A0A3Q0KKR2_SCHMA Loading...

Putative sodium/potassium-dependent atpase beta subunit; Sodium/potassium ATPase1 beta subunit

AlphaFold DB , UniProt , Accession A0A3Q0KKR2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 289 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	53.6	Low	64.8	Low	189 Å²	189	108.5 Å²	108.5	93%	0.931	57%	0.567	S	S	*	*				0	110.6	0	-170.4	169.7	-83.6	0	0	106.5	F6	M1-F6 HydrophobicContact SD-CD2 4.34Å
2	S	70.2	Confident	64.3	Low	54 Å²	54	106.8 Å²	106.8	38%	0.378	57%	0.565	S	S	.	*			trans	-66.8	147.1	-179.4	63.6	0	0	0	0	109.6	Q4 E5 F6	S2-Q4 PolarHBondContact O-N 3.1Å; S2-E5 PolarHBondContact N-OE2 2.74Å; S2-E5 VanDerWaalsContact N-OE2 3.11Å; S2-E5 PolarHBondContact O-N 2.78Å; S2-E5 VanDerWaalsContact O-N 3.13Å; S2-E5 WeakPolarHBondContact OG-CG 3.11Å; S2-E5 PolarHBondContact OG-N 3.39Å; S2-E5 VanDerWaalsContact OG-N 3.15Å; S2-E5 PolarHBondContact OG-OE2 3.17Å; S2-E5 VanDerWaalsContact OG-OE2 3.08Å; S2-F6 PolarHBondContact O-N 2.67Å
3	M	67.5	Low	63.6	Low	175 Å²	175	107.8 Å²	107.8	86%	0.862	57%	0.569	S	S	*	*	H	α-helix	trans	-58.8	-25.5	173	-82.3	-160.3	-72.9	0	0	111.9	S7	M3-S7 WeakPolarHBondContact O-CB 3.41Å; M3-S7 PolarHBondContact O-N 3.49Å; M3-S7 VanDerWaalsContact O-N 3.16Å
4	Q	71	Confident	63.3	Low	143 Å²	143	107.2 Å²	107.2	67%	0.668	58%	0.579	S	S	*	*	H	α-helix	trans	-62.3	-51.4	171.6	-117.4	103.7	-12.3	0	0	112.1	S2 F6 S7 D8	S2-Q4 PolarHBondContact O-N 3.1Å; Q4-F6 VanDerWaalsContact C-N 3.27Å; Q4-F6 PolarHBondContact O-N 2.7Å; Q4-S7 WeakPolarHBondContact O-CB 3.45Å; Q4-S7 PolarHBondContact O-N 3.15Å; Q4-D8 VanDerWaalsContact O-CG 3.25Å; Q4-D8 PolarHBondContact O-N 3.34Å
5	E	65.8	Low	62.6	Low	105 Å²	105	113.6 Å²	113.6	49%	0.491	59%	0.593	S	S	.	*	H	α-helix	trans	-62.8	-31.6	179.8	-79	168.4	134.8	0	0	113.2	S2 N9	S2-E5 PolarHBondContact N-OE2 2.74Å; S2-E5 VanDerWaalsContact N-OE2 3.11Å; S2-E5 PolarHBondContact O-N 2.78Å; S2-E5 VanDerWaalsContact O-N 3.13Å; S2-E5 WeakPolarHBondContact OG-CG 3.11Å; S2-E5 PolarHBondContact OG-N 3.39Å; S2-E5 VanDerWaalsContact OG-N 3.15Å; S2-E5 PolarHBondContact OG-OE2 3.17Å; S2-E5 VanDerWaalsContact OG-OE2 3.08Å; E5-N9 PolarHBondContact O-N 3.3Å; E5-N9 VanDerWaalsContact O-N 3.16Å; E5-N9 PolarHBondContact O-ND2 3.47Å
6	F	68.8	Low	62.1	Low	121 Å²	121	115.4 Å²	115.4	53%	0.531	60%	0.6	S	S	.	*	H	α-helix	trans	-73.7	-37.8	177.1	-167.4	-103.9	0	0	0	111.7	M1 S2 Q4 N9 L10	M1-F6 HydrophobicContact SD-CD2 4.34Å; S2-F6 PolarHBondContact O-N 2.67Å; Q4-F6 VanDerWaalsContact C-N 3.27Å; Q4-F6 PolarHBondContact O-N 2.7Å; F6-N9 PolarHBondContact O-N 3.43Å; F6-L10 HydrophobicContact CD1-CD1 3.64Å; F6-L10 HydrophobicContact CE1-CD1 3.3Å; F6-L10 HydrophobicContact CE1-CG 4.36Å; F6-L10 HydrophobicContact CZ-CD1 3.95Å; F6-L10 PolarHBondContact O-N 3.41Å; F6-L10 VanDerWaalsContact O-N 3.1Å
7	S	68.1	Low	61.7	Low	69 Å²	69	114.2 Å²	114.2	48%	0.483	60%	0.603	S	S	.	*	H	α-helix	trans	-64.9	-39.7	172.9	174.9	0	0	0	0	112.2	M3 Q4 L10 S11	M3-S7 WeakPolarHBondContact O-CB 3.41Å; M3-S7 PolarHBondContact O-N 3.49Å; M3-S7 VanDerWaalsContact O-N 3.16Å; Q4-S7 WeakPolarHBondContact O-CB 3.45Å; Q4-S7 PolarHBondContact O-N 3.15Å; S7-L10 PolarHBondContact O-N 3.19Å; S7-S11 WeakPolarHBondContact O-CB 3.35Å; S7-S11 PolarHBondContact O-N 3.16Å; S7-S11 PolarHBondContact O-OG 3.29Å
8	D	65.1	Low	61.5	Low	90 Å²	90	121.6 Å²	121.6	48%	0.481	62%	0.622	S	S	.	*	H	α-helix	trans	-69.8	-33.9	179	-66.5	-17.4	0	0	0	112.1	Q4 S11 T12	Q4-D8 VanDerWaalsContact O-CG 3.25Å; Q4-D8 PolarHBondContact O-N 3.34Å; D8-S11 WeakPolarHBondContact CA-OG 3.46Å; D8-S11 PolarHBondContact O-OG 3.15Å; D8-T12 VanDerWaalsContact O-CG2 3.3Å; D8-T12 WeakPolarHBondContact O-CG2 2.98Å; D8-T12 PolarHBondContact O-N 3.29Å; D8-T12 PolarHBondContact O-OG1 3.07Å
9	N	62.4	Low	61.4	Low	95 Å²	95	121.5 Å²	121.5	51%	0.508	61%	0.613	S	S	.	*	H	α-helix	trans	-74.7	-31	174	-74.9	-50.9	0	0	0	113.4	E5 F6 T12 L13	E5-N9 PolarHBondContact O-N 3.3Å; E5-N9 VanDerWaalsContact O-N 3.16Å; E5-N9 PolarHBondContact O-ND2 3.47Å; F6-N9 PolarHBondContact O-N 3.43Å; N9-T12 WeakPolarHBondContact CA-OG1 3.42Å; N9-T12 PolarHBondContact O-OG1 2.78Å; N9-L13 PolarHBondContact O-N 3.42Å
10	L	60.3	Low	61.6	Low	93 Å²	93	128.2 Å²	128.2	49%	0.487	63%	0.63	S	S	.	*	H	α-helix	trans	-76.5	-35.2	175.4	-85.7	164.6	0	0	0	112.9	F6 S7 L13 S14	F6-L10 HydrophobicContact CD1-CD1 3.64Å; F6-L10 HydrophobicContact CE1-CD1 3.3Å; F6-L10 HydrophobicContact CE1-CG 4.36Å; F6-L10 HydrophobicContact CZ-CD1 3.95Å; F6-L10 PolarHBondContact O-N 3.41Å; F6-L10 VanDerWaalsContact O-N 3.1Å; S7-L10 PolarHBondContact O-N 3.19Å; L10-L13 PolarHBondContact O-N 2.75Å; L10-S14 PolarHBondContact O-N 2Å; L10-S14 PolarHBondContact O-OG 2.92Å
11	S	60.2	Low	61.8	Low	60 Å²	60	126.4 Å²	126.4	42%	0.42	62%	0.622	S	S	.	*	H	α-helix	trans	-69.6	-32.2	175.1	56	0	0	0	0	112.4	S7 D8 S14 Y15	S7-S11 WeakPolarHBondContact O-CB 3.35Å; S7-S11 PolarHBondContact O-N 3.16Å; S7-S11 PolarHBondContact O-OG 3.29Å; D8-S11 WeakPolarHBondContact CA-OG 3.46Å; D8-S11 PolarHBondContact O-OG 3.15Å; S11-S14 PolarHBondContact O-OG 2.94Å; S11-S14 VanDerWaalsContact O-OG 3.08Å; S11-Y15 PolarHBondContact O-N 3.49Å
12	T	58.7	Low	62.5	Low	88 Å²	88	120 Å²	120	54%	0.54	60%	0.595	S	S	.	*	H	α-helix	trans	-73.7	-30.8	174.2	48.6	0	0	0	0	113.5	D8 N9	D8-T12 VanDerWaalsContact O-CG2 3.3Å; D8-T12 WeakPolarHBondContact O-CG2 2.98Å; D8-T12 PolarHBondContact O-N 3.29Å; D8-T12 PolarHBondContact O-OG1 3.07Å; N9-T12 WeakPolarHBondContact CA-OG1 3.42Å; N9-T12 PolarHBondContact O-OG1 2.78Å
13	L	55.9	Low	62.3	Low	119 Å²	119	121.2 Å²	121.2	62%	0.623	60%	0.6	S	S	*	*	H	α-helix	trans	-73.1	-31.9	174	-82.4	164.8	0	0	0	113.4	N9 L10	N9-L13 PolarHBondContact O-N 3.42Å; L10-L13 PolarHBondContact O-N 2.75Å
14	S	58.3	Low	62.5	Low	100 Å²	100	121 Å²	121	70%	0.699	59%	0.59	S	S	*	*	H	α-helix	trans	-78.3	-16.8	179.2	59	0	0	0	0	114	L10 S11	L10-S14 PolarHBondContact O-N 2Å; L10-S14 PolarHBondContact O-OG 2.92Å; S11-S14 PolarHBondContact O-OG 2.94Å; S11-S14 VanDerWaalsContact O-OG 3.08Å
15	Y	52.7	Low	62.9	Low	203 Å²	203	116.6 Å²	116.6	80%	0.796	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	23	177	-146.9	-94.7	0	0	0	113.9	S11 S17	S11-Y15 PolarHBondContact O-N 3.49Å; Y15-S17 VanDerWaalsContact C-N 3.28Å; Y15-S17 PolarHBondContact O-N 3.14Å
16	M	55	Low	63.5	Low	143 Å²	143	116.4 Å²	116.4	70%	0.704	57%	0.566	S	S	*	*			trans	-77.6	82.9	171.2	-73.6	-131.6	-67.7	0	0	110.8	R18	M16-R18 PolarHBondContact O-N 3.45Å
17	S	56.4	Low	63.9	Low	94 Å²	94	112.2 Å²	112.2	66%	0.657	55%	0.549	S	S	*	.			trans	-39.1	123.6	164.2	162.3	0	0	0	0	111.1	Y15 R19	Y15-S17 VanDerWaalsContact C-N 3.28Å; Y15-S17 PolarHBondContact O-N 3.14Å; S17-R19 PolarHBondContact O-N 3.21Å
18	R	57.9	Low	64.1	Low	248 Å²	248	112.1 Å²	112.1	94%	0.936	55%	0.547	S	S	*	.			trans	-63.7	77.4	179	-164.9	-179.3	-165.2	-162.7	4.6	110.5	M16 R20	M16-R18 PolarHBondContact O-N 3.45Å; R18-R20 PolarHBondContact O-N 2.88Å
19	R	58.5	Low	64.6	Low	120 Å²	120	116.1 Å²	116.1	45%	0.453	56%	0.56	S	S	.	*			trans	-65	131.7	171.2	-72.3	-171.2	176.4	-167.7	-0.1	108.8	S17 I21	S17-R19 PolarHBondContact O-N 3.21Å; R19-I21 WeakPolarHBondContact CB-O 3Å; R19-I21 PolarHBondContact O-N 3.34Å
20	R	65	Low	65.1	Low	255 Å²	255	116.7 Å²	116.7	96%	0.962	56%	0.563	S	S	*	*	S	Bend	trans	-58.4	-21.4	-178.1	-155.3	-175.9	-72.1	-177.7	-2.2	112.8	R18	R18-R20 PolarHBondContact O-N 2.88Å
21	I	66.1	Low	65.9	Low	90 Å²	90	119.7 Å²	119.7	46%	0.462	57%	0.572	S	S	.	*	S	Bend	trans	-123.1	124.7	170	-59.2	170.1	0	0	0	106.7	R19 T23 I25	R19-I21 WeakPolarHBondContact CB-O 3Å; R19-I21 PolarHBondContact O-N 3.34Å; I21-T23 PolarHBondContact O-N 3.34Å; I21-I25 HydrophobicContact CG2-CB 3.9Å; I21-I25 HydrophobicContact CG2-CG2 3.9Å
22	P	68.8	Low	66.9	Low	55 Å²	55	118.2 Å²	118.2	36%	0.357	56%	0.561	S	S	.	*			trans	-53.3	136.1	172.6	-22.3	28.7	0	0	0	111.2	W24 I25 Y26	P22-W24 HydrophobicContact CB-CG 4.04Å; P22-W24 PolarHBondContact O-N 2.79Å; P22-I25 HydrophobicContact CB-CD1 4.49Å; P22-I25 HydrophobicContact CG-CD1 4.05Å; P22-I25 PolarHBondContact O-N 2.82Å; P22-Y26 PolarHBondContact O-N 2.96Å
23	T	65.7	Low	67.8	Low	79 Å²	79	117.7 Å²	117.7	49%	0.485	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.1	-19.6	179.7	45.8	0	0	0	0	113.5	I21	I21-T23 PolarHBondContact O-N 3.34Å
24	W	71.8	Confident	69	Low	171 Å²	171	117.4 Å²	117.4	65%	0.648	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-26.1	174.7	73	-95.4	0	0	0	113.7	P22 F34	P22-W24 HydrophobicContact CB-CG 4.04Å; P22-W24 PolarHBondContact O-N 2.79Å; W24-F34 HydrophobicContact CE3-CD1 4.05Å; W24-F34 HydrophobicContact CE3-CE1 4.12Å; W24-F34 HydrophobicContact CH2-CE1 4.15Å; W24-F34 AromaticContact CZ3-CD1 3.79Å; W24-F34 HydrophobicContact CZ3-CD1 3.79Å; W24-F34 AromaticContact CZ3-CE1 3.5Å; W24-F34 HydrophobicContact CZ3-CE1 3.5Å; W24-F34 VanDerWaalsContact CZ3-CE1 3.5Å
25	I	79.1	Confident	69.9	Low	51 Å²	51	115.6 Å²	115.6	26%	0.262	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-49.9	176.5	-69.4	172.4	0	0	0	109.8	I21 P22 L33 F34	I21-I25 HydrophobicContact CG2-CB 3.9Å; I21-I25 HydrophobicContact CG2-CG2 3.9Å; P22-I25 HydrophobicContact CB-CD1 4.49Å; P22-I25 HydrophobicContact CG-CD1 4.05Å; P22-I25 PolarHBondContact O-N 2.82Å; I25-L33 CarbonylContact O-C 3.59Å; I25-L33 WeakPolarHBondContact O-CA 3.38Å; I25-F34 HydrophobicContact CG1-CE1 4.12Å; I25-F34 PolarHBondContact O-N 3.31Å
26	Y	78.6	Confident	71.2	Confident	101 Å²	101	112.1 Å²	112.1	40%	0.396	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	118.7	-179.2	-177.8	-112.4	0	0	0	110.7	P22 P28 T32 L33	P22-Y26 PolarHBondContact O-N 2.96Å; Y26-P28 HydrophobicContact CD1-CB 4.43Å; Y26-P28 HydrophobicContact CE1-CB 3.9Å; Y26-P28 WeakPolarHBondContact O-CD 3.4Å; Y26-T32 WeakPolarHBondContact CA-O 3.14Å; Y26-T32 WeakPolarHBondContact CD2-O 3.31Å; Y26-L33 HydrophobicContact CD2-CD1 4.19Å
27	D	77.5	Confident	72.7	Confident	32 Å²	32	108.3 Å²	108.3	17%	0.171	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	104.8	171	-176.1	4.3	0	0	0	109.8	K29 N30 K31 T32	D27-K29 PolarHBondContact O-N 3.16Å; D27-K29 PolarHBondContact OD1-N 3.15Å; D27-N30 PolarHBondContact O-N 3.04Å; D27-N30 PolarHBondContact OD2-ND2 3.08Å; D27-K31 WeakPolarHBondContact O-CA 3.44Å; D27-K31 PolarHBondContact O-N 2.69Å; D27-T32 WeakPolarHBondContact CB-OG1 2.9Å; D27-T32 PolarHBondContact N-O 3.5Å; D27-T32 PolarHBondContact O-N 3.46Å
28	P	73.4	Confident	74	Confident	67 Å²	67	107.9 Å²	107.9	44%	0.435	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.2	-179.5	26.7	-34.4	0	0	0	113.2	Y26	Y26-P28 HydrophobicContact CD1-CB 4.43Å; Y26-P28 HydrophobicContact CE1-CB 3.9Å; Y26-P28 WeakPolarHBondContact O-CD 3.4Å
29	K	74.1	Confident	75.3	Confident	174 Å²	174	100.9 Å²	100.9	76%	0.757	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-45.6	178.8	-81.4	-171.4	172.7	-175.1	0	111.4	D27	D27-K29 PolarHBondContact O-N 3.16Å; D27-K29 PolarHBondContact OD1-N 3.15Å
30	N	73.8	Confident	76.8	Confident	108 Å²	108	97 Å²	97	58%	0.578	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-1.1	-176.5	-65	-50.1	0	0	0	113.4	D27 T32	D27-N30 PolarHBondContact O-N 3.04Å; D27-N30 PolarHBondContact OD2-ND2 3.08Å; N30-T32 HydrophobicContact CB-CG2 3.92Å; N30-T32 PolarHBondContact O-N 2.88Å
31	K	76.2	Confident	77.8	Confident	156 Å²	156	89.1 Å²	89.1	68%	0.678	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	40.8	-172.7	-59.2	-177.8	-179.3	179.6	0	112	D27	D27-K31 WeakPolarHBondContact O-CA 3.44Å; D27-K31 PolarHBondContact O-N 2.69Å
32	T	81.4	Confident	79	Confident	29 Å²	29	89.8 Å²	89.8	18%	0.178	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.9	177.7	57.9	0	0	0	0	110.5	Y26 D27 N30 R36 T37	Y26-T32 WeakPolarHBondContact CA-O 3.14Å; Y26-T32 WeakPolarHBondContact CD2-O 3.31Å; D27-T32 WeakPolarHBondContact CB-OG1 2.9Å; D27-T32 PolarHBondContact N-O 3.5Å; D27-T32 PolarHBondContact O-N 3.46Å; N30-T32 HydrophobicContact CB-CG2 3.92Å; N30-T32 PolarHBondContact O-N 2.88Å; T32-R36 CarbonylContact C-O 3.58Å; T32-R36 VanDerWaalsContact CA-O 3.27Å; T32-R36 WeakPolarHBondContact CA-O 3.24Å; T32-T37 HydrophobicContact CG2-CG2 3.93Å
33	L	78.8	Confident	80.1	Confident	76 Å²	76	92.9 Å²	92.9	40%	0.398	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.2	173.6	-169.8	93.4	0	0	0	107.3	I25 Y26 G35 R36 W41	I25-L33 CarbonylContact O-C 3.59Å; I25-L33 WeakPolarHBondContact O-CA 3.38Å; Y26-L33 HydrophobicContact CD2-CD1 4.19Å; L33-G35 PolarHBondContact O-N 2.04Å; L33-G35 VanDerWaalsContact O-N 3.08Å; L33-R36 PolarHBondContact N-O 3.15Å; L33-R36 PolarHBondContact O-N 3.41Å; L33-R36 VanDerWaalsContact O-O 3.09Å; L33-W41 PolarHBondContact O-NE1 3.49Å
34	F	79.6	Confident	81.4	Confident	113 Å²	113	90.1 Å²	90.1	50%	0.496	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.4	42.9	-175.9	-65.2	-68.4	0	0	0	113.5	W24 I25 R36 W41	W24-F34 HydrophobicContact CE3-CD1 4.05Å; W24-F34 HydrophobicContact CE3-CE1 4.12Å; W24-F34 HydrophobicContact CH2-CE1 4.15Å; W24-F34 AromaticContact CZ3-CD1 3.79Å; W24-F34 HydrophobicContact CZ3-CD1 3.79Å; W24-F34 AromaticContact CZ3-CE1 3.5Å; W24-F34 HydrophobicContact CZ3-CE1 3.5Å; W24-F34 VanDerWaalsContact CZ3-CE1 3.5Å; I25-F34 HydrophobicContact CG1-CE1 4.12Å; I25-F34 PolarHBondContact O-N 3.31Å; F34-R36 PolarHBondContact O-N 3.12Å; F34-W41 HydrophobicContact CB-CZ2 3.9Å; F34-W41 HydrophobicContact CD2-CZ2 4.5Å
35	G	77.1	Confident	82.4	Confident	62 Å²	62	86.3 Å²	86.3	64%	0.639	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	1.7	177.6	0	0	0	0	0	116.9	L33	L33-G35 PolarHBondContact O-N 2.04Å; L33-G35 VanDerWaalsContact O-N 3.08Å
36	R	80.9	Confident	83.2	Confident	130 Å²	130	88.9 Å²	88.9	49%	0.491	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.2	176.7	-67.1	-172.9	177.9	-175.4	0.8	112.8	T32 L33 F34 C44	T32-R36 CarbonylContact C-O 3.58Å; T32-R36 VanDerWaalsContact CA-O 3.27Å; T32-R36 WeakPolarHBondContact CA-O 3.24Å; L33-R36 PolarHBondContact N-O 3.15Å; L33-R36 PolarHBondContact O-N 3.41Å; L33-R36 VanDerWaalsContact O-O 3.09Å; F34-R36 PolarHBondContact O-N 3.12Å; R36-C44 PolarHBondContact NH1-SG 3.26Å
37	T	86.2	Confident	84	Confident	64 Å²	64	89.8 Å²	89.8	39%	0.393	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	154.1	173.8	55.6	0	0	0	0	110.7	T32 C39 S40 W41	T32-T37 HydrophobicContact CG2-CG2 3.93Å; T37-C39 PolarHBondContact O-N 2.91Å; T37-S40 WeakPolarHBondContact O-CA 3.39Å; T37-S40 WeakPolarHBondContact O-CB 3.48Å; T37-S40 PolarHBondContact O-N 3.27Å; T37-S40 WeakPolarHBondContact OG1-CB 3.41Å; T37-S40 PolarHBondContact OG1-N 2.89Å; T37-W41 PolarHBondContact O-N 3.15Å
38	C	83.5	Confident	84.9	Confident	85 Å²	85	94.1 Å²	94.1	57%	0.574	49%	0.487	S	S	*	.	H	α-helix	trans	-54.8	-39.7	177.6	-174	0	0	0	0	112.5	S40 W41 I42	C38-S40 VanDerWaalsContact C-N 3.34Å; C38-S40 PolarHBondContact O-N 3.39Å; C38-W41 WeakPolarHBondContact O-CB 3.44Å; C38-W41 PolarHBondContact O-N 2.98Å; C38-I42 WeakPolarHBondContact O-CG1 3.49Å; C38-I42 PolarHBondContact O-N 3.37Å
39	C	85.5	Confident	86.1	Confident	101 Å²	101	96.4 Å²	96.4	68%	0.682	50%	0.495	S	S	*	.	H	α-helix	trans	-61.7	-39.8	174	-69.2	0	0	0	0	112.5	T37 I42 L43	T37-C39 PolarHBondContact O-N 2.91Å; C39-I42 PolarHBondContact O-N 3.07Å; C39-L43 WeakPolarHBondContact O-CB 3.49Å; C39-L43 PolarHBondContact O-N 3.45Å
40	S	88.7	Confident	87.2	Confident	39 Å²	39	92 Å²	92	27%	0.273	48%	0.482	S	S	.	.	H	α-helix	trans	-66.6	-39.4	175.6	178.2	0	0	0	0	111.6	T37 C38 L43 C44	T37-S40 WeakPolarHBondContact O-CA 3.39Å; T37-S40 WeakPolarHBondContact O-CB 3.48Å; T37-S40 PolarHBondContact O-N 3.27Å; T37-S40 WeakPolarHBondContact OG1-CB 3.41Å; T37-S40 PolarHBondContact OG1-N 2.89Å; C38-S40 VanDerWaalsContact C-N 3.34Å; C38-S40 PolarHBondContact O-N 3.39Å; S40-L43 PolarHBondContact O-N 3.27Å; S40-C44 WeakPolarHBondContact O-CB 3.41Å; S40-C44 PolarHBondContact O-N 3.38Å; S40-C44 PolarHBondContact O-SG 3.41Å
41	W	87.9	Confident	88.3	Confident	89 Å²	89	92.1 Å²	92.1	34%	0.337	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-48.3	173	-88.7	107.8	0	0	0	112.5	L33 F34 T37 C38 L43 C44 I45	L33-W41 PolarHBondContact O-NE1 3.49Å; F34-W41 HydrophobicContact CB-CZ2 3.9Å; F34-W41 HydrophobicContact CD2-CZ2 4.5Å; T37-W41 PolarHBondContact O-N 3.15Å; C38-W41 WeakPolarHBondContact O-CB 3.44Å; C38-W41 PolarHBondContact O-N 2.98Å; W41-L43 VanDerWaalsContact C-N 3.3Å; W41-L43 PolarHBondContact O-N 3.34Å; W41-C44 PolarHBondContact O-N 3.42Å; W41-I45 HydrophobicContact CE3-CD1 4.47Å; W41-I45 WeakPolarHBondContact O-CB 3.07Å; W41-I45 VanDerWaalsContact O-CG1 3.3Å; W41-I45 WeakPolarHBondContact O-CG1 3Å; W41-I45 PolarHBondContact O-N 3.44Å
