32Å; F150-F173 HydrophobicContact CE1-CD2 4.4Å; F150-F173 HydrophobicContact CE1-CE2 4.13Å; F150-L176 HydrophobicContact CD1-CD1 3.93Å; F150-L176 HydrophobicContact CE1-CD1 3.94Å
151	G	90.1	Very high	93.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-62.8	-7.2	173.3	0	0	0	0	0	115.5	T149 L153 K154 N172	T149-G151 VanDerWaalsContact C-N 3.29Å; T149-G151 PolarHBondContact O-N 2.87Å; G151-L153 VanDerWaalsContact C-N 3.31Å; G151-K154 WeakPolarHBondContact O-CE 3.5Å; G151-K154 PolarHBondContact O-NZ 3.47Å; G151-N172 WeakPolarHBondContact CA-O 3.36Å; G151-N172 PolarHBondContact N-ND2 3.12Å; G151-N172 PolarHBondContact N-OD1 2.94Å
152	Q	92.3	Very high	93.3	Very high	86 Å²	86	41.2 Å²	41.2	40%	0.402	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-80	-9	175.8	-59.6	175.8	4.1	0	0	113.5	T149 F150 K154	T149-Q152 WeakPolarHBondContact O-CB 3.41Å; T149-Q152 VanDerWaalsContact O-CG 3.23Å; T149-Q152 WeakPolarHBondContact O-CG 3.49Å; T149-Q152 PolarHBondContact O-N 3.3Å; F150-Q152 PolarHBondContact O-N 3.43Å; Q152-K154 PolarHBondContact O-N 2.93Å
153	L	94.1	Very high	93.1	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.184	C	C	.	.			trans	-72	63.5	176	-60	173	0	0	0	111.9	F127 L130 M133 L136 F150 G151 S155 L156 L176	F127-L153 HydrophobicContact CD1-CD1 4.19Å; F127-L153 HydrophobicContact CE1-CD1 4.2Å; L130-L153 HydrophobicContact CB-CD2 3.74Å; L130-L153 WeakPolarHBondContact O-CD2 3.38Å; M133-L153 HydrophobicContact CB-CD2 4.41Å; L136-L153 HydrophobicContact CD2-CD1 4.48Å; F150-L153 HydrophobicContact CD1-CD1 4.33Å; F150-L153 HydrophobicContact CD2-CD1 4.13Å; F150-L153 HydrophobicContact CE1-CD1 4.15Å; F150-L153 HydrophobicContact CE2-CD1 3.95Å; F150-L153 HydrophobicContact CG-CD1 4.32Å; F150-L153 HydrophobicContact CZ-CD1 3.97Å; F150-L153 WeakPolarHBondContact O-CG 3.49Å; F150-L153 PolarHBondContact O-N 2.95Å; G151-L153 VanDerWaalsContact C-N 3.31Å; L153-S155 PolarHBondContact O-N 3.4Å; L153-S155 VanDerWaalsContact O-N 3.14Å; L153-L156 HydrophobicContact CB-CB 3.95Å; L153-L156 HydrophobicContact CB-CD2 4.26Å; L153-L156 HydrophobicContact CD1-CD2 3.99Å; L153-L156 WeakPolarHBondContact O-CB 3.16Å; L153-L156 PolarHBondContact O-N 2.94Å; L153-L176 HydrophobicContact CB-CD2 3.98Å; L153-L176 WeakPolarHBondContact O-CD2 3.11Å
154	K	93	Very high	92.9	Very high	106 Å²	106	37.5 Å²	37.5	46%	0.461	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.5	-170.8	-59.1	-49	-176.4	-168.1	0	114.4	G151 Q152 L156	G151-K154 WeakPolarHBondContact O-CE 3.5Å; G151-K154 PolarHBondContact O-NZ 3.47Å; Q152-K154 PolarHBondContact O-N 2.93Å; K154-L156 VanDerWaalsContact C-N 3.35Å
155	S	96.2	Very high	92.9	Very high	41 Å²	41	37.4 Å²	37.4	29%	0.287	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-10.8	177.9	-60.1	0	0	0	0	113.6	K131 M133 L153 K157	K131-S155 WeakPolarHBondContact O-CB 3.15Å; K131-S155 PolarHBondContact O-OG 2.88Å; M133-S155 CarbonylContact O-C 3.09Å; M133-S155 WeakPolarHBondContact O-CB 3.36Å; L153-S155 PolarHBondContact O-N 3.4Å; L153-S155 VanDerWaalsContact O-N 3.14Å; S155-K157 PolarHBondContact O-N 3.21Å
156	L	96.7	Very high	92.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.149	C	C	.	.			trans	-67.5	128.1	-172.6	-168.5	68	0	0	0	110.8	M133 L136 F150 L153 K154 L159 L176 L178	M133-L156 HydrophobicContact CG-CD1 3.84Å; M133-L156 WeakPolarHBondContact O-CA 3.07Å; M133-L156 PolarHBondContact O-N 3.38Å; L136-L156 HydrophobicContact CB-CD1 3.71Å; F150-L156 HydrophobicContact CE1-CD2 4.39Å; L153-L156 HydrophobicContact CB-CB 3.95Å; L153-L156 HydrophobicContact CB-CD2 4.26Å; L153-L156 HydrophobicContact CD1-CD2 3.99Å; L153-L156 WeakPolarHBondContact O-CB 3.16Å; L153-L156 PolarHBondContact O-N 2.94Å; K154-L156 VanDerWaalsContact C-N 3.35Å; L156-L159 HydrophobicContact CD2-CB 4.06Å; L156-L159 HydrophobicContact CD2-CD1 4.27Å; L156-L159 HydrophobicContact CD2-CD2 4.18Å; L156-L159 HydrophobicContact CD2-CG 4.41Å; L156-L176 HydrophobicContact CD2-CD1 4.41Å; L156-L178 HydrophobicContact CB-CD2 4.19Å; L156-L178 HydrophobicContact CD2-CD2 3.89Å; L156-L178 HydrophobicContact CG-CD2 3.76Å
157	K	95.8	Very high	92.2	Very high	74 Å²	74	34.5 Å²	34.5	32%	0.322	18%	0.176	S	C	.	.			trans	-119.6	-36.2	-179.1	-61	-52.7	174.3	-160.1	0	112.9	K134 S155 K177 K179 E180	K134-K157 PolarHBondContact O-N 3.41Å; S155-K157 PolarHBondContact O-N 3.21Å; K157-K177 WeakPolarHBondContact CD-O 3.33Å; K157-K177 PolarHBondContact NZ-O 3.42Å; K157-K177 VanDerWaalsContact NZ-O 3.15Å; K157-K179 HydrophobicContact CB-CD 4.41Å; K157-K179 HydrophobicContact CB-CG 4.36Å; K157-K179 HydrophobicContact CD-CG 4.31Å; K157-K179 PolarHBondContact O-N 2.79Å; K157-E180 PolarHBondContact O-N 2.99Å
158	V	96.5	Very high	91.7	Very high	24 Å²	24	36.8 Å²	36.8	15%	0.145	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.8	178.6	-178.4	0	0	0	0	107.8	K134 T135 L136 I137 E180	K134-V158 PolarHBondContact O-N 3.22Å; T135-V158 WeakPolarHBondContact CA-O 3.2Å; T135-V158 HydrophobicContact CG2-CB 4.05Å; T135-V158 HydrophobicContact CG2-CG1 4.19Å; L136-V158 PolarHBondContact N-O 2.83Å; I137-V158 HydrophobicContact CD1-CG1 4.32Å; V158-E180 HydrophobicContact CB-CB 4.49Å; V158-E180 HydrophobicContact CG1-CB 4.17Å; V158-E180 HydrophobicContact CG2-CB 4.24Å
159	L	96.1	Very high	91.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	121.4	177.7	174.9	58.7	0	0	0	109.5	L136 F150 L156 L161 F173 L178 E180 F181 Y182	L136-L159 HydrophobicContact CB-CD1 4.16Å; L136-L159 HydrophobicContact CD2-CD1 3.94Å; L136-L159 HydrophobicContact CG-CD1 4.16Å; L136-L159 WeakPolarHBondContact O-CA 3.12Å; F150-L159 HydrophobicContact CE1-CD1 4.4Å; F150-L159 HydrophobicContact CE1-CD2 3.67Å; F150-L159 HydrophobicContact CZ-CD1 3.91Å; F150-L159 HydrophobicContact CZ-CD2 4.03Å; L156-L159 HydrophobicContact CD2-CB 4.06Å; L156-L159 HydrophobicContact CD2-CD1 4.27Å; L156-L159 HydrophobicContact CD2-CD2 4.18Å; L156-L159 HydrophobicContact CD2-CG 4.41Å; L159-L161 HydrophobicContact CD1-CD1 4.3Å; L159-L161 HydrophobicContact CD1-CD2 4.09Å; L159-L161 HydrophobicContact CD1-CG 3.86Å; L159-L161 HydrophobicContact CD2-CD1 3.98Å; L159-L161 HydrophobicContact CD2-CG 4.35Å; L159-L161 HydrophobicContact CG-CD1 4.18Å; L159-L161 HydrophobicContact CG-CG 3.99Å; L159-F173 HydrophobicContact CD2-CE2 3.73Å; L159-F173 HydrophobicContact CD2-CZ 3.89Å; L159-L178 HydrophobicContact CB-CD1 4.08Å; L159-L178 HydrophobicContact CB-CD2 3.93Å; L159-L178 HydrophobicContact CD2-CD1 4.01Å; L159-E180 PolarHBondContact N-O 3.2Å; L159-F181 HydrophobicContact CB-CD2 4.04Å; L159-F181 HydrophobicContact CD2-CD2 3.85Å; L159-F181 HydrophobicContact CD2-CE2 3.73Å; L159-F181 HydrophobicContact CG-CD2 3.87Å; L159-F181 HydrophobicContact CG-CE2 3.97Å; L159-F181 VanDerWaalsContact O-CA 3.31Å; L159-F181 WeakPolarHBondContact O-CA 3.19Å; L159-Y182 PolarHBondContact O-N 3.49Å
160	D	96.2	Very high	91.3	Very high	21 Å²	21	30.7 Å²	30.7	11%	0.112	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	110.9	175.6	-176.9	0.9	0	0	0	110.3	L136 I137 L138 H139 A162 Y182	L136-D160 PolarHBondContact O-N 3.26Å; I137-D160 HydrophobicContact CD1-CB 3.7Å; I137-D160 HydrophobicContact CG2-CB 4.24Å; L138-D160 CarbonylContact C-O 3.46Å; L138-D160 WeakPolarHBondContact CA-O 3.33Å; L138-D160 PolarHBondContact N-O 3.12Å; H139-D160 WeakPolarHBondContact CB-OD1 3.3Å; H139-D160 IonicContact CE1-OD2 3.76Å; H139-D160 IonicContact CG-OD2 3.49Å; H139-D160 PolarHBondContact N-O 3.39Å; H139-D160 IonicContact ND1-OD2 2.73Å; H139-D160 PolarHBondContact ND1-OD2 3.28Å; D160-A162 VanDerWaalsContact OD1-CB 3.26Å; D160-A162 WeakPolarHBondContact OD1-CB 3.23Å; D160-A162 PolarHBondContact OD1-N 2.69Å; D160-Y182 HydrophobicContact CB-CD2 4.06Å; D160-Y182 WeakPolarHBondContact OD1-CB 3.5Å
161	L	95.1	Very high	90.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.168	C	C	.	.			trans	-115.5	12.2	176.4	-65.2	175.2	0	0	0	111.4	L138 L146 L159 N164 L166 F181 Y182 N186	L138-L161 HydrophobicContact CB-CD2 3.98Å; L138-L161 HydrophobicContact CD1-CD2 3.91Å; L146-L161 HydrophobicContact CD1-CD1 3.72Å; L146-L161 HydrophobicContact CD2-CD1 4.1Å; L146-L161 HydrophobicContact CD2-CD2 4.09Å; L146-L161 HydrophobicContact CG-CD1 4.38Å; L159-L161 HydrophobicContact CD1-CD1 4.3Å; L159-L161 HydrophobicContact CD1-CD2 4.09Å; L159-L161 HydrophobicContact CD1-CG 3.86Å; L159-L161 HydrophobicContact CD2-CD1 3.98Å; L159-L161 HydrophobicContact CD2-CG 4.35Å; L159-L161 HydrophobicContact CG-CD1 4.18Å; L159-L161 HydrophobicContact CG-CG 3.99Å; L161-N164 PolarHBondContact O-ND2 3.07Å; L161-L166 HydrophobicContact CB-CD1 3.85Å; L161-L166 HydrophobicContact CD1-CD1 3.66Å; L161-L166 HydrophobicContact CD2-CD1 4.39Å; L161-L166 HydrophobicContact CG-CD1 4.19Å; L161-F181 HydrophobicContact CD1-CE2 3.86Å; L161-F181 HydrophobicContact CD1-CZ 4.34Å; L161-F181 HydrophobicContact CG-CE2 4.33Å; L161-Y182 PolarHBondContact N-O 3.01Å; L161-N186 PolarHBondContact O-ND2 3.23Å
162	A	91.2	Very high	90.3	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.033	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	141.2	-173.7	0	0	0	0	0	112.7	H139 K140 D160 Y182 E184	H139-A162 CarbonylContact C-O 3.21Å; H139-A162 WeakPolarHBondContact CA-O 3.07Å; H139-A162 HydrophobicContact CB-CB 4.08Å; H139-A162 WeakPolarHBondContact CB-O 3.27Å; K140-A162 PolarHBondContact N-O 2.87Å; D160-A162 VanDerWaalsContact OD1-CB 3.26Å; D160-A162 WeakPolarHBondContact OD1-CB 3.23Å; D160-A162 PolarHBondContact OD1-N 2.69Å; A162-Y182 PolarHBondContact N-O 3.15Å; A162-E184 CarbonylContact C-O 3.28Å; A162-E184 VanDerWaalsContact CA-O 3.26Å; A162-E184 WeakPolarHBondContact CA-O 3.29Å; A162-E184 HydrophobicContact CB-CG 4.03Å; A162-E184 WeakPolarHBondContact CB-OE1 3.43Å