42	I	90.7	Very high	89.3	Confident	103 Å²	103	91.2 Å²	91.2	53%	0.528	47%	0.469	S	S	.	.	H	α-helix	trans	-58.7	-44.3	177.2	-67.6	166.8	0	0	0	110.5	C38 C39 C44 I45 L46	C38-I42 WeakPolarHBondContact O-CG1 3.49Å; C38-I42 PolarHBondContact O-N 3.37Å; C39-I42 PolarHBondContact O-N 3.07Å; I42-C44 PolarHBondContact O-N 3.08Å; I42-I45 PolarHBondContact O-N 3.01Å; I42-L46 VanDerWaalsContact O-CB 3.28Å; I42-L46 WeakPolarHBondContact O-CB 3.43Å; I42-L46 PolarHBondContact O-N 3.03Å
43	L	92	Very high	90.1	Very high	121 Å²	121	92.4 Å²	92.4	63%	0.634	48%	0.481	S	S	*	.	H	α-helix	trans	-64.6	-39.1	178.2	-168.4	145.8	0	0	0	112.1	C39 S40 W41 F47	C39-L43 WeakPolarHBondContact O-CB 3.49Å; C39-L43 PolarHBondContact O-N 3.45Å; S40-L43 PolarHBondContact O-N 3.27Å; W41-L43 VanDerWaalsContact C-N 3.3Å; W41-L43 PolarHBondContact O-N 3.34Å; L43-F47 VanDerWaalsContact O-CB 3.3Å; L43-F47 WeakPolarHBondContact O-CB 3.32Å; L43-F47 PolarHBondContact O-N 2.96Å
44	C	92	Very high	91	Very high	20 Å²	20	92.4 Å²	92.4	14%	0.135	49%	0.487	C	S	.	.	H	α-helix	trans	-66.6	-45.5	175.2	-66.1	0	0	0	0	112	R36 S40 W41 I42 F47 Y48	R36-C44 PolarHBondContact NH1-SG 3.26Å; S40-C44 WeakPolarHBondContact O-CB 3.41Å; S40-C44 PolarHBondContact O-N 3.38Å; S40-C44 PolarHBondContact O-SG 3.41Å; W41-C44 PolarHBondContact O-N 3.42Å; I42-C44 PolarHBondContact O-N 3.08Å; C44-F47 WeakPolarHBondContact O-CB 3.5Å; C44-F47 PolarHBondContact O-N 2.86Å; C44-Y48 VanDerWaalsContact O-CD2 3.24Å; C44-Y48 WeakPolarHBondContact O-CD2 3.37Å; C44-Y48 PolarHBondContact O-N 3.24Å
45	I	93.7	Very high	91.8	Very high	92 Å²	92	90.7 Å²	90.7	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-62.3	-47.3	178.2	-69.6	166	0	0	0	109.7	W41 I42 F47 Y48 L49	W41-I45 HydrophobicContact CE3-CD1 4.47Å; W41-I45 WeakPolarHBondContact O-CB 3.07Å; W41-I45 VanDerWaalsContact O-CG1 3.3Å; W41-I45 WeakPolarHBondContact O-CG1 3Å; W41-I45 PolarHBondContact O-N 3.44Å; I42-I45 PolarHBondContact O-N 3.01Å; I45-F47 VanDerWaalsContact C-N 3.33Å; I45-F47 PolarHBondContact O-N 3.24Å; I45-Y48 PolarHBondContact O-N 2.55Å; I45-L49 HydrophobicContact CG2-CD1 3.83Å; I45-L49 HydrophobicContact CG2-CG 4.19Å; I45-L49 WeakPolarHBondContact O-CB 3.35Å; I45-L49 VanDerWaalsContact O-CG 3.26Å; I45-L49 WeakPolarHBondContact O-CG 3.16Å; I45-L49 PolarHBondContact O-N 3.44Å
46	L	95.7	Very high	92.8	Very high	104 Å²	104	90.2 Å²	90.2	55%	0.545	47%	0.473	S	S	.	.	H	α-helix	trans	-59.3	-44.5	176.8	-177.2	66.2	0	0	0	111.5	I42 L49 V50	I42-L46 VanDerWaalsContact O-CB 3.28Å; I42-L46 WeakPolarHBondContact O-CB 3.43Å; I42-L46 PolarHBondContact O-N 3.03Å; L46-L49 PolarHBondContact O-N 2.69Å; L46-V50 HydrophobicContact CD1-CG2 4.4Å; L46-V50 WeakPolarHBondContact O-CG2 3.23Å; L46-V50 PolarHBondContact O-N 3.11Å
47	F	96.1	Very high	93.6	Very high	120 Å²	120	88.2 Å²	88.2	53%	0.526	48%	0.475	S	S	.	.	H	α-helix	trans	-57.1	-50.8	175	169.3	-95.5	0	0	0	111.6	L43 C44 I45 L49 V50 Y51	L43-F47 VanDerWaalsContact O-CB 3.3Å; L43-F47 WeakPolarHBondContact O-CB 3.32Å; L43-F47 PolarHBondContact O-N 2.96Å; C44-F47 WeakPolarHBondContact O-CB 3.5Å; C44-F47 PolarHBondContact O-N 2.86Å; I45-F47 VanDerWaalsContact C-N 3.33Å; I45-F47 PolarHBondContact O-N 3.24Å; F47-L49 PolarHBondContact O-N 3.49Å; F47-V50 PolarHBondContact O-N 2.88Å; F47-Y51 WeakPolarHBondContact O-CB 3.49Å; F47-Y51 PolarHBondContact O-N 3.06Å
48	Y	96.6	Very high	94.1	Very high	124 Å²	124	91.2 Å²	91.2	49%	0.486	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-36.6	179.6	-83.5	-71.8	0	0	0	112.3	C44 I45 Y51 Y52	C44-Y48 VanDerWaalsContact O-CD2 3.24Å; C44-Y48 WeakPolarHBondContact O-CD2 3.37Å; C44-Y48 PolarHBondContact O-N 3.24Å; I45-Y48 PolarHBondContact O-N 2.55Å; Y48-Y51 PolarHBondContact O-N 3.05Å; Y48-Y52 HydrophobicContact CD1-CD2 4.19Å; Y48-Y52 AromaticContact CD1-CE2 3.61Å; Y48-Y52 HydrophobicContact CD1-CE2 3.61Å; Y48-Y52 HydrophobicContact CE1-CE2 4.41Å; Y48-Y52 HydrophobicContact CG-CE2 4.38Å; Y48-Y52 WeakPolarHBondContact O-CB 3.32Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.28Å; Y48-Y52 PolarHBondContact O-N 3.05Å
49	L	97	Very high	94.8	Very high	114 Å²	114	93 Å²	93	60%	0.597	48%	0.481	S	S	*	.	H	α-helix	trans	-61.7	-48	175.1	-74.6	174.4	0	0	0	111.5	I45 L46 F47 A53	I45-L49 HydrophobicContact CG2-CD1 3.83Å; I45-L49 HydrophobicContact CG2-CG 4.19Å; I45-L49 WeakPolarHBondContact O-CB 3.35Å; I45-L49 VanDerWaalsContact O-CG 3.26Å; I45-L49 WeakPolarHBondContact O-CG 3.16Å; I45-L49 PolarHBondContact O-N 3.44Å; L46-L49 PolarHBondContact O-N 2.69Å; F47-L49 PolarHBondContact O-N 3.49Å; L49-A53 VanDerWaalsContact O-CB 3.25Å; L49-A53 WeakPolarHBondContact O-CB 3.5Å; L49-A53 PolarHBondContact O-N 3.33Å
50	V	97.2	Very high	95.3	Very high	81 Å²	81	92.2 Å²	92.2	49%	0.491	47%	0.474	S	S	.	.	H	α-helix	trans	-66	-45	177.5	174.7	0	0	0	0	110.7	L46 F47 A53 C54	L46-V50 HydrophobicContact CD1-CG2 4.4Å; L46-V50 WeakPolarHBondContact O-CG2 3.23Å; L46-V50 PolarHBondContact O-N 3.11Å; F47-V50 PolarHBondContact O-N 2.88Å; V50-A53 PolarHBondContact O-N 3.07Å; V50-C54 PolarHBondContact O-N 2.96Å; V50-C54 PolarHBondContact O-SG 3.25Å; V50-C54 VanDerWaalsContact O-SG 3.32Å
51	Y	97.3	Very high	95.7	Very high	112 Å²	112	94 Å²	94	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-58.7	-50.3	178.4	173.4	-100.4	0	0	0	112	F47 Y48 A53 C54 L55	F47-Y51 WeakPolarHBondContact O-CB 3.49Å; F47-Y51 PolarHBondContact O-N 3.06Å; Y48-Y51 PolarHBondContact O-N 3.05Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 3.13Å; Y51-C54 PolarHBondContact O-N 3.08Å; Y51-L55 HydrophobicContact CE1-CD2 4.41Å; Y51-L55 WeakPolarHBondContact O-CB 3.22Å; Y51-L55 PolarHBondContact O-N 3.01Å
52	Y	97.7	Very high	96.1	Very high	137 Å²	137	93.3 Å²	93.3	54%	0.537	49%	0.488	S	S	.	.	H	α-helix	trans	-69.2	-31	178.8	-77.4	-61.9	0	0	0	112.4	Y48 L55 A56	Y48-Y52 HydrophobicContact CD1-CD2 4.19Å; Y48-Y52 AromaticContact CD1-CE2 3.61Å; Y48-Y52 HydrophobicContact CD1-CE2 3.61Å; Y48-Y52 HydrophobicContact CE1-CE2 4.41Å; Y48-Y52 HydrophobicContact CG-CE2 4.38Å; Y48-Y52 WeakPolarHBondContact O-CB 3.32Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.28Å; Y48-Y52 PolarHBondContact O-N 3.05Å; Y52-L55 HydrophobicContact CD1-CD2 4.24Å; Y52-L55 HydrophobicContact CE1-CD2 4.46Å; Y52-L55 PolarHBondContact O-N 2.8Å; Y52-A56 WeakPolarHBondContact O-CB 3.4Å; Y52-A56 PolarHBondContact O-N 2.89Å
53	A	97.4	Very high	96.3	Very high	53 Å²	53	92.1 Å²	92.1	44%	0.438	48%	0.482	S	S	.	.	H	α-helix	trans	-64.5	-44.3	171.7	0	0	0	0	0	111.8	L49 V50 Y51 A56 T57	L49-A53 VanDerWaalsContact O-CB 3.25Å; L49-A53 WeakPolarHBondContact O-CB 3.5Å; L49-A53 PolarHBondContact O-N 3.33Å; V50-A53 PolarHBondContact O-N 3.07Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 3.13Å; A53-A56 PolarHBondContact O-N 3.34Å; A53-T57 WeakPolarHBondContact O-CB 3.28Å; A53-T57 WeakPolarHBondContact O-CG2 3.49Å; A53-T57 PolarHBondContact O-N 3.19Å; A53-T57 PolarHBondContact O-OG1 3.49Å
54	C	97.7	Very high	96.4	Very high	76 Å²	76	94.4 Å²	94.4	51%	0.514	48%	0.482	S	S	.	.	H	α-helix	trans	-63.4	-42.8	174.1	-69	0	0	0	0	111.9	V50 Y51 T57 F58	V50-C54 PolarHBondContact O-N 2.96Å; V50-C54 PolarHBondContact O-SG 3.25Å; V50-C54 VanDerWaalsContact O-SG 3.32Å; Y51-C54 PolarHBondContact O-N 3.08Å; C54-T57 WeakPolarHBondContact CA-OG1 3.28Å; C54-T57 PolarHBondContact O-OG1 2.74Å; C54-F58 WeakPolarHBondContact O-CB 3.33Å; C54-F58 PolarHBondContact O-N 3.25Å
55	L	97.5	Very high	96.5	Very high	77 Å²	77	97.9 Å²	97.9	40%	0.403	50%	0.499	S	S	.	.	H	α-helix	trans	-65.6	-42.8	178.3	-171.6	69.2	0	0	0	111.7	Y51 Y52 F58 F59	Y51-L55 HydrophobicContact CE1-CD2 4.41Å; Y51-L55 WeakPolarHBondContact O-CB 3.22Å; Y51-L55 PolarHBondContact O-N 3.01Å; Y52-L55 HydrophobicContact CD1-CD2 4.24Å; Y52-L55 HydrophobicContact CE1-CD2 4.46Å; Y52-L55 PolarHBondContact O-N 2.8Å; L55-F58 PolarHBondContact O-N 3.01Å; L55-F59 WeakPolarHBondContact O-CB 3.3Å; L55-F59 PolarHBondContact O-N 3.24Å
56	A	97.6	Very high	96.5	Very high	53 Å²	53	97 Å²	97	44%	0.438	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-46.6	177.9	0	0	0	0	0	111.3	Y52 A53 F59 T60	Y52-A56 WeakPolarHBondContact O-CB 3.4Å; Y52-A56 PolarHBondContact O-N 2.89Å; A53-A56 PolarHBondContact O-N 3.34Å; A56-F59 PolarHBondContact O-N 3.21Å; A56-T60 WeakPolarHBondContact O-CG2 3.31Å; A56-T60 PolarHBondContact O-N 3.08Å; A56-T60 PolarHBondContact O-OG1 3.45Å
57	T	97.5	Very high	96.3	Very high	88 Å²	88	97.1 Å²	97.1	54%	0.54	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-39.3	177.5	49.6	0	0	0	0	112.8	A53 C54 T60 C61	A53-T57 WeakPolarHBondContact O-CB 3.28Å; A53-T57 WeakPolarHBondContact O-CG2 3.49Å; A53-T57 PolarHBondContact O-N 3.19Å; A53-T57 PolarHBondContact O-OG1 3.49Å; C54-T57 WeakPolarHBondContact CA-OG1 3.28Å; C54-T57 PolarHBondContact O-OG1 2.74Å; T57-T60 PolarHBondContact O-OG1 2.97Å; T57-C61 WeakPolarHBondContact O-CB 3.03Å; T57-C61 PolarHBondContact O-N 3.12Å
58	F	97.4	Very high	96	Very high	127 Å²	127	99.7 Å²	99.7	56%	0.557	51%	0.506	S	S	*	.	H	α-helix	trans	-61.7	-47.4	172.6	175.2	-107.2	0	0	0	111.6	C54 L55 C61 L62	C54-F58 WeakPolarHBondContact O-CB 3.33Å; C54-F58 PolarHBondContact O-N 3.25Å; L55-F58 PolarHBondContact O-N 3.01Å; F58-C61 PolarHBondContact O-N 3.14Å; F58-L62 HydrophobicContact CD1-CD1 3.92Å; F58-L62 HydrophobicContact CD2-CD1 4.46Å; F58-L62 HydrophobicContact CD2-CG 4.44Å; F58-L62 HydrophobicContact CE1-CD1 3.31Å; F58-L62 HydrophobicContact CE1-CG 4.25Å; F58-L62 HydrophobicContact CE2-CD1 3.92Å; F58-L62 HydrophobicContact CE2-CD2 4.46Å; F58-L62 HydrophobicContact CE2-CG 4.09Å; F58-L62 HydrophobicContact CG-CD1 4.47Å; F58-L62 HydrophobicContact CZ-CD1 3.33Å; F58-L62 HydrophobicContact CZ-CD2 4.48Å; F58-L62 HydrophobicContact CZ-CG 4.02Å; F58-L62 WeakPolarHBondContact O-CB 3.13Å; F58-L62 WeakPolarHBondContact O-CG 3.09Å; F58-L62 PolarHBondContact O-N 3.18Å
59	F	97.6	Very high	95.6	Very high	121 Å²	121	98.1 Å²	98.1	53%	0.531	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-43.7	179.6	-178	-108.6	0	0	0	112.3	L55 A56 L62 L63	L55-F59 WeakPolarHBondContact O-CB 3.3Å; L55-F59 PolarHBondContact O-N 3.24Å; A56-F59 PolarHBondContact O-N 3.21Å; F59-L62 PolarHBondContact O-N 3.2Å; F59-L63 HydrophobicContact CD1-CD1 3.84Å; F59-L63 HydrophobicContact CD1-CG 4.35Å; F59-L63 HydrophobicContact CE1-CD1 3.28Å; F59-L63 HydrophobicContact CE1-CG 4.01Å; F59-L63 HydrophobicContact CE2-CD1 4.31Å; F59-L63 HydrophobicContact CE2-CD2 4.4Å; F59-L63 HydrophobicContact CE2-CG 4.2Å; F59-L63 HydrophobicContact CZ-CD1 3.55Å; F59-L63 HydrophobicContact CZ-CD2 4.17Å; F59-L63 HydrophobicContact CZ-CG 3.92Å; F59-L63 WeakPolarHBondContact O-CB 3.29Å; F59-L63 WeakPolarHBondContact O-CG 3.13Å; F59-L63 PolarHBondContact O-N 3.25Å
60	T	96.7	Very high	95.2	Very high	86 Å²	86	97.7 Å²	97.7	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-67	-37.2	177.5	57.6	0	0	0	0	112.3	A56 T57 L63 W64	A56-T60 WeakPolarHBondContact O-CG2 3.31Å; A56-T60 PolarHBondContact O-N 3.08Å; A56-T60 PolarHBondContact O-OG1 3.45Å; T57-T60 PolarHBondContact O-OG1 2.97Å; T60-L63 PolarHBondContact O-N 3.31Å; T60-W64 VanDerWaalsContact O-CB 3.32Å; T60-W64 WeakPolarHBondContact O-CB 3.26Å; T60-W64 PolarHBondContact O-N 2.73Å
61	C	97	Very high	94.7	Very high	76 Å²	76	96 Å²	96	51%	0.514	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-45.7	174.5	-174.9	0	0	0	0	111.7	T57 F58 W64 L65	T57-C61 WeakPolarHBondContact O-CB 3.03Å; T57-C61 PolarHBondContact O-N 3.12Å; F58-C61 PolarHBondContact O-N 3.14Å; C61-W64 PolarHBondContact O-N 2.94Å; C61-L65 WeakPolarHBondContact O-CB 3.32Å; C61-L65 PolarHBondContact O-N 3.41Å
62	L	96.3	Very high	94.1	Very high	75 Å²	75	93.8 Å²	93.8	39%	0.393	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-45.5	174.6	-78.3	-177.6	0	0	0	112	F58 F59 L65 V66	F58-L62 HydrophobicContact CD1-CD1 3.92Å; F58-L62 HydrophobicContact CD2-CD1 4.46Å; F58-L62 HydrophobicContact CD2-CG 4.44Å; F58-L62 HydrophobicContact CE1-CD1 3.31Å; F58-L62 HydrophobicContact CE1-CG 4.25Å; F58-L62 HydrophobicContact CE2-CD1 3.92Å; F58-L62 HydrophobicContact CE2-CD2 4.46Å; F58-L62 HydrophobicContact CE2-CG 4.09Å; F58-L62 HydrophobicContact CG-CD1 4.47Å; F58-L62 HydrophobicContact CZ-CD1 3.33Å; F58-L62 HydrophobicContact CZ-CD2 4.48Å; F58-L62 HydrophobicContact CZ-CG 4.02Å; F58-L62 WeakPolarHBondContact O-CB 3.13Å; F58-L62 WeakPolarHBondContact O-CG 3.09Å; F58-L62 PolarHBondContact O-N 3.18Å; F59-L62 PolarHBondContact O-N 3.2Å; L62-L65 PolarHBondContact O-N 2.81Å; L62-V66 WeakPolarHBondContact O-CB 3.37Å; L62-V66 VanDerWaalsContact O-CG2 3.28Å; L62-V66 WeakPolarHBondContact O-CG2 3.4Å; L62-V66 PolarHBondContact O-N 3.44Å
63	L	95.1	Very high	93.4	Very high	77 Å²	77	96.5 Å²	96.5	40%	0.403	52%	0.522	S	S	.	.	H	α-helix	trans	-60.8	-45.3	176.2	-77.5	-176.7	0	0	0	111.5	F59 T60 L65 V66 L67	F59-L63 HydrophobicContact CD1-CD1 3.84Å; F59-L63 HydrophobicContact CD1-CG 4.35Å; F59-L63 HydrophobicContact CE1-CD1 3.28Å; F59-L63 HydrophobicContact CE1-CG 4.01Å; F59-L63 HydrophobicContact CE2-CD1 4.31Å; F59-L63 HydrophobicContact CE2-CD2 4.4Å; F59-L63 HydrophobicContact CE2-CG 4.2Å; F59-L63 HydrophobicContact CZ-CD1 3.55Å; F59-L63 HydrophobicContact CZ-CD2 4.17Å; F59-L63 HydrophobicContact CZ-CG 3.92Å; F59-L63 WeakPolarHBondContact O-CB 3.29Å; F59-L63 WeakPolarHBondContact O-CG 3.13Å; F59-L63 PolarHBondContact O-N 3.25Å; T60-L63 PolarHBondContact O-N 3.31Å; L63-L65 PolarHBondContact O-N 2.95Å; L63-V66 PolarHBondContact O-N 3.24Å; L63-L67 WeakPolarHBondContact O-CB 3.46Å; L63-L67 VanDerWaalsContact O-CG 3.22Å; L63-L67 WeakPolarHBondContact O-CG 3.5Å; L63-L67 PolarHBondContact O-N 2.8Å
64	W	93.9	Very high	92.7	Very high	170 Å²	170	100.4 Å²	100.4	64%	0.644	54%	0.535	S	S	*	.	H	α-helix	trans	-60.5	-45.5	177.9	179.7	76.1	0	0	0	111.8	T60 C61 L67 Y68	T60-W64 VanDerWaalsContact O-CB 3.32Å; T60-W64 WeakPolarHBondContact O-CB 3.26Å; T60-W64 PolarHBondContact O-N 2.73Å; C61-W64 PolarHBondContact O-N 2.94Å; W64-L67 PolarHBondContact O-N 2.84Å; W64-Y68 WeakPolarHBondContact O-CB 3.39Å; W64-Y68 PolarHBondContact O-N 3.39Å
65	L	94	Very high	92.1	Very high	93 Å²	93	101.5 Å²	101.5	49%	0.487	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-46	177.3	-174.6	114.5	0	0	0	112	C61 L62 L63 Y68 C69	C61-L65 WeakPolarHBondContact O-CB 3.32Å; C61-L65 PolarHBondContact O-N 3.41Å; L62-L65 PolarHBondContact O-N 2.81Å; L63-L65 PolarHBondContact O-N 2.95Å; L65-Y68 PolarHBondContact O-N 3.34Å; L65-C69 WeakPolarHBondContact O-CB 3.31Å; L65-C69 PolarHBondContact O-N 3.27Å; L65-C69 PolarHBondContact O-SG 2.92Å; L65-C69 VanDerWaalsContact O-SG 3.39Å
66	V	93.1	Very high	91.5	Very high	74 Å²	74	101 Å²	101	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-63.5	-45.3	178.6	169.6	0	0	0	0	110.8	L62 L63 N70	L62-V66 WeakPolarHBondContact O-CB 3.37Å; L62-V66 VanDerWaalsContact O-CG2 3.28Å; L62-V66 WeakPolarHBondContact O-CG2 3.4Å; L62-V66 PolarHBondContact O-N 3.44Å; L63-V66 PolarHBondContact O-N 3.24Å; V66-N70 VanDerWaalsContact O-CB 3.3Å; V66-N70 WeakPolarHBondContact O-CB 3.45Å; V66-N70 PolarHBondContact O-N 3.26Å; V66-N70 PolarHBondContact O-ND2 3.25Å
67	L	92	Very high	90.9	Very high	105 Å²	105	101.3 Å²	101.3	55%	0.55	54%	0.536	S	S	.	.	H	α-helix	trans	-66.1	-44.2	179	-70.3	174	0	0	0	111.3	L63 W64 C69 N70 A71	L63-L67 WeakPolarHBondContact O-CB 3.46Å; L63-L67 VanDerWaalsContact O-CG 3.22Å; L63-L67 WeakPolarHBondContact O-CG 3.5Å; L63-L67 PolarHBondContact O-N 2.8Å; W64-L67 PolarHBondContact O-N 2.84Å; L67-C69 PolarHBondContact O-N 3Å; L67-N70 PolarHBondContact O-N 2.87Å; L67-A71 WeakPolarHBondContact O-CA 3.39Å; L67-A71 WeakPolarHBondContact O-CB 3.44Å; L67-A71 PolarHBondContact O-N 2.83Å
68	Y	89	Confident	90.2	Very high	174 Å²	174	104.9 Å²	104.9	68%	0.682	54%	0.54	S	S	*	.	H	α-helix	trans	-61.4	-42.6	179	-175.3	-98.1	0	0	0	112.5	W64 L65	W64-Y68 WeakPolarHBondContact O-CB 3.39Å; W64-Y68 PolarHBondContact O-N 3.39Å; L65-Y68 PolarHBondContact O-N 3.34Å
69	C	88.5	Confident	89.4	Confident	92 Å²	92	101.8 Å²	101.8	62%	0.622	53%	0.532	S	S	*	.	H	α-helix	trans	-76.4	-31.4	-179.3	-69.4	0	0	0	0	113.9	L65 L67	L65-C69 WeakPolarHBondContact O-CB 3.31Å; L65-C69 PolarHBondContact O-N 3.27Å; L65-C69 PolarHBondContact O-SG 2.92Å; L65-C69 VanDerWaalsContact O-SG 3.39Å; L67-C69 PolarHBondContact O-N 3Å
70	N	88	Confident	88.5	Confident	105 Å²	105	97 Å²	97	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-108.6	-17.7	-170.2	-63.7	-87.2	0	0	0	114.2	V66 L67 A77	V66-N70 VanDerWaalsContact O-CB 3.3Å; V66-N70 WeakPolarHBondContact O-CB 3.45Å; V66-N70 PolarHBondContact O-N 3.26Å; V66-N70 PolarHBondContact O-ND2 3.25Å; L67-N70 PolarHBondContact O-N 2.87Å; N70-A77 WeakPolarHBondContact O-CB 3.28Å
71	A	87.7	Confident	87.7	Confident	45 Å²	45	96.5 Å²	96.5	37%	0.372	52%	0.521	S	S	.	.			trans	-124.2	91	-176.2	0	0	0	0	0	110.5	L67	L67-A71 WeakPolarHBondContact O-CA 3.39Å; L67-A71 WeakPolarHBondContact O-CB 3.44Å; L67-A71 PolarHBondContact O-N 2.83Å
72	P	84.3	Confident	86.8	Confident	65 Å²	65	99.8 Å²	99.8	42%	0.422	53%	0.529	S	S	.	.			trans	-62.2	146.9	174	26.2	-32.7	0	0	0	110.8	N74 Q75	P72-N74 VanDerWaalsContact C-N 3.33Å; P72-N74 PolarHBondContact O-N 3.47Å; P72-Q75 HydrophobicContact CB-CG 4.28Å; P72-Q75 HydrophobicContact CG-CG 3.58Å
73	E	83.1	Confident	86.1	Confident	194 Å²	194	97.3 Å²	97.3	91%	0.907	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-31.6	-172.3	-168.4	170.3	-174	0	0	113.6
74	N	83.1	Confident	85.4	Confident	136 Å²	136	102.4 Å²	102.4	73%	0.727	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-8.9	-170.4	-61.9	-29.7	0	0	0	114.5	P72 F189	P72-N74 VanDerWaalsContact C-N 3.33Å; P72-N74 PolarHBondContact O-N 3.47Å; N74-F189 WeakPolarHBondContact O-CE2 3.48Å
75	Q	84.9	Confident	84.7	Confident	99 Å²	99	99.7 Å²	99.7	46%	0.463	54%	0.542	S	S	.	.	S	Bend	trans	-150.9	149.5	-176.4	67.7	-177.7	10.9	0	0	111.3	P72 F189	P72-Q75 HydrophobicContact CB-CG 4.28Å; P72-Q75 HydrophobicContact CG-CG 3.58Å; Q75-F189 HydrophobicContact CB-CD1 4.38Å; Q75-F189 HydrophobicContact CB-CD2 4.48Å; Q75-F189 HydrophobicContact CB-CE1 3.7Å; Q75-F189 HydrophobicContact CB-CE2 3.8Å; Q75-F189 HydrophobicContact CB-CZ 3.37Å
76	P	85.7	Confident	84.1	Confident	66 Å²	66	98.9 Å²	98.9	43%	0.429	54%	0.538	S	S	.	.			trans	-67	144.7	175.8	27.4	-31	0	0	0	110.5	R78 T79 F189	P76-R78 PolarHBondContact O-N 2.71Å; P76-R78 VanDerWaalsContact O-N 3.13Å; P76-T79 HydrophobicContact CG-CG2 3.68Å; P76-F189 HydrophobicContact CG-CB 4.03Å; P76-F189 HydrophobicContact CG-CG 4.28Å
77	A	83.4	Confident	83.7	Confident	59 Å²	59	97.8 Å²	97.8	49%	0.488	53%	0.528	S	S	.	.	S	Bend	trans	-57.8	-28.5	-178.9	0	0	0	0	0	114.1	N70	N70-A77 WeakPolarHBondContact O-CB 3.28Å
78	R	83.7	Confident	83.6	Confident	164 Å²	164	96.6 Å²	96.6	62%	0.619	52%	0.518	S	S	*	.	S	Bend	trans	-122.6	108.2	178.9	-60.4	-64.9	-178.1	167.4	-2.3	109.2	P76	P76-R78 PolarHBondContact O-N 2.71Å; P76-R78 VanDerWaalsContact O-N 3.13Å
79	T	80.6	Confident	83.7	Confident	61 Å²	61	88.4 Å²	88.4	37%	0.374	49%	0.486	S	S	.	.			trans	-114	167.8	175.8	52.3	0	0	0	0	110.8	P76 F189	P76-T79 HydrophobicContact CG-CG2 3.68Å; T79-F189 HydrophobicContact CG2-CD1 3.71Å; T79-F189 HydrophobicContact CG2-CE1 4.36Å; T79-F189 HydrophobicContact CG2-CG 4.44Å
80	G	79.4	Confident	83.8	Confident	20 Å²	20	84.9 Å²	84.9	21%	0.206	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	70.3	-151.4	175.2	0	0	0	0	0	114.1	Q82 S83 F87	G80-Q82 PolarHBondContact O-N 2.73Å; G80-S83 WeakPolarHBondContact O-CB 3.08Å; G80-S83 PolarHBondContact O-N 3.41Å; G80-S83 PolarHBondContact O-OG 2.9Å; G80-F87 VanDerWaalsContact CA-CD2 3.45Å
81	A	78.5	Confident	84	Confident	77 Å²	77	80.7 Å²	80.7	64%	0.636	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-66.5	-14.7	179	0	0	0	0	0	113.6	S83	A81-S83 VanDerWaalsContact C-N 3.27Å
82	Q	78.6	Confident	84.2	Confident	145 Å²	145	79.1 Å²	79.1	68%	0.678	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-81.4	-7.6	173.3	-60.2	-165.6	13.2	0	0	113.1	G80	G80-Q82 PolarHBondContact O-N 2.73Å
83	S	82.1	Confident	84.7	Confident	23 Å²	23	76.5 Å²	76.5	16%	0.161	41%	0.413	C	S	.	.	S	Bend	trans	-79.2	151.6	172.6	72.5	0	0	0	0	110.3	G80 A81 L85 D86	G80-S83 WeakPolarHBondContact O-CB 3.08Å; G80-S83 PolarHBondContact O-N 3.41Å; G80-S83 PolarHBondContact O-OG 2.9Å; A81-S83 VanDerWaalsContact C-N 3.27Å; S83-L85 PolarHBondContact O-N 2.8Å; S83-D86 PolarHBondContact O-N 3.49Å
84	L	80.5	Confident	85.3	Confident	184 Å²	184	70.6 Å²	70.6	96%	0.963	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.9	174.4	-172.9	66.6	0	0	0	112.8	D86	L84-D86 VanDerWaalsContact C-N 3.3Å
85	L	77.6	Confident	85.9	Confident	112 Å²	112	64.2 Å²	64.2	59%	0.586	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-4.4	179.2	-63.2	172.3	0	0	0	113.4	S83 F87 K88	S83-L85 PolarHBondContact O-N 2.8Å; L85-F87 PolarHBondContact O-N 2.82Å; L85-K88 PolarHBondContact O-N 3.41Å
86	D	82.8	Confident	86.2	Confident	76 Å²	76	61.8 Å²	61.8	41%	0.406	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	33.7	-177.8	-169.8	33.2	0	0	0	113	S83 L84 K88	S83-D86 PolarHBondContact O-N 3.49Å; L84-D86 VanDerWaalsContact C-N 3.3Å; D86-K88 HydrophobicContact CB-CD 4.45Å; D86-K88 WeakPolarHBondContact O-CG 3.34Å; D86-K88 PolarHBondContact O-N 3.32Å; D86-K88 VanDerWaalsContact O-N 3.1Å; D86-K88 WeakPolarHBondContact OD2-CE 3.41Å; D86-K88 IonicContact OD2-NZ 2.7Å; D86-K88 PolarHBondContact OD2-NZ 3.13Å
87	F	84.8	Confident	86.4	Confident	52 Å²	52	62.7 Å²	62.7	23%	0.228	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	54	29.1	-178.1	-152.2	-125	0	0	0	115.2	G80 L85 V188 F189 G190 W191	G80-F87 VanDerWaalsContact CA-CD2 3.45Å; L85-F87 PolarHBondContact O-N 2.82Å; F87-V188 HydrophobicContact CD2-CG1 3.98Å; F87-V188 HydrophobicContact CE2-CG1 4.35Å; F87-F189 WeakPolarHBondContact CE2-O 3.3Å; F87-G190 VanDerWaalsContact CZ-C 3.5Å; F87-G190 VanDerWaalsContact CZ-O 3.27Å; F87-G190 WeakPolarHBondContact CZ-O 3.34Å; F87-W191 AromaticContact CD1-CD1 3.81Å; F87-W191 HydrophobicContact CE1-CB 4.43Å; F87-W191 AromaticContact CE1-CD1 3.94Å; F87-W191 HydrophobicContact CE2-CB 4.1Å; F87-W191 HydrophobicContact CZ-CB 4.09Å; F87-W191 PolarHBondContact O-NE1 3.39Å
88	K	89.4	Confident	86.6	Confident	80 Å²	80	62.9 Å²	62.9	35%	0.348	33%	0.332	S	S	.	.			trans	-116.1	103.3	-177.6	-77.9	165.6	-176.7	160.2	0	110.1	L85 D86 N278	L85-K88 PolarHBondContact O-N 3.41Å; D86-K88 HydrophobicContact CB-CD 4.45Å; D86-K88 WeakPolarHBondContact O-CG 3.34Å; D86-K88 PolarHBondContact O-N 3.32Å; D86-K88 VanDerWaalsContact O-N 3.1Å; D86-K88 WeakPolarHBondContact OD2-CE 3.41Å; D86-K88 IonicContact OD2-NZ 2.7Å; D86-K88 PolarHBondContact OD2-NZ 3.13Å; K88-N278 HydrophobicContact CB-CB 4.04Å
89	P	91.4	Very high	86.6	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.013	35%	0.345	C	S	.	.			trans	-68.8	142	176.2	29.6	-35.9	0	0	0	110.6	V185 N186 V188 W191 N278	P89-V185 HydrophobicContact CB-CG1 3.68Å; P89-V185 HydrophobicContact CG-CG1 3.81Å; P89-N186 WeakPolarHBondContact CB-O 3.5Å; P89-V188 HydrophobicContact CB-CG2 3.83Å; P89-W191 HydrophobicContact CG-CD2 3.71Å; P89-W191 HydrophobicContact CG-CE3 4.12Å; P89-W191 HydrophobicContact CG-CG 4.28Å; P89-W191 HydrophobicContact CG-CH2 3.81Å; P89-W191 HydrophobicContact CG-CZ2 3.39Å; P89-W191 HydrophobicContact CG-CZ3 4.16Å; P89-N278 WeakPolarHBondContact O-CB 3.4Å; P89-N278 PolarHBondContact O-N 2.83Å
90	G	90.4	Very high	86.8	Confident	18 Å²	18	67.7 Å²	67.7	19%	0.186	37%	0.367	C	S	.	.			trans	-89.1	178.6	165.5	0	0	0	0	0	112.4	N186	G90-N186 WeakPolarHBondContact O-CB 3.46Å; G90-N186 PolarHBondContact O-N 3.39Å
91	L	91.8	Very high	87.1	Confident	16 Å²	16	73.2 Å²	73.2	8%	0.084	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	147.6	168.4	-72.1	170.4	0	0	0	110.8	K184 V185 V206 C269 I271 L282	L91-K184 WeakPolarHBondContact CA-O 3.44Å; L91-V185 HydrophobicContact CD2-CG2 4.05Å; L91-V206 HydrophobicContact CD1-CG1 4.36Å; L91-V206 HydrophobicContact CD2-CG1 4.02Å; L91-C269 HydrophobicContact CD1-CB 4.37Å; L91-I271 HydrophobicContact CD1-CD1 4.36Å; L91-I271 HydrophobicContact CD1-CG1 3.54Å; L91-I271 HydrophobicContact CD2-CD1 3.73Å; L91-I271 HydrophobicContact CD2-CG1 3.63Å; L91-I271 HydrophobicContact CG-CD1 3.66Å; L91-I271 HydrophobicContact CG-CG1 3.4Å; L91-L282 HydrophobicContact CB-CB 3.88Å; L91-L282 HydrophobicContact CB-CD2 3.86Å; L91-L282 HydrophobicContact CB-CG 4.42Å
92	G	92.9	Very high	87.6	Confident	13 Å²	13	71.6 Å²	71.6	13%	0.134	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	159.7	162.8	0	0	0	0	0	109.9	K184	G92-K184 PolarHBondContact N-O 2.84Å; G92-K184 PolarHBondContact O-N 3.42Å
93	F	94.9	Very high	88.3	Confident	9 Å²	9	67.6 Å²	67.6	4%	0.039	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	165.1	173.5	71.5	-73.9	0	0	0	113	P95 L96 I104 V181 L182 L183 L282 F284	F93-P95 VanDerWaalsContact CE2-O 3.3Å; F93-P95 WeakPolarHBondContact CE2-O 3.32Å; F93-L96 HydrophobicContact CD2-CG 4.4Å; F93-L96 HydrophobicContact CE1-CD1 4.28Å; F93-L96 HydrophobicContact CE1-CD2 3.91Å; F93-L96 HydrophobicContact CE1-CG 4.2Å; F93-L96 HydrophobicContact CE2-CD2 3.85Å; F93-L96 HydrophobicContact CE2-CG 3.94Å; F93-L96 HydrophobicContact CZ-CD1 4.43Å; F93-L96 HydrophobicContact CZ-CD2 3.38Å; F93-L96 HydrophobicContact CZ-CG 3.85Å; F93-L96 WeakPolarHBondContact O-CD1 3.15Å; F93-I104 HydrophobicContact CE2-CD1 4.2Å; F93-V181 HydrophobicContact CB-CG1 3.8Å; F93-V181 HydrophobicContact CD2-CG1 3.98Å; F93-V181 HydrophobicContact CG-CG1 4.31Å; F93-L182 CarbonylContact C-O 3.47Å; F93-L182 WeakPolarHBondContact CA-O 3.42Å; F93-L183 HydrophobicContact CB-CD2 3.9Å; F93-L282 HydrophobicContact CB-CD2 3.97Å; F93-L282 HydrophobicContact CD1-CD1 3.82Å; F93-L282 HydrophobicContact CD1-CD2 3.94Å; F93-L282 HydrophobicContact CD1-CG 4.23Å; F93-L282 HydrophobicContact CE1-CD1 4.26Å; F93-L282 HydrophobicContact CG-CD2 4.37Å; F93-F284 HydrophobicContact CD1-CB 4.41Å; F93-F284 HydrophobicContact CD1-CD1 4.33Å; F93-F284 HydrophobicContact CD2-CG 4.4Å; F93-F284 HydrophobicContact CE1-CB 3.76Å; F93-F284 HydrophobicContact CE1-CD1 4.49Å; F93-F284 HydrophobicContact CE1-CG 4.39Å; F93-F284 HydrophobicContact CE2-CB 3.94Å; F93-F284 HydrophobicContact CE2-CG 4.18Å; F93-F284 HydrophobicContact CG-CD1 4.32Å; F93-F284 HydrophobicContact CZ-CB 3.48Å; F93-F284 VanDerWaalsContact CZ-CB 3.48Å; F93-F284 HydrophobicContact CZ-CG 4.16Å
94	R	94.9	Very high	88.9	Confident	71 Å²	71	66.6 Å²	66.6	27%	0.268	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	145.9	165.7	-68.6	-66	-172.5	-120	13.2	107.9	Y124 V181 L182	R94-Y124 HydrophobicContact CB-CD1 4.48Å; R94-Y124 HydrophobicContact CG-CD1 4.08Å; R94-Y124 HydrophobicContact CG-CD2 4.24Å; R94-Y124 HydrophobicContact CG-CE1 4.31Å; R94-Y124 HydrophobicContact CG-CE2 4.48Å; R94-Y124 HydrophobicContact CG-CG 4.04Å; R94-V181 CarbonylContact O-C 3.59Å; R94-V181 WeakPolarHBondContact O-CG1 3.42Å; R94-L182 HydrophobicContact CB-CB 4.25Å; R94-L182 PolarHBondContact N-O 3.43Å; R94-L182 PolarHBondContact O-N 2.86Å
95	P	95	Very high	89.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.006	32%	0.323	C	S	.	.			cis	-79.9	151.7	7.7	28.4	-30.3	0	0	0	114	F93 I104 Y117 N120 M121 Y174	F93-P95 VanDerWaalsContact CE2-O 3.3Å; F93-P95 WeakPolarHBondContact CE2-O 3.32Å; P95-I104 HydrophobicContact CG-CD1 4.28Å; P95-Y117 HydrophobicContact CB-CD1 4.08Å; P95-Y117 HydrophobicContact CG-CD1 3.77Å; P95-Y117 HydrophobicContact CG-CG 4.3Å; P95-N120 WeakPolarHBondContact CA-OD1 3.45Å; P95-N120 HydrophobicContact CB-CB 4.17Å; P95-M121 HydrophobicContact CB-CG 3.97Å; P95-M121 HydrophobicContact CG-CE 4.24Å; P95-M121 HydrophobicContact CG-CG 4.28Å; P95-M121 HydrophobicContact CG-SD 4.27Å; P95-Y174 WeakPolarHBondContact CG-OH 3.38Å
96	L	91.5	Very high	90.4	Very high	49 Å²	49	59 Å²	59	26%	0.257	30%	0.296	S	S	.	.			trans	-133	109.2	172.1	-90.2	171.2	0	0	0	108.5	F93 N120	F93-L96 HydrophobicContact CD2-CG 4.4Å; F93-L96 HydrophobicContact CE1-CD1 4.28Å; F93-L96 HydrophobicContact CE1-CD2 3.91Å; F93-L96 HydrophobicContact CE1-CG 4.2Å; F93-L96 HydrophobicContact CE2-CD2 3.85Å; F93-L96 HydrophobicContact CE2-CG 3.94Å; F93-L96 HydrophobicContact CZ-CD1 4.43Å; F93-L96 HydrophobicContact CZ-CD2 3.38Å; F93-L96 HydrophobicContact CZ-CG 3.85Å; F93-L96 WeakPolarHBondContact O-CD1 3.15Å; L96-N120 PolarHBondContact N-OD1 3.48Å; L96-N120 VanDerWaalsContact N-OD1 3.1Å; L96-N120 PolarHBondContact O-ND2 2.69Å
97	L	90.2	Very high	91	Very high	84 Å²	84	56.6 Å²	56.6	44%	0.44	29%	0.285	S	S	.	.	S	Bend	trans	-91.4	-42.1	179.3	-61.7	-174.4	0	0	0	112.5	P116 Y117 N120	L97-P116 HydrophobicContact CD1-CB 3.82Å; L97-P116 HydrophobicContact CD2-CB 4.06Å; L97-P116 WeakPolarHBondContact CD2-O 3.29Å; L97-Y117 HydrophobicContact CD1-CD1 3.56Å; L97-Y117 HydrophobicContact CD1-CD2 4.07Å; L97-Y117 HydrophobicContact CD1-CE1 3.28Å; L97-Y117 HydrophobicContact CD1-CE2 3.85Å; L97-Y117 HydrophobicContact CD1-CG 3.97Å; L97-Y117 VanDerWaalsContact CD1-CZ 3.45Å; L97-Y117 HydrophobicContact CD2-CD1 4.39Å; L97-Y117 HydrophobicContact CG-CD1 3.73Å; L97-Y117 HydrophobicContact CG-CE1 3.69Å; L97-Y117 HydrophobicContact CG-CG 4.42Å; L97-N120 HydrophobicContact CD2-CB 3.93Å
98	D	87.4	Confident	91.3	Very high	63 Å²	63	54.7 Å²	54.7	34%	0.337	28%	0.279	S	S	.	.			trans	-120.5	126.9	177	-173	-12.5	0	0	0	108.7	Q100 K101	D98-Q100 PolarHBondContact O-N 3.13Å; D98-Q100 WeakPolarHBondContact OD1-CB 3.28Å; D98-Q100 PolarHBondContact OD1-N 3.41Å; D98-K101 HydrophobicContact CB-CB 4.22Å; D98-K101 PolarHBondContact O-N 3.33Å
99	V	83.2	Confident	91.5	Very high	149 Å²	149	57.7 Å²	57.7	90%	0.903	30%	0.299	S	S	*	.	S	Bend	trans	-70.7	-21.9	-179.3	-170.8	0	0	0	0	111.1
100	Q	84.9	Confident	91.6	Very high	177 Å²	177	61.1 Å²	61.1	83%	0.827	32%	0.317	S	S	*	.	S	Bend	trans	-87.3	-21.1	179.6	-61.2	-175.4	-15.7	0	0	113.1	D98	D98-Q100 PolarHBondContact O-N 3.13Å; D98-Q100 WeakPolarHBondContact OD1-CB 3.28Å; D98-Q100 PolarHBondContact OD1-N 3.41Å
101	K	85.9	Confident	91.8	Very high	136 Å²	136	62.3 Å²	62.3	59%	0.591	33%	0.325	S	S	*	.			trans	-125.8	113.6	-176	-61.8	177.2	-175.3	171.2	0	110.1	D98 L103	D98-K101 HydrophobicContact CB-CB 4.22Å; D98-K101 PolarHBondContact O-N 3.33Å; K101-L103 PolarHBondContact O-N 3.11Å; K101-L103 VanDerWaalsContact O-N 3.1Å
102	S	90.2	Very high	91.9	Very high	43 Å²	43	68 Å²	68	30%	0.301	35%	0.351	S	S	.	.			trans	-80.9	28.8	173.9	52.9	0	0	0	0	113	F284 E285	S102-F284 WeakPolarHBondContact O-CB 3.37Å; S102-E285 PolarHBondContact O-N 3.17Å
103	L	93.1	Very high	92	Very high	61 Å²	61	69.5 Å²	69.5	32%	0.319	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.1	-178.1	176.2	65.9	0	0	0	111.6	K101 R105 T264 E285	K101-L103 PolarHBondContact O-N 3.11Å; K101-L103 VanDerWaalsContact O-N 3.1Å; L103-R105 HydrophobicContact CD1-CB 4.49Å; L103-R105 HydrophobicContact CD2-CB 4.22Å; L103-R105 HydrophobicContact CG-CB 4.13Å; L103-T264 HydrophobicContact CD1-CG2 4.32Å; L103-E285 CarbonylContact C-O 3.58Å; L103-E285 WeakPolarHBondContact CA-O 3.4Å; L103-E285 HydrophobicContact CB-CB 4.31Å; L103-E285 HydrophobicContact CD1-CB 3.58Å
104	I	94.9	Very high	92	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.01	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	98.5	168.4	-58.7	173.3	0	0	0	107.5	F93 P95 Y106 Y117 Y174 V181 F284 E285 I286 M287	F93-I104 HydrophobicContact CE2-CD1 4.2Å; P95-I104 HydrophobicContact CG-CD1 4.28Å; I104-Y106 HydrophobicContact CG2-CD1 4.17Å; I104-Y106 HydrophobicContact CG2-CE1 4.49Å; I104-Y117 HydrophobicContact CB-CE1 4.22Å; I104-Y117 HydrophobicContact CG1-CE1 4.3Å; I104-Y117 HydrophobicContact CG2-CD1 4.09Å; I104-Y117 HydrophobicContact CG2-CE1 3.88Å; I104-Y174 HydrophobicContact CG2-CE1 3.93Å; I104-V181 HydrophobicContact CD1-CG2 3.9Å; I104-F284 HydrophobicContact CD1-CD2 4.37Å; I104-E285 PolarHBondContact N-O 3.11Å; I104-I286 HydrophobicContact CB-CG1 4.19Å; I104-I286 HydrophobicContact CG2-CG1 4.27Å; I104-I286 CarbonylContact O-C 3.5Å; I104-I286 WeakPolarHBondContact O-CA 3.22Å; I104-M287 PolarHBondContact O-N 3.08Å
105	R	94.5	Very high	92	Very high	134 Å²	134	70 Å²	70	51%	0.506	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.1	175.5	-179.3	-176.3	-179	146.4	8.4	110.6	L103 Y117 M287 D289	L103-R105 HydrophobicContact CD1-CB 4.49Å; L103-R105 HydrophobicContact CD2-CB 4.22Å; L103-R105 HydrophobicContact CG-CB 4.13Å; R105-Y117 PolarHBondContact N-OH 2.95Å; R105-Y117 VanDerWaalsContact O-CE2 3.26Å; R105-Y117 WeakPolarHBondContact O-CE2 3.5Å; R105-Y117 PolarHBondContact O-OH 3.16Å; R105-M287 WeakPolarHBondContact CA-O 3.44Å; R105-M287 HydrophobicContact CG-CB 4.48Å; R105-M287 HydrophobicContact CG-CE 3.72Å; R105-M287 VanDerWaalsContact NH2-CE 3.31Å; R105-D289 IonicContact CZ-OD2 2.94Å; R105-D289 IonicContact NE-OD2 3.61Å; R105-D289 PolarHBondContact NE-OD2 3.18Å; R105-D289 VanDerWaalsContact NE-OD2 3.17Å; R105-D289 IonicContact NH2-OD1 3.49Å; R105-D289 IonicContact NH2-OD2 3.17Å; R105-D289 PolarHBondContact NH2-OD2 3.16Å