163	G	91.9	Very high	90	Very high	14 Å²	14	29.4 Å²	29.4	14%	0.144	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	44	177.6	0	0	0	0	0	113.8	K140 E184 A185	K140-G163 WeakPolarHBondContact CA-O 3.22Å; K140-G163 PolarHBondContact N-O 3.4Å; G163-E184 PolarHBondContact N-O 2.98Å; G163-A185 WeakPolarHBondContact CA-O 3.26Å
164	N	93.3	Very high	89.4	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.016	17%	0.166	C	C	.	.	S	Bend	trans	-109.9	-170.2	168.3	-83.7	-81.8	0	0	0	110.3	L138 N141 F142 I143 L161 L166 N186 P187	L138-N164 PolarHBondContact O-ND2 3.03Å; N141-N164 WeakPolarHBondContact CA-OD1 3.3Å; N141-N164 WeakPolarHBondContact CB-OD1 3.44Å; N141-N164 PolarHBondContact O-OD1 3.27Å; F142-N164 PolarHBondContact N-OD1 3.14Å; I143-N164 HydrophobicContact CB-CB 4.35Å; I143-N164 VanDerWaalsContact CB-OD1 3.3Å; I143-N164 WeakPolarHBondContact CB-OD1 3.33Å; I143-N164 WeakPolarHBondContact CG1-OD1 3.1Å; I143-N164 PolarHBondContact N-OD1 3.23Å; L161-N164 PolarHBondContact O-ND2 3.07Å; N164-L166 HydrophobicContact CB-CD1 4.45Å; N164-L166 HydrophobicContact CB-CG 4.31Å; N164-N186 VanDerWaalsContact CA-OD1 3.32Å; N164-N186 WeakPolarHBondContact CA-OD1 3.14Å; N164-N186 WeakPolarHBondContact CB-OD1 3.46Å; N164-N186 PolarHBondContact N-OD1 3.28Å; N164-N186 PolarHBondContact O-OD1 3.39Å; N164-N186 VanDerWaalsContact O-OD1 3.13Å; N164-P187 WeakPolarHBondContact O-CD 3.32Å
165	N	90.6	Very high	89.1	Confident	70 Å²	70	30.9 Å²	30.9	37%	0.374	17%	0.166	S	C	.	.			trans	-108.5	28	178.5	-68.5	-31.6	0	0	0	112.3	I143 T144 Q167	I143-N165 CarbonylContact O-C 3.58Å; I143-N165 WeakPolarHBondContact O-CA 3.26Å; I143-N165 PolarHBondContact O-N 3.02Å; T144-N165 HydrophobicContact CG2-CB 4.06Å; N165-Q167 PolarHBondContact O-N 2.98Å
166	L	87.2	Confident	88.8	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.			trans	-68.1	135.3	-178.1	-65.7	163.9	0	0	0	110.1	I143 L146 L161 N164 N186 P187 F188	I143-L166 HydrophobicContact CG2-CD2 4.01Å; I143-L166 PolarHBondContact O-N 2.94Å; L146-L166 HydrophobicContact CD2-CD2 4.21Å; L146-L166 HydrophobicContact CG-CD2 4.03Å; L161-L166 HydrophobicContact CB-CD1 3.85Å; L161-L166 HydrophobicContact CD1-CD1 3.66Å; L161-L166 HydrophobicContact CD2-CD1 4.39Å; L161-L166 HydrophobicContact CG-CD1 4.19Å; N164-L166 HydrophobicContact CB-CD1 4.45Å; N164-L166 HydrophobicContact CB-CG 4.31Å; L166-N186 HydrophobicContact CB-CB 4.32Å; L166-N186 VanDerWaalsContact CB-OD1 3.26Å; L166-N186 WeakPolarHBondContact CB-OD1 3.49Å; L166-N186 PolarHBondContact N-OD1 2.89Å; L166-P187 VanDerWaalsContact O-CD 3.29Å; L166-P187 WeakPolarHBondContact O-CD 3.31Å; L166-F188 HydrophobicContact CB-CD1 3.7Å; L166-F188 HydrophobicContact CB-CE1 3.53Å; L166-F188 HydrophobicContact CD1-CE1 4.28Å; L166-F188 WeakPolarHBondContact O-CD1 3.23Å; L166-F188 PolarHBondContact O-N 2.81Å
167	Q	81.7	Confident	88.5	Confident	131 Å²	131	35.4 Å²	35.4	61%	0.612	18%	0.181	S	C	*	.			trans	-108.8	-30	173.9	-62.6	-179.8	20.7	0	0	112	N165 P187 F188	N165-Q167 PolarHBondContact O-N 2.98Å; Q167-P187 HydrophobicContact CG-CB 4.43Å; Q167-F188 VanDerWaalsContact O-CB 3.27Å; Q167-F188 WeakPolarHBondContact O-CB 3.41Å
168	L	79.7	Confident	88.2	Confident	63 Å²	63	33 Å²	33	33%	0.33	17%	0.172	S	C	.	.			trans	-147.9	157	-172	-64.7	168.1	0	0	0	109.4	V254 Y256	L168-V254 HydrophobicContact CB-CG1 3.77Å; L168-V254 HydrophobicContact CD1-CG1 3.62Å; L168-V254 HydrophobicContact CD2-CG1 3.59Å; L168-V254 HydrophobicContact CG-CG1 3.83Å; L168-Y256 HydrophobicContact CD2-CD1 4.47Å
169	L	84.8	Confident	87.9	Confident	3 Å²	3	40 Å²	40	2%	0.016	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	148.3	171	-59.6	179.9	0	0	0	110	L146 F173 F181 F233 L255	L146-L169 HydrophobicContact CD1-CD2 3.74Å; L146-L169 HydrophobicContact CG-CD2 4.43Å; L169-F173 HydrophobicContact CB-CB 4.13Å; L169-F173 HydrophobicContact CB-CD2 4.28Å; L169-F173 HydrophobicContact CB-CG 4.08Å; L169-F173 HydrophobicContact CD1-CD1 3.63Å; L169-F173 HydrophobicContact CD1-CD2 4.02Å; L169-F173 HydrophobicContact CD1-CE1 3.59Å; L169-F173 HydrophobicContact CD1-CE2 3.97Å; L169-F173 HydrophobicContact CD1-CG 3.86Å; L169-F173 HydrophobicContact CD1-CZ 3.77Å; L169-F173 HydrophobicContact CD2-CD2 4.27Å; L169-F173 HydrophobicContact CD2-CE2 4.22Å; L169-F173 HydrophobicContact CG-CD2 4.44Å; L169-F173 HydrophobicContact CG-CG 4.47Å; L169-F181 HydrophobicContact CD1-CZ 4.27Å; L169-F233 HydrophobicContact CD1-CD1 3.62Å; L169-F233 HydrophobicContact CD1-CD2 4.1Å; L169-F233 HydrophobicContact CD1-CE1 3.31Å; L169-F233 HydrophobicContact CD1-CE2 3.84Å; L169-F233 HydrophobicContact CD1-CG 3.99Å; L169-F233 HydrophobicContact CD1-CZ 3.43Å; L169-F233 VanDerWaalsContact CD1-CZ 3.43Å; L169-F233 HydrophobicContact CG-CD1 4.24Å; L169-F233 HydrophobicContact CG-CE1 3.91Å; L169-F233 HydrophobicContact CG-CZ 4.39Å; L169-L255 HydrophobicContact CB-CB 4.26Å; L169-L255 HydrophobicContact CB-CD1 4.42Å; L169-L255 PolarHBondContact O-N 3.21Å
170	P	84	Confident	87.5	Confident	4 Å²	4	44.2 Å²	44.2	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	149.2	176.5	27.4	-34.4	0	0	0	110.6	L146 E148 F150 N172 F173	L146-P170 HydrophobicContact CB-CG 4.22Å; E148-P170 WeakPolarHBondContact OE2-CB 3.47Å; F150-P170 HydrophobicContact CB-CG 4.32Å; P170-N172 PolarHBondContact O-N 3.42Å; P170-N172 VanDerWaalsContact O-N 3.13Å; P170-F173 HydrophobicContact CG-CB 4.28Å; P170-F173 WeakPolarHBondContact O-CB 3.42Å; P170-F173 PolarHBondContact O-N 3.46Å
171	S	76.6	Confident	87.1	Confident	36 Å²	36	43.9 Å²	43.9	25%	0.252	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-54.2	-36.1	-177.1	45.8	0	0	0	0	113.9	F173 T174 E253	S171-F173 PolarHBondContact O-N 2.98Å; S171-T174 PolarHBondContact O-OG1 2.83Å; S171-E253 WeakPolarHBondContact CA-O 3.41Å; S171-E253 WeakPolarHBondContact CB-O 3.19Å; S171-E253 PolarHBondContact N-O 3.44Å; S171-E253 WeakPolarHBondContact OG-CA 3.48Å; S171-E253 PolarHBondContact OG-O 3.21Å; S171-E253 VanDerWaalsContact OG-O 3.11Å
172	N	83.6	Confident	86.7	Confident	21 Å²	21	48.6 Å²	48.6	11%	0.112	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-77.2	-1.6	-179.8	74.6	-10.7	0	0	0	113.8	E148 G151 P170 T174 Q175	E148-N172 PolarHBondContact O-ND2 2.96Å; E148-N172 PolarHBondContact O-OD1 2.95Å; G151-N172 WeakPolarHBondContact CA-O 3.36Å; G151-N172 PolarHBondContact N-ND2 3.12Å; G151-N172 PolarHBondContact N-OD1 2.94Å; P170-N172 PolarHBondContact O-N 3.42Å; P170-N172 VanDerWaalsContact O-N 3.13Å; N172-T174 PolarHBondContact O-N 3.21Å; N172-Q175 HydrophobicContact CB-CG 4.27Å; N172-Q175 WeakPolarHBondContact O-CB 3.18Å; N172-Q175 VanDerWaalsContact O-CG 3.28Å; N172-Q175 WeakPolarHBondContact O-CG 3.34Å; N172-Q175 PolarHBondContact O-N 3.29Å
173	F	86.1	Confident	86.5	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-58.9	-34.7	176.2	-174.1	-84.7	0	0	0	111.8	L146 F150 L159 L169 P170 S171 Q175 L176 L178 F181 L255 Y275	L146-F173 HydrophobicContact CD1-CD2 4Å; L146-F173 HydrophobicContact CD1-CE2 3.95Å; F150-F173 HydrophobicContact CD1-CD2 4.12Å; F150-F173 HydrophobicContact CD1-CE2 4.32Å; F150-F173 HydrophobicContact CE1-CD2 4.4Å; F150-F173 HydrophobicContact CE1-CE2 4.13Å; L159-F173 HydrophobicContact CD2-CE2 3.73Å; L159-F173 HydrophobicContact CD2-CZ 3.89Å; L169-F173 HydrophobicContact CB-CB 4.13Å; L169-F173 HydrophobicContact CB-CD2 4.28Å; L169-F173 HydrophobicContact CB-CG 4.08Å; L169-F173 HydrophobicContact CD1-CD1 3.63Å; L169-F173 HydrophobicContact CD1-CD2 4.02Å; L169-F173 HydrophobicContact CD1-CE1 3.59Å; L169-F173 HydrophobicContact CD1-CE2 3.97Å; L169-F173 HydrophobicContact CD1-CG 3.86Å; L169-F173 HydrophobicContact CD1-CZ 3.77Å; L169-F173 HydrophobicContact CD2-CD2 4.27Å; L169-F173 HydrophobicContact CD2-CE2 4.22Å; L169-F173 HydrophobicContact CG-CD2 4.44Å; L169-F173 HydrophobicContact CG-CG 4.47Å; P170-F173 HydrophobicContact CG-CB 4.28Å; P170-F173 WeakPolarHBondContact O-CB 3.42Å; P170-F173 PolarHBondContact O-N 3.46Å; S171-F173 PolarHBondContact O-N 2.98Å; F173-Q175 PolarHBondContact O-N 2.97Å; F173-Q175 VanDerWaalsContact O-N 3.08Å; F173-L176 HydrophobicContact CD2-CD1 3.86Å; F173-L176 HydrophobicContact CE2-CD1 3.88Å; F173-L176 HydrophobicContact CG-CD1 4.29Å; F173-L176 HydrophobicContact CZ-CD1 4.31Å; F173-L176 VanDerWaalsContact O-CB 3.28Å; F173-L176 WeakPolarHBondContact O-CB 3.36Å; F173-L176 WeakPolarHBondContact O-CG 3.38Å; F173-L176 PolarHBondContact O-N 3.34Å; F173-L178 HydrophobicContact CE1-CD1 4.32Å; F173-L178 HydrophobicContact CZ-CD1 3.99Å; F173-F181 HydrophobicContact CE1-CE1 4.33Å; F173-F181 HydrophobicContact CE1-CZ 4.28Å; F173-F181 HydrophobicContact CE2-CE2 4.39Å; F173-F181 HydrophobicContact CE2-CZ 4.42Å; F173-F181 HydrophobicContact CZ-CD2 4.17Å; F173-F181 HydrophobicContact CZ-CE1 4.09Å; F173-F181 AromaticContact CZ-CE2 3.69Å; F173-F181 HydrophobicContact CZ-CE2 3.69Å; F173-F181 AromaticContact CZ-CZ 3.61Å; F173-F181 HydrophobicContact CZ-CZ 3.61Å; F173-L255 HydrophobicContact CB-CD1 3.75Å; F173-L255 HydrophobicContact CD1-CD1 4.37Å; F173-L255 HydrophobicContact CG-CD1 4.48Å; F173-Y275 HydrophobicContact CE1-CE2 4.35Å
174	T	81.8	Confident	85.9	Confident	40 Å²	40	51.4 Å²	51.4	25%	0.245	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-61.1	-15.9	173.6	54.9	0	0	0	0	114.2	S171 N172 L176 L255	S171-T174 PolarHBondContact O-OG1 2.83Å; N172-T174 PolarHBondContact O-N 3.21Å; T174-L176 PolarHBondContact O-N 3.03Å; T174-L255 HydrophobicContact CG2-CD1 3.58Å; T174-L255 HydrophobicContact CG2-CD2 3.89Å; T174-L255 HydrophobicContact CG2-CG 4.39Å