106	Y	95.1	Very high	92	Very high	3 Å²	3	72.5 Å²	72.5	1%	0.012	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	162.6	173.8	73.5	-82.3	0	0	0	110.6	I104 Y114 Y174 P179 M287 V288 D289	I104-Y106 HydrophobicContact CG2-CD1 4.17Å; I104-Y106 HydrophobicContact CG2-CE1 4.49Å; Y106-Y114 HydrophobicContact CD2-CD1 4.26Å; Y106-Y114 HydrophobicContact CD2-CG 4.48Å; Y106-Y174 AromaticContact CD1-CD1 3.54Å; Y106-Y174 HydrophobicContact CD1-CD1 3.54Å; Y106-Y174 AromaticContact CD1-CE1 3.53Å; Y106-Y174 HydrophobicContact CD1-CE1 3.53Å; Y106-Y174 AromaticContact CD2-CD1 3.85Å; Y106-Y174 HydrophobicContact CD2-CD1 3.85Å; Y106-Y174 AromaticContact CE1-CD1 3.41Å; Y106-Y174 HydrophobicContact CE1-CD1 3.41Å; Y106-Y174 VanDerWaalsContact CE1-CD1 3.41Å; Y106-Y174 AromaticContact CE1-CE1 3.48Å; Y106-Y174 HydrophobicContact CE1-CE1 3.48Å; Y106-Y174 VanDerWaalsContact CE1-CE1 3.48Å; Y106-Y174 HydrophobicContact CE1-CG 4.42Å; Y106-Y174 AromaticContact CE2-CD1 3.76Å; Y106-Y174 HydrophobicContact CE2-CD1 3.76Å; Y106-Y174 HydrophobicContact CE2-CG 4.37Å; Y106-Y174 VanDerWaalsContact CE2-O 3.28Å; Y106-Y174 WeakPolarHBondContact CE2-O 3.32Å; Y106-Y174 AromaticContact CG-CD1 3.75Å; Y106-Y174 HydrophobicContact CG-CD1 3.75Å; Y106-Y174 HydrophobicContact CG-CE1 4.13Å; Y106-Y174 AromaticContact CZ-CD1 3.52Å; Y106-P179 HydrophobicContact CE1-CB 3.87Å; Y106-P179 HydrophobicContact CE1-CG 4.03Å; Y106-P179 VanDerWaalsContact OH-CB 3.32Å; Y106-P179 WeakPolarHBondContact OH-CB 3.37Å; Y106-P179 WeakPolarHBondContact OH-CD 3.45Å; Y106-P179 VanDerWaalsContact OH-CG 3.28Å; Y106-P179 WeakPolarHBondContact OH-CG 3.42Å; Y106-M287 PolarHBondContact N-O 3.15Å; Y106-V288 HydrophobicContact CE1-CG2 3.78Å; Y106-V288 HydrophobicContact CE2-CG1 4.15Å; Y106-D289 PolarHBondContact O-N 3.19Å
107	S	94.9	Very high	92.2	Very high	25 Å²	25	71.2 Å²	71.2	18%	0.175	37%	0.372	C	S	.	.			trans	-103.1	135.9	169.3	179.2	0	0	0	0	110.1	D109 T113 D289	S107-D109 PolarHBondContact O-N 2.94Å; S107-D109 PolarHBondContact OG-N 3.33Å; S107-T113 PolarHBondContact N-OG1 3.09Å; S107-T113 PolarHBondContact O-OG1 2.73Å; S107-D289 VanDerWaalsContact CA-O 3.29Å; S107-D289 WeakPolarHBondContact CA-O 3.33Å; S107-D289 PolarHBondContact OG-O 3.13Å
108	A	91.8	Very high	92.4	Very high	12 Å²	12	67.3 Å²	67.3	10%	0.099	35%	0.352	C	S	.	.	S	Bend	trans	-66.5	-27.1	178.5	0	0	0	0	0	112.4	D289	A108-D289 PolarHBondContact N-O 2.96Å; A108-D289 VanDerWaalsContact N-O 3.16Å
109	D	92.4	Very high	92.8	Very high	143 Å²	143	69.5 Å²	69.5	77%	0.765	36%	0.36	S	S	*	.	S	Bend	trans	-81.8	-29.6	-175.1	-61.9	-31.5	0	0	0	112.6	S107	S107-D109 PolarHBondContact O-N 2.94Å; S107-D109 PolarHBondContact OG-N 3.33Å
110	D	94.4	Very high	93.4	Very high	75 Å²	75	64.5 Å²	64.5	40%	0.401	33%	0.328	S	S	.	.			trans	-104.9	108.9	-179.6	-176.3	9.1	0	0	0	112.4	Q112 T113	D110-Q112 PolarHBondContact O-N 3.09Å; D110-Q112 WeakPolarHBondContact OD1-CB 3.34Å; D110-Q112 PolarHBondContact OD1-N 3.01Å; D110-T113 HydrophobicContact CB-CG2 3.92Å; D110-T113 PolarHBondContact O-N 3.49Å; D110-T113 VanDerWaalsContact O-N 3.09Å; D110-T113 PolarHBondContact O-OG1 3.03Å; D110-T113 WeakPolarHBondContact OD2-CG2 3.36Å
111	A	93.9	Very high	93.9	Very high	43 Å²	43	56.1 Å²	56.1	36%	0.355	29%	0.289	S	S	.	.	H	α-helix	trans	-57.1	-30.8	177	0	0	0	0	0	114.4	T113 Y114 L115	A111-T113 PolarHBondContact O-N 3.35Å; A111-Y114 VanDerWaalsContact CA-CZ 3.48Å; A111-Y114 HydrophobicContact CB-CE1 4.14Å; A111-Y114 HydrophobicContact CB-CE2 4.37Å; A111-Y114 PolarHBondContact O-N 2.92Å; A111-L115 VanDerWaalsContact O-CB 3.3Å; A111-L115 WeakPolarHBondContact O-CB 3.42Å; A111-L115 PolarHBondContact O-N 3.35Å; A111-L115 VanDerWaalsContact O-N 3.09Å
112	Q	94.1	Very high	94.4	Very high	134 Å²	134	52 Å²	52	63%	0.626	27%	0.273	S	S	*	.	H	α-helix	trans	-67.8	-27.7	-179.8	-61.7	-58.1	-45.9	0	0	112	D110 P116	D110-Q112 PolarHBondContact O-N 3.09Å; D110-Q112 WeakPolarHBondContact OD1-CB 3.34Å; D110-Q112 PolarHBondContact OD1-N 3.01Å; Q112-P116 WeakPolarHBondContact O-CD 3.26Å
113	T	94.6	Very high	94.6	Very high	46 Å²	46	53 Å²	53	28%	0.282	29%	0.285	S	S	.	.	H	α-helix	trans	-74.4	-37.8	-178.9	67.6	0	0	0	0	112.5	S107 D110 A111 Y117	S107-T113 PolarHBondContact N-OG1 3.09Å; S107-T113 PolarHBondContact O-OG1 2.73Å; D110-T113 HydrophobicContact CB-CG2 3.92Å; D110-T113 PolarHBondContact O-N 3.49Å; D110-T113 VanDerWaalsContact O-N 3.09Å; D110-T113 PolarHBondContact O-OG1 3.03Å; D110-T113 WeakPolarHBondContact OD2-CG2 3.36Å; A111-T113 PolarHBondContact O-N 3.35Å; T113-Y117 WeakPolarHBondContact O-CE2 3.3Å
114	Y	94.9	Very high	94.7	Very high	30 Å²	30	51.8 Å²	51.8	12%	0.118	28%	0.276	C	S	.	.	H	α-helix	trans	-91.1	-17.7	-179.3	63.1	-108.1	0	0	0	114.4	Y106 A111 P116 Y117 T118 N171	Y106-Y114 HydrophobicContact CD2-CD1 4.26Å; Y106-Y114 HydrophobicContact CD2-CG 4.48Å; A111-Y114 VanDerWaalsContact CA-CZ 3.48Å; A111-Y114 HydrophobicContact CB-CE1 4.14Å; A111-Y114 HydrophobicContact CB-CE2 4.37Å; A111-Y114 PolarHBondContact O-N 2.92Å; Y114-P116 VanDerWaalsContact C-CD 3.45Å; Y114-Y117 WeakPolarHBondContact O-CB 3.37Å; Y114-Y117 PolarHBondContact O-N 3.2Å; Y114-T118 HydrophobicContact CD2-CG2 3.96Å; Y114-T118 PolarHBondContact O-N 3.02Å; Y114-T118 VanDerWaalsContact O-N 3.11Å; Y114-N171 HydrophobicContact CE2-CB 4.38Å
115	L	95.3	Very high	94.8	Very high	61 Å²	61	52 Å²	52	32%	0.319	28%	0.277	S	S	.	.	H	α-helix	trans	-53.2	-41.3	-178.9	-176.4	66.2	0	0	0	114.3	A111 Y117 T118 Q119	A111-L115 VanDerWaalsContact O-CB 3.3Å; A111-L115 WeakPolarHBondContact O-CB 3.42Å; A111-L115 PolarHBondContact O-N 3.35Å; A111-L115 VanDerWaalsContact O-N 3.09Å; L115-Y117 VanDerWaalsContact C-N 3.27Å; L115-Y117 PolarHBondContact O-N 3.43Å; L115-T118 WeakPolarHBondContact CA-OG1 3.47Å; L115-T118 PolarHBondContact O-N 2.9Å; L115-T118 PolarHBondContact O-OG1 3.11Å; L115-Q119 HydrophobicContact CD1-CG 4.09Å; L115-Q119 HydrophobicContact CG-CG 4.26Å; L115-Q119 WeakPolarHBondContact O-CB 3.44Å; L115-Q119 VanDerWaalsContact O-CG 3.26Å; L115-Q119 WeakPolarHBondContact O-CG 3.42Å; L115-Q119 PolarHBondContact O-N 3.33Å
116	P	95.2	Very high	94.8	Very high	53 Å²	53	49.1 Å²	49.1	34%	0.344	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-36.3	176.7	-24.4	35.3	0	0	0	112.8	L97 Q112 Y114 N120	L97-P116 HydrophobicContact CD1-CB 3.82Å; L97-P116 HydrophobicContact CD2-CB 4.06Å; L97-P116 WeakPolarHBondContact CD2-O 3.29Å; Q112-P116 WeakPolarHBondContact O-CD 3.26Å; Y114-P116 VanDerWaalsContact C-CD 3.45Å; P116-N120 VanDerWaalsContact O-CB 3.31Å; P116-N120 WeakPolarHBondContact O-CB 3.24Å; P116-N120 PolarHBondContact O-N 3.37Å
117	Y	95.4	Very high	94.8	Very high	21 Å²	21	52 Å²	52	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-71	-42.5	178.8	-60.2	-82	0	0	0	111.6	P95 L97 I104 R105 T113 Y114 L115 N120 M121 Y174	P95-Y117 HydrophobicContact CB-CD1 4.08Å; P95-Y117 HydrophobicContact CG-CD1 3.77Å; P95-Y117 HydrophobicContact CG-CG 4.3Å; L97-Y117 HydrophobicContact CD1-CD1 3.56Å; L97-Y117 HydrophobicContact CD1-CD2 4.07Å; L97-Y117 HydrophobicContact CD1-CE1 3.28Å; L97-Y117 HydrophobicContact CD1-CE2 3.85Å; L97-Y117 HydrophobicContact CD1-CG 3.97Å; L97-Y117 VanDerWaalsContact CD1-CZ 3.45Å; L97-Y117 HydrophobicContact CD2-CD1 4.39Å; L97-Y117 HydrophobicContact CG-CD1 3.73Å; L97-Y117 HydrophobicContact CG-CE1 3.69Å; L97-Y117 HydrophobicContact CG-CG 4.42Å; I104-Y117 HydrophobicContact CB-CE1 4.22Å; I104-Y117 HydrophobicContact CG1-CE1 4.3Å; I104-Y117 HydrophobicContact CG2-CD1 4.09Å; I104-Y117 HydrophobicContact CG2-CE1 3.88Å; R105-Y117 PolarHBondContact N-OH 2.95Å; R105-Y117 VanDerWaalsContact O-CE2 3.26Å; R105-Y117 WeakPolarHBondContact O-CE2 3.5Å; R105-Y117 PolarHBondContact O-OH 3.16Å; T113-Y117 WeakPolarHBondContact O-CE2 3.3Å; Y114-Y117 WeakPolarHBondContact O-CB 3.37Å; Y114-Y117 PolarHBondContact O-N 3.2Å; L115-Y117 VanDerWaalsContact C-N 3.27Å; L115-Y117 PolarHBondContact O-N 3.43Å; Y117-N120 PolarHBondContact O-N 3.46Å; Y117-M121 WeakPolarHBondContact O-CE 3.01Å; Y117-M121 PolarHBondContact O-N 2.96Å; Y117-Y174 HydrophobicContact CD2-CE1 4.28Å; Y117-Y174 HydrophobicContact CG-CE1 4.04Å
118	T	95.5	Very high	94.7	Very high	3 Å²	3	51 Å²	51	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-65.5	-43.8	177.3	62.1	0	0	0	0	111.1	Y114 L115 N120 M121 D122 N171 Y172 Y174	Y114-T118 HydrophobicContact CD2-CG2 3.96Å; Y114-T118 PolarHBondContact O-N 3.02Å; Y114-T118 VanDerWaalsContact O-N 3.11Å; L115-T118 WeakPolarHBondContact CA-OG1 3.47Å; L115-T118 PolarHBondContact O-N 2.9Å; L115-T118 PolarHBondContact O-OG1 3.11Å; T118-N120 VanDerWaalsContact C-N 3.33Å; T118-N120 PolarHBondContact O-N 3.1Å; T118-M121 PolarHBondContact O-N 3.5Å; T118-M121 VanDerWaalsContact O-N 3.13Å; T118-D122 PolarHBondContact O-N 3.36Å; T118-N171 HydrophobicContact CG2-CB 4.13Å; T118-Y172 HydrophobicContact CG2-CD2 4.13Å; T118-Y174 HydrophobicContact CG2-CD2 4.47Å; T118-Y174 HydrophobicContact CG2-CG 4.48Å
119	Q	95.3	Very high	94.8	Very high	109 Å²	109	54 Å²	54	51%	0.509	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-39.1	174.7	-72.6	176.5	-15.3	0	0	112.6	L115 M121 D122 A123	L115-Q119 HydrophobicContact CD1-CG 4.09Å; L115-Q119 HydrophobicContact CG-CG 4.26Å; L115-Q119 WeakPolarHBondContact O-CB 3.44Å; L115-Q119 VanDerWaalsContact O-CG 3.26Å; L115-Q119 WeakPolarHBondContact O-CG 3.42Å; L115-Q119 PolarHBondContact O-N 3.33Å; Q119-M121 VanDerWaalsContact C-N 3.32Å; Q119-M121 PolarHBondContact O-N 2.99Å; Q119-D122 PolarHBondContact O-N 2.85Å; Q119-A123 VanDerWaalsContact O-CB 3.31Å; Q119-A123 WeakPolarHBondContact O-CB 3.37Å; Q119-A123 PolarHBondContact O-N 3.36Å
120	N	95.1	Very high	94.9	Very high	44 Å²	44	52.7 Å²	52.7	24%	0.235	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-40.2	174.8	-172.7	-93.4	0	0	0	111.8	P95 L96 L97 P116 Y117 T118 Y124	P95-N120 WeakPolarHBondContact CA-OD1 3.45Å; P95-N120 HydrophobicContact CB-CB 4.17Å; L96-N120 PolarHBondContact N-OD1 3.48Å; L96-N120 VanDerWaalsContact N-OD1 3.1Å; L96-N120 PolarHBondContact O-ND2 2.69Å; L97-N120 HydrophobicContact CD2-CB 3.93Å; P116-N120 VanDerWaalsContact O-CB 3.31Å; P116-N120 WeakPolarHBondContact O-CB 3.24Å; P116-N120 PolarHBondContact O-N 3.37Å; Y117-N120 PolarHBondContact O-N 3.46Å; T118-N120 VanDerWaalsContact C-N 3.33Å; T118-N120 PolarHBondContact O-N 3.1Å; N120-Y124 WeakPolarHBondContact O-CB 3.44Å; N120-Y124 PolarHBondContact O-N 2.86Å; N120-Y124 VanDerWaalsContact O-N 3.11Å
121	M	95.6	Very high	94.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-70.7	-42.3	175.9	-72.3	-175.1	-75.9	0	0	112.3	P95 Y117 T118 Q119 A123 Y124 L125 Y172 Y174 L182	P95-M121 HydrophobicContact CB-CG 3.97Å; P95-M121 HydrophobicContact CG-CE 4.24Å; P95-M121 HydrophobicContact CG-CG 4.28Å; P95-M121 HydrophobicContact CG-SD 4.27Å; Y117-M121 WeakPolarHBondContact O-CE 3.01Å; Y117-M121 PolarHBondContact O-N 2.96Å; T118-M121 PolarHBondContact O-N 3.5Å; T118-M121 VanDerWaalsContact O-N 3.13Å; Q119-M121 VanDerWaalsContact C-N 3.32Å; Q119-M121 PolarHBondContact O-N 2.99Å; M121-A123 PolarHBondContact O-N 2.8Å; M121-Y124 WeakPolarHBondContact O-CB 3.39Å; M121-Y124 PolarHBondContact O-N 3.01Å; M121-Y124 VanDerWaalsContact O-N 3.13Å; M121-L125 WeakPolarHBondContact O-CB 3.11Å; M121-L125 WeakPolarHBondContact O-CG 3.07Å; M121-L125 PolarHBondContact O-N 3.14Å; M121-Y172 HydrophobicContact CB-CD1 4.33Å; M121-Y172 HydrophobicContact CB-CD2 4.11Å; M121-Y172 HydrophobicContact CB-CE1 3.93Å; M121-Y172 HydrophobicContact CB-CE2 3.68Å; M121-Y172 HydrophobicContact CB-CG 4.4Å; M121-Y172 VanDerWaalsContact CE-CB 3.43Å; M121-Y172 HydrophobicContact CE-CD1 4.12Å; M121-Y172 HydrophobicContact CE-CD2 3.43Å; M121-Y172 VanDerWaalsContact CE-CD2 3.43Å; M121-Y172 HydrophobicContact CE-CE2 4.19Å; M121-Y172 HydrophobicContact CE-CG 3.38Å; M121-Y172 HydrophobicContact SD-CD1 3.78Å; M121-Y172 HydrophobicContact SD-CD2 4.13Å; M121-Y172 HydrophobicContact SD-CE1 4.29Å; M121-Y172 HydrophobicContact SD-CG 3.68Å; M121-Y174 HydrophobicContact CE-CD2 3.9Å; M121-Y174 HydrophobicContact CE-CE2 3.36Å; M121-Y174 HydrophobicContact SD-CE2 4.45Å; M121-L182 HydrophobicContact CG-CD1 4.44Å; M121-L182 HydrophobicContact SD-CG 4.47Å
122	D	96	Very high	94.7	Very high	49 Å²	49	49.6 Å²	49.6	26%	0.262	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-46.6	175.7	-71.9	-31	0	0	0	110.8	T118 Q119 Y124 L125 D126 T168 Y172	T118-D122 PolarHBondContact O-N 3.36Å; Q119-D122 PolarHBondContact O-N 2.85Å; D122-Y124 VanDerWaalsContact C-N 3.26Å; D122-Y124 PolarHBondContact O-N 3.02Å; D122-L125 PolarHBondContact O-N 3.09Å; D122-D126 WeakPolarHBondContact O-CB 3.33Å; D122-D126 PolarHBondContact O-N 3.4Å; D122-T168 WeakPolarHBondContact OD1-CB 3.3Å; D122-T168 WeakPolarHBondContact OD1-CG2 3.44Å; D122-T168 PolarHBondContact OD1-OG1 2.98Å; D122-Y172 PolarHBondContact N-OH 3.42Å; D122-Y172 VanDerWaalsContact OD1-CE2 3.28Å; D122-Y172 WeakPolarHBondContact OD1-CE2 3.45Å; D122-Y172 VanDerWaalsContact OD1-CZ 3.31Å; D122-Y172 PolarHBondContact OD1-OH 2.91Å
123	A	95.6	Very high	94.6	Very high	65 Å²	65	47.4 Å²	47.4	54%	0.537	27%	0.268	S	S	.	.	H	α-helix	trans	-61.2	-35	175.8	0	0	0	0	0	112.5	Q119 M121	Q119-A123 VanDerWaalsContact O-CB 3.31Å; Q119-A123 WeakPolarHBondContact O-CB 3.37Å; Q119-A123 PolarHBondContact O-N 3.36Å; M121-A123 PolarHBondContact O-N 2.8Å
124	Y	95	Very high	94.4	Very high	36 Å²	36	49.8 Å²	49.8	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-70.5	-46.4	175.1	178.1	-109.3	0	0	0	112.1	R94 N120 M121 D122 D126 T127 Y128 L182 K184 I251	R94-Y124 HydrophobicContact CB-CD1 4.48Å; R94-Y124 HydrophobicContact CG-CD1 4.08Å; R94-Y124 HydrophobicContact CG-CD2 4.24Å; R94-Y124 HydrophobicContact CG-CE1 4.31Å; R94-Y124 HydrophobicContact CG-CE2 4.48Å; R94-Y124 HydrophobicContact CG-CG 4.04Å; N120-Y124 WeakPolarHBondContact O-CB 3.44Å; N120-Y124 PolarHBondContact O-N 2.86Å; N120-Y124 VanDerWaalsContact O-N 3.11Å; M121-Y124 WeakPolarHBondContact O-CB 3.39Å; M121-Y124 PolarHBondContact O-N 3.01Å; M121-Y124 VanDerWaalsContact O-N 3.13Å; D122-Y124 VanDerWaalsContact C-N 3.26Å; D122-Y124 PolarHBondContact O-N 3.02Å; Y124-D126 VanDerWaalsContact C-N 3.3Å; Y124-D126 PolarHBondContact O-N 2.86Å; Y124-T127 PolarHBondContact O-N 2.04Å; Y124-T127 PolarHBondContact O-OG1 2.84Å; Y124-Y128 AromaticContact CE1-CE2 3.89Å; Y124-Y128 HydrophobicContact CE1-CE2 3.89Å; Y124-Y128 HydrophobicContact CE2-CE2 4.37Å; Y124-Y128 AromaticContact CZ-CE2 3.8Å; Y124-Y128 PolarHBondContact OH-OH 3Å; Y124-Y128 VanDerWaalsContact OH-OH 3.09Å; Y124-L182 HydrophobicContact CD1-CD1 4.04Å; Y124-L182 HydrophobicContact CE1-CD1 4.36Å; Y124-K184 WeakPolarHBondContact OH-CD 3.3Å; Y124-I251 HydrophobicContact CE1-CG2 4.23Å
125	L	95.6	Very high	94.1	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-73.7	-19.6	-179.7	-67.6	-172.6	0	0	0	113.2	M121 D122 T127 Y128 N129 L160 L163 Y172 L182 I251	M121-L125 WeakPolarHBondContact O-CB 3.11Å; M121-L125 WeakPolarHBondContact O-CG 3.07Å; M121-L125 PolarHBondContact O-N 3.14Å; D122-L125 PolarHBondContact O-N 3.09Å; L125-T127 PolarHBondContact O-N 3.41Å; L125-Y128 HydrophobicContact CD2-CD2 4.22Å; L125-Y128 WeakPolarHBondContact O-CA 3.37Å; L125-Y128 WeakPolarHBondContact O-CB 3.5Å; L125-Y128 PolarHBondContact O-N 3.18Å; L125-N129 PolarHBondContact O-N 3.09Å; L125-L160 HydrophobicContact CB-CD1 4.34Å; L125-L160 HydrophobicContact CD2-CD2 3.93Å; L125-L163 HydrophobicContact CD1-CD1 4.19Å; L125-L163 HydrophobicContact CD2-CD1 4.31Å; L125-Y172 HydrophobicContact CD1-CE1 3.68Å; L125-Y172 WeakPolarHBondContact CD1-OH 3.17Å; L125-L182 HydrophobicContact CD1-CD1 4.31Å; L125-L182 HydrophobicContact CD2-CD1 3.97Å; L125-L182 HydrophobicContact CG-CD1 4.16Å; L125-I251 HydrophobicContact CD2-CD1 3.61Å
126	D	95.4	Very high	93.6	Very high	73 Å²	73	55 Å²	55	39%	0.39	31%	0.31	S	S	.	.	H	α-helix	trans	-57.9	-35.5	172.8	-171.7	55.5	0	0	0	111.7	D122 Y124 Y128 N129 Q130	D122-D126 WeakPolarHBondContact O-CB 3.33Å; D122-D126 PolarHBondContact O-N 3.4Å; Y124-D126 VanDerWaalsContact C-N 3.3Å; Y124-D126 PolarHBondContact O-N 2.86Å; D126-Y128 PolarHBondContact O-N 3.37Å; D126-N129 WeakPolarHBondContact O-CB 3.38Å; D126-N129 PolarHBondContact O-N 2.8Å; D126-N129 VanDerWaalsContact O-N 3.15Å; D126-Q130 WeakPolarHBondContact O-CG 3.36Å; D126-Q130 PolarHBondContact O-N 3.24Å; D126-Q130 PolarHBondContact OD2-NE2 2.81Å
127	T	94	Very high	92.9	Very high	62 Å²	62	57.1 Å²	57.1	38%	0.38	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-33.1	173.5	66.7	0	0	0	0	112.8	Y124 L125 V131	Y124-T127 PolarHBondContact O-N 2.04Å; Y124-T127 PolarHBondContact O-OG1 2.84Å; L125-T127 PolarHBondContact O-N 3.41Å; T127-V131 WeakPolarHBondContact O-CG2 3.15Å; T127-V131 PolarHBondContact O-N 3.19Å