175	Q	86.9	Confident	85.5	Confident	98 Å²	98	53.6 Å²	53.6	46%	0.458	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-77.5	-12.2	175.3	-52.9	179.3	-2.2	0	0	112.6	N172 F173	N172-Q175 HydrophobicContact CB-CG 4.27Å; N172-Q175 WeakPolarHBondContact O-CB 3.18Å; N172-Q175 VanDerWaalsContact O-CG 3.28Å; N172-Q175 WeakPolarHBondContact O-CG 3.34Å; N172-Q175 PolarHBondContact O-N 3.29Å; F173-Q175 PolarHBondContact O-N 2.97Å; F173-Q175 VanDerWaalsContact O-N 3.08Å
176	L	90.3	Very high	85	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	25%	0.246	C	C	.	.			trans	-73.1	135.9	172.4	-58.3	177.6	0	0	0	109.5	F150 L153 L156 F173 T174 L178	F150-L176 HydrophobicContact CD1-CD1 3.93Å; F150-L176 HydrophobicContact CE1-CD1 3.94Å; L153-L176 HydrophobicContact CB-CD2 3.98Å; L153-L176 WeakPolarHBondContact O-CD2 3.11Å; L156-L176 HydrophobicContact CD2-CD1 4.41Å; F173-L176 HydrophobicContact CD2-CD1 3.86Å; F173-L176 HydrophobicContact CE2-CD1 3.88Å; F173-L176 HydrophobicContact CG-CD1 4.29Å; F173-L176 HydrophobicContact CZ-CD1 4.31Å; F173-L176 VanDerWaalsContact O-CB 3.28Å; F173-L176 WeakPolarHBondContact O-CB 3.36Å; F173-L176 WeakPolarHBondContact O-CG 3.38Å; F173-L176 PolarHBondContact O-N 3.34Å; T174-L176 PolarHBondContact O-N 3.03Å; L176-L178 HydrophobicContact CB-CD1 4.45Å; L176-L178 HydrophobicContact CB-CD2 4.28Å; L176-L178 HydrophobicContact CB-CG 3.94Å; L176-L178 HydrophobicContact CD1-CD1 4.45Å
177	K	89	Confident	84.6	Confident	135 Å²	135	52.7 Å²	52.7	59%	0.587	26%	0.262	S	S	*	.			trans	-108	65.3	175.3	-59.3	-57.1	-177.9	-170.6	0	109.3	K157	K157-K177 WeakPolarHBondContact CD-O 3.33Å; K157-K177 PolarHBondContact NZ-O 3.42Å; K157-K177 VanDerWaalsContact NZ-O 3.15Å
178	L	89.9	Confident	84.2	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.126	23%	0.234	C	C	.	.			trans	-68.5	143.7	179.9	-59.1	175.9	0	0	0	110.5	L156 L159 F173 L176 F181 Y275	L156-L178 HydrophobicContact CB-CD2 4.19Å; L156-L178 HydrophobicContact CD2-CD2 3.89Å; L156-L178 HydrophobicContact CG-CD2 3.76Å; L159-L178 HydrophobicContact CB-CD1 4.08Å; L159-L178 HydrophobicContact CB-CD2 3.93Å; L159-L178 HydrophobicContact CD2-CD1 4.01Å; F173-L178 HydrophobicContact CE1-CD1 4.32Å; F173-L178 HydrophobicContact CZ-CD1 3.99Å; L176-L178 HydrophobicContact CB-CD1 4.45Å; L176-L178 HydrophobicContact CB-CD2 4.28Å; L176-L178 HydrophobicContact CB-CG 3.94Å; L176-L178 HydrophobicContact CD1-CD1 4.45Å; L178-F181 HydrophobicContact CD1-CB 3.95Å; L178-F181 HydrophobicContact CD1-CD2 3.99Å; L178-F181 HydrophobicContact CD1-CG 4.05Å; L178-Y275 HydrophobicContact CB-CE1 4.2Å; L178-Y275 HydrophobicContact CD1-CE1 4.25Å
179	K	89.1	Confident	83.3	Confident	171 Å²	171	45 Å²	45	74%	0.743	23%	0.225	S	C	*	.	S	Bend	trans	-93.1	-39.2	167.3	-68.6	-175.4	174.9	-172.2	0	110.9	K157	K157-K179 HydrophobicContact CB-CD 4.41Å; K157-K179 HydrophobicContact CB-CG 4.36Å; K157-K179 HydrophobicContact CD-CG 4.31Å; K157-K179 PolarHBondContact O-N 2.79Å
180	E	88.3	Confident	82	Confident	88 Å²	88	52.1 Å²	52.1	41%	0.411	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.6	-178.8	-67.7	164.9	-141.8	0	0	108.5	K157 V158 L159 Y182	K157-E180 PolarHBondContact O-N 2.99Å; V158-E180 HydrophobicContact CB-CB 4.49Å; V158-E180 HydrophobicContact CG1-CB 4.17Å; V158-E180 HydrophobicContact CG2-CB 4.24Å; L159-E180 PolarHBondContact N-O 3.2Å; E180-Y182 HydrophobicContact CB-CE2 3.89Å; E180-Y182 PolarHBondContact OE2-OH 2.75Å
181	F	88.3	Confident	80.4	Confident	14 Å²	14	55.6 Å²	55.6	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	114.4	176.4	-179.8	-129.9	0	0	0	109.7	L159 L161 L169 F173 L178 A183 F233 Y275	L159-F181 HydrophobicContact CB-CD2 4.04Å; L159-F181 HydrophobicContact CD2-CD2 3.85Å; L159-F181 HydrophobicContact CD2-CE2 3.73Å; L159-F181 HydrophobicContact CG-CD2 3.87Å; L159-F181 HydrophobicContact CG-CE2 3.97Å; L159-F181 VanDerWaalsContact O-CA 3.31Å; L159-F181 WeakPolarHBondContact O-CA 3.19Å; L161-F181 HydrophobicContact CD1-CE2 3.86Å; L161-F181 HydrophobicContact CD1-CZ 4.34Å; L161-F181 HydrophobicContact CG-CE2 4.33Å; L169-F181 HydrophobicContact CD1-CZ 4.27Å; F173-F181 HydrophobicContact CE1-CE1 4.33Å; F173-F181 HydrophobicContact CE1-CZ 4.28Å; F173-F181 HydrophobicContact CE2-CE2 4.39Å; F173-F181 HydrophobicContact CE2-CZ 4.42Å; F173-F181 HydrophobicContact CZ-CD2 4.17Å; F173-F181 HydrophobicContact CZ-CE1 4.09Å; F173-F181 AromaticContact CZ-CE2 3.69Å; F173-F181 HydrophobicContact CZ-CE2 3.69Å; F173-F181 AromaticContact CZ-CZ 3.61Å; F173-F181 HydrophobicContact CZ-CZ 3.61Å; L178-F181 HydrophobicContact CD1-CB 3.95Å; L178-F181 HydrophobicContact CD1-CD2 3.99Å; L178-F181 HydrophobicContact CD1-CG 4.05Å; F181-A183 HydrophobicContact CD1-CB 4.15Å; F181-A183 HydrophobicContact CE1-CB 3.46Å; F181-A183 VanDerWaalsContact CE1-CB 3.46Å; F181-A183 HydrophobicContact CE2-CB 3.9Å; F181-A183 HydrophobicContact CZ-CB 3.33Å; F181-F233 HydrophobicContact CD1-CE2 4.31Å; F181-F233 AromaticContact CE1-CE2 3.62Å; F181-F233 HydrophobicContact CE1-CE2 3.62Å; F181-F233 AromaticContact CE1-CZ 3.87Å; F181-F233 HydrophobicContact CE1-CZ 3.87Å; F181-Y275 HydrophobicContact CB-CD1 3.31Å; F181-Y275 HydrophobicContact CB-CE1 3.66Å; F181-Y275 HydrophobicContact CB-CG 3.88Å; F181-Y275 AromaticContact CD1-CD1 3.76Å; F181-Y275 HydrophobicContact CD1-CD1 3.76Å; F181-Y275 AromaticContact CD1-CD2 3.61Å; F181-Y275 HydrophobicContact CD1-CD2 3.61Å; F181-Y275 HydrophobicContact CD1-CE1 4.17Å; F181-Y275 HydrophobicContact CD1-CE2 4.04Å; F181-Y275 AromaticContact CD1-CG 3.41Å; F181-Y275 HydrophobicContact CD1-CG 3.41Å; F181-Y275 VanDerWaalsContact CD1-CG 3.41Å; F181-Y275 HydrophobicContact CE1-CD2 4.21Å; F181-Y275 HydrophobicContact CE1-CG 4.4Å; F181-Y275 AromaticContact CG-CD1 3.96Å; F181-Y275 HydrophobicContact CG-CD1 3.96Å; F181-Y275 HydrophobicContact CG-CE1 4.21Å; F181-Y275 HydrophobicContact CG-CG 4.09Å
182	Y	87.3	Confident	78.9	Confident	99 Å²	99	58.3 Å²	58.3	39%	0.388	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.1	175.9	-54.5	-84.4	0	0	0	108.2	L159 D160 L161 A162 E180	L159-Y182 PolarHBondContact O-N 3.49Å; D160-Y182 HydrophobicContact CB-CD2 4.06Å; D160-Y182 WeakPolarHBondContact OD1-CB 3.5Å; L161-Y182 PolarHBondContact N-O 3.01Å; A162-Y182 PolarHBondContact N-O 3.15Å; E180-Y182 HydrophobicContact CB-CE2 3.89Å; E180-Y182 PolarHBondContact OE2-OH 2.75Å
183	A	85.6	Confident	77	Confident	3 Å²	3	59.9 Å²	59.9	3%	0.025	29%	0.29	C	S	.	.			trans	-150.7	6.3	-172.3	0	0	0	0	0	112.6	F181 N186 F188 T189	F181-A183 HydrophobicContact CD1-CB 4.15Å; F181-A183 HydrophobicContact CE1-CB 3.46Å; F181-A183 VanDerWaalsContact CE1-CB 3.46Å; F181-A183 HydrophobicContact CE2-CB 3.9Å; F181-A183 HydrophobicContact CZ-CB 3.33Å; A183-N186 WeakPolarHBondContact O-CB 3.22Å; A183-N186 PolarHBondContact O-ND2 3.32Å; A183-F188 HydrophobicContact CB-CE2 4.29Å; A183-F188 HydrophobicContact CB-CZ 3.74Å; A183-T189 VanDerWaalsContact O-CG2 3.23Å; A183-T189 WeakPolarHBondContact O-CG2 3.38Å
184	E	80.5	Confident	75.2	Confident	73 Å²	73	63.7 Å²	63.7	34%	0.341	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	161.3	175.2	71.3	-80.2	-172.5	0	0	111.5	A162 G163 N186	A162-E184 CarbonylContact C-O 3.28Å; A162-E184 VanDerWaalsContact CA-O 3.26Å; A162-E184 WeakPolarHBondContact CA-O 3.29Å; A162-E184 HydrophobicContact CB-CG 4.03Å; A162-E184 WeakPolarHBondContact CB-OE1 3.43Å; G163-E184 PolarHBondContact N-O 2.98Å; E184-N186 PolarHBondContact O-N 2.98Å; E184-N186 VanDerWaalsContact O-N 3.07Å; E184-N186 PolarHBondContact O-ND2 2.88Å
185	A	83.5	Confident	73.2	Confident	50 Å²	50	66 Å²	66	41%	0.413	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	25.5	-177.9	0	0	0	0	0	114.2	G163 T189	G163-A185 WeakPolarHBondContact CA-O 3.26Å; A185-T189 PolarHBondContact N-OG1 3.25Å
186	N	81.4	Confident	71	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.328	C	S	.	.	S	Bend	trans	-94.5	149.8	160.7	-77.9	-85.8	0	0	0	109.5	L161 N164 L166 A183 E184 F188 T189	L161-N186 PolarHBondContact O-ND2 3.23Å; N164-N186 VanDerWaalsContact CA-OD1 3.32Å; N164-N186 WeakPolarHBondContact CA-OD1 3.14Å; N164-N186 WeakPolarHBondContact CB-OD1 3.46Å; N164-N186 PolarHBondContact N-OD1 3.28Å; N164-N186 PolarHBondContact O-OD1 3.39Å; N164-N186 VanDerWaalsContact O-OD1 3.13Å; L166-N186 HydrophobicContact CB-CB 4.32Å; L166-N186 VanDerWaalsContact CB-OD1 3.26Å; L166-N186 WeakPolarHBondContact CB-OD1 3.49Å; L166-N186 PolarHBondContact N-OD1 2.89Å; A183-N186 WeakPolarHBondContact O-CB 3.22Å; A183-N186 PolarHBondContact O-ND2 3.32Å; E184-N186 PolarHBondContact O-N 2.98Å; E184-N186 VanDerWaalsContact O-N 3.07Å; E184-N186 PolarHBondContact O-ND2 2.88Å; N186-F188 HydrophobicContact CB-CD1 3.85Å; N186-F188 HydrophobicContact CB-CE1 3.71Å; N186-F188 HydrophobicContact CB-CG 4.34Å; N186-F188 HydrophobicContact CB-CZ 4.12Å; N186-F188 PolarHBondContact O-N 2.88Å; N186-T189 PolarHBondContact O-N 3.01Å; N186-T189 PolarHBondContact O-OG1 3.03Å
187	P	79	Confident	68.8	Low	51 Å²	51	71.2 Å²	71.2	33%	0.331	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-49.4	-35.7	176.2	-30	33.4	0	0	0	113.8	N164 L166 Q167 T189 R190	N164-P187 WeakPolarHBondContact O-CD 3.32Å; L166-P187 VanDerWaalsContact O-CD 3.29Å; L166-P187 WeakPolarHBondContact O-CD 3.31Å; Q167-P187 HydrophobicContact CG-CB 4.43Å; P187-T189 VanDerWaalsContact C-N 3.26Å; P187-T189 PolarHBondContact O-N 3.07Å; P187-R190 PolarHBondContact O-N 3.38Å
188	F	72.9	Confident	66.9	Low	8 Å²	8	67.7 Å²	67.7	4%	0.035	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-71.4	-16.9	-178.3	80.3	-120.8	0	0	0	114.6	L166 Q167 A183 N186 F233 P257	L166-F188 HydrophobicContact CB-CD1 3.7Å; L166-F188 HydrophobicContact CB-CE1 3.53Å; L166-F188 HydrophobicContact CD1-CE1 4.28Å; L166-F188 WeakPolarHBondContact O-CD1 3.23Å; L166-F188 PolarHBondContact O-N 2.81Å; Q167-F188 VanDerWaalsContact O-CB 3.27Å; Q167-F188 WeakPolarHBondContact O-CB 3.41Å; A183-F188 HydrophobicContact CB-CE2 4.29Å; A183-F188 HydrophobicContact CB-CZ 3.74Å; N186-F188 HydrophobicContact CB-CD1 3.85Å; N186-F188 HydrophobicContact CB-CE1 3.71Å; N186-F188 HydrophobicContact CB-CG 4.34Å; N186-F188 HydrophobicContact CB-CZ 4.12Å; N186-F188 PolarHBondContact O-N 2.88Å; F188-F233 HydrophobicContact CD2-CE1 4.24Å; F188-F233 HydrophobicContact CD2-CZ 4.44Å; F188-F233 AromaticContact CE2-CE1 3.87Å; F188-F233 HydrophobicContact CE2-CE1 3.87Å; F188-F233 AromaticContact CE2-CZ 3.67Å; F188-F233 HydrophobicContact CE2-CZ 3.67Å; F188-F233 HydrophobicContact CZ-CE1 4.26Å; F188-F233 HydrophobicContact CZ-CZ 4.01Å; F188-P257 HydrophobicContact CB-CB 4.41Å; F188-P257 HydrophobicContact CB-CG 3.45Å; F188-P257 VanDerWaalsContact CB-CG 3.45Å; F188-P257 HydrophobicContact CD2-CB 3.66Å; F188-P257 HydrophobicContact CD2-CG 3.61Å; F188-P257 HydrophobicContact CE2-CB 4.42Å; F188-P257 HydrophobicContact CG-CB 4.31Å; F188-P257 HydrophobicContact CG-CG 3.74Å
189	T	60.4	Low	65	Low	24 Å²	24	71.2 Å²	71.2	15%	0.147	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-90.7	-9.7	175.6	67	0	0	0	0	112.6	A183 A185 N186 P187 V231 L277	A183-T189 VanDerWaalsContact O-CG2 3.23Å; A183-T189 WeakPolarHBondContact O-CG2 3.38Å; A185-T189 PolarHBondContact N-OG1 3.25Å; N186-T189 PolarHBondContact O-N 3.01Å; N186-T189 PolarHBondContact O-OG1 3.03Å; P187-T189 VanDerWaalsContact C-N 3.26Å; P187-T189 PolarHBondContact O-N 3.07Å; T189-V231 HydrophobicContact CG2-CG2 4.41Å; T189-L277 HydrophobicContact CG2-CD1 4.16Å; T189-L277 HydrophobicContact CG2-CD2 3.72Å
190	R	58	Low	63	Low	152 Å²	152	69.1 Å²	69.1	57%	0.574	37%	0.366	S	S	*	.	S	Bend	trans	-77.3	140.6	179.6	-67.8	-171.6	-179.9	-175.1	1.1	110.1	P187 D192 L193	P187-R190 PolarHBondContact O-N 3.38Å; R190-D192 HydrophobicContact CB-CB 4.48Å; R190-D192 PolarHBondContact O-N 3.42Å; R190-L193 PolarHBondContact O-N 3.11Å
191	N	50.3	Low	61.1	Low	78 Å²	78	66 Å²	66	42%	0.417	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-63.3	-8.9	172.6	-73.8	-31.3	0	0	0	112.8	L193 Y194 R259	N191-L193 PolarHBondContact O-N 3.33Å; N191-Y194 HydrophobicContact CB-CD2 4.02Å; N191-Y194 VanDerWaalsContact O-CA 3.32Å; N191-Y194 WeakPolarHBondContact O-CA 3.48Å; N191-Y194 WeakPolarHBondContact O-CB 3.43Å; N191-Y194 WeakPolarHBondContact O-CD2 3.36Å; N191-Y194 PolarHBondContact O-N 3.23Å; N191-R259 WeakPolarHBondContact OD1-CD 3.5Å
192	D	44.5	Very low	59.2	Low	92 Å²	92	70.3 Å²	70.3	49%	0.492	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-72.1	-10.4	-177.1	-48.8	-29	0	0	0	113	R190 Y194 T195	R190-D192 HydrophobicContact CB-CB 4.48Å; R190-D192 PolarHBondContact O-N 3.42Å; D192-Y194 PolarHBondContact O-N 3.35Å; D192-T195 PolarHBondContact O-N 2.82Å
193	L	44.9	Very low	57.3	Low	54 Å²	54	70 Å²	70	28%	0.283	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-60.1	-20.1	159.9	-71.9	175.7	0	0	0	112	R190 N191 L201	R190-L193 PolarHBondContact O-N 3.11Å; N191-L193 PolarHBondContact O-N 3.33Å; L193-L201 HydrophobicContact CB-CD2 4.09Å; L193-L201 HydrophobicContact CD1-CD2 4.31Å; L193-L201 HydrophobicContact CD2-CD1 4.41Å; L193-L201 HydrophobicContact CD2-CD2 4.15Å; L193-L201 HydrophobicContact CG-CD2 4.42Å
194	Y	47.4	Very low	55.3	Low	81 Å²	81	70.7 Å²	70.7	32%	0.318	39%	0.388	S	S	.	.	S	Bend	trans	-96.9	-20.4	179	-54.9	-72.9	0	0	0	114.1	N191 D192 W210 R259	N191-Y194 HydrophobicContact CB-CD2 4.02Å; N191-Y194 VanDerWaalsContact O-CA 3.32Å; N191-Y194 WeakPolarHBondContact O-CA 3.48Å; N191-Y194 WeakPolarHBondContact O-CB 3.43Å; N191-Y194 WeakPolarHBondContact O-CD2 3.36Å; N191-Y194 PolarHBondContact O-N 3.23Å; D192-Y194 PolarHBondContact O-N 3.35Å; Y194-W210 HydrophobicContact CD1-CB 4.37Å; Y194-W210 HydrophobicContact CE1-CB 3.76Å; Y194-W210 HydrophobicContact CE1-CD2 4.46Å; Y194-W210 AromaticContact CE1-CG 3.91Å; Y194-W210 HydrophobicContact CE1-CG 3.91Å; Y194-R259 HydrophobicContact CE2-CB 4.26Å; Y194-R259 WeakPolarHBondContact OH-CB 3.49Å
195	T	40.1	Very low	53.7	Low	89 Å²	89	68.6 Å²	68.6	55%	0.546	38%	0.378	S	S	.	.	S	Bend	trans	-117.8	92.6	-177.2	57.8	0	0	0	0	110.7	D192	D192-T195 PolarHBondContact O-N 2.82Å
196	A	40.9	Very low	51.9	Low	77 Å²	77	67.6 Å²	67.6	64%	0.636	37%	0.373	S	S	*	.	S	Bend	trans	79	117.3	167.9	0	0	0	0	0	116.8
197	T	43.2	Very low	49.9	Very low	133 Å²	133	72.3 Å²	72.3	82%	0.816	41%	0.406	S	S	*	.			trans	80.1	37.1	153.5	68.2	0	0	0	0	120.2	P199	T197-P199 VanDerWaalsContact C-CD 3.41Å; T197-P199 WeakPolarHBondContact O-CD 3.39Å
198	N	48.5	Very low	48.1	Very low	60 Å²	60	79.1 Å²	79.1	32%	0.321	43%	0.43	S	S	.	.			trans	-111.5	81.7	145	-163	-30.9	0	0	0	110.7	W200 L201 E202	N198-W200 PolarHBondContact O-N 2.95Å; N198-W200 VanDerWaalsContact OD1-CB 3.27Å; N198-W200 WeakPolarHBondContact OD1-CB 3.47Å; N198-W200 PolarHBondContact OD1-N 2.96Å; N198-L201 HydrophobicContact CB-CB 3.9Å; N198-L201 PolarHBondContact O-N 3.06Å; N198-L201 PolarHBondContact OD1-N 3.31Å; N198-E202 PolarHBondContact O-N 2.95Å
199	P	51.1	Low	46.6	Very low	99 Å²	99	84.8 Å²	84.8	64%	0.643	46%	0.457	S	S	*	.	H	α-helix	trans	-52.9	-30.8	177.1	-24.2	33.1	0	0	0	112.7	T197 S203	T197-P199 VanDerWaalsContact C-CD 3.41Å; T197-P199 WeakPolarHBondContact O-CD 3.39Å; P199-S203 WeakPolarHBondContact O-CB 3.12Å; P199-S203 PolarHBondContact O-N 2.88Å
200	W	47.9	Very low	45.9	Very low	127 Å²	127	87 Å²	87	48%	0.481	46%	0.463	S	S	.	.	H	α-helix	trans	-68.4	-46.5	177.6	178.2	87.9	0	0	0	111.7	N198 S203 I204 Y256	N198-W200 PolarHBondContact O-N 2.95Å; N198-W200 VanDerWaalsContact OD1-CB 3.27Å; N198-W200 WeakPolarHBondContact OD1-CB 3.47Å; N198-W200 PolarHBondContact OD1-N 2.96Å; W200-S203 PolarHBondContact O-N 3.15Å; W200-S203 PolarHBondContact O-OG 2.82Å; W200-I204 HydrophobicContact CD2-CD1 3.58Å; W200-I204 HydrophobicContact CE3-CD1 3.94Å; W200-I204 HydrophobicContact CG-CD1 4.22Å; W200-I204 HydrophobicContact CH2-CD1 3.83Å; W200-I204 HydrophobicContact CZ2-CD1 3.4Å; W200-I204 HydrophobicContact CZ3-CD1 4.06Å; W200-I204 WeakPolarHBondContact O-CG1 3.41Å; W200-I204 PolarHBondContact O-N 3.19Å; W200-Y256 AromaticContact CH2-CE1 3.43Å; W200-Y256 HydrophobicContact CH2-CE1 3.43Å; W200-Y256 VanDerWaalsContact CH2-CE1 3.43Å; W200-Y256 AromaticContact CH2-CZ 3.75Å; W200-Y256 WeakPolarHBondContact CH2-OH 3.28Å; W200-Y256 HydrophobicContact CZ2-CE1 4.42Å; W200-Y256 AromaticContact CZ3-CE1 3.66Å; W200-Y256 HydrophobicContact CZ3-CE1 3.66Å
201	L	47.3	Very low	45	Very low	23 Å²	23	88.1 Å²	88.1	12%	0.12	48%	0.475	C	S	.	.	H	α-helix	trans	-66.4	-41.9	178.1	-140.4	104.1	0	0	0	111.7	L193 N198 S203 I204 I205	L193-L201 HydrophobicContact CB-CD2 4.09Å; L193-L201 HydrophobicContact CD1-CD2 4.31Å; L193-L201 HydrophobicContact CD2-CD1 4.41Å; L193-L201 HydrophobicContact CD2-CD2 4.15Å; L193-L201 HydrophobicContact CG-CD2 4.42Å; N198-L201 HydrophobicContact CB-CB 3.9Å; N198-L201 PolarHBondContact O-N 3.06Å; N198-L201 PolarHBondContact OD1-N 3.31Å; L201-S203 VanDerWaalsContact C-N 3.33Å; L201-S203 PolarHBondContact O-N 3.21Å; L201-I204 PolarHBondContact O-N 3.3Å; L201-I204 VanDerWaalsContact O-N 3.17Å; L201-I205 HydrophobicContact CD2-CD1 3.59Å; L201-I205 HydrophobicContact CG-CD1 3.76Å; L201-I205 WeakPolarHBondContact O-CB 3.45Å; L201-I205 PolarHBondContact O-N 3.03Å
202	E	47.7	Very low	44.7	Very low	103 Å²	103	87.9 Å²	87.9	48%	0.481	48%	0.479	S	S	.	.	H	α-helix	trans	-61	-40.2	174.5	-76.1	-159.8	168.4	0	0	112.2	N198 I204 G206	N198-E202 PolarHBondContact O-N 2.95Å; E202-I204 PolarHBondContact O-N 2.92Å; E202-G206 WeakPolarHBondContact O-CA 3.49Å; E202-G206 PolarHBondContact O-N 3.03Å
203	S	48.4	Very low	45	Very low	94 Å²	94	87.4 Å²	87.4	66%	0.657	49%	0.488	S	S	*	.	H	α-helix	trans	-64.3	-28.4	177.1	82.3	0	0	0	0	113.1	P199 W200 L201	P199-S203 WeakPolarHBondContact O-CB 3.12Å; P199-S203 PolarHBondContact O-N 2.88Å; W200-S203 PolarHBondContact O-N 3.15Å; W200-S203 PolarHBondContact O-OG 2.82Å; L201-S203 VanDerWaalsContact C-N 3.33Å; L201-S203 PolarHBondContact O-N 3.21Å
204	I	43.8	Very low	45.8	Very low	17 Å²	17	85.2 Å²	85.2	9%	0.087	48%	0.478	C	S	.	.	H	α-helix	trans	-88.3	-43.4	-177.5	-68.2	170.2	0	0	0	111.5	W200 L201 E202 I239 Y256	W200-I204 HydrophobicContact CD2-CD1 3.58Å; W200-I204 HydrophobicContact CE3-CD1 3.94Å; W200-I204 HydrophobicContact CG-CD1 4.22Å; W200-I204 HydrophobicContact CH2-CD1 3.83Å; W200-I204 HydrophobicContact CZ2-CD1 3.4Å; W200-I204 HydrophobicContact CZ3-CD1 4.06Å; W200-I204 WeakPolarHBondContact O-CG1 3.41Å; W200-I204 PolarHBondContact O-N 3.19Å; L201-I204 PolarHBondContact O-N 3.3Å; L201-I204 VanDerWaalsContact O-N 3.17Å; E202-I204 PolarHBondContact O-N 2.92Å; I204-I239 HydrophobicContact CG2-CG2 4.21Å; I204-I239 WeakPolarHBondContact O-CG2 3.3Å; I204-Y256 HydrophobicContact CD1-CE1 4.47Å
205	I	47.4	Very low	47.1	Very low	28 Å²	28	85.2 Å²	85.2	14%	0.144	48%	0.483	C	S	.	.	H	α-helix	trans	-98.2	-25.1	-168.9	-58.8	179.5	0	0	0	111.9	L201 W210 I239 L258	L201-I205 HydrophobicContact CD2-CD1 3.59Å; L201-I205 HydrophobicContact CG-CD1 3.76Å; L201-I205 WeakPolarHBondContact O-CB 3.45Å; L201-I205 PolarHBondContact O-N 3.03Å; I205-W210 HydrophobicContact CG2-CZ2 4.25Å; I205-I239 HydrophobicContact CB-CG2 4.48Å; I205-I239 HydrophobicContact CG1-CD1 4.5Å; I205-I239 HydrophobicContact CG1-CG2 4.07Å; I205-L258 HydrophobicContact CD1-CD2 4.31Å
206	G	44.7	Very low	48.9	Very low	30 Å²	30	81 Å²	81	31%	0.309	46%	0.457	S	S	.	.			trans	75.7	137.3	-174.5	0	0	0	0	0	112.9	E202 K208	E202-G206 WeakPolarHBondContact O-CA 3.49Å; E202-G206 PolarHBondContact O-N 3.03Å; G206-K208 VanDerWaalsContact C-N 3.26Å; G206-K208 PolarHBondContact O-N 2.76Å; G206-K208 VanDerWaalsContact O-N 3.13Å