128	Y	94.4	Very high	92.2	Very high	5 Å²	5	61.8 Å²	61.8	2%	0.02	35%	0.348	C	S	.	.	H	α-helix	trans	-74.8	-41.7	175.2	-69	-106.5	0	0	0	111	Y124 L125 D126 Q130 V131 N132 F158 L160 L248 G249 I251	Y124-Y128 AromaticContact CE1-CE2 3.89Å; Y124-Y128 HydrophobicContact CE1-CE2 3.89Å; Y124-Y128 HydrophobicContact CE2-CE2 4.37Å; Y124-Y128 AromaticContact CZ-CE2 3.8Å; Y124-Y128 PolarHBondContact OH-OH 3Å; Y124-Y128 VanDerWaalsContact OH-OH 3.09Å; L125-Y128 HydrophobicContact CD2-CD2 4.22Å; L125-Y128 WeakPolarHBondContact O-CA 3.37Å; L125-Y128 WeakPolarHBondContact O-CB 3.5Å; L125-Y128 PolarHBondContact O-N 3.18Å; D126-Y128 PolarHBondContact O-N 3.37Å; Y128-Q130 PolarHBondContact O-N 3.24Å; Y128-V131 PolarHBondContact O-N 3.06Å; Y128-N132 VanDerWaalsContact O-CB 3.28Å; Y128-N132 WeakPolarHBondContact O-CB 3.49Å; Y128-N132 PolarHBondContact O-N 2.77Å; Y128-N132 PolarHBondContact O-ND2 3.06Å; Y128-F158 HydrophobicContact CD1-CB 4.02Å; Y128-F158 AromaticContact CD1-CD1 3.89Å; Y128-F158 HydrophobicContact CD1-CD1 3.89Å; Y128-F158 HydrophobicContact CD1-CG 4.34Å; Y128-F158 HydrophobicContact CE1-CB 4.1Å; Y128-F158 HydrophobicContact CE1-CD1 4Å; Y128-F158 HydrophobicContact CE1-CG 4.27Å; Y128-L160 HydrophobicContact CD1-CD2 4.11Å; Y128-L160 HydrophobicContact CG-CD2 3.99Å; Y128-L248 HydrophobicContact CD1-CB 4.16Å; Y128-L248 HydrophobicContact CD1-CD1 3.67Å; Y128-L248 HydrophobicContact CD1-CD2 4.42Å; Y128-L248 HydrophobicContact CD1-CG 4.31Å; Y128-L248 HydrophobicContact CD2-CD2 4.38Å; Y128-L248 HydrophobicContact CE1-CB 3.79Å; Y128-L248 HydrophobicContact CE1-CD1 4.14Å; Y128-L248 HydrophobicContact CE1-CD2 4.28Å; Y128-L248 HydrophobicContact CE1-CG 4.3Å; Y128-L248 HydrophobicContact CE2-CD2 4.24Å; Y128-L248 HydrophobicContact CG-CD1 3.92Å; Y128-L248 HydrophobicContact CG-CD2 4.44Å; Y128-G249 PolarHBondContact OH-O 2.96Å; Y128-I251 HydrophobicContact CE1-CD1 4.25Å; Y128-I251 HydrophobicContact CE1-CG1 4.34Å; Y128-I251 HydrophobicContact CE1-CG2 4.49Å; Y128-I251 WeakPolarHBondContact OH-CG2 3.26Å
129	N	94.4	Very high	91.7	Very high	76 Å²	76	62.4 Å²	62.4	41%	0.406	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-47.3	175.2	-71.4	-35.9	0	0	0	111.9	L125 D126 V131 N132 A133 L160	L125-N129 PolarHBondContact O-N 3.09Å; D126-N129 WeakPolarHBondContact O-CB 3.38Å; D126-N129 PolarHBondContact O-N 2.8Å; D126-N129 VanDerWaalsContact O-N 3.15Å; N129-V131 PolarHBondContact O-N 2.78Å; N129-N132 PolarHBondContact O-N 3.11Å; N129-A133 WeakPolarHBondContact O-CB 3.36Å; N129-A133 PolarHBondContact O-N 3.1Å; N129-L160 WeakPolarHBondContact OD1-CD1 3.42Å
130	Q	93.6	Very high	91	Very high	114 Å²	114	58.1 Å²	58.1	53%	0.533	33%	0.334	S	S	.	.	H	α-helix	trans	-61	-41.3	179.4	-71.3	-178.3	41.4	0	0	112.5	D126 Y128	D126-Q130 WeakPolarHBondContact O-CG 3.36Å; D126-Q130 PolarHBondContact O-N 3.24Å; D126-Q130 PolarHBondContact OD2-NE2 2.81Å; Y128-Q130 PolarHBondContact O-N 3.24Å
131	V	92.1	Very high	90.2	Very high	12 Å²	12	62.4 Å²	62.4	7%	0.073	36%	0.357	C	S	.	.	H	α-helix	trans	-71.4	-40.2	177.2	171.7	0	0	0	0	111.2	T127 Y128 N129 A133 K134 F139 K157 L248	T127-V131 WeakPolarHBondContact O-CG2 3.15Å; T127-V131 PolarHBondContact O-N 3.19Å; Y128-V131 PolarHBondContact O-N 3.06Å; N129-V131 PolarHBondContact O-N 2.78Å; V131-A133 VanDerWaalsContact C-N 3.27Å; V131-A133 PolarHBondContact O-N 2.98Å; V131-K134 WeakPolarHBondContact O-CB 3.27Å; V131-K134 PolarHBondContact O-N 3.35Å; V131-F139 HydrophobicContact CG1-CD1 4.41Å; V131-F139 HydrophobicContact CG1-CE1 3.52Å; V131-F139 HydrophobicContact CG1-CZ 3.72Å; V131-K157 WeakPolarHBondContact O-CE 3.26Å; V131-L248 HydrophobicContact CB-CD1 3.5Å; V131-L248 HydrophobicContact CB-CG 4.37Å; V131-L248 HydrophobicContact CG1-CD1 3.66Å; V131-L248 HydrophobicContact CG1-CG 4.34Å; V131-L248 HydrophobicContact CG2-CD1 3.74Å; V131-L248 HydrophobicContact CG2-CD2 4.48Å; V131-L248 HydrophobicContact CG2-CG 4.14Å
132	N	91.1	Very high	89.2	Confident	41 Å²	41	63.4 Å²	63.4	22%	0.219	36%	0.364	C	S	.	.	H	α-helix	trans	-65.1	-32.8	178.3	-73.5	-19.3	0	0	0	112.1	Y128 N129 K134 K157 F158	Y128-N132 VanDerWaalsContact O-CB 3.28Å; Y128-N132 WeakPolarHBondContact O-CB 3.49Å; Y128-N132 PolarHBondContact O-N 2.77Å; Y128-N132 PolarHBondContact O-ND2 3.06Å; N129-N132 PolarHBondContact O-N 3.11Å; N132-K134 VanDerWaalsContact C-N 3.33Å; N132-K134 PolarHBondContact O-N 3.48Å; N132-K157 PolarHBondContact O-NZ 3.41Å; N132-K157 WeakPolarHBondContact OD1-CB 3.47Å; N132-F158 PolarHBondContact ND2-O 3.27Å; N132-F158 PolarHBondContact OD1-O 2.89Å
133	A	92.3	Very high	87.9	Confident	88 Å²	88	69.8 Å²	69.8	73%	0.727	39%	0.389	S	S	*	.	H	α-helix	trans	-72.1	-18.3	177.3	0	0	0	0	0	114.7	N129 V131	N129-A133 WeakPolarHBondContact O-CB 3.36Å; N129-A133 PolarHBondContact O-N 3.1Å; V131-A133 VanDerWaalsContact C-N 3.27Å; V131-A133 PolarHBondContact O-N 2.98Å
134	K	91.1	Very high	86.3	Confident	96 Å²	96	68.2 Å²	68.2	42%	0.417	38%	0.379	S	S	.	.	S	Bend	trans	-68.8	154.4	177.4	-73.4	178.1	-177.9	-175.9	0	111.6	V131 N132 F139 K157	V131-K134 WeakPolarHBondContact O-CB 3.27Å; V131-K134 PolarHBondContact O-N 3.35Å; N132-K134 VanDerWaalsContact C-N 3.33Å; N132-K134 PolarHBondContact O-N 3.48Å; K134-F139 HydrophobicContact CB-CE2 3.66Å; K134-F139 HydrophobicContact CB-CZ 4.21Å; K134-F139 HydrophobicContact CD-CE2 4.29Å; K134-F139 HydrophobicContact CD-CZ 4.1Å; K134-K157 PolarHBondContact O-NZ 3.05Å
135	P	88.5	Confident	84.2	Confident	82 Å²	82	75.9 Å²	75.9	53%	0.532	41%	0.413	S	S	.	.			trans	-61.5	144.7	178.3	25.8	-35	0	0	0	112.2	S137 F139	P135-S137 PolarHBondContact O-N 2.85Å; P135-S137 VanDerWaalsContact O-N 3.15Å; P135-F139 WeakPolarHBondContact O-CD2 3.48Å
136	D	83.8	Confident	82.1	Confident	120 Å²	120	83.1 Å²	83.1	64%	0.642	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-65.9	-15.6	-175.8	-71	-22.4	0	0	0	114.1	Q138 F139 K157	D136-Q138 PolarHBondContact O-N 2.76Å; D136-Q138 VanDerWaalsContact O-N 3.16Å; D136-F139 PolarHBondContact O-N 2.94Å; D136-F139 VanDerWaalsContact O-N 3.08Å; D136-K157 IonicContact OD1-NZ 2.74Å; D136-K157 PolarHBondContact OD1-NZ 3.21Å
137	S	81.1	Confident	80.1	Confident	96 Å²	96	79.9 Å²	79.9	67%	0.671	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-61.2	-25.4	-177.2	58.4	0	0	0	0	114.4	P135	P135-S137 PolarHBondContact O-N 2.85Å; P135-S137 VanDerWaalsContact O-N 3.15Å
138	Q	80	Confident	78.2	Confident	119 Å²	119	84 Å²	84	56%	0.556	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-90.5	-7.7	-179.9	-65.4	-179.9	-13.1	0	0	113.2	D136	D136-Q138 PolarHBondContact O-N 2.76Å; D136-Q138 VanDerWaalsContact O-N 3.16Å
139	F	85	Confident	76.5	Confident	16 Å²	16	85.3 Å²	85.3	7%	0.07	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	155.3	-170.9	-63.6	-84.5	0	0	0	111	V131 K134 P135 D136 V155 K157	V131-F139 HydrophobicContact CG1-CD1 4.41Å; V131-F139 HydrophobicContact CG1-CE1 3.52Å; V131-F139 HydrophobicContact CG1-CZ 3.72Å; K134-F139 HydrophobicContact CB-CE2 3.66Å; K134-F139 HydrophobicContact CB-CZ 4.21Å; K134-F139 HydrophobicContact CD-CE2 4.29Å; K134-F139 HydrophobicContact CD-CZ 4.1Å; P135-F139 WeakPolarHBondContact O-CD2 3.48Å; D136-F139 PolarHBondContact O-N 2.94Å; D136-F139 VanDerWaalsContact O-N 3.08Å; F139-V155 HydrophobicContact CD1-CG2 3.52Å; F139-V155 HydrophobicContact CE1-CG2 3.65Å; F139-K157 HydrophobicContact CB-CG 4.16Å; F139-K157 HydrophobicContact CD1-CG 3.98Å; F139-K157 VanDerWaalsContact CD2-CE 3.42Å; F139-K157 HydrophobicContact CD2-CG 4.49Å; F139-K157 HydrophobicContact CG-CD 4.36Å; F139-K157 HydrophobicContact CG-CG 3.94Å
140	A	81.6	Confident	75.1	Confident	19 Å²	19	90.6 Å²	90.6	16%	0.157	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	143.1	173.2	0	0	0	0	0	110.3	C142 T149 K154 V155	A140-C142 PolarHBondContact O-N 2.87Å; A140-C142 VanDerWaalsContact O-N 3.14Å; A140-C142 PolarHBondContact O-SG 2.77Å; A140-T149 HydrophobicContact CB-CG2 3.32Å; A140-K154 HydrophobicContact CB-CB 3.83Å; A140-V155 PolarHBondContact N-O 3.17Å
141	N	77.4	Confident	74.2	Confident	134 Å²	134	88.1 Å²	88.1	72%	0.717	46%	0.464	S	S	*	.			trans	-82.3	91.1	172.4	-171	1.2	0	0	0	109.8	K143	N141-K143 PolarHBondContact O-N 2.83Å; N141-K143 WeakPolarHBondContact OD1-CB 3.19Å; N141-K143 PolarHBondContact OD1-N 2.79Å
142	C	75.9	Confident	73.5	Confident	22 Å²	22	91.9 Å²	91.9	15%	0.149	49%	0.487	C	S	.	.			trans	-90.5	25.2	-177.2	-50.3	0	0	0	0	113	A140 C156 A237	A140-C142 PolarHBondContact O-N 2.87Å; A140-C142 VanDerWaalsContact O-N 3.14Å; A140-C142 PolarHBondContact O-SG 2.77Å; C142-C156 HydrophobicContact CB-CB 3.65Å; C142-C156 WeakPolarHBondContact CB-SG 2.98Å; C142-C156 WeakPolarHBondContact SG-CA 3.46Å; C142-C156 WeakPolarHBondContact SG-CB 3.46Å; C142-C156 CovalentContact SG-SG 2Å; C142-C156 PolarHBondContact SG-SG 3.34Å; C142-A237 HydrophobicContact CB-CB 4.2Å
143	K	67.9	Low	73	Confident	182 Å²	182	96.2 Å²	96.2	79%	0.791	51%	0.51	S	S	*	.			trans	-89.9	102.7	174.3	-64.3	-179.9	-179.4	175.3	0	108.8	N141	N141-K143 PolarHBondContact O-N 2.83Å; N141-K143 WeakPolarHBondContact OD1-CB 3.19Å; N141-K143 PolarHBondContact OD1-N 2.79Å
144	G	61.3	Low	72.6	Confident	32 Å²	32	95.6 Å²	95.6	33%	0.33	49%	0.491	S	S	.	.	S	Bend	trans	138.8	179.5	171.2	0	0	0	0	0	114.1	E146	G144-E146 PolarHBondContact O-N 3.18Å
145	K	52	Low	72.5	Confident	197 Å²	197	91.4 Å²	91.4	86%	0.857	47%	0.473	S	S	*	.	S	Bend	trans	-73.1	-12.9	178.3	-68.5	-174	176.9	-178.3	0	113.5	G147	K145-G147 PolarHBondContact O-N 3.32Å; K145-G147 VanDerWaalsContact O-N 3.07Å
146	E	52	Low	72.4	Confident	159 Å²	159	87.6 Å²	87.6	74%	0.743	45%	0.449	S	S	*	.			trans	-84.4	53.1	172.2	-65.4	-172.3	-177.5	0	0	110.6	G144 E148	G144-E146 PolarHBondContact O-N 3.18Å; E146-E148 PolarHBondContact O-N 2.74Å
147	G	52.6	Low	72.7	Confident	5 Å²	5	83.8 Å²	83.8	5%	0.052	43%	0.426	C	S	.	.			trans	-69.8	35.1	-175.4	0	0	0	0	0	114.8	K145 A237	K145-G147 PolarHBondContact O-N 3.32Å; K145-G147 VanDerWaalsContact O-N 3.07Å; G147-A237 WeakPolarHBondContact O-CA 3.37Å; G147-A237 WeakPolarHBondContact O-CB 3.42Å; G147-A237 PolarHBondContact O-N 3.35Å
148	E	55.3	Low	73.1	Confident	149 Å²	149	79.3 Å²	79.3	70%	0.696	40%	0.395	S	S	*	.	S	Bend	trans	-118.5	117	170.9	-72	-177	170	0	0	108.1	E146 K150	E146-E148 PolarHBondContact O-N 2.74Å; E148-K150 VanDerWaalsContact C-N 3.32Å; E148-K150 PolarHBondContact O-N 2.89Å
149	T	58.3	Low	73.5	Confident	33 Å²	33	75 Å²	75	20%	0.202	38%	0.377	C	S	.	.			trans	-64.7	98.4	167.2	57.4	0	0	0	0	107	A140 D151	A140-T149 HydrophobicContact CB-CG2 3.32Å; T149-D151 PolarHBondContact O-N 2.83Å
150	K	64.5	Low	73.8	Confident	187 Å²	187	75.5 Å²	75.5	81%	0.813	38%	0.381	S	S	*	.	S	Bend	trans	-55.3	-22	175.2	-65.6	-177	-177.7	171.5	0	112.4	E148	E148-K150 VanDerWaalsContact C-N 3.32Å; E148-K150 PolarHBondContact O-N 2.89Å
151	D	74	Confident	74.2	Confident	61 Å²	61	81.9 Å²	81.9	33%	0.326	41%	0.407	S	S	.	.	S	Bend	trans	-99.6	113.1	177.6	-167.3	-20	0	0	0	109.4	T149 D153 K154	T149-D151 PolarHBondContact O-N 2.83Å; D151-D153 PolarHBondContact O-N 2.83Å; D151-D153 PolarHBondContact OD1-N 2.87Å; D151-K154 HydrophobicContact CB-CB 4.15Å; D151-K154 HydrophobicContact CB-CD 4Å; D151-K154 HydrophobicContact CB-CG 4.08Å; D151-K154 PolarHBondContact O-N 2.79Å; D151-K154 VanDerWaalsContact OD2-CD 3.29Å; D151-K154 WeakPolarHBondContact OD2-CD 3.31Å; D151-K154 WeakPolarHBondContact OD2-CE 3.42Å; D151-K154 WeakPolarHBondContact OD2-CG 3.31Å; D151-K154 IonicContact OD2-NZ 3.97Å; D151-K154 PolarHBondContact OD2-NZ 2.96Å
152	V	77.3	Confident	74.7	Confident	92 Å²	92	76.3 Å²	76.3	56%	0.558	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.9	-175.4	-177	0	0	0	0	111.8	L242 Q244	V152-L242 HydrophobicContact CG1-CD1 3.31Å; V152-Q244 PolarHBondContact O-NE2 2.87Å
153	D	81.1	Confident	75.5	Confident	131 Å²	131	75.4 Å²	75.4	70%	0.701	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-13.8	-178.2	-66.8	-30.6	0	0	0	113	D151	D151-D153 PolarHBondContact O-N 2.83Å; D151-D153 PolarHBondContact OD1-N 2.87Å
154	K	84.9	Confident	76.6	Confident	76 Å²	76	68.4 Å²	68.4	33%	0.33	35%	0.351	S	S	.	.			trans	-94.6	138.8	-176.7	-70.4	-176.5	-179.7	132.4	0	112.5	A140 D151 Q244	A140-K154 HydrophobicContact CB-CB 3.83Å; D151-K154 HydrophobicContact CB-CB 4.15Å; D151-K154 HydrophobicContact CB-CD 4Å; D151-K154 HydrophobicContact CB-CG 4.08Å; D151-K154 PolarHBondContact O-N 2.79Å; D151-K154 VanDerWaalsContact OD2-CD 3.29Å; D151-K154 WeakPolarHBondContact OD2-CD 3.31Å; D151-K154 WeakPolarHBondContact OD2-CE 3.42Å; D151-K154 WeakPolarHBondContact OD2-CG 3.31Å; D151-K154 IonicContact OD2-NZ 3.97Å; D151-K154 PolarHBondContact OD2-NZ 2.96Å; K154-Q244 PolarHBondContact O-NE2 2.98Å
155	V	87.9	Confident	78.1	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.042	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	153.6	-179.9	-57.7	0	0	0	0	111.8	F139 A140 Q244 Y247	F139-V155 HydrophobicContact CD1-CG2 3.52Å; F139-V155 HydrophobicContact CE1-CG2 3.65Å; A140-V155 PolarHBondContact N-O 3.17Å; V155-Q244 HydrophobicContact CG1-CB 3.37Å; V155-Q244 VanDerWaalsContact CG1-CD 3.48Å; V155-Q244 HydrophobicContact CG1-CG 4.02Å; V155-Y247 HydrophobicContact CG1-CD2 4Å; V155-Y247 HydrophobicContact CG1-CG 4.48Å
156	C	87.3	Confident	80.1	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.02	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	138.5	174.4	-59.9	0	0	0	0	111.9	C142 A237 Y238	C142-C156 HydrophobicContact CB-CB 3.65Å; C142-C156 WeakPolarHBondContact CB-SG 2.98Å; C142-C156 WeakPolarHBondContact SG-CA 3.46Å; C142-C156 WeakPolarHBondContact SG-CB 3.46Å; C142-C156 CovalentContact SG-SG 2Å; C142-C156 PolarHBondContact SG-SG 3.34Å; C156-A237 VanDerWaalsContact SG-C 3.55Å; C156-A237 PolarHBondContact SG-O 3.05Å; C156-Y238 HydrophobicContact CB-CD1 3.64Å; C156-Y238 HydrophobicContact CB-CE1 3.58Å; C156-Y238 HydrophobicContact CB-CG 4.25Å
157	K	88.8	Confident	82.1	Confident	40 Å²	40	54.3 Å²	54.3	17%	0.174	29%	0.285	C	S	.	.			trans	-75.5	136.7	165.2	-72.5	-177.2	175	-175.8	0	110.3	V131 N132 K134 D136 F139 P159 Y238	V131-K157 WeakPolarHBondContact O-CE 3.26Å; N132-K157 PolarHBondContact O-NZ 3.41Å; N132-K157 WeakPolarHBondContact OD1-CB 3.47Å; K134-K157 PolarHBondContact O-NZ 3.05Å; D136-K157 IonicContact OD1-NZ 2.74Å; D136-K157 PolarHBondContact OD1-NZ 3.21Å; F139-K157 HydrophobicContact CB-CG 4.16Å; F139-K157 HydrophobicContact CD1-CG 3.98Å; F139-K157 VanDerWaalsContact CD2-CE 3.42Å; F139-K157 HydrophobicContact CD2-CG 4.49Å; F139-K157 HydrophobicContact CG-CD 4.36Å; F139-K157 HydrophobicContact CG-CG 3.94Å; K157-P159 WeakPolarHBondContact O-CD 3.18Å; K157-Y238 PolarHBondContact O-OH 3.41Å
158	F	89.4	Confident	84	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	30%	0.302	C	S	.	.			trans	-100.5	111.3	175.1	-176.7	-93.5	0	0	0	110.1	Y128 N132 L160 V162 L163 Y235 Y238 P250 I251	Y128-F158 HydrophobicContact CD1-CB 4.02Å; Y128-F158 AromaticContact CD1-CD1 3.89Å; Y128-F158 HydrophobicContact CD1-CD1 3.89Å; Y128-F158 HydrophobicContact CD1-CG 4.34Å; Y128-F158 HydrophobicContact CE1-CB 4.1Å; Y128-F158 HydrophobicContact CE1-CD1 4Å; Y128-F158 HydrophobicContact CE1-CG 4.27Å; N132-F158 PolarHBondContact ND2-O 3.27Å; N132-F158 PolarHBondContact OD1-O 2.89Å; F158-L160 HydrophobicContact CD1-CD2 4.11Å; F158-L160 HydrophobicContact CE1-CD2 4.3Å; F158-L160 PolarHBondContact O-N 2.86Å; F158-V162 HydrophobicContact CE1-CG2 3.89Å; F158-V162 HydrophobicContact CE2-CG2 4.09Å; F158-V162 HydrophobicContact CZ-CG2 3.4Å; F158-V162 VanDerWaalsContact CZ-CG2 3.4Å; F158-L163 HydrophobicContact CE1-CD2 4.33Å; F158-L163 HydrophobicContact CZ-CD2 4.43Å; F158-Y235 AromaticContact CE2-CE1 3.93Å; F158-Y235 HydrophobicContact CE2-CE1 3.93Å; F158-Y238 HydrophobicContact CB-CE1 3.87Å; F158-Y238 AromaticContact CD2-CE1 3.97Å; F158-Y238 HydrophobicContact CD2-CE1 3.97Å; F158-Y238 AromaticContact CD2-CZ 3.82Å; F158-Y238 HydrophobicContact CG-CE1 4.43Å; F158-P250 HydrophobicContact CD2-CB 4.34Å; F158-P250 HydrophobicContact CE2-CB 4.31Å; F158-I251 HydrophobicContact CD1-CD1 4.24Å; F158-I251 HydrophobicContact CD1-CG1 3.81Å; F158-I251 HydrophobicContact CE1-CD1 3.77Å; F158-I251 HydrophobicContact CE1-CG1 3.21Å; F158-I251 HydrophobicContact CE2-CG1 4.49Å; F158-I251 HydrophobicContact CZ-CG1 3.61Å; F158-I251 VanDerWaalsContact CZ-O 3.32Å; F158-I251 WeakPolarHBondContact CZ-O 3.39Å
159	P	88.8	Confident	85.9	Confident	29 Å²	29	54.7 Å²	54.7	19%	0.188	31%	0.306	C	S	.	.			trans	-72.7	125.7	179.8	24.6	-27.6	0	0	0	110.9	K157 E161 V162	K157-P159 WeakPolarHBondContact O-CD 3.18Å; P159-E161 VanDerWaalsContact C-N 3.28Å; P159-E161 WeakPolarHBondContact CA-OE2 3.38Å; P159-E161 WeakPolarHBondContact CB-OE2 3.49Å; P159-E161 PolarHBondContact O-N 2.82Å; P159-V162 HydrophobicContact CB-CG1 4.47Å; P159-V162 HydrophobicContact CG-CG1 3.98Å; P159-V162 WeakPolarHBondContact O-CG2 3.4Å