207	S	40	Very low	50.7	Low	98 Å²	98	79 Å²	79	69%	0.685	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-7.8	-170.4	55	0	0	0	0	116.5
208	K	41.5	Very low	52.5	Low	194 Å²	194	76.8 Å²	76.8	84%	0.843	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-7.3	-162.9	-85.3	-173.6	174.7	-177.4	0	117.8	G206	G206-K208 VanDerWaalsContact C-N 3.26Å; G206-K208 PolarHBondContact O-N 2.76Å; G206-K208 VanDerWaalsContact O-N 3.13Å
209	Q	40.9	Very low	54.2	Low	127 Å²	127	76.3 Å²	76.3	59%	0.593	42%	0.418	S	S	*	.	S	Bend	trans	-86.2	-8.9	-172.7	-91.4	-175.7	-1.4	0	0	115.9
210	W	46.1	Very low	55.8	Low	70 Å²	70	78.3 Å²	78.3	27%	0.265	42%	0.416	S	S	.	.	S	Bend	trans	-112.9	5.9	-160.8	-58.4	87.4	0	0	0	116.1	Y194 I205 L258 R259	Y194-W210 HydrophobicContact CD1-CB 4.37Å; Y194-W210 HydrophobicContact CE1-CB 3.76Å; Y194-W210 HydrophobicContact CE1-CD2 4.46Å; Y194-W210 AromaticContact CE1-CG 3.91Å; Y194-W210 HydrophobicContact CE1-CG 3.91Å; I205-W210 HydrophobicContact CG2-CZ2 4.25Å; W210-L258 HydrophobicContact CH2-CB 3.51Å; W210-L258 HydrophobicContact CH2-CD1 3.8Å; W210-L258 HydrophobicContact CH2-CD2 3.76Å; W210-L258 HydrophobicContact CH2-CG 3.88Å; W210-L258 HydrophobicContact CZ2-CB 4.37Å; W210-L258 HydrophobicContact CZ2-CD1 4.23Å; W210-L258 HydrophobicContact CZ2-CD2 3.73Å; W210-L258 HydrophobicContact CZ2-CG 4.33Å; W210-L258 HydrophobicContact CZ3-CB 3.83Å; W210-R259 WeakPolarHBondContact CZ3-O 3.24Å
211	Q	38.7	Very low	57.5	Low	177 Å²	177	77 Å²	77	83%	0.827	42%	0.419	S	S	*	.			trans	-118	12.4	-179.9	-74.6	-173.7	-1.9	0	0	115.3	A213	Q211-A213 PolarHBondContact O-N 3.31Å
212	S	44	Very low	59	Low	72 Å²	72	81 Å²	81	50%	0.503	45%	0.446	S	S	.	.			trans	-74.2	80.4	161.9	62.1	0	0	0	0	107.8	G214	S212-G214 PolarHBondContact O-N 2.85Å
213	A	49.9	Very low	60.1	Low	83 Å²	83	77.1 Å²	77.1	69%	0.686	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	130.1	158	0	0	0	0	0	107.3	Q211	Q211-A213 PolarHBondContact O-N 3.31Å
214	G	63	Low	60.8	Low	7 Å²	7	79.1 Å²	79.1	7%	0.072	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	40.5	173.6	0	0	0	0	0	116.9	S212 P222 F223	S212-G214 PolarHBondContact O-N 2.85Å; G214-P222 CarbonylContact O-C 3.44Å; G214-P222 WeakPolarHBondContact O-CA 3.45Å; G214-P222 WeakPolarHBondContact O-CB 3.49Å; G214-F223 WeakPolarHBondContact CA-O 3.42Å; G214-F223 PolarHBondContact O-N 3.15Å; G214-F223 VanDerWaalsContact O-N 3.14Å
215	I	74.3	Confident	61.8	Low	81 Å²	81	83.4 Å²	83.4	42%	0.415	46%	0.463	S	S	.	.	B	Isolated β-bridge	trans	-134.8	122	157.3	-61.7	-179.6	0	0	0	109.3	A217 K220	I215-A217 PolarHBondContact O-N 3.06Å; I215-K220 WeakPolarHBondContact CG2-O 3.15Å
216	C	78	Confident	62.6	Low	0 Å²	0	92.3 Å²	92.3	0%	0	50%	0.495	C	S	.	.			trans	-67.4	129.3	179.9	176.2	0	0	0	0	110.9	R218 C219 K220 N221 F223 C263	C216-R218 PolarHBondContact O-N 3.42Å; C216-R218 VanDerWaalsContact O-N 3.08Å; C216-R218 PolarHBondContact SG-N 3.29Å; C216-R218 VanDerWaalsContact SG-N 3.43Å; C216-C219 WeakPolarHBondContact CB-SG 3.34Å; C216-K220 WeakPolarHBondContact O-CA 3.41Å; C216-K220 PolarHBondContact O-N 3.21Å; C216-N221 PolarHBondContact N-O 3.09Å; C216-F223 HydrophobicContact CB-CD1 4.26Å; C216-F223 HydrophobicContact CB-CE1 4.3Å; C216-C263 HydrophobicContact CB-CB 3.93Å
217	A	77.6	Confident	63.8	Low	36 Å²	36	94.8 Å²	94.8	30%	0.298	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.4	179.7	0	0	0	0	0	113.9	I215 K220 T260 L261 F262	I215-A217 PolarHBondContact O-N 3.06Å; A217-K220 WeakPolarHBondContact O-CE 3.25Å; A217-K220 PolarHBondContact O-NZ 2.93Å; A217-T260 HydrophobicContact CB-CG2 3.12Å; A217-L261 WeakPolarHBondContact CB-O 3.24Å; A217-L261 PolarHBondContact N-O 3.09Å; A217-F262 HydrophobicContact CB-CD1 4.5Å; A217-F262 HydrophobicContact CB-CE1 4.07Å; A217-F262 HydrophobicContact CB-CZ 4.29Å
218	R	82.5	Confident	65.4	Low	87 Å²	87	90.7 Å²	90.7	33%	0.328	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-64.5	179.6	-172.6	171.6	173.2	-156.5	-6	114.2	C216 K220 F262 H266 C267 S270 S271	C216-R218 PolarHBondContact O-N 3.42Å; C216-R218 VanDerWaalsContact O-N 3.08Å; C216-R218 PolarHBondContact SG-N 3.29Å; C216-R218 VanDerWaalsContact SG-N 3.43Å; R218-K220 VanDerWaalsContact C-N 3.27Å; R218-K220 PolarHBondContact O-N 3.39Å; R218-F262 HydrophobicContact CB-CD1 4.21Å; R218-F262 HydrophobicContact CB-CE1 3.96Å; R218-H266 PolarHBondContact NH1-O 2.84Å; R218-C267 HydrophobicContact CB-CB 4.25Å; R218-C267 WeakPolarHBondContact CD-O 3.26Å; R218-C267 PolarHBondContact NH1-O 2.97Å; R218-S270 PolarHBondContact NE-O 3.46Å; R218-S270 PolarHBondContact NH1-O 3.24Å; R218-S270 PolarHBondContact NH1-OG 2.96Å; R218-S270 PolarHBondContact NH2-O 3.09Å; R218-S270 PolarHBondContact NH2-OG 2.98Å; R218-S271 WeakPolarHBondContact CD-OG 3.42Å
219	C	83.8	Confident	66.9	Low	49 Å²	49	82.8 Å²	82.8	33%	0.331	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-9	-175.2	68	0	0	0	0	113.2	C216 N221 C263	C216-C219 WeakPolarHBondContact CB-SG 3.34Å; C219-N221 PolarHBondContact O-N 2.85Å; C219-C263 VanDerWaalsContact SG-SG 3.61Å
220	K	84.4	Confident	68.4	Low	142 Å²	142	76.8 Å²	76.8	62%	0.617	40%	0.403	S	S	*	.			trans	60.9	7.4	-177.3	-48.9	-55	-172.6	-172.7	0	114.7	I215 C216 A217 R218	I215-K220 WeakPolarHBondContact CG2-O 3.15Å; C216-K220 WeakPolarHBondContact O-CA 3.41Å; C216-K220 PolarHBondContact O-N 3.21Å; A217-K220 WeakPolarHBondContact O-CE 3.25Å; A217-K220 PolarHBondContact O-NZ 2.93Å; R218-K220 VanDerWaalsContact C-N 3.27Å; R218-K220 PolarHBondContact O-N 3.39Å
221	N	83	Confident	69.8	Low	98 Å²	98	73.6 Å²	73.6	52%	0.524	39%	0.391	S	S	.	.			trans	-75.2	145.7	174	-67.2	-21.8	0	0	0	110.9	C216 C219	C216-N221 PolarHBondContact N-O 3.09Å; C219-N221 PolarHBondContact O-N 2.85Å
222	P	79.6	Confident	71.6	Confident	107 Å²	107	70 Å²	70	70%	0.695	37%	0.37	S	S	*	.	B	Isolated β-bridge	trans	-72.9	154.1	174	30.2	-33.8	0	0	0	113.3	G214	G214-P222 CarbonylContact O-C 3.44Å; G214-P222 WeakPolarHBondContact O-CA 3.45Å; G214-P222 WeakPolarHBondContact O-CB 3.49Å
223	F	71.1	Confident	73.1	Confident	23 Å²	23	66.8 Å²	66.8	10%	0.101	35%	0.347	C	S	.	.			trans	-141.6	145.4	174.2	58.5	-97.7	0	0	0	110.2	G214 C216 W227 L261 C263	G214-F223 WeakPolarHBondContact CA-O 3.42Å; G214-F223 PolarHBondContact O-N 3.15Å; G214-F223 VanDerWaalsContact O-N 3.14Å; C216-F223 HydrophobicContact CB-CD1 4.26Å; C216-F223 HydrophobicContact CB-CE1 4.3Å; F223-W227 HydrophobicContact CD2-CB 3.82Å; F223-W227 HydrophobicContact CD2-CE3 4.12Å; F223-W227 HydrophobicContact CE2-CB 3.33Å; F223-W227 AromaticContact CE2-CD2 3.94Å; F223-W227 HydrophobicContact CE2-CD2 3.94Å; F223-W227 AromaticContact CE2-CE3 3.8Å; F223-W227 HydrophobicContact CE2-CE3 3.8Å; F223-W227 AromaticContact CE2-CG 3.79Å; F223-W227 HydrophobicContact CE2-CG 3.79Å; F223-W227 HydrophobicContact CZ-CB 3.76Å; F223-W227 HydrophobicContact CZ-CG 4.34Å; F223-L261 HydrophobicContact CE1-CB 4.24Å; F223-L261 HydrophobicContact CZ-CB 3.68Å; F223-L261 HydrophobicContact CZ-CD1 3.93Å; F223-L261 HydrophobicContact CZ-CG 4.43Å; F223-C263 HydrophobicContact CB-CB 4.1Å; F223-C263 HydrophobicContact CD1-CB 3.79Å; F223-C263 HydrophobicContact CG-CB 4.21Å
224	V	63.4	Low	74.3	Confident	136 Å²	136	62.9 Å²	62.9	82%	0.824	32%	0.315	S	S	*	.	S	Bend	trans	-107.9	-35.1	-168.1	-168.5	0	0	0	0	112.8
225	T	64.1	Low	74.9	Confident	106 Å²	106	64.3 Å²	64.3	65%	0.65	32%	0.321	S	S	*	.	S	Bend	trans	-120.8	-56.1	-166	52.2	0	0	0	0	114.1	W227	T225-W227 VanDerWaalsContact O-CZ3 3.25Å; T225-W227 WeakPolarHBondContact O-CZ3 3.37Å
226	W	64.9	Low	74.7	Confident	216 Å²	216	62.8 Å²	62.8	82%	0.818	31%	0.31	S	S	*	.			trans	-110.4	135.8	-175.1	-64.9	-9.3	0	0	0	111.3
227	W	69.9	Low	74.4	Confident	82 Å²	82	70 Å²	70	31%	0.311	34%	0.341	S	S	.	.			trans	-146	154.2	173.2	61.2	81.4	0	0	0	111.1	F223 T225 L261 F262	F223-W227 HydrophobicContact CD2-CB 3.82Å; F223-W227 HydrophobicContact CD2-CE3 4.12Å; F223-W227 HydrophobicContact CE2-CB 3.33Å; F223-W227 AromaticContact CE2-CD2 3.94Å; F223-W227 HydrophobicContact CE2-CD2 3.94Å; F223-W227 AromaticContact CE2-CE3 3.8Å; F223-W227 HydrophobicContact CE2-CE3 3.8Å; F223-W227 AromaticContact CE2-CG 3.79Å; F223-W227 HydrophobicContact CE2-CG 3.79Å; F223-W227 HydrophobicContact CZ-CB 3.76Å; F223-W227 HydrophobicContact CZ-CG 4.34Å; T225-W227 VanDerWaalsContact O-CZ3 3.25Å; T225-W227 WeakPolarHBondContact O-CZ3 3.37Å; W227-L261 VanDerWaalsContact CD1-CD2 3.5Å; W227-L261 HydrophobicContact CG-CD2 4.21Å; W227-F262 CarbonylContact C-O 3.59Å; W227-F262 VanDerWaalsContact CA-O 3.3Å; W227-F262 WeakPolarHBondContact CA-O 3.4Å
228	L	71.8	Confident	74	Confident	11 Å²	11	72.1 Å²	72.1	6%	0.058	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.5	168	-59	173.3	0	0	0	108.9	F262 Y265 L268 V279	L228-F262 HydrophobicContact CB-CB 4.31Å; L228-F262 PolarHBondContact N-O 3.13Å; L228-F262 PolarHBondContact O-N 2.89Å; L228-Y265 VanDerWaalsContact CD1-CA 3.49Å; L228-Y265 HydrophobicContact CD1-CD1 3.48Å; L228-Y265 VanDerWaalsContact CD1-CD1 3.48Å; L228-Y265 HydrophobicContact CD1-CD2 3.8Å; L228-Y265 HydrophobicContact CD1-CE1 3.75Å; L228-Y265 HydrophobicContact CD1-CE2 4.04Å; L228-Y265 HydrophobicContact CD1-CG 3.51Å; L228-Y265 VanDerWaalsContact CD1-N 3.32Å; L228-Y265 HydrophobicContact CD2-CD2 4.39Å; L228-Y265 HydrophobicContact CD2-CE1 4.07Å; L228-Y265 HydrophobicContact CD2-CE2 3.83Å; L228-L268 HydrophobicContact CD1-CB 4.25Å; L228-L268 HydrophobicContact CD1-CD2 3.99Å; L228-V279 HydrophobicContact CD2-CG1 4.44Å; L228-V279 HydrophobicContact CD2-CG2 4.45Å