160	L	91.7	Very high	87.5	Confident	26 Å²	26	56.1 Å²	56.1	14%	0.136	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-76.2	-15.9	-176.8	-65.8	-175.5	0	0	0	113.3	L125 Y128 N129 F158 V162 L163 I251	L125-L160 HydrophobicContact CB-CD1 4.34Å; L125-L160 HydrophobicContact CD2-CD2 3.93Å; Y128-L160 HydrophobicContact CD1-CD2 4.11Å; Y128-L160 HydrophobicContact CG-CD2 3.99Å; N129-L160 WeakPolarHBondContact OD1-CD1 3.42Å; F158-L160 HydrophobicContact CD1-CD2 4.11Å; F158-L160 HydrophobicContact CE1-CD2 4.3Å; F158-L160 PolarHBondContact O-N 2.86Å; L160-V162 PolarHBondContact O-N 2.92Å; L160-V162 VanDerWaalsContact O-N 3.15Å; L160-L163 HydrophobicContact CD2-CD1 4.09Å; L160-L163 WeakPolarHBondContact O-CB 3.49Å; L160-L163 WeakPolarHBondContact O-CG 3.22Å; L160-L163 PolarHBondContact O-N 2.82Å; L160-L163 VanDerWaalsContact O-N 3.12Å; L160-I251 HydrophobicContact CD2-CD1 4.23Å
161	E	89.7	Confident	88.9	Confident	152 Å²	152	50.2 Å²	50.2	71%	0.71	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-64.4	-21.7	-179.8	-55	75.1	-160.3	0	0	111.9	P159 L163 G164	P159-E161 VanDerWaalsContact C-N 3.28Å; P159-E161 WeakPolarHBondContact CA-OE2 3.38Å; P159-E161 WeakPolarHBondContact CB-OE2 3.49Å; P159-E161 PolarHBondContact O-N 2.82Å; E161-L163 PolarHBondContact O-N 2.96Å; E161-G164 PolarHBondContact O-N 2.8Å
162	V	89.1	Confident	90	Very high	17 Å²	17	47.3 Å²	47.3	10%	0.103	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-70.8	-13.5	178.2	-53.6	0	0	0	0	113.3	F158 P159 L160 G164 P226 F230	F158-V162 HydrophobicContact CE1-CG2 3.89Å; F158-V162 HydrophobicContact CE2-CG2 4.09Å; F158-V162 HydrophobicContact CZ-CG2 3.4Å; F158-V162 VanDerWaalsContact CZ-CG2 3.4Å; P159-V162 HydrophobicContact CB-CG1 4.47Å; P159-V162 HydrophobicContact CG-CG1 3.98Å; P159-V162 WeakPolarHBondContact O-CG2 3.4Å; L160-V162 PolarHBondContact O-N 2.92Å; L160-V162 VanDerWaalsContact O-N 3.15Å; V162-G164 PolarHBondContact O-N 3.49Å; V162-P226 HydrophobicContact CB-CB 4.26Å; V162-P226 HydrophobicContact CB-CG 4.41Å; V162-P226 HydrophobicContact CG2-CG 4.37Å; V162-F230 HydrophobicContact CG1-CE2 4.23Å; V162-F230 HydrophobicContact CG1-CZ 4.28Å
163	L	91.9	Very high	90.8	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-76.7	-2.6	178	-58.5	179	0	0	0	113.2	L125 F158 L160 E161 C166 L182 Y225 I251 A253	L125-L163 HydrophobicContact CD1-CD1 4.19Å; L125-L163 HydrophobicContact CD2-CD1 4.31Å; F158-L163 HydrophobicContact CE1-CD2 4.33Å; F158-L163 HydrophobicContact CZ-CD2 4.43Å; L160-L163 HydrophobicContact CD2-CD1 4.09Å; L160-L163 WeakPolarHBondContact O-CB 3.49Å; L160-L163 WeakPolarHBondContact O-CG 3.22Å; L160-L163 PolarHBondContact O-N 2.82Å; L160-L163 VanDerWaalsContact O-N 3.12Å; E161-L163 PolarHBondContact O-N 2.96Å; L163-C166 HydrophobicContact CB-CB 4.49Å; L163-C166 WeakPolarHBondContact O-CB 3.36Å; L163-C166 PolarHBondContact O-N 3.19Å; L163-C166 VanDerWaalsContact O-N 3.15Å; L163-L182 HydrophobicContact CD1-CD2 4.44Å; L163-Y225 WeakPolarHBondContact O-CB 3.35Å; L163-I251 HydrophobicContact CD1-CD1 3.79Å; L163-I251 HydrophobicContact CD2-CD1 4.09Å; L163-I251 HydrophobicContact CD2-CG1 4.1Å; L163-I251 HydrophobicContact CG-CD1 4.48Å; L163-A253 HydrophobicContact CD2-CB 4.1Å
164	G	90.6	Very high	91.5	Very high	35 Å²	35	37 Å²	37	36%	0.361	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	-123.7	173.1	0	0	0	0	0	112.7	E161 V162 C166 N167	E161-G164 PolarHBondContact O-N 2.8Å; V162-G164 PolarHBondContact O-N 3.49Å; G164-C166 PolarHBondContact O-N 3.36Å; G164-N167 PolarHBondContact O-ND2 2.97Å; G164-N167 VanDerWaalsContact O-ND2 3.15Å
165	P	93	Very high	91.8	Very high	35 Å²	35	35 Å²	35	23%	0.227	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.5	-178.3	31.4	-34.8	0	0	0	113.3	N167 N170 Y225	P165-N167 PolarHBondContact O-N 2.94Å; P165-N170 WeakPolarHBondContact O-CB 3.37Å; P165-N170 PolarHBondContact O-ND2 2.92Å; P165-Y225 VanDerWaalsContact CD-CE1 3.48Å; P165-Y225 HydrophobicContact CG-CD2 4.23Å; P165-Y225 HydrophobicContact CG-CE1 4.19Å; P165-Y225 HydrophobicContact CG-CE2 3.54Å
166	C	94.4	Very high	92.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.248	C	C	.	.			trans	-82.5	62.4	-176.6	-56.2	0	0	0	0	111.8	L163 G164 C180 A253	L163-C166 HydrophobicContact CB-CB 4.49Å; L163-C166 WeakPolarHBondContact O-CB 3.36Å; L163-C166 PolarHBondContact O-N 3.19Å; L163-C166 VanDerWaalsContact O-N 3.15Å; G164-C166 PolarHBondContact O-N 3.36Å; C166-C180 VanDerWaalsContact CA-SG 3.52Å; C166-C180 HydrophobicContact CB-CB 3.56Å; C166-C180 WeakPolarHBondContact CB-SG 3.42Å; C166-C180 WeakPolarHBondContact SG-CB 3.34Å; C166-C180 CovalentContact SG-SG 2.04Å; C166-C180 PolarHBondContact SG-SG 3.06Å; C166-A253 HydrophobicContact CB-CB 3.66Å
167	N	93.9	Very high	92.4	Very high	58 Å²	58	42.3 Å²	42.3	31%	0.31	25%	0.251	S	S	.	.	S	Bend	trans	-123.9	167	180	62.4	46.5	0	0	0	111.4	G164 P165 A169 N170 N171 Y172	G164-N167 PolarHBondContact O-ND2 2.97Å; G164-N167 VanDerWaalsContact O-ND2 3.15Å; P165-N167 PolarHBondContact O-N 2.94Å; N167-A169 VanDerWaalsContact C-N 3.28Å; N167-A169 PolarHBondContact O-N 2.92Å; N167-A169 WeakPolarHBondContact OD1-CB 3.22Å; N167-A169 PolarHBondContact OD1-N 3.32Å; N167-A169 VanDerWaalsContact OD1-N 3.16Å; N167-N170 PolarHBondContact O-N 3.36Å; N167-N170 PolarHBondContact OD1-N 3.01Å; N167-N171 PolarHBondContact O-N 3.37Å; N167-Y172 PolarHBondContact O-N 2.82Å
168	T	93.1	Very high	92.7	Very high	69 Å²	69	41.6 Å²	41.6	42%	0.423	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-57.8	-38.1	178	-51.5	0	0	0	0	112.5	D122 N170 N171 Y172	D122-T168 WeakPolarHBondContact OD1-CB 3.3Å; D122-T168 WeakPolarHBondContact OD1-CG2 3.44Å; D122-T168 PolarHBondContact OD1-OG1 2.98Å; T168-N170 VanDerWaalsContact C-N 3.27Å; T168-N170 PolarHBondContact O-N 2.94Å; T168-N171 PolarHBondContact O-N 2.91Å; T168-N171 VanDerWaalsContact O-N 3.07Å; T168-Y172 PolarHBondContact OG1-OH 3.37Å
169	A	93.4	Very high	93	Very high	93 Å²	93	41.5 Å²	41.5	77%	0.769	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-63.6	-31.6	-178	0	0	0	0	0	113.3	N167	N167-A169 VanDerWaalsContact C-N 3.28Å; N167-A169 PolarHBondContact O-N 2.92Å; N167-A169 WeakPolarHBondContact OD1-CB 3.22Å; N167-A169 PolarHBondContact OD1-N 3.32Å; N167-A169 VanDerWaalsContact OD1-N 3.16Å
170	N	92.7	Very high	93.4	Very high	62 Å²	62	40.1 Å²	40.1	33%	0.332	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-95.1	10.6	177	-72.8	-35.3	0	0	0	113.3	P165 N167 T168 Y172 G173	P165-N170 WeakPolarHBondContact O-CB 3.37Å; P165-N170 PolarHBondContact O-ND2 2.92Å; N167-N170 PolarHBondContact O-N 3.36Å; N167-N170 PolarHBondContact OD1-N 3.01Å; T168-N170 VanDerWaalsContact C-N 3.27Å; T168-N170 PolarHBondContact O-N 2.94Å; N170-Y172 PolarHBondContact O-N 3.17Å; N170-Y172 VanDerWaalsContact O-N 3.11Å; N170-G173 PolarHBondContact O-N 2.71Å
171	N	94.5	Very high	93.6	Very high	64 Å²	64	38.9 Å²	38.9	34%	0.342	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	49.4	35	-171.9	-67.6	-37.7	0	0	0	112.4	Y114 T118 N167 T168 G173 Y174	Y114-N171 HydrophobicContact CE2-CB 4.38Å; T118-N171 HydrophobicContact CG2-CB 4.13Å; N167-N171 PolarHBondContact O-N 3.37Å; T168-N171 PolarHBondContact O-N 2.91Å; T168-N171 VanDerWaalsContact O-N 3.07Å; N171-G173 PolarHBondContact O-N 3.1Å; N171-Y174 WeakPolarHBondContact O-CB 3.33Å; N171-Y174 PolarHBondContact O-N 3.47Å
172	Y	95.8	Very high	93.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	53	28.9	-177.1	-52.8	-86.5	0	0	0	113.7	T118 M121 D122 L125 N167 T168 N170 Y174 C180	T118-Y172 HydrophobicContact CG2-CD2 4.13Å; M121-Y172 HydrophobicContact CB-CD1 4.33Å; M121-Y172 HydrophobicContact CB-CD2 4.11Å; M121-Y172 HydrophobicContact CB-CE1 3.93Å; M121-Y172 HydrophobicContact CB-CE2 3.68Å; M121-Y172 HydrophobicContact CB-CG 4.4Å; M121-Y172 VanDerWaalsContact CE-CB 3.43Å; M121-Y172 HydrophobicContact CE-CD1 4.12Å; M121-Y172 HydrophobicContact CE-CD2 3.43Å; M121-Y172 VanDerWaalsContact CE-CD2 3.43Å; M121-Y172 HydrophobicContact CE-CE2 4.19Å; M121-Y172 HydrophobicContact CE-CG 3.38Å; M121-Y172 HydrophobicContact SD-CD1 3.78Å; M121-Y172 HydrophobicContact SD-CD2 4.13Å; M121-Y172 HydrophobicContact SD-CE1 4.29Å; M121-Y172 HydrophobicContact SD-CG 3.68Å; D122-Y172 PolarHBondContact N-OH 3.42Å; D122-Y172 VanDerWaalsContact OD1-CE2 3.28Å; D122-Y172 WeakPolarHBondContact OD1-CE2 3.45Å; D122-Y172 VanDerWaalsContact OD1-CZ 3.31Å; D122-Y172 PolarHBondContact OD1-OH 2.91Å; L125-Y172 HydrophobicContact CD1-CE1 3.68Å; L125-Y172 WeakPolarHBondContact CD1-OH 3.17Å; N167-Y172 PolarHBondContact O-N 2.82Å; T168-Y172 PolarHBondContact OG1-OH 3.37Å; N170-Y172 PolarHBondContact O-N 3.17Å; N170-Y172 VanDerWaalsContact O-N 3.11Å; Y172-Y174 WeakPolarHBondContact O-CD2 3.47Å; Y172-Y174 PolarHBondContact O-N 3.34Å; Y172-C180 WeakPolarHBondContact O-CB 3.44Å; Y172-C180 PolarHBondContact O-N 3.1Å; Y172-C180 PolarHBondContact O-SG 2.83Å; Y172-C180 VanDerWaalsContact O-SG 3.41Å
173	G	94.4	Very high	94.1	Very high	6 Å²	6	31.1 Å²	31.1	6%	0.062	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	75.4	-2.2	-180	0	0	0	0	0	115.8	N170 N171 G175 K176 G177 T178	N170-G173 PolarHBondContact O-N 2.71Å; N171-G173 PolarHBondContact O-N 3.1Å; G173-G175 PolarHBondContact O-N 3.02Å; G173-K176 PolarHBondContact O-N 2.68Å; G173-K176 VanDerWaalsContact O-N 3.08Å; G173-G177 PolarHBondContact O-N 3.06Å; G173-T178 CarbonylContact C-O 3.52Å; G173-T178 VanDerWaalsContact C-O 3.31Å; G173-T178 VanDerWaalsContact CA-O 3.23Å; G173-T178 WeakPolarHBondContact CA-O 3.29Å; G173-T178 CarbonylContact O-C 3.56Å; G173-T178 PolarHBondContact O-N 2.97Å; G173-T178 PolarHBondContact O-OG1 3.17Å
174	Y	95.2	Very high	94.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-59.5	-44.5	-179.3	-82.4	-103.2	0	0	0	112.3	P95 I104 Y106 Y117 T118 M121 N171 Y172 K176 G177 P179	P95-Y174 WeakPolarHBondContact CG-OH 3.38Å; I104-Y174 HydrophobicContact CG2-CE1 3.93Å; Y106-Y174 AromaticContact CD1-CD1 3.54Å; Y106-Y174 HydrophobicContact CD1-CD1 3.54Å; Y106-Y174 AromaticContact CD1-CE1 3.53Å; Y106-Y174 HydrophobicContact CD1-CE1 3.53Å; Y106-Y174 AromaticContact CD2-CD1 3.85Å; Y106-Y174 HydrophobicContact CD2-CD1 3.85Å; Y106-Y174 AromaticContact CE1-CD1 3.41Å; Y106-Y174 HydrophobicContact CE1-CD1 3.41Å; Y106-Y174 VanDerWaalsContact CE1-CD1 3.41Å; Y106-Y174 AromaticContact CE1-CE1 3.48Å; Y106-Y174 HydrophobicContact CE1-CE1 3.48Å; Y106-Y174 VanDerWaalsContact CE1-CE1 3.48Å; Y106-Y174 HydrophobicContact CE1-CG 4.42Å; Y106-Y174 AromaticContact CE2-CD1 3.76Å; Y106-Y174 HydrophobicContact CE2-CD1 3.76Å; Y106-Y174 HydrophobicContact CE2-CG 4.37Å; Y106-Y174 VanDerWaalsContact CE2-O 3.28Å; Y106-Y174 WeakPolarHBondContact CE2-O 3.32Å; Y106-Y174 AromaticContact CG-CD1 3.75Å; Y106-Y174 HydrophobicContact CG-CD1 3.75Å; Y106-Y174 HydrophobicContact CG-CE1 4.13Å; Y106-Y174 AromaticContact CZ-CD1 3.52Å; Y117-Y174 HydrophobicContact CD2-CE1 4.28Å; Y117-Y174 HydrophobicContact CG-CE1 4.04Å; T118-Y174 HydrophobicContact CG2-CD2 4.47Å; T118-Y174 HydrophobicContact CG2-CG 4.48Å; M121-Y174 HydrophobicContact CE-CD2 3.9Å; M121-Y174 HydrophobicContact CE-CE2 3.36Å; M121-Y174 HydrophobicContact SD-CE2 4.45Å; N171-Y174 WeakPolarHBondContact O-CB 3.33Å; N171-Y174 PolarHBondContact O-N 3.47Å; Y172-Y174 WeakPolarHBondContact O-CD2 3.47Å; Y172-Y174 PolarHBondContact O-N 3.34Å; Y174-K176 PolarHBondContact O-N 2.77Å; Y174-K176 VanDerWaalsContact O-N 3.13Å; Y174-G177 PolarHBondContact O-N 3.13Å; Y174-P179 HydrophobicContact CD1-CB 4.3Å; Y174-P179 HydrophobicContact CD2-CB 4.17Å; Y174-P179 HydrophobicContact CE1-CB 4.08Å; Y174-P179 HydrophobicContact CE2-CB 3.9Å; Y174-P179 HydrophobicContact CG-CB 4.36Å
175	G	92.8	Very high	94.2	Very high	34 Å²	34	32.6 Å²	32.6	35%	0.351	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-67	-12.1	178.5	0	0	0	0	0	115.1	G173	G173-G175 PolarHBondContact O-N 3.02Å
176	K	92.8	Very high	94.2	Very high	156 Å²	156	34.1 Å²	34.1	68%	0.678	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-99.9	-1.7	174.8	-64.9	-178.3	-174.7	173.8	0	112.7	G173 Y174 T178	G173-K176 PolarHBondContact O-N 2.68Å; G173-K176 VanDerWaalsContact O-N 3.08Å; Y174-K176 PolarHBondContact O-N 2.77Å; Y174-K176 VanDerWaalsContact O-N 3.13Å; K176-T178 PolarHBondContact O-N 3.23Å
177	G	93.6	Very high	94	Very high	8 Å²	8	39.2 Å²	39.2	8%	0.082	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	16.6	-169.9	0	0	0	0	0	113.6	G173 Y174 P179	G173-G177 PolarHBondContact O-N 3.06Å; Y174-G177 PolarHBondContact O-N 3.13Å; G177-P179 WeakPolarHBondContact O-CD 3.45Å
178	T	95.2	Very high	93.8	Very high	25 Å²	25	37.4 Å²	37.4	15%	0.153	21%	0.214	C	C	.	.			trans	-119.3	69.9	178.3	61	0	0	0	0	110.3	G173 K176 F256 K257	G173-T178 CarbonylContact C-O 3.52Å; G173-T178 VanDerWaalsContact C-O 3.31Å; G173-T178 VanDerWaalsContact CA-O 3.23Å; G173-T178 WeakPolarHBondContact CA-O 3.29Å; G173-T178 CarbonylContact O-C 3.56Å; G173-T178 PolarHBondContact O-N 2.97Å; G173-T178 PolarHBondContact O-OG1 3.17Å; K176-T178 PolarHBondContact O-N 3.23Å; T178-F256 CarbonylContact C-O 3.57Å; T178-F256 WeakPolarHBondContact CA-O 3.36Å; T178-F256 VanDerWaalsContact CB-O 3.28Å; T178-F256 WeakPolarHBondContact CB-O 3.28Å; T178-K257 WeakPolarHBondContact CG2-O 3.3Å
179	P	96.1	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.			trans	-65.6	143.3	-169	26.5	-30.3	0	0	0	111.5	Y106 Y174 G177 F256 I286 V288	Y106-P179 HydrophobicContact CE1-CB 3.87Å; Y106-P179 HydrophobicContact CE1-CG 4.03Å; Y106-P179 VanDerWaalsContact OH-CB 3.32Å; Y106-P179 WeakPolarHBondContact OH-CB 3.37Å; Y106-P179 WeakPolarHBondContact OH-CD 3.45Å; Y106-P179 VanDerWaalsContact OH-CG 3.28Å; Y106-P179 WeakPolarHBondContact OH-CG 3.42Å; Y174-P179 HydrophobicContact CD1-CB 4.3Å; Y174-P179 HydrophobicContact CD2-CB 4.17Å; Y174-P179 HydrophobicContact CE1-CB 4.08Å; Y174-P179 HydrophobicContact CE2-CB 3.9Å; Y174-P179 HydrophobicContact CG-CB 4.36Å; G177-P179 WeakPolarHBondContact O-CD 3.45Å; P179-F256 HydrophobicContact CG-CB 4.12Å; P179-F256 WeakPolarHBondContact O-CD2 3.49Å; P179-F256 PolarHBondContact O-N 3.03Å; P179-I286 HydrophobicContact CB-CD1 4.11Å; P179-I286 HydrophobicContact CG-CD1 3.4Å; P179-I286 VanDerWaalsContact CG-CD1 3.4Å; P179-I286 HydrophobicContact CG-CG1 4.48Å; P179-V288 HydrophobicContact CG-CG2 4.11Å
180	C	96.7	Very high	93.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.9	169.2	-66.5	0	0	0	0	111.3	C166 Y172 V254	C166-C180 VanDerWaalsContact CA-SG 3.52Å; C166-C180 HydrophobicContact CB-CB 3.56Å; C166-C180 WeakPolarHBondContact CB-SG 3.42Å; C166-C180 WeakPolarHBondContact SG-CB 3.34Å; C166-C180 CovalentContact SG-SG 2.04Å; C166-C180 PolarHBondContact SG-SG 3.06Å; Y172-C180 WeakPolarHBondContact O-CB 3.44Å; Y172-C180 PolarHBondContact O-N 3.1Å; Y172-C180 PolarHBondContact O-SG 2.83Å; Y172-C180 VanDerWaalsContact O-SG 3.41Å; C180-V254 CarbonylContact C-O 3.6Å; C180-V254 VanDerWaalsContact CA-O 3.31Å; C180-V254 WeakPolarHBondContact CA-O 3.2Å
181	V	96.3	Very high	93.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.1	171.3	178.2	0	0	0	0	108.7	F93 R94 I104 L183 V254 F256 F284	F93-V181 HydrophobicContact CB-CG1 3.8Å; F93-V181 HydrophobicContact CD2-CG1 3.98Å; F93-V181 HydrophobicContact CG-CG1 4.31Å; R94-V181 CarbonylContact O-C 3.59Å; R94-V181 WeakPolarHBondContact O-CG1 3.42Å; I104-V181 HydrophobicContact CD1-CG2 3.9Å; V181-L183 HydrophobicContact CG1-CD2 4.29Å; V181-V254 PolarHBondContact N-O 3.49Å; V181-V254 PolarHBondContact O-N 2.94Å; V181-F256 HydrophobicContact CB-CE2 4.13Å; V181-F256 HydrophobicContact CG2-CD2 4.35Å; V181-F256 HydrophobicContact CG2-CE2 3.69Å; V181-F284 HydrophobicContact CB-CZ 4.34Å; V181-F284 HydrophobicContact CG1-CE1 4.33Å; V181-F284 HydrophobicContact CG1-CE2 4.42Å; V181-F284 HydrophobicContact CG1-CZ 3.96Å; V181-F284 HydrophobicContact CG2-CE2 4.04Å; V181-F284 HydrophobicContact CG2-CZ 4.16Å
182	L	96	Very high	93	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118.8	176.9	-53.6	178.6	0	0	0	109.4	F93 R94 M121 Y124 L125 L163 V252 A253	F93-L182 CarbonylContact C-O 3.47Å; F93-L182 WeakPolarHBondContact CA-O 3.42Å; R94-L182 HydrophobicContact CB-CB 4.25Å; R94-L182 PolarHBondContact N-O 3.43Å; R94-L182 PolarHBondContact O-N 2.86Å; M121-L182 HydrophobicContact CG-CD1 4.44Å; M121-L182 HydrophobicContact SD-CG 4.47Å; Y124-L182 HydrophobicContact CD1-CD1 4.04Å; Y124-L182 HydrophobicContact CE1-CD1 4.36Å; L125-L182 HydrophobicContact CD1-CD1 4.31Å; L125-L182 HydrophobicContact CD2-CD1 3.97Å; L125-L182 HydrophobicContact CG-CD1 4.16Å; L163-L182 HydrophobicContact CD1-CD2 4.44Å; L182-V252 CarbonylContact C-O 3.31Å; L182-A253 HydrophobicContact CD2-CB 3.66Å