229	E	73.1	Confident	73.2	Confident	29 Å²	29	69 Å²	69	14%	0.136	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.3	174.2	-175.7	162	178.6	0	0	110.5	R259 L261 L277	E229-R259 VanDerWaalsContact CD-NH2 3.27Å; E229-R259 HydrophobicContact CG-CG 4.42Å; E229-R259 WeakPolarHBondContact OE1-CD 3.15Å; E229-R259 IonicContact OE1-CZ 3.55Å; E229-R259 IonicContact OE1-NE 3.52Å; E229-R259 PolarHBondContact OE1-NE 3.07Å; E229-R259 IonicContact OE1-NH2 2.75Å; E229-R259 IonicContact OE2-CZ 3.9Å; E229-R259 IonicContact OE2-NE 3.54Å; E229-R259 IonicContact OE2-NH2 2.72Å; E229-R259 PolarHBondContact OE2-NH2 3.25Å; E229-L261 HydrophobicContact CB-CD2 4.5Å; E229-L277 HydrophobicContact CG-CD1 4.49Å; E229-L277 PolarHBondContact O-N 3.48Å
230	S	73.8	Confident	72.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	156	-178.2	174.6	0	0	0	0	110.9	T260 Y275	S230-T260 PolarHBondContact N-O 3.27Å; S230-T260 PolarHBondContact O-N 3.06Å; S230-Y275 CarbonylContact C-O 3.52Å; S230-Y275 WeakPolarHBondContact CA-O 3.34Å; S230-Y275 VanDerWaalsContact CB-O 3.27Å; S230-Y275 WeakPolarHBondContact CB-O 3.44Å; S230-Y275 VanDerWaalsContact OG-C 3.27Å; S230-Y275 PolarHBondContact OG-N 3.41Å; S230-Y275 VanDerWaalsContact OG-N 3.08Å; S230-Y275 PolarHBondContact OG-O 3.17Å
231	V	75.3	Confident	71.1	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.024	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.2	162.9	177.9	0	0	0	0	108.8	T189 F233 P257 Y275 L277	T189-V231 HydrophobicContact CG2-CG2 4.41Å; V231-F233 HydrophobicContact CB-CE2 4.2Å; V231-F233 HydrophobicContact CB-CZ 4.21Å; V231-F233 HydrophobicContact CG1-CD1 4.09Å; V231-F233 HydrophobicContact CG1-CD2 4.05Å; V231-F233 HydrophobicContact CG1-CE1 3.64Å; V231-F233 HydrophobicContact CG1-CE2 3.58Å; V231-F233 HydrophobicContact CG1-CG 4.3Å; V231-F233 HydrophobicContact CG1-CZ 3.37Å; V231-P257 HydrophobicContact CG1-CB 3.47Å; V231-P257 VanDerWaalsContact CG1-CB 3.47Å; V231-Y275 PolarHBondContact N-O 3.32Å; V231-Y275 PolarHBondContact O-N 2.86Å; V231-L277 HydrophobicContact CG2-CD1 3.31Å; V231-L277 HydrophobicContact CG2-CD2 3.85Å; V231-L277 HydrophobicContact CG2-CG 3.64Å
232	R	76.8	Confident	69.6	Low	102 Å²	102	65.2 Å²	65.2	39%	0.385	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	136.2	161.6	-178.8	179	164.3	-170.3	-5.8	108.6	E238 L258 T260 N273	R232-E238 IonicContact CZ-OE2 3.53Å; R232-E238 IonicContact NH2-OE2 2.9Å; R232-E238 PolarHBondContact NH2-OE2 2.81Å; R232-L258 HydrophobicContact CB-CB 4.44Å; R232-L258 PolarHBondContact N-O 3.1Å; R232-L258 WeakPolarHBondContact O-CA 3.43Å; R232-L258 WeakPolarHBondContact O-CB 3.46Å; R232-L258 PolarHBondContact O-N 3.22Å; R232-T260 WeakPolarHBondContact CB-OG1 3.42Å; R232-N273 WeakPolarHBondContact CA-O 3.4Å
233	F	75.5	Confident	68	Low	3 Å²	3	67.6 Å²	67.6	1%	0.013	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.4	173.4	-66	-80.5	0	0	0	110.2	L169 F181 F188 V231 L255 Y256 P257 Y275	L169-F233 HydrophobicContact CD1-CD1 3.62Å; L169-F233 HydrophobicContact CD1-CD2 4.1Å; L169-F233 HydrophobicContact CD1-CE1 3.31Å; L169-F233 HydrophobicContact CD1-CE2 3.84Å; L169-F233 HydrophobicContact CD1-CG 3.99Å; L169-F233 HydrophobicContact CD1-CZ 3.43Å; L169-F233 VanDerWaalsContact CD1-CZ 3.43Å; L169-F233 HydrophobicContact CG-CD1 4.24Å; L169-F233 HydrophobicContact CG-CE1 3.91Å; L169-F233 HydrophobicContact CG-CZ 4.39Å; F181-F233 HydrophobicContact CD1-CE2 4.31Å; F181-F233 AromaticContact CE1-CE2 3.62Å; F181-F233 HydrophobicContact CE1-CE2 3.62Å; F181-F233 AromaticContact CE1-CZ 3.87Å; F181-F233 HydrophobicContact CE1-CZ 3.87Å; F188-F233 HydrophobicContact CD2-CE1 4.24Å; F188-F233 HydrophobicContact CD2-CZ 4.44Å; F188-F233 AromaticContact CE2-CE1 3.87Å; F188-F233 HydrophobicContact CE2-CE1 3.87Å; F188-F233 AromaticContact CE2-CZ 3.67Å; F188-F233 HydrophobicContact CE2-CZ 3.67Å; F188-F233 HydrophobicContact CZ-CE1 4.26Å; F188-F233 HydrophobicContact CZ-CZ 4.01Å; V231-F233 HydrophobicContact CB-CE2 4.2Å; V231-F233 HydrophobicContact CB-CZ 4.21Å; V231-F233 HydrophobicContact CG1-CD1 4.09Å; V231-F233 HydrophobicContact CG1-CD2 4.05Å; V231-F233 HydrophobicContact CG1-CE1 3.64Å; V231-F233 HydrophobicContact CG1-CE2 3.58Å; V231-F233 HydrophobicContact CG1-CG 4.3Å; V231-F233 HydrophobicContact CG1-CZ 3.37Å; F233-L255 HydrophobicContact CB-CB 4.04Å; F233-L255 HydrophobicContact CB-CD1 3.95Å; F233-L255 HydrophobicContact CB-CG 4.45Å; F233-L255 HydrophobicContact CD1-CB 4.43Å; F233-Y256 WeakPolarHBondContact CA-O 3.46Å; F233-P257 HydrophobicContact CD1-CB 4.09Å; F233-P257 HydrophobicContact CE1-CB 3.73Å; F233-P257 HydrophobicContact CE1-CG 4.33Å; F233-Y275 AromaticContact CD2-CD2 3.79Å; F233-Y275 HydrophobicContact CD2-CD2 3.79Å; F233-Y275 AromaticContact CD2-CE2 3.8Å; F233-Y275 HydrophobicContact CD2-CE2 3.8Å; F233-Y275 AromaticContact CE2-CD2 3.67Å; F233-Y275 HydrophobicContact CE2-CD2 3.67Å; F233-Y275 HydrophobicContact CE2-CE2 4.01Å
234	A	74.1	Confident	66.8	Low	1 Å²	1	77.2 Å²	77.2	1%	0.008	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.1	-179.8	0	0	0	0	0	110.3	E238 I239 Y256 L258	A234-E238 HydrophobicContact CB-CB 4.07Å; A234-I239 HydrophobicContact CB-CG1 4.22Å; A234-Y256 PolarHBondContact N-O 3.23Å; A234-Y256 WeakPolarHBondContact O-CD2 3.23Å; A234-Y256 PolarHBondContact O-N 3.39Å; A234-L258 HydrophobicContact CB-CD1 3.45Å; A234-L258 VanDerWaalsContact CB-CD1 3.45Å; A234-L258 HydrophobicContact CB-CG 4.17Å
235	N	76.6	Confident	66	Low	38 Å²	38	73.8 Å²	73.8	20%	0.203	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	169.1	170.5	63.2	60.5	0	0	0	111.1	K237 E238 I239 L255	N235-K237 VanDerWaalsContact C-N 3.25Å; N235-K237 PolarHBondContact O-N 3.07Å; N235-K237 WeakPolarHBondContact OD1-CA 3.27Å; N235-K237 WeakPolarHBondContact OD1-CB 3.12Å; N235-K237 PolarHBondContact OD1-N 3.17Å; N235-E238 PolarHBondContact ND2-OE1 2.93Å; N235-E238 PolarHBondContact O-N 3.34Å; N235-E238 PolarHBondContact OD1-N 2.68Å; N235-I239 PolarHBondContact O-N 2.88Å; N235-L255 HydrophobicContact CB-CD2 4.24Å
236	R	68.6	Low	65	Low	49 Å²	49	78.4 Å²	78.4	19%	0.185	37%	0.369	C	S	.	.	H	α-helix	trans	-55.4	-35	179.2	-170.6	175	-179.3	-160.3	-0.4	114.1	I239 I240 A250 Y256	R236-I239 PolarHBondContact O-N 2.81Å; R236-I240 HydrophobicContact CG-CD1 3.59Å; R236-I240 HydrophobicContact CG-CG1 4.29Å; R236-I240 WeakPolarHBondContact O-CG1 3.29Å; R236-I240 PolarHBondContact O-N 3.16Å; R236-I240 VanDerWaalsContact O-N 3.09Å; R236-A250 PolarHBondContact NH1-O 2.89Å; R236-Y256 HydrophobicContact CB-CE2 3.95Å
237	K	72.1	Confident	64.1	Low	150 Å²	150	73.7 Å²	73.7	65%	0.652	36%	0.359	S	S	*	.	H	α-helix	trans	-68.2	-41.8	-178.5	-63.6	178.9	179.1	173.3	0	111.3	N235 I239 I240 S241	N235-K237 VanDerWaalsContact C-N 3.25Å; N235-K237 PolarHBondContact O-N 3.07Å; N235-K237 WeakPolarHBondContact OD1-CA 3.27Å; N235-K237 WeakPolarHBondContact OD1-CB 3.12Å; N235-K237 PolarHBondContact OD1-N 3.17Å; K237-I239 VanDerWaalsContact C-N 3.26Å; K237-I239 PolarHBondContact O-N 2.93Å; K237-I240 PolarHBondContact O-N 3.23Å; K237-S241 WeakPolarHBondContact O-CB 3.33Å; K237-S241 PolarHBondContact O-N 3.01Å; K237-S241 VanDerWaalsContact O-N 3.1Å; K237-S241 PolarHBondContact O-OG 3.15Å
238	E	69.5	Low	63	Low	82 Å²	82	76.5 Å²	76.5	38%	0.383	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-33.6	176.6	-73.7	173.5	-131.8	0	0	112.6	R232 A234 N235 S241	R232-E238 IonicContact CZ-OE2 3.53Å; R232-E238 IonicContact NH2-OE2 2.9Å; R232-E238 PolarHBondContact NH2-OE2 2.81Å; A234-E238 HydrophobicContact CB-CB 4.07Å; N235-E238 PolarHBondContact ND2-OE1 2.93Å; N235-E238 PolarHBondContact O-N 3.34Å; N235-E238 PolarHBondContact OD1-N 2.68Å; E238-S241 PolarHBondContact O-OG 2.98Å
239	I	65.4	Low	61.8	Low	20 Å²	20	86.5 Å²	86.5	10%	0.103	42%	0.423	C	S	.	.	H	α-helix	trans	-75.7	-48.6	180	-62.2	168.6	0	0	0	110.7	I204 I205 A234 N235 R236 K237 S242 Y256 L258	I204-I239 HydrophobicContact CG2-CG2 4.21Å; I204-I239 WeakPolarHBondContact O-CG2 3.3Å; I205-I239 HydrophobicContact CB-CG2 4.48Å; I205-I239 HydrophobicContact CG1-CD1 4.5Å; I205-I239 HydrophobicContact CG1-CG2 4.07Å; A234-I239 HydrophobicContact CB-CG1 4.22Å; N235-I239 PolarHBondContact O-N 2.88Å; R236-I239 PolarHBondContact O-N 2.81Å; K237-I239 VanDerWaalsContact C-N 3.26Å; K237-I239 PolarHBondContact O-N 2.93Å; I239-S242 PolarHBondContact O-OG 3.39Å; I239-Y256 HydrophobicContact CD1-CD1 4.5Å; I239-Y256 HydrophobicContact CD1-CD2 3.7Å; I239-Y256 HydrophobicContact CD1-CE2 4.49Å; I239-Y256 HydrophobicContact CD1-CG 3.72Å; I239-L258 HydrophobicContact CD1-CD2 4.29Å; I239-L258 HydrophobicContact CG1-CD1 4.34Å
240	I	66.8	Low	60.5	Low	36 Å²	36	87.9 Å²	87.9	19%	0.185	44%	0.44	C	S	.	.	H	α-helix	trans	-78	-22.2	-171.8	-62.7	177.9	0	0	0	112.5	R236 K237 S242 K243	R236-I240 HydrophobicContact CG-CD1 3.59Å; R236-I240 HydrophobicContact CG-CG1 4.29Å; R236-I240 WeakPolarHBondContact O-CG1 3.29Å; R236-I240 PolarHBondContact O-N 3.16Å; R236-I240 VanDerWaalsContact O-N 3.09Å; K237-I240 PolarHBondContact O-N 3.23Å; I240-S242 PolarHBondContact O-N 2.83Å; I240-K243 CarbonylContact O-C 3.37Å; I240-K243 PolarHBondContact O-N 3.13Å
241	S	58.1	Low	59.3	Low	101 Å²	101	90.4 Å²	90.4	71%	0.706	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-6.7	-179.5	55.6	0	0	0	0	115.2	K237 E238	K237-S241 WeakPolarHBondContact O-CB 3.33Å; K237-S241 PolarHBondContact O-N 3.01Å; K237-S241 VanDerWaalsContact O-N 3.1Å; K237-S241 PolarHBondContact O-OG 3.15Å; E238-S241 PolarHBondContact O-OG 2.98Å
242	S	51.4	Low	58.3	Low	74 Å²	74	93.3 Å²	93.3	52%	0.517	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-12.4	168.1	70	0	0	0	0	114.8	I239 I240	I239-S242 PolarHBondContact O-OG 3.39Å; I240-S242 PolarHBondContact O-N 2.83Å
243	K	46.6	Very low	57.9	Low	156 Å²	156	93.8 Å²	93.8	68%	0.678	48%	0.484	S	S	*	.	S	Bend	trans	-140.2	120.5	175.6	-73.6	-174.7	178.6	177.7	0	111.6	I240 S245	I240-K243 CarbonylContact O-C 3.37Å; I240-K243 PolarHBondContact O-N 3.13Å; K243-S245 PolarHBondContact O-N 3.19Å
244	K	45.9	Very low	57.7	Low	225 Å²	225	95.1 Å²	95.1	98%	0.978	49%	0.493	S	S	*	.			trans	-44.9	97	166.7	-76.2	177.5	175	176.7	0	110.1
245	S	46.2	Very low	57.8	Low	64 Å²	64	95.2 Å²	95.2	45%	0.448	49%	0.493	S	S	.	.			trans	-144.7	124.3	163.7	73.8	0	0	0	0	110.4	K243 L247	K243-S245 PolarHBondContact O-N 3.19Å; S245-L247 PolarHBondContact O-N 3.42Å
246	Q	42.6	Very low	57.6	Low	203 Å²	203	93.6 Å²	93.6	95%	0.949	48%	0.484	S	S	*	.			trans	-74.5	93.7	168.2	-65.7	-172.3	-4.8	0	0	107.4
247	L	47.2	Very low	57.7	Low	117 Å²	117	92 Å²	92	61%	0.613	48%	0.48	S	S	*	.			trans	-121.7	134.8	169.6	-82.7	161.3	0	0	0	109	S245	S245-L247 PolarHBondContact O-N 3.42Å
248	N	46.5	Very low	57.7	Low	141 Å²	141	85.5 Å²	85.5	75%	0.754	45%	0.452	S	S	*	.			trans	-45.1	145.7	-169.7	-72	-26.7	0	0	0	113.8	A250	N248-A250 PolarHBondContact O-N 3.28Å
249	K	46.6	Very low	57.8	Low	221 Å²	221	84.2 Å²	84.2	96%	0.961	44%	0.444	S	S	*	.			trans	-55.1	22.2	177.6	-77.5	179.1	174.7	174.6	0	115.8	S251	K249-S251 PolarHBondContact O-N 3.03Å
250	A	44.7	Very low	58.2	Low	59 Å²	59	83.8 Å²	83.8	49%	0.488	44%	0.442	S	S	.	.			trans	-71.9	112.9	176.6	0	0	0	0	0	110.9	R236 N248	R236-A250 PolarHBondContact NH1-O 2.89Å; N248-A250 PolarHBondContact O-N 3.28Å
251	S	49.3	Very low	58.7	Low	53 Å²	53	83.1 Å²	83.1	37%	0.371	44%	0.439	S	S	.	.			trans	47.4	89.7	168.7	69.4	0	0	0	0	116.7	K249 E253	K249-S251 PolarHBondContact O-N 3.03Å; S251-E253 PolarHBondContact O-N 2.8Å
252	S	54.7	Low	59.7	Low	64 Å²	64	78.3 Å²	78.3	45%	0.448	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	18.9	155	49.5	0	0	0	0	113.3
253	E	68	Low	61.1	Low	112 Å²	112	77 Å²	77	52%	0.523	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-2	-159.7	-64.8	178.3	173.7	0	0	113.9	S171 S251	S171-E253 WeakPolarHBondContact CA-O 3.41Å; S171-E253 WeakPolarHBondContact CB-O 3.19Å; S171-E253 PolarHBondContact N-O 3.44Å; S171-E253 WeakPolarHBondContact OG-CA 3.48Å; S171-E253 PolarHBondContact OG-O 3.21Å; S171-E253 VanDerWaalsContact OG-O 3.11Å; S251-E253 PolarHBondContact O-N 2.8Å
254	V	71.9	Confident	62.8	Low	32 Å²	32	71.7 Å²	71.7	19%	0.194	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.5	-174.3	-179.8	0	0	0	0	110	L168	L168-V254 HydrophobicContact CB-CG1 3.77Å; L168-V254 HydrophobicContact CD1-CG1 3.62Å; L168-V254 HydrophobicContact CD2-CG1 3.59Å; L168-V254 HydrophobicContact CG-CG1 3.83Å
255	L	74.6	Confident	64.6	Low	2 Å²	2	66.3 Å²	66.3	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.9	168.2	-62.8	177	0	0	0	111.1	L169 F173 T174 F233 N235	L169-L255 HydrophobicContact CB-CB 4.26Å; L169-L255 HydrophobicContact CB-CD1 4.42Å; L169-L255 PolarHBondContact O-N 3.21Å; F173-L255 HydrophobicContact CB-CD1 3.75Å; F173-L255 HydrophobicContact CD1-CD1 4.37Å; F173-L255 HydrophobicContact CG-CD1 4.48Å; T174-L255 HydrophobicContact CG2-CD1 3.58Å; T174-L255 HydrophobicContact CG2-CD2 3.89Å; T174-L255 HydrophobicContact CG2-CG 4.39Å; F233-L255 HydrophobicContact CB-CB 4.04Å; F233-L255 HydrophobicContact CB-CD1 3.95Å; F233-L255 HydrophobicContact CB-CG 4.45Å; F233-L255 HydrophobicContact CD1-CB 4.43Å; N235-L255 HydrophobicContact CB-CD2 4.24Å
256	Y	73.4	Confident	66.5	Low	5 Å²	5	69.6 Å²	69.6	2%	0.02	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.7	174.8	-60.8	-96.9	0	0	0	109.1	L168 W200 I204 F233 A234 R236 I239	L168-Y256 HydrophobicContact CD2-CD1 4.47Å; W200-Y256 AromaticContact CH2-CE1 3.43Å; W200-Y256 HydrophobicContact CH2-CE1 3.43Å; W200-Y256 VanDerWaalsContact CH2-CE1 3.43Å; W200-Y256 AromaticContact CH2-CZ 3.75Å; W200-Y256 WeakPolarHBondContact CH2-OH 3.28Å; W200-Y256 HydrophobicContact CZ2-CE1 4.42Å; W200-Y256 AromaticContact CZ3-CE1 3.66Å; W200-Y256 HydrophobicContact CZ3-CE1 3.66Å; I204-Y256 HydrophobicContact CD1-CE1 4.47Å; F233-Y256 WeakPolarHBondContact CA-O 3.46Å; A234-Y256 PolarHBondContact N-O 3.23Å; A234-Y256 WeakPolarHBondContact O-CD2 3.23Å; A234-Y256 PolarHBondContact O-N 3.39Å; R236-Y256 HydrophobicContact CB-CE2 3.95Å; I239-Y256 HydrophobicContact CD1-CD1 4.5Å; I239-Y256 HydrophobicContact CD1-CD2 3.7Å; I239-Y256 HydrophobicContact CD1-CE2 4.49Å; I239-Y256 HydrophobicContact CD1-CG 3.72Å
257	P	71.5	Confident	68.5	Low	14 Å²	14	60.4 Å²	60.4	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	129.7	170.2	16.2	-6.5	0	0	0	109.7	F188 V231 F233	F188-P257 HydrophobicContact CB-CB 4.41Å; F188-P257 HydrophobicContact CB-CG 3.45Å; F188-P257 VanDerWaalsContact CB-CG 3.45Å; F188-P257 HydrophobicContact CD2-CB 3.66Å; F188-P257 HydrophobicContact CD2-CG 3.61Å; F188-P257 HydrophobicContact CE2-CB 4.42Å; F188-P257 HydrophobicContact CG-CB 4.31Å; F188-P257 HydrophobicContact CG-CG 3.74Å; V231-P257 HydrophobicContact CG1-CB 3.47Å; V231-P257 VanDerWaalsContact CG1-CB 3.47Å; F233-P257 HydrophobicContact CD1-CB 4.09Å; F233-P257 HydrophobicContact CE1-CB 3.73Å; F233-P257 HydrophobicContact CE1-CG 4.33Å
258	L	71.5	Confident	70.1	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	115.9	177.8	-62.5	-175.1	0	0	0	108.3	I205 W210 R232 A234 I239 T260	I205-L258 HydrophobicContact CD1-CD2 4.31Å; W210-L258 HydrophobicContact CH2-CB 3.51Å; W210-L258 HydrophobicContact CH2-CD1 3.8Å; W210-L258 HydrophobicContact CH2-CD2 3.76Å; W210-L258 HydrophobicContact CH2-CG 3.88Å; W210-L258 HydrophobicContact CZ2-CB 4.37Å; W210-L258 HydrophobicContact CZ2-CD1 4.23Å; W210-L258 HydrophobicContact CZ2-CD2 3.73Å; W210-L258 HydrophobicContact CZ2-CG 4.33Å; W210-L258 HydrophobicContact CZ3-CB 3.83Å; R232-L258 HydrophobicContact CB-CB 4.44Å; R232-L258 PolarHBondContact N-O 3.1Å; R232-L258 WeakPolarHBondContact O-CA 3.43Å; R232-L258 WeakPolarHBondContact O-CB 3.46Å; R232-L258 PolarHBondContact O-N 3.22Å; A234-L258 HydrophobicContact CB-CD1 3.45Å; A234-L258 VanDerWaalsContact CB-CD1 3.45Å; A234-L258 HydrophobicContact CB-CG 4.17Å; I239-L258 HydrophobicContact CD1-CD2 4.29Å; I239-L258 HydrophobicContact CG1-CD1 4.34Å; L258-T260 PolarHBondContact O-N 3.39Å; L258-T260 VanDerWaalsContact O-N 3.13Å; L258-T260 PolarHBondContact O-OG1 3.45Å
259	R	70.3	Confident	71.8	Confident	55 Å²	55	54.2 Å²	54.2	21%	0.208	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	114.7	174.6	-174	-179	-175.1	-97.9	-4.5	110.4	N191 Y194 W210 E229	N191-R259 WeakPolarHBondContact OD1-CD 3.5Å; Y194-R259 HydrophobicContact CE2-CB 4.26Å; Y194-R259 WeakPolarHBondContact OH-CB 3.49Å; W210-R259 WeakPolarHBondContact CZ3-O 3.24Å; E229-R259 VanDerWaalsContact CD-NH2 3.27Å; E229-R259 HydrophobicContact CG-CG 4.42Å; E229-R259 WeakPolarHBondContact OE1-CD 3.15Å; E229-R259 IonicContact OE1-CZ 3.55Å; E229-R259 IonicContact OE1-NE 3.52Å; E229-R259 PolarHBondContact OE1-NE 3.07Å; E229-R259 IonicContact OE1-NH2 2.75Å; E229-R259 IonicContact OE2-CZ 3.9Å; E229-R259 IonicContact OE2-NE 3.54Å; E229-R259 IonicContact OE2-NH2 2.72Å; E229-R259 PolarHBondContact OE2-NH2 3.25Å
260	T	74.7	Confident	73.6	Confident	11 Å²	11	46.6 Å²	46.6	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.3	-171.8	-56.3	0	0	0	0	109.3	A217 S230 R232 L258 F262	A217-T260 HydrophobicContact CB-CG2 3.12Å; S230-T260 PolarHBondContact N-O 3.27Å; S230-T260 PolarHBondContact O-N 3.06Å; R232-T260 WeakPolarHBondContact CB-OG1 3.42Å; L258-T260 PolarHBondContact O-N 3.39Å; L258-T260 VanDerWaalsContact O-N 3.13Å; L258-T260 PolarHBondContact O-OG1 3.45Å; T260-F262 HydrophobicContact CG2-CD2 4.3Å; T260-F262 HydrophobicContact CG2-CE1 4.28Å; T260-F262 HydrophobicContact CG2-CE2 3.47Å; T260-F262 VanDerWaalsContact CG2-CE2 3.47Å; T260-F262 HydrophobicContact CG2-CZ 3.46Å; T260-F262 VanDerWaalsContact CG2-CZ 3.46Å
261	L	77.7	Confident	75.3	Confident	21 Å²	21	45.3 Å²	45.3	11%	0.11	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	136.9	-180	-61.3	-178.3	0	0	0	111.9	A217 F223 W227 E229	A217-L261 WeakPolarHBondContact CB-O 3.24Å; A217-L261 PolarHBondContact N-O 3.09Å; F223-L261 HydrophobicContact CE1-CB 4.24Å; F223-L261 HydrophobicContact CZ-CB 3.68Å; F223-L261 HydrophobicContact CZ-CD1 3.93Å; F223-L261 HydrophobicContact CZ-CG 4.43Å; W227-L261 VanDerWaalsContact CD1-CD2 3.5Å; W227-L261 HydrophobicContact CG-CD2 4.21Å; E229-L261 HydrophobicContact CB-CD2 4.5Å
262	F	78.9	Confident	76.5	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139.5	177.9	-64.2	-81.9	0	0	0	111.9	A217 R218 W227 L228 T260 S264 C267 L268 S271 C274	A217-F262 HydrophobicContact CB-CD1 4.5Å; A217-F262 HydrophobicContact CB-CE1 4.07Å; A217-F262 HydrophobicContact CB-CZ 4.29Å; R218-F262 HydrophobicContact CB-CD1 4.21Å; R218-F262 HydrophobicContact CB-CE1 3.96Å; W227-F262 CarbonylContact C-O 3.59Å; W227-F262 VanDerWaalsContact CA-O 3.3Å; W227-F262 WeakPolarHBondContact CA-O 3.4Å; L228-F262 HydrophobicContact CB-CB 4.31Å; L228-F262 PolarHBondContact N-O 3.13Å; L228-F262 PolarHBondContact O-N 2.89Å; T260-F262 HydrophobicContact CG2-CD2 4.3Å; T260-F262 HydrophobicContact CG2-CE1 4.28Å; T260-F262 HydrophobicContact CG2-CE2 3.47Å; T260-F262 VanDerWaalsContact CG2-CE2 3.47Å; T260-F262 HydrophobicContact CG2-CZ 3.46Å; T260-F262 VanDerWaalsContact CG2-CZ 3.46Å; F262-S264 VanDerWaalsContact C-N 3.27Å; F262-S264 PolarHBondContact O-N 2.88Å; F262-C267 HydrophobicContact CB-CB 4.36Å; F262-C267 HydrophobicContact CD1-CB 3.92Å; F262-L268 HydrophobicContact CB-CB 4.22Å; F262-L268 HydrophobicContact CD1-CB 4.46Å; F262-L268 HydrophobicContact CD2-CB 4.06Å; F262-L268 HydrophobicContact CD2-CD1 3.6Å; F262-L268 HydrophobicContact CD2-CG 4.41Å; F262-L268 HydrophobicContact CE2-CD1 3.5Å; F262-L268 VanDerWaalsContact CE2-CD1 3.5Å; F262-L268 HydrophobicContact CG-CB 3.99Å; F262-L268 HydrophobicContact CG-CD1 4.37Å; F262-L268 HydrophobicContact CZ-CD1 4.21Å; F262-S271 VanDerWaalsContact CE1-OG 3.26Å; F262-S271 WeakPolarHBondContact CE1-OG 3.49Å; F262-C274 HydrophobicContact CE2-CB 4.02Å; F262-C274 HydrophobicContact CZ-CB 3.93Å; F262-C274 VanDerWaalsContact CZ-SG 3.59Å