183	L	94.6	Very high	92.6	Very high	3 Å²	3	32 Å²	32	2%	0.016	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	142.7	171.4	-57.9	-178.4	0	0	0	110.3	F93 V181 V206 I251 V252 V254 C269 L282	F93-L183 HydrophobicContact CB-CD2 3.9Å; V181-L183 HydrophobicContact CG1-CD2 4.29Å; L183-V206 HydrophobicContact CD1-CB 4.23Å; L183-V206 HydrophobicContact CD1-CG2 4.09Å; L183-I251 WeakPolarHBondContact O-CA 3.34Å; L183-V252 PolarHBondContact N-O 3.31Å; L183-V252 PolarHBondContact O-N 3.27Å; L183-V254 HydrophobicContact CD1-CG2 3.52Å; L183-V254 HydrophobicContact CG-CG2 3.9Å; L183-C269 HydrophobicContact CD1-CB 4.37Å; L183-L282 HydrophobicContact CD2-CD2 3.94Å
184	K	92.8	Very high	92.3	Very high	55 Å²	55	34.4 Å²	34.4	24%	0.239	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	146	173.8	71.6	180	-173.6	175.1	0	110.3	L91 G92 Y124 I251	L91-K184 WeakPolarHBondContact CA-O 3.44Å; G92-K184 PolarHBondContact N-O 2.84Å; G92-K184 PolarHBondContact O-N 3.42Å; Y124-K184 WeakPolarHBondContact OH-CD 3.3Å; K184-I251 HydrophobicContact CB-CG2 4.03Å
185	V	91.7	Very high	91.9	Very high	15 Å²	15	36.3 Å²	36.3	9%	0.091	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	133.5	168	-178.5	0	0	0	0	108.5	P89 L91 W191 I204 I271	P89-V185 HydrophobicContact CB-CG1 3.68Å; P89-V185 HydrophobicContact CG-CG1 3.81Å; L91-V185 HydrophobicContact CD2-CG2 4.05Å; V185-W191 HydrophobicContact CG1-CH2 4.37Å; V185-W191 HydrophobicContact CG1-CZ3 4.29Å; V185-I204 HydrophobicContact CG2-CG2 4.43Å; V185-I271 HydrophobicContact CG2-CD1 4.33Å
186	N	92.2	Very high	91.6	Very high	66 Å²	66	38.7 Å²	38.7	35%	0.353	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-65	137.8	179.4	-73.2	-22.5	0	0	0	110.9	P89 G90 V188	P89-N186 WeakPolarHBondContact CB-O 3.5Å; G90-N186 WeakPolarHBondContact O-CB 3.46Å; G90-N186 PolarHBondContact O-N 3.39Å; N186-V188 PolarHBondContact O-N 3.04Å
187	K	91	Very high	91.2	Very high	108 Å²	108	36.3 Å²	36.3	47%	0.47	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-71.5	120.6	-178.6	-56.5	-176.3	-177.1	-177.6	0	109.4	Y241 Y247	K187-Y241 HydrophobicContact CB-CD1 4.05Å; K187-Y241 HydrophobicContact CB-CE1 4.4Å; K187-Y241 HydrophobicContact CB-CG 4.36Å; K187-Y247 HydrophobicContact CD-CD1 3.86Å; K187-Y247 HydrophobicContact CD-CE1 3.79Å; K187-Y247 HydrophobicContact CG-CE1 4Å; K187-Y247 PolarHBondContact NZ-O 2.95Å
188	V	89.9	Confident	90.6	Very high	19 Å²	19	39.3 Å²	39.3	12%	0.115	21%	0.205	C	C	.	.			trans	-122	128.1	173.8	176.6	0	0	0	0	108.3	F87 P89 N186 G190 W191	F87-V188 HydrophobicContact CD2-CG1 3.98Å; F87-V188 HydrophobicContact CE2-CG1 4.35Å; P89-V188 HydrophobicContact CB-CG2 3.83Å; N186-V188 PolarHBondContact O-N 3.04Å; V188-G190 PolarHBondContact O-N 3.05Å; V188-W191 HydrophobicContact CB-CB 3.74Å; V188-W191 HydrophobicContact CB-CG 4.39Å; V188-W191 HydrophobicContact CG1-CB 3.92Å; V188-W191 WeakPolarHBondContact O-CB 3.5Å; V188-W191 PolarHBondContact O-N 2.88Å
189	F	89.8	Confident	89.9	Confident	39 Å²	39	44 Å²	44	17%	0.171	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-61.5	125.8	-176.4	-172.5	-83.4	0	0	0	110.9	N74 Q75 P76 T79 F87 W191 Y241 L242	N74-F189 WeakPolarHBondContact O-CE2 3.48Å; Q75-F189 HydrophobicContact CB-CD1 4.38Å; Q75-F189 HydrophobicContact CB-CD2 4.48Å; Q75-F189 HydrophobicContact CB-CE1 3.7Å; Q75-F189 HydrophobicContact CB-CE2 3.8Å; Q75-F189 HydrophobicContact CB-CZ 3.37Å; P76-F189 HydrophobicContact CG-CB 4.03Å; P76-F189 HydrophobicContact CG-CG 4.28Å; T79-F189 HydrophobicContact CG2-CD1 3.71Å; T79-F189 HydrophobicContact CG2-CE1 4.36Å; T79-F189 HydrophobicContact CG2-CG 4.44Å; F87-F189 WeakPolarHBondContact CE2-O 3.3Å; F189-W191 PolarHBondContact O-N 2.92Å; F189-Y241 CarbonylContact C-O 3.5Å; F189-Y241 WeakPolarHBondContact CA-O 3.41Å; F189-L242 HydrophobicContact CE1-CD2 4.27Å; F189-L242 VanDerWaalsContact CE2-C 3.41Å; F189-L242 WeakPolarHBondContact CE2-O 3.45Å; F189-L242 HydrophobicContact CZ-CD2 4.25Å
190	G	88.2	Confident	89	Confident	27 Å²	27	51.4 Å²	51.4	28%	0.278	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-1.7	180	0	0	0	0	0	115.3	F87 V188 Y241	F87-G190 VanDerWaalsContact CZ-C 3.5Å; F87-G190 VanDerWaalsContact CZ-O 3.27Å; F87-G190 WeakPolarHBondContact CZ-O 3.34Å; V188-G190 PolarHBondContact O-N 3.05Å; G190-Y241 PolarHBondContact N-O 3.45Å
191	W	89.6	Confident	88	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.008	28%	0.282	C	S	.	.			trans	-70.7	132.6	-175.9	-178.7	83.8	0	0	0	112.6	F87 P89 V185 V188 F189 P193 I204 Y239 P240 V274 N276	F87-W191 AromaticContact CD1-CD1 3.81Å; F87-W191 HydrophobicContact CE1-CB 4.43Å; F87-W191 AromaticContact CE1-CD1 3.94Å; F87-W191 HydrophobicContact CE2-CB 4.1Å; F87-W191 HydrophobicContact CZ-CB 4.09Å; F87-W191 PolarHBondContact O-NE1 3.39Å; P89-W191 HydrophobicContact CG-CD2 3.71Å; P89-W191 HydrophobicContact CG-CE3 4.12Å; P89-W191 HydrophobicContact CG-CG 4.28Å; P89-W191 HydrophobicContact CG-CH2 3.81Å; P89-W191 HydrophobicContact CG-CZ2 3.39Å; P89-W191 HydrophobicContact CG-CZ3 4.16Å; V185-W191 HydrophobicContact CG1-CH2 4.37Å; V185-W191 HydrophobicContact CG1-CZ3 4.29Å; V188-W191 HydrophobicContact CB-CB 3.74Å; V188-W191 HydrophobicContact CB-CG 4.39Å; V188-W191 HydrophobicContact CG1-CB 3.92Å; V188-W191 WeakPolarHBondContact O-CB 3.5Å; V188-W191 PolarHBondContact O-N 2.88Å; F189-W191 PolarHBondContact O-N 2.92Å; W191-P193 HydrophobicContact CH2-CB 3.66Å; W191-P193 HydrophobicContact CH2-CG 4.37Å; W191-P193 HydrophobicContact CZ2-CB 4.08Å; W191-P193 HydrophobicContact CZ3-CB 4.13Å; W191-P193 HydrophobicContact CZ3-CG 4.36Å; W191-I204 HydrophobicContact CH2-CD1 3.79Å; W191-I204 HydrophobicContact CZ3-CD1 4.05Å; W191-Y239 AromaticContact CE3-CD1 3.63Å; W191-Y239 HydrophobicContact CE3-CD1 3.63Å; W191-Y239 AromaticContact CE3-CE1 3.69Å; W191-Y239 HydrophobicContact CE3-CE1 3.69Å; W191-Y239 HydrophobicContact CE3-CG 4.26Å; W191-Y239 AromaticContact CZ3-CD1 3.74Å; W191-Y239 HydrophobicContact CZ3-CD1 3.74Å; W191-Y239 HydrophobicContact CZ3-CD2 4.34Å; W191-Y239 AromaticContact CZ3-CE1 3.48Å; W191-Y239 HydrophobicContact CZ3-CE1 3.48Å; W191-Y239 VanDerWaalsContact CZ3-CE1 3.48Å; W191-Y239 HydrophobicContact CZ3-CE2 4.13Å; W191-Y239 HydrophobicContact CZ3-CG 4.16Å; W191-Y239 AromaticContact CZ3-CZ 3.7Å; W191-P240 WeakPolarHBondContact O-CA 3.32Å; W191-V274 HydrophobicContact CH2-CG1 4.49Å; W191-V274 HydrophobicContact CZ2-CG1 3.97Å; W191-N276 PolarHBondContact NE1-ND2 3.3Å; W191-N276 VanDerWaalsContact NE1-ND2 3.19Å; W191-N276 PolarHBondContact NE1-O 2.97Å
192	M	87.8	Confident	87.1	Confident	89 Å²	89	56.5 Å²	56.5	44%	0.438	30%	0.303	S	S	.	.			trans	-128.7	129.9	175.6	-164.1	171.6	-166.6	0	0	109.1	S194 N276	M192-S194 PolarHBondContact O-N 3.49Å; M192-N276 PolarHBondContact O-ND2 3.39Å
193	P	87.5	Confident	86.3	Confident	18 Å²	18	58.1 Å²	58.1	12%	0.117	31%	0.312	C	S	.	.			trans	-66.6	125.2	-177.3	25.8	-33.7	0	0	0	111.4	W191 I195 I204 Y239 V274	W191-P193 HydrophobicContact CH2-CB 3.66Å; W191-P193 HydrophobicContact CH2-CG 4.37Å; W191-P193 HydrophobicContact CZ2-CB 4.08Å; W191-P193 HydrophobicContact CZ3-CB 4.13Å; W191-P193 HydrophobicContact CZ3-CG 4.36Å; P193-I195 HydrophobicContact CB-CD1 4.34Å; P193-I204 HydrophobicContact CB-CD1 3.91Å; P193-I204 HydrophobicContact CB-CG1 3.91Å; P193-I204 HydrophobicContact CG-CD1 4.09Å; P193-I204 HydrophobicContact CG-CG1 4.31Å; P193-Y239 HydrophobicContact CG-CD2 4.06Å; P193-V274 HydrophobicContact CB-CG1 4.23Å
194	S	88.2	Confident	85.9	Confident	57 Å²	57	59 Å²	59	40%	0.399	32%	0.316	S	S	.	.			trans	-92.7	103.6	170	-176.8	0	0	0	0	109.2	M192 E196 V274 L275 N276	M192-S194 PolarHBondContact O-N 3.49Å; S194-E196 PolarHBondContact O-N 2.88Å; S194-V274 WeakPolarHBondContact O-CA 3.43Å; S194-L275 PolarHBondContact O-N 2.92Å; S194-N276 WeakPolarHBondContact CB-OD1 3.27Å; S194-N276 PolarHBondContact N-OD1 3.38Å
195	I	87.3	Confident	85.6	Confident	39 Å²	39	58 Å²	58	20%	0.2	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-72.1	126.3	-175	-57.6	-58	0	0	0	110.6	P193 P198 S201 N273 V274	P193-I195 HydrophobicContact CB-CD1 4.34Å; I195-P198 HydrophobicContact CG2-CB 4.29Å; I195-S201 VanDerWaalsContact CG2-O 3.31Å; I195-S201 WeakPolarHBondContact CG2-O 3.48Å; I195-N273 WeakPolarHBondContact CA-O 3.42Å; I195-V274 HydrophobicContact CD1-CG2 4.41Å
196	E	85.8	Confident	85.6	Confident	85 Å²	85	58.5 Å²	58.5	40%	0.397	32%	0.317	S	S	.	.	S	Bend	trans	-73.7	-46.2	-178.3	-174.6	-173.1	-171.2	0	0	112.1	S194 P198 N273 L275	S194-E196 PolarHBondContact O-N 2.88Å; E196-P198 WeakPolarHBondContact O-CD 3.22Å; E196-N273 PolarHBondContact N-O 3.24Å; E196-N273 VanDerWaalsContact N-O 3.1Å; E196-L275 HydrophobicContact CB-CD2 4.06Å; E196-L275 HydrophobicContact CB-CG 3.97Å; E196-L275 HydrophobicContact CG-CD2 3.81Å; E196-L275 HydrophobicContact CG-CG 4.24Å
197	R	84.9	Confident	85.6	Confident	105 Å²	105	57.6 Å²	57.6	40%	0.396	32%	0.315	S	S	.	.			trans	-124.6	73.6	-176.9	-61.6	-176.5	-165.5	70.4	14.4	110.8	S199 Q200 S201 N273	R197-S199 PolarHBondContact O-N 2.93Å; R197-S199 VanDerWaalsContact O-N 3.08Å; R197-Q200 HydrophobicContact CB-CB 4.31Å; R197-Q200 HydrophobicContact CB-CG 4.31Å; R197-Q200 PolarHBondContact O-N 3.14Å; R197-S201 PolarHBondContact O-N 2.89Å; R197-N273 PolarHBondContact N-OD1 3.32Å
198	P	81.4	Confident	85.8	Confident	71 Å²	71	53 Å²	53	46%	0.461	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.6	179.4	24.2	-34	0	0	0	112.7	I195 E196 Q200 N202	I195-P198 HydrophobicContact CG2-CB 4.29Å; E196-P198 WeakPolarHBondContact O-CD 3.22Å; P198-Q200 VanDerWaalsContact C-N 3.26Å; P198-Q200 PolarHBondContact O-N 3.47Å; P198-N202 VanDerWaalsContact CA-OD1 3.3Å; P198-N202 WeakPolarHBondContact CA-OD1 3.34Å; P198-N202 WeakPolarHBondContact CB-OD1 3.37Å; P198-N202 PolarHBondContact O-OD1 3.41Å; P198-N202 VanDerWaalsContact O-OD1 3.05Å
199	S	79.6	Confident	86	Confident	125 Å²	125	53.9 Å²	53.9	87%	0.874	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-23.2	175.6	-45.9	0	0	0	0	114.4	R197	R197-S199 PolarHBondContact O-N 2.93Å; R197-S199 VanDerWaalsContact O-N 3.08Å
200	Q	77.9	Confident	86.3	Confident	155 Å²	155	52.2 Å²	52.2	72%	0.724	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-44.7	-179.4	-67.8	-178.3	-0.1	0	0	111.9	R197 P198	R197-Q200 HydrophobicContact CB-CB 4.31Å; R197-Q200 HydrophobicContact CB-CG 4.31Å; R197-Q200 PolarHBondContact O-N 3.14Å; P198-Q200 VanDerWaalsContact C-N 3.26Å; P198-Q200 PolarHBondContact O-N 3.47Å
201	S	76.1	Confident	86.7	Confident	25 Å²	25	54.8 Å²	54.8	18%	0.175	30%	0.302	C	S	.	.			trans	-157	134.3	180	175.2	0	0	0	0	108.6	I195 R197 D203 N273	I195-S201 VanDerWaalsContact CG2-O 3.31Å; I195-S201 WeakPolarHBondContact CG2-O 3.48Å; R197-S201 PolarHBondContact O-N 2.89Å; S201-D203 PolarHBondContact OG-N 2.85Å; S201-D203 VanDerWaalsContact OG-N 3.12Å; S201-D203 PolarHBondContact OG-O 3.41Å; S201-N273 PolarHBondContact O-ND2 2.98Å
202	N	76.7	Confident	86.9	Confident	81 Å²	81	58.9 Å²	58.9	43%	0.433	32%	0.324	S	S	.	.	S	Bend	trans	-88.3	8.1	171.3	-74.7	-21.5	0	0	0	112.7	P198 Q234	P198-N202 VanDerWaalsContact CA-OD1 3.3Å; P198-N202 WeakPolarHBondContact CA-OD1 3.34Å; P198-N202 WeakPolarHBondContact CB-OD1 3.37Å; P198-N202 PolarHBondContact O-OD1 3.41Å; P198-N202 VanDerWaalsContact O-OD1 3.05Å; N202-Q234 HydrophobicContact CB-CG 4.49Å
203	D	79.7	Confident	87.3	Confident	36 Å²	36	59.2 Å²	59.2	19%	0.193	34%	0.335	C	S	.	.	S	Bend	trans	-111.6	154.2	-175.8	-67.2	-41.9	0	0	0	112.5	S201 L205 Y235 N273	S201-D203 PolarHBondContact OG-N 2.85Å; S201-D203 VanDerWaalsContact OG-N 3.12Å; S201-D203 PolarHBondContact OG-O 3.41Å; D203-L205 PolarHBondContact O-N 3.28Å; D203-Y235 HydrophobicContact CB-CD2 4.19Å; D203-Y235 PolarHBondContact OD1-N 2.92Å; D203-N273 PolarHBondContact O-ND2 3.02Å
204	I	85.8	Confident	87.6	Confident	22 Å²	22	60.8 Å²	60.8	11%	0.113	35%	0.35	C	S	.	.			trans	-65.8	121.1	168.7	-54.1	173	0	0	0	107.4	V185 W191 P193 Y239 I271 V274	V185-I204 HydrophobicContact CG2-CG2 4.43Å; W191-I204 HydrophobicContact CH2-CD1 3.79Å; W191-I204 HydrophobicContact CZ3-CD1 4.05Å; P193-I204 HydrophobicContact CB-CD1 3.91Å; P193-I204 HydrophobicContact CB-CG1 3.91Å; P193-I204 HydrophobicContact CG-CD1 4.09Å; P193-I204 HydrophobicContact CG-CG1 4.31Å; I204-Y239 HydrophobicContact CD1-CD2 4.43Å; I204-Y239 HydrophobicContact CD1-CE2 3.61Å; I204-I271 HydrophobicContact CG2-CG2 3.67Å; I204-V274 HydrophobicContact CB-CG2 4.06Å; I204-V274 HydrophobicContact CG1-CG2 3.81Å; I204-V274 HydrophobicContact CG2-CG2 3.83Å
205	L	87.7	Confident	88	Confident	35 Å²	35	58.6 Å²	58.6	18%	0.183	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.5	179.7	-62	-176.8	0	0	0	109.8	D203 I271 S272 N273	D203-L205 PolarHBondContact O-N 3.28Å; L205-I271 CarbonylContact O-C 3.54Å; L205-I271 WeakPolarHBondContact O-CA 3.42Å; L205-S272 VanDerWaalsContact CB-OG 3.24Å; L205-S272 WeakPolarHBondContact CB-OG 3.35Å; L205-S272 PolarHBondContact N-O 3.48Å; L205-S272 VanDerWaalsContact N-O 3.11Å; L205-S272 PolarHBondContact O-N 3.2Å; L205-S272 PolarHBondContact O-OG 2.95Å; L205-N273 HydrophobicContact CB-CB 4.27Å; L205-N273 HydrophobicContact CD1-CB 3.97Å; L205-N273 HydrophobicContact CG-CB 3.95Å
206	V	90.5	Very high	88.4	Confident	25 Å²	25	61.6 Å²	61.6	15%	0.152	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	140.1	172	-65.2	0	0	0	0	109.5	L91 L183 Y224 V252 T270	L91-V206 HydrophobicContact CD1-CG1 4.36Å; L91-V206 HydrophobicContact CD2-CG1 4.02Å; L183-V206 HydrophobicContact CD1-CB 4.23Å; L183-V206 HydrophobicContact CD1-CG2 4.09Å; V206-Y224 HydrophobicContact CG2-CD1 4.42Å; V206-V252 HydrophobicContact CG2-CB 4.06Å; V206-V252 HydrophobicContact CG2-CG1 3.77Å; V206-V252 HydrophobicContact CG2-CG2 4.19Å; V206-T270 WeakPolarHBondContact CA-O 3.36Å
207	S	92.5	Very high	88.8	Confident	47 Å²	47	65.1 Å²	65.1	33%	0.329	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	132.8	178.1	46.6	0	0	0	0	109.7	C269 T270	S207-C269 CarbonylContact O-C 3.55Å; S207-C269 VanDerWaalsContact O-CA 3.3Å; S207-C269 WeakPolarHBondContact O-CA 3.48Å; S207-T270 PolarHBondContact N-O 3.17Å; S207-T270 PolarHBondContact O-N 2.98Å; S207-T270 PolarHBondContact O-OG1 2.97Å; S207-T270 PolarHBondContact OG-OG1 3.47Å
208	C	95.2	Very high	89.3	Confident	12 Å²	12	61.2 Å²	61.2	8%	0.081	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.9	174	-57.3	0	0	0	0	110.6	L222 Y224 V267 K268 C269	C208-L222 HydrophobicContact CB-CD1 3.93Å; C208-L222 WeakPolarHBondContact O-CD1 3.34Å; C208-Y224 PolarHBondContact N-OH 2.93Å; C208-Y224 PolarHBondContact O-OH 3.43Å; C208-V267 HydrophobicContact CB-CG1 4.12Å; C208-K268 CarbonylContact C-O 3.49Å; C208-K268 WeakPolarHBondContact CA-O 3.42Å; C208-C269 HydrophobicContact CB-CB 4.13Å; C208-C269 WeakPolarHBondContact CB-SG 3.43Å; C208-C269 WeakPolarHBondContact SG-CB 3.4Å; C208-C269 CovalentContact SG-SG 2.04Å; C208-C269 PolarHBondContact SG-SG 2.94Å
209	S	95.1	Very high	90	Very high	36 Å²	36	58 Å²	58	25%	0.252	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	171.6	178	76.5	0	0	0	0	109.7	E216 K268	S209-E216 VanDerWaalsContact CB-OE2 3.3Å; S209-E216 WeakPolarHBondContact CB-OE2 3.4Å; S209-K268 PolarHBondContact N-O 2.87Å; S209-K268 WeakPolarHBondContact O-CG 3.46Å; S209-K268 PolarHBondContact O-N 3.31Å; S209-K268 VanDerWaalsContact OG-CE 3.22Å; S209-K268 WeakPolarHBondContact OG-CE 3.27Å; S209-K268 WeakPolarHBondContact OG-CG 3.08Å
210	G	95.6	Very high	90.5	Very high	4 Å²	4	53.6 Å²	53.6	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	150.4	167.3	0	0	0	0	0	111.5	E216 L266 K268	G210-E216 PolarHBondContact N-OE2 3.28Å; G210-L266 CarbonylContact C-O 3.39Å; G210-L266 WeakPolarHBondContact CA-O 3.39Å; G210-K268 WeakPolarHBondContact O-CE 3.35Å
211	Q	95.2	Very high	91.3	Very high	82 Å²	82	49.4 Å²	49.4	38%	0.383	29%	0.291	S	S	.	.	S	Bend	trans	-73	-40.8	176.2	-172.2	174.7	-12.1	0	0	111.6	L266	Q211-L266 HydrophobicContact CB-CB 3.7Å; Q211-L266 PolarHBondContact N-O 3.27Å
212	N	95.3	Very high	92.2	Very high	88 Å²	88	50.2 Å²	50.2	47%	0.471	29%	0.293	S	S	.	.	S	Bend	trans	-118.7	170.3	176.4	-49.6	-65.1	0	0	0	111.2	A214 D215 E216	N212-A214 VanDerWaalsContact C-N 3.25Å; N212-A214 PolarHBondContact O-N 3.32Å; N212-D215 WeakPolarHBondContact CB-OD2 3.32Å; N212-D215 PolarHBondContact N-OD2 3.48Å; N212-D215 VanDerWaalsContact N-OD2 3.17Å; N212-D215 PolarHBondContact ND2-OD2 2.84Å; N212-D215 PolarHBondContact O-N 3.31Å; N212-E216 PolarHBondContact O-N 2.89Å