263	C	79.9	Confident	77.3	Confident	46 Å²	46	49.7 Å²	49.7	31%	0.311	26%	0.257	S	S	.	.	S	Bend	trans	-77	-11	177.5	66.5	0	0	0	0	113.8	C216 C219 F223	C216-C263 HydrophobicContact CB-CB 3.93Å; C219-C263 VanDerWaalsContact SG-SG 3.61Å; F223-C263 HydrophobicContact CB-CB 4.1Å; F223-C263 HydrophobicContact CD1-CB 3.79Å; F223-C263 HydrophobicContact CG-CB 4.21Å
264	S	83	Confident	77.7	Confident	44 Å²	44	45.3 Å²	45.3	31%	0.308	24%	0.239	S	C	.	.	S	Bend	trans	-166.9	160.8	-179.3	66.3	0	0	0	0	112.2	F262 H266 C267 L268	F262-S264 VanDerWaalsContact C-N 3.27Å; F262-S264 PolarHBondContact O-N 2.88Å; S264-H266 PolarHBondContact O-N 2.81Å; S264-C267 PolarHBondContact O-N 3.46Å; S264-C267 VanDerWaalsContact O-N 3.08Å; S264-C267 PolarHBondContact OG-N 3.41Å; S264-L268 PolarHBondContact O-N 2.91Å; S264-L268 VanDerWaalsContact O-N 3.1Å
265	Y	83.6	Confident	77.9	Confident	113 Å²	113	45.1 Å²	45.1	44%	0.443	23%	0.234	S	C	.	.	H	α-helix	trans	-59.6	-34.3	172.6	-79.6	-76.4	0	0	0	112.4	L228 C267 L268 N269 E276	L228-Y265 VanDerWaalsContact CD1-CA 3.49Å; L228-Y265 HydrophobicContact CD1-CD1 3.48Å; L228-Y265 VanDerWaalsContact CD1-CD1 3.48Å; L228-Y265 HydrophobicContact CD1-CD2 3.8Å; L228-Y265 HydrophobicContact CD1-CE1 3.75Å; L228-Y265 HydrophobicContact CD1-CE2 4.04Å; L228-Y265 HydrophobicContact CD1-CG 3.51Å; L228-Y265 VanDerWaalsContact CD1-N 3.32Å; L228-Y265 HydrophobicContact CD2-CD2 4.39Å; L228-Y265 HydrophobicContact CD2-CE1 4.07Å; L228-Y265 HydrophobicContact CD2-CE2 3.83Å; Y265-C267 VanDerWaalsContact C-N 3.29Å; Y265-C267 PolarHBondContact O-N 3.5Å; Y265-L268 HydrophobicContact CD1-CD2 4.39Å; Y265-L268 PolarHBondContact O-N 3.16Å; Y265-N269 WeakPolarHBondContact O-CB 3.42Å; Y265-N269 PolarHBondContact O-N 3Å; Y265-N269 PolarHBondContact O-ND2 3.41Å; Y265-E276 PolarHBondContact OH-OE1 3.32Å
266	H	86.1	Confident	78	Confident	132 Å²	132	48.5 Å²	48.5	61%	0.611	25%	0.25	S	S	*	.	H	α-helix	trans	-58.4	-44	174.4	176.1	-88.3	0	0	0	111.3	R218 S264 S270	R218-H266 PolarHBondContact NH1-O 2.84Å; S264-H266 PolarHBondContact O-N 2.81Å; H266-S270 PolarHBondContact O-N 3.37Å; H266-S270 PolarHBondContact O-OG 2.63Å
267	C	83.9	Confident	77.7	Confident	10 Å²	10	49.7 Å²	49.7	7%	0.068	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-43.9	177.9	-72	0	0	0	0	111.9	R218 F262 S264 Y265 S271	R218-C267 HydrophobicContact CB-CB 4.25Å; R218-C267 WeakPolarHBondContact CD-O 3.26Å; R218-C267 PolarHBondContact NH1-O 2.97Å; F262-C267 HydrophobicContact CB-CB 4.36Å; F262-C267 HydrophobicContact CD1-CB 3.92Å; S264-C267 PolarHBondContact O-N 3.46Å; S264-C267 VanDerWaalsContact O-N 3.08Å; S264-C267 PolarHBondContact OG-N 3.41Å; Y265-C267 VanDerWaalsContact C-N 3.29Å; Y265-C267 PolarHBondContact O-N 3.5Å; C267-S271 PolarHBondContact O-N 3.2Å
268	L	82.3	Confident	77	Confident	8 Å²	8	52 Å²	52	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-54.1	175.1	174.9	63.3	0	0	0	111.7	L228 F262 S264 Y265 S270 S271 C274 E276	L228-L268 HydrophobicContact CD1-CB 4.25Å; L228-L268 HydrophobicContact CD1-CD2 3.99Å; F262-L268 HydrophobicContact CB-CB 4.22Å; F262-L268 HydrophobicContact CD1-CB 4.46Å; F262-L268 HydrophobicContact CD2-CB 4.06Å; F262-L268 HydrophobicContact CD2-CD1 3.6Å; F262-L268 HydrophobicContact CD2-CG 4.41Å; F262-L268 HydrophobicContact CE2-CD1 3.5Å; F262-L268 VanDerWaalsContact CE2-CD1 3.5Å; F262-L268 HydrophobicContact CG-CB 3.99Å; F262-L268 HydrophobicContact CG-CD1 4.37Å; F262-L268 HydrophobicContact CZ-CD1 4.21Å; S264-L268 PolarHBondContact O-N 2.91Å; S264-L268 VanDerWaalsContact O-N 3.1Å; Y265-L268 HydrophobicContact CD1-CD2 4.39Å; Y265-L268 PolarHBondContact O-N 3.16Å; L268-S270 PolarHBondContact O-N 3.18Å; L268-S270 VanDerWaalsContact O-N 3.11Å; L268-S271 WeakPolarHBondContact O-CB 3.43Å; L268-S271 PolarHBondContact O-N 3.21Å; L268-C274 HydrophobicContact CD1-CB 3.96Å; L268-E276 HydrophobicContact CD2-CB 4.11Å; L268-E276 HydrophobicContact CD2-CG 4.27Å
269	N	82.2	Confident	75.9	Confident	120 Å²	120	55.7 Å²	55.7	64%	0.642	30%	0.296	S	S	*	.	H	α-helix	trans	-67.6	-15.3	-170.8	-72.4	-12.7	0	0	0	115	Y265	Y265-N269 WeakPolarHBondContact O-CB 3.42Å; Y265-N269 PolarHBondContact O-N 3Å; Y265-N269 PolarHBondContact O-ND2 3.41Å
270	S	83.4	Confident	74.4	Confident	62 Å²	62	58 Å²	58	43%	0.434	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	22.3	170.4	28.1	0	0	0	0	113.9	R218 H266 L268	R218-S270 PolarHBondContact NE-O 3.46Å; R218-S270 PolarHBondContact NH1-O 3.24Å; R218-S270 PolarHBondContact NH1-OG 2.96Å; R218-S270 PolarHBondContact NH2-O 3.09Å; R218-S270 PolarHBondContact NH2-OG 2.98Å; H266-S270 PolarHBondContact O-N 3.37Å; H266-S270 PolarHBondContact O-OG 2.63Å; L268-S270 PolarHBondContact O-N 3.18Å; L268-S270 VanDerWaalsContact O-N 3.11Å
271	S	79.6	Confident	74.4	Confident	32 Å²	32	60.3 Å²	60.3	22%	0.224	35%	0.35	C	S	.	.	S	Bend	trans	-89.5	137.6	156	-93.7	0	0	0	0	110.3	R218 F262 C267 L268	R218-S271 WeakPolarHBondContact CD-OG 3.42Å; F262-S271 VanDerWaalsContact CE1-OG 3.26Å; F262-S271 WeakPolarHBondContact CE1-OG 3.49Å; C267-S271 PolarHBondContact O-N 3.2Å; L268-S271 WeakPolarHBondContact O-CB 3.43Å; L268-S271 PolarHBondContact O-N 3.21Å
272	E	75.5	Confident	74.2	Confident	159 Å²	159	62.4 Å²	62.4	74%	0.743	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	145.7	175.6	-62.9	-174	175.6	0	0	111.6	C274	E272-C274 PolarHBondContact O-N 2.89Å
273	N	71.6	Confident	74	Confident	50 Å²	50	65.8 Å²	65.8	27%	0.267	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	30	175.8	-53.3	-39.8	0	0	0	114.5	R232	R232-N273 WeakPolarHBondContact CA-O 3.4Å
274	C	76.1	Confident	73.6	Confident	20 Å²	20	66.9 Å²	66.9	14%	0.135	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	129.7	174.7	-68.6	0	0	0	0	109.6	F262 L268 E272	F262-C274 HydrophobicContact CE2-CB 4.02Å; F262-C274 HydrophobicContact CZ-CB 3.93Å; F262-C274 VanDerWaalsContact CZ-SG 3.59Å; L268-C274 HydrophobicContact CD1-CB 3.96Å; E272-C274 PolarHBondContact O-N 2.89Å
275	Y	76.5	Confident	73	Confident	27 Å²	27	68.4 Å²	68.4	11%	0.106	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131.2	-178.3	-54.8	-80.3	0	0	0	109.6	F173 L178 F181 S230 V231 F233	F173-Y275 HydrophobicContact CE1-CE2 4.35Å; L178-Y275 HydrophobicContact CB-CE1 4.2Å; L178-Y275 HydrophobicContact CD1-CE1 4.25Å; F181-Y275 HydrophobicContact CB-CD1 3.31Å; F181-Y275 HydrophobicContact CB-CE1 3.66Å; F181-Y275 HydrophobicContact CB-CG 3.88Å; F181-Y275 AromaticContact CD1-CD1 3.76Å; F181-Y275 HydrophobicContact CD1-CD1 3.76Å; F181-Y275 AromaticContact CD1-CD2 3.61Å; F181-Y275 HydrophobicContact CD1-CD2 3.61Å; F181-Y275 HydrophobicContact CD1-CE1 4.17Å; F181-Y275 HydrophobicContact CD1-CE2 4.04Å; F181-Y275 AromaticContact CD1-CG 3.41Å; F181-Y275 HydrophobicContact CD1-CG 3.41Å; F181-Y275 VanDerWaalsContact CD1-CG 3.41Å; F181-Y275 HydrophobicContact CE1-CD2 4.21Å; F181-Y275 HydrophobicContact CE1-CG 4.4Å; F181-Y275 AromaticContact CG-CD1 3.96Å; F181-Y275 HydrophobicContact CG-CD1 3.96Å; F181-Y275 HydrophobicContact CG-CE1 4.21Å; F181-Y275 HydrophobicContact CG-CG 4.09Å; S230-Y275 CarbonylContact C-O 3.52Å; S230-Y275 WeakPolarHBondContact CA-O 3.34Å; S230-Y275 VanDerWaalsContact CB-O 3.27Å; S230-Y275 WeakPolarHBondContact CB-O 3.44Å; S230-Y275 VanDerWaalsContact OG-C 3.27Å; S230-Y275 PolarHBondContact OG-N 3.41Å; S230-Y275 VanDerWaalsContact OG-N 3.08Å; S230-Y275 PolarHBondContact OG-O 3.17Å; V231-Y275 PolarHBondContact N-O 3.32Å; V231-Y275 PolarHBondContact O-N 2.86Å; F233-Y275 AromaticContact CD2-CD2 3.79Å; F233-Y275 HydrophobicContact CD2-CD2 3.79Å; F233-Y275 AromaticContact CD2-CE2 3.8Å; F233-Y275 HydrophobicContact CD2-CE2 3.8Å; F233-Y275 AromaticContact CE2-CD2 3.67Å; F233-Y275 HydrophobicContact CE2-CD2 3.67Å; F233-Y275 HydrophobicContact CE2-CE2 4.01Å
276	E	75.7	Confident	72.3	Confident	74 Å²	74	65.4 Å²	65.4	35%	0.346	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	135.3	179.4	-166.1	176	172	0	0	110.5	Y265 L268	Y265-E276 PolarHBondContact OH-OE1 3.32Å; L268-E276 HydrophobicContact CD2-CB 4.11Å; L268-E276 HydrophobicContact CD2-CG 4.27Å
277	L	67.1	Low	71.3	Confident	30 Å²	30	60.6 Å²	60.6	16%	0.157	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-38.1	173.5	-73.7	-175.6	0	0	0	112.7	T189 E229 V231	T189-L277 HydrophobicContact CG2-CD1 4.16Å; T189-L277 HydrophobicContact CG2-CD2 3.72Å; E229-L277 HydrophobicContact CG-CD1 4.49Å; E229-L277 PolarHBondContact O-N 3.48Å; V231-L277 HydrophobicContact CG2-CD1 3.31Å; V231-L277 HydrophobicContact CG2-CD2 3.85Å; V231-L277 HydrophobicContact CG2-CG 3.64Å
278	S	57.9	Low	70.4	Confident	63 Å²	63	64.5 Å²	64.5	44%	0.441	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	177.6	159.3	-178.5	48.3	0	0	0	0	110.4
279	V	48.2	Very low	69.4	Low	92 Å²	92	69.3 Å²	69.3	56%	0.558	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	126.8	165.5	-164.7	0	0	0	0	108.1	L228	L228-V279 HydrophobicContact CD2-CG1 4.44Å; L228-V279 HydrophobicContact CD2-CG2 4.45Å
280	G	38.7	Very low	68.2	Low	102 Å²	102	64.6 Å²	64.6	100%	1.052	41%	0.406	S	S	*	.			trans	-92.5	0	166.3	0	0	0	0	0	111.3

Retrieved 280 of 280 residues in 291 ms (Link to these results)

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