213	S	95.5	Very high	93	Very high	96 Å²	96	47 Å²	47	67%	0.671	28%	0.278	S	S	*	.	H	α-helix	trans	-56.6	-38.3	176.8	54.4	0	0	0	0	113	E216 E217	S213-E216 PolarHBondContact O-N 3.45Å; S213-E217 WeakPolarHBondContact O-CG 3.32Å; S213-E217 PolarHBondContact O-N 2.95Å
214	A	94.8	Very high	93.7	Very high	51 Å²	51	48.1 Å²	48.1	42%	0.421	28%	0.28	S	S	.	.	H	α-helix	trans	-64.9	-39.8	175.8	0	0	0	0	0	112.2	N212 E217 N218	N212-A214 VanDerWaalsContact C-N 3.25Å; N212-A214 PolarHBondContact O-N 3.32Å; A214-E217 PolarHBondContact O-N 3.48Å; A214-N218 WeakPolarHBondContact O-CB 3.21Å; A214-N218 PolarHBondContact O-N 3.47Å; A214-N218 VanDerWaalsContact O-N 3.09Å; A214-N218 PolarHBondContact O-ND2 2.92Å
215	D	96.2	Very high	94	Very high	11 Å²	11	49.5 Å²	49.5	6%	0.059	28%	0.284	C	S	.	.	H	α-helix	trans	-68.7	-37.7	178.2	-59.6	-62.5	0	0	0	111.2	N212 E217 N218 I219 I265 L266	N212-D215 WeakPolarHBondContact CB-OD2 3.32Å; N212-D215 PolarHBondContact N-OD2 3.48Å; N212-D215 VanDerWaalsContact N-OD2 3.17Å; N212-D215 PolarHBondContact ND2-OD2 2.84Å; N212-D215 PolarHBondContact O-N 3.31Å; D215-E217 VanDerWaalsContact C-N 3.28Å; D215-E217 PolarHBondContact O-N 2.86Å; D215-N218 PolarHBondContact O-N 2.84Å; D215-N218 VanDerWaalsContact O-N 3.14Å; D215-I219 WeakPolarHBondContact O-CB 3.44Å; D215-I219 PolarHBondContact O-N 3.48Å; D215-I265 HydrophobicContact CB-CG2 4.24Å; D215-L266 WeakPolarHBondContact CB-O 3.46Å; D215-L266 PolarHBondContact OD1-N 2.75Å
216	E	94.8	Very high	94	Very high	101 Å²	101	48.9 Å²	48.9	47%	0.472	28%	0.282	S	S	.	.	H	α-helix	trans	-62.6	-35.3	176	-167.7	66	-157.3	0	0	112.1	S209 G210 N212 S213 I219	S209-E216 VanDerWaalsContact CB-OE2 3.3Å; S209-E216 WeakPolarHBondContact CB-OE2 3.4Å; G210-E216 PolarHBondContact N-OE2 3.28Å; N212-E216 PolarHBondContact O-N 2.89Å; S213-E216 PolarHBondContact O-N 3.45Å; E216-I219 WeakPolarHBondContact O-CG2 3.43Å
217	E	94.7	Very high	93.3	Very high	160 Å²	160	51.2 Å²	51.2	75%	0.748	30%	0.3	S	S	*	.	H	α-helix	trans	-74.7	-31.9	174.2	-70.1	175.9	-166	0	0	112.4	S213 A214 D215	S213-E217 WeakPolarHBondContact O-CG 3.32Å; S213-E217 PolarHBondContact O-N 2.95Å; A214-E217 PolarHBondContact O-N 3.48Å; D215-E217 VanDerWaalsContact C-N 3.28Å; D215-E217 PolarHBondContact O-N 2.86Å
218	N	95.6	Very high	92	Very high	22 Å²	22	57.1 Å²	57.1	12%	0.118	32%	0.32	C	S	.	.	H	α-helix	trans	-89.1	-22	-175	-65.2	-36	0	0	0	113.9	A214 D215 G220 K260 I265	A214-N218 WeakPolarHBondContact O-CB 3.21Å; A214-N218 PolarHBondContact O-N 3.47Å; A214-N218 VanDerWaalsContact O-N 3.09Å; A214-N218 PolarHBondContact O-ND2 2.92Å; D215-N218 PolarHBondContact O-N 2.84Å; D215-N218 VanDerWaalsContact O-N 3.14Å; N218-G220 VanDerWaalsContact C-N 3.32Å; N218-G220 PolarHBondContact O-N 2.96Å; N218-K260 HydrophobicContact CB-CB 4.06Å; N218-K260 HydrophobicContact CB-CD 4.29Å; N218-K260 WeakPolarHBondContact O-CB 3.3Å; N218-K260 PolarHBondContact O-N 3.47Å; N218-K260 WeakPolarHBondContact OD1-CD 3.3Å; N218-K260 PolarHBondContact OD1-NZ 3.39Å; N218-I265 HydrophobicContact CB-CD1 4.26Å; N218-I265 HydrophobicContact CB-CG1 3.83Å; N218-I265 VanDerWaalsContact O-CD1 3.27Å; N218-I265 WeakPolarHBondContact O-CD1 3.44Å
219	I	94.9	Very high	90	Very high	4 Å²	4	63 Å²	63	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-66.6	-31.8	-177.2	-163.4	171.8	0	0	0	113.1	D215 E216 L222 F256 I265 V267	D215-I219 WeakPolarHBondContact O-CB 3.44Å; D215-I219 PolarHBondContact O-N 3.48Å; E216-I219 WeakPolarHBondContact O-CG2 3.43Å; I219-L222 HydrophobicContact CD1-CD1 3.99Å; I219-L222 HydrophobicContact CD1-CD2 4.31Å; I219-L222 HydrophobicContact CD1-CG 4.49Å; I219-L222 HydrophobicContact CG1-CD2 4.12Å; I219-F256 HydrophobicContact CD1-CE1 3.88Å; I219-F256 HydrophobicContact CG1-CD1 3.9Å; I219-F256 HydrophobicContact CG1-CE1 3.69Å; I219-I265 HydrophobicContact CB-CG2 3.97Å; I219-I265 HydrophobicContact CG1-CG2 4.24Å; I219-V267 HydrophobicContact CD1-CG1 4.1Å; I219-V267 HydrophobicContact CD1-CG2 4Å; I219-V267 HydrophobicContact CG1-CG2 4.49Å
220	G	91.9	Very high	88.1	Confident	33 Å²	33	66 Å²	66	34%	0.34	36%	0.359	S	S	.	.			trans	69.9	-164.4	-177.1	0	0	0	0	0	113.8	N218 S258	N218-G220 VanDerWaalsContact C-N 3.32Å; N218-G220 PolarHBondContact O-N 2.96Å; G220-S258 WeakPolarHBondContact CA-O 3.42Å
221	S	94.2	Very high	85.4	Confident	66 Å²	66	71.7 Å²	71.7	46%	0.462	40%	0.398	S	S	.	.			trans	-75.9	136	-178.6	66.9	0	0	0	0	112.4	K257	S221-K257 WeakPolarHBondContact O-CB 3.32Å; S221-K257 PolarHBondContact O-N 3.34Å; S221-K257 WeakPolarHBondContact OG-CB 3.22Å
222	L	94.7	Very high	83	Confident	42 Å²	42	69.4 Å²	69.4	22%	0.22	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	142.7	178	-60.3	-179	0	0	0	111.1	C208 I219 Y224 V254 E255 F256	C208-L222 HydrophobicContact CB-CD1 3.93Å; C208-L222 WeakPolarHBondContact O-CD1 3.34Å; I219-L222 HydrophobicContact CD1-CD1 3.99Å; I219-L222 HydrophobicContact CD1-CD2 4.31Å; I219-L222 HydrophobicContact CD1-CG 4.49Å; I219-L222 HydrophobicContact CG1-CD2 4.12Å; L222-Y224 HydrophobicContact CB-CE2 4.05Å; L222-V254 HydrophobicContact CB-CG1 4.45Å; L222-V254 HydrophobicContact CD1-CG1 4.4Å; L222-V254 HydrophobicContact CD2-CG1 4.26Å; L222-E255 WeakPolarHBondContact CA-O 3.13Å; L222-F256 HydrophobicContact CD2-CB 4.35Å; L222-F256 HydrophobicContact CD2-CD1 3.45Å; L222-F256 VanDerWaalsContact CD2-CD1 3.45Å; L222-F256 HydrophobicContact CD2-CD2 4.4Å; L222-F256 HydrophobicContact CD2-CE1 3.72Å; L222-F256 HydrophobicContact CD2-CG 3.82Å; L222-F256 HydrophobicContact CD2-CZ 4.3Å
223	A	94.3	Very high	81	Confident	13 Å²	13	67.5 Å²	67.5	11%	0.107	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.6	168.4	0	0	0	0	0	111	Y225 V254 E255 K257	A223-Y225 HydrophobicContact CB-CE2 3.92Å; A223-V254 CarbonylContact O-C 3.34Å; A223-V254 WeakPolarHBondContact O-CA 3.41Å; A223-E255 HydrophobicContact CB-CB 4.34Å; A223-E255 PolarHBondContact N-O 2.82Å; A223-E255 PolarHBondContact O-N 3.25Å; A223-K257 HydrophobicContact CB-CD 4.22Å; A223-K257 HydrophobicContact CB-CG 4.49Å
224	Y	93	Very high	79.2	Confident	60 Å²	60	66.2 Å²	66.2	24%	0.235	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.1	-176.4	-61.9	-96.4	0	0	0	110.1	V206 C208 L222 P226 S227 V252 A253 V254	V206-Y224 HydrophobicContact CG2-CD1 4.42Å; C208-Y224 PolarHBondContact N-OH 2.93Å; C208-Y224 PolarHBondContact O-OH 3.43Å; L222-Y224 HydrophobicContact CB-CE2 4.05Å; Y224-P226 CarbonylContact O-C 3.46Å; Y224-S227 WeakPolarHBondContact O-CA 3.21Å; Y224-S227 PolarHBondContact O-N 3.38Å; Y224-V252 HydrophobicContact CD1-CG1 4.45Å; Y224-A253 CarbonylContact C-O 3.59Å; Y224-A253 WeakPolarHBondContact CA-O 3.44Å; Y224-V254 HydrophobicContact CD1-CG1 4.45Å; Y224-V254 HydrophobicContact CD1-CG2 3.7Å; Y224-V254 HydrophobicContact CE1-CB 4.5Å; Y224-V254 HydrophobicContact CE1-CG1 4.09Å; Y224-V254 HydrophobicContact CE1-CG2 3.67Å
225	Y	91.8	Very high	78	Confident	51 Å²	51	65.2 Å²	65.2	20%	0.2	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124.5	179.1	-55.4	-82	0	0	0	111.1	L163 P165 A223 V252 A253 E255	L163-Y225 WeakPolarHBondContact O-CB 3.35Å; P165-Y225 VanDerWaalsContact CD-CE1 3.48Å; P165-Y225 HydrophobicContact CG-CD2 4.23Å; P165-Y225 HydrophobicContact CG-CE1 4.19Å; P165-Y225 HydrophobicContact CG-CE2 3.54Å; A223-Y225 HydrophobicContact CB-CE2 3.92Å; Y225-V252 CarbonylContact O-C 3.5Å; Y225-V252 WeakPolarHBondContact O-CA 3.28Å; Y225-A253 PolarHBondContact N-O 3.33Å; Y225-A253 PolarHBondContact O-N 2.93Å; Y225-E255 HydrophobicContact CD2-CB 4.4Å; Y225-E255 HydrophobicContact CE2-CB 3.75Å; Y225-E255 VanDerWaalsContact CE2-OE2 3.24Å; Y225-E255 WeakPolarHBondContact CE2-OE2 3.42Å; Y225-E255 PolarHBondContact OH-OE2 2.86Å
226	P	88.5	Confident	76.8	Confident	22 Å²	22	65.4 Å²	65.4	14%	0.143	36%	0.355	C	S	.	.	S	Bend	cis	-67.4	145.9	-5.7	26.7	-29.2	0	0	0	111.4	V162 Y224 F230 Y235	V162-P226 HydrophobicContact CB-CB 4.26Å; V162-P226 HydrophobicContact CB-CG 4.41Å; V162-P226 HydrophobicContact CG2-CG 4.37Å; Y224-P226 CarbonylContact O-C 3.46Å; P226-F230 HydrophobicContact CB-CB 4.06Å; P226-Y235 VanDerWaalsContact CD-OH 3.31Å; P226-Y235 WeakPolarHBondContact CD-OH 3.38Å; P226-Y235 HydrophobicContact CG-CE2 4.39Å; P226-Y235 WeakPolarHBondContact CG-OH 3.46Å
227	S	75.4	Confident	76	Confident	74 Å²	74	60.9 Å²	60.9	52%	0.517	34%	0.335	S	S	.	.			trans	-69.9	160.2	171.8	-178.8	0	0	0	0	110	Y224 N229 F230	Y224-S227 WeakPolarHBondContact O-CA 3.21Å; Y224-S227 PolarHBondContact O-N 3.38Å; S227-N229 PolarHBondContact O-N 2.85Å; S227-F230 PolarHBondContact O-N 3.48Å
228	K	65.6	Low	75.5	Confident	172 Å²	172	53.9 Å²	53.9	75%	0.748	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-16.8	-177.6	-68.1	-177.3	178.3	179.6	0	114.8
229	N	54.2	Low	75.1	Confident	134 Å²	134	53.5 Å²	53.5	72%	0.717	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	22.9	-174.6	-63.2	-15.5	0	0	0	114.7	S227 S231	S227-N229 PolarHBondContact O-N 2.85Å; N229-S231 PolarHBondContact O-N 2.91Å; N229-S231 PolarHBondContact O-OG 3.41Å; N229-S231 VanDerWaalsContact O-OG 3.1Å
230	F	54.9	Low	74.9	Confident	101 Å²	101	55.1 Å²	55.1	44%	0.443	31%	0.31	S	S	.	.			trans	-73.5	78.1	168.8	-156.9	-87.8	0	0	0	110.2	V162 P226 S227 G232 K233	V162-F230 HydrophobicContact CG1-CE2 4.23Å; V162-F230 HydrophobicContact CG1-CZ 4.28Å; P226-F230 HydrophobicContact CB-CB 4.06Å; S227-F230 PolarHBondContact O-N 3.48Å; F230-G232 VanDerWaalsContact C-N 3.27Å; F230-G232 PolarHBondContact O-N 3.37Å; F230-K233 HydrophobicContact CD1-CB 4.11Å; F230-K233 HydrophobicContact CD1-CD 3.75Å; F230-K233 HydrophobicContact CD1-CG 3.91Å; F230-K233 HydrophobicContact CE1-CD 3.46Å; F230-K233 VanDerWaalsContact CE1-CD 3.46Å; F230-K233 VanDerWaalsContact CE1-CE 3.41Å; F230-K233 HydrophobicContact CE1-CG 3.81Å; F230-K233 VanDerWaalsContact CE1-NZ 3.3Å; F230-K233 HydrophobicContact CZ-CD 4.47Å; F230-K233 PolarHBondContact O-N 3.2Å
231	S	37.9	Very low	74.8	Confident	122 Å²	122	56.8 Å²	56.8	85%	0.853	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	72.7	-170.8	-59.7	0	0	0	0	113.1	N229	N229-S231 PolarHBondContact O-N 2.91Å; N229-S231 PolarHBondContact O-OG 3.41Å; N229-S231 VanDerWaalsContact O-OG 3.1Å
232	G	45.5	Very low	74.5	Confident	34 Å²	34	56.2 Å²	56.2	35%	0.351	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	150.8	6.5	169.4	0	0	0	0	0	118.1	F230	F230-G232 VanDerWaalsContact C-N 3.27Å; F230-G232 PolarHBondContact O-N 3.37Å
233	K	53.5	Low	74.2	Confident	49 Å²	49	56.1 Å²	56.1	21%	0.213	31%	0.307	C	S	.	.			trans	-116.8	100	175.1	-71.6	179.6	-175.5	152.8	0	110.2	F230 Y235	F230-K233 HydrophobicContact CD1-CB 4.11Å; F230-K233 HydrophobicContact CD1-CD 3.75Å; F230-K233 HydrophobicContact CD1-CG 3.91Å; F230-K233 HydrophobicContact CE1-CD 3.46Å; F230-K233 VanDerWaalsContact CE1-CD 3.46Å; F230-K233 VanDerWaalsContact CE1-CE 3.41Å; F230-K233 HydrophobicContact CE1-CG 3.81Å; F230-K233 VanDerWaalsContact CE1-NZ 3.3Å; F230-K233 HydrophobicContact CZ-CD 4.47Å; F230-K233 PolarHBondContact O-N 3.2Å; K233-Y235 PolarHBondContact O-N 3.02Å
234	Q	57	Low	73.9	Confident	69 Å²	69	56.7 Å²	56.7	32%	0.322	31%	0.307	S	S	.	.			trans	-73.8	121.2	170.3	-160.9	-179.1	-16	0	0	108.2	N202 S236 A237	N202-Q234 HydrophobicContact CB-CG 4.49Å; Q234-S236 WeakPolarHBondContact CG-OG 3.33Å; Q234-S236 PolarHBondContact NE2-OG 3.46Å; Q234-S236 PolarHBondContact O-N 2.96Å; Q234-A237 PolarHBondContact O-N 2.96Å
235	Y	69.7	Low	73.7	Confident	29 Å²	29	58.4 Å²	58.4	11%	0.114	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-68.2	-13.5	179.1	-80.3	-71.3	0	0	0	113.4	F158 D203 P226 K233 A237 Y238 Y239 P250	F158-Y235 AromaticContact CE2-CE1 3.93Å; F158-Y235 HydrophobicContact CE2-CE1 3.93Å; D203-Y235 HydrophobicContact CB-CD2 4.19Å; D203-Y235 PolarHBondContact OD1-N 2.92Å; P226-Y235 VanDerWaalsContact CD-OH 3.31Å; P226-Y235 WeakPolarHBondContact CD-OH 3.38Å; P226-Y235 HydrophobicContact CG-CE2 4.39Å; P226-Y235 WeakPolarHBondContact CG-OH 3.46Å; K233-Y235 PolarHBondContact O-N 3.02Å; Y235-A237 PolarHBondContact O-N 3.23Å; Y235-Y238 AromaticContact CD1-CD2 3.82Å; Y235-Y238 HydrophobicContact CD1-CD2 3.82Å; Y235-Y238 AromaticContact CD1-CE2 3.83Å; Y235-Y238 HydrophobicContact CD1-CE2 3.83Å; Y235-Y238 HydrophobicContact CE1-CE2 4.23Å; Y235-Y238 PolarHBondContact O-N 3.43Å; Y235-Y238 VanDerWaalsContact O-N 3.14Å; Y235-Y239 VanDerWaalsContact O-CD2 3.26Å; Y235-Y239 WeakPolarHBondContact O-CD2 3.34Å; Y235-P250 HydrophobicContact CD1-CB 3.17Å; Y235-P250 HydrophobicContact CD1-CG 3.72Å; Y235-P250 HydrophobicContact CE1-CB 3.2Å; Y235-P250 HydrophobicContact CE1-CG 4.22Å; Y235-P250 HydrophobicContact CG-CB 4.32Å
236	S	70	Confident	73.5	Confident	16 Å²	16	57.1 Å²	57.1	11%	0.112	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-55.3	-30.9	171.6	65.7	0	0	0	0	112.7	Q234 Y238 Y239	Q234-S236 WeakPolarHBondContact CG-OG 3.33Å; Q234-S236 PolarHBondContact NE2-OG 3.46Å; Q234-S236 PolarHBondContact O-N 2.96Å; S236-Y238 PolarHBondContact O-N 3Å; S236-Y239 PolarHBondContact O-N 2.95Å
237	A	77.8	Confident	73.7	Confident	6 Å²	6	56.8 Å²	56.8	5%	0.05	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-62.1	-25.6	-179.3	0	0	0	0	0	113.1	C142 G147 C156 Q234 Y235 Y239	C142-A237 HydrophobicContact CB-CB 4.2Å; G147-A237 WeakPolarHBondContact O-CA 3.37Å; G147-A237 WeakPolarHBondContact O-CB 3.42Å; G147-A237 PolarHBondContact O-N 3.35Å; C156-A237 VanDerWaalsContact SG-C 3.55Å; C156-A237 PolarHBondContact SG-O 3.05Å; Q234-A237 PolarHBondContact O-N 2.96Å; Y235-A237 PolarHBondContact O-N 3.23Å; A237-Y239 PolarHBondContact O-N 3.24Å
238	Y	86	Confident	74.4	Confident	13 Å²	13	53.9 Å²	53.9	5%	0.051	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-81.3	-2.2	177.2	-62.1	-93.4	0	0	0	112.7	C156 K157 F158 Y235 S236 Y247 P250	C156-Y238 HydrophobicContact CB-CD1 3.64Å; C156-Y238 HydrophobicContact CB-CE1 3.58Å; C156-Y238 HydrophobicContact CB-CG 4.25Å; K157-Y238 PolarHBondContact O-OH 3.41Å; F158-Y238 HydrophobicContact CB-CE1 3.87Å; F158-Y238 AromaticContact CD2-CE1 3.97Å; F158-Y238 HydrophobicContact CD2-CE1 3.97Å; F158-Y238 AromaticContact CD2-CZ 3.82Å; F158-Y238 HydrophobicContact CG-CE1 4.43Å; Y235-Y238 AromaticContact CD1-CD2 3.82Å; Y235-Y238 HydrophobicContact CD1-CD2 3.82Å; Y235-Y238 AromaticContact CD1-CE2 3.83Å; Y235-Y238 HydrophobicContact CD1-CE2 3.83Å; Y235-Y238 HydrophobicContact CE1-CE2 4.23Å; Y235-Y238 PolarHBondContact O-N 3.43Å; Y235-Y238 VanDerWaalsContact O-N 3.14Å; S236-Y238 PolarHBondContact O-N 3Å; Y238-Y247 WeakPolarHBondContact O-CE2 3.48Å; Y238-Y247 PolarHBondContact O-OH 3.43Å; Y238-P250 HydrophobicContact CD2-CB 4.38Å; Y238-P250 HydrophobicContact CG-CB 4.4Å; Y238-P250 HydrophobicContact CG-CG 4.37Å
239	Y	87.3	Confident	75.6	Confident	13 Å²	13	46 Å²	46	5%	0.051	28%	0.278	C	S	.	.			trans	-123.1	149.1	-178.5	-61.3	-76.7	0	0	0	109.9	W191 P193 I204 Y235 S236 A237 P250	W191-Y239 AromaticContact CE3-CD1 3.63Å; W191-Y239 HydrophobicContact CE3-CD1 3.63Å; W191-Y239 AromaticContact CE3-CE1 3.69Å; W191-Y239 HydrophobicContact CE3-CE1 3.69Å; W191-Y239 HydrophobicContact CE3-CG 4.26Å; W191-Y239 AromaticContact CZ3-CD1 3.74Å; W191-Y239 HydrophobicContact CZ3-CD1 3.74Å; W191-Y239 HydrophobicContact CZ3-CD2 4.34Å; W191-Y239 AromaticContact CZ3-CE1 3.48Å; W191-Y239 HydrophobicContact CZ3-CE1 3.48Å; W191-Y239 VanDerWaalsContact CZ3-CE1 3.48Å; W191-Y239 HydrophobicContact CZ3-CE2 4.13Å; W191-Y239 HydrophobicContact CZ3-CG 4.16Å; W191-Y239 AromaticContact CZ3-CZ 3.7Å; P193-Y239 HydrophobicContact CG-CD2 4.06Å; I204-Y239 HydrophobicContact CD1-CD2 4.43Å; I204-Y239 HydrophobicContact CD1-CE2 3.61Å; Y235-Y239 VanDerWaalsContact O-CD2 3.26Å; Y235-Y239 WeakPolarHBondContact O-CD2 3.34Å; S236-Y239 PolarHBondContact O-N 2.95Å; A237-Y239 PolarHBondContact O-N 3.24Å; Y239-P250 HydrophobicContact CE2-CG 3.95Å; Y239-P250 WeakPolarHBondContact OH-CG 3.19Å
240	P	89.1	Confident	77.3	Confident	39 Å²	39	40.1 Å²	40.1	25%	0.253	25%	0.247	S	C	.	.			cis	-85.5	159.6	5.8	33.6	-35.1	0	0	0	114.3	W191 L242 Q244	W191-P240 WeakPolarHBondContact O-CA 3.32Å; P240-L242 HydrophobicContact CB-CD2 4.29Å; P240-L242 HydrophobicContact CB-CG 4.39Å; P240-L242 HydrophobicContact CG-CD1 4.09Å; P240-L242 HydrophobicContact CG-CD2 4.13Å; P240-L242 HydrophobicContact CG-CG 3.99Å; P240-Q244 PolarHBondContact O-OE1 2.79Å
241	Y	89.9	Confident	79.2	Confident	67 Å²	67	35.4 Å²	35.4	26%	0.263	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-81.2	117.7	166	171.8	-118.9	0	0	0	110	K187 F189 G190 Y247	K187-Y241 HydrophobicContact CB-CD1 4.05Å; K187-Y241 HydrophobicContact CB-CE1 4.4Å; K187-Y241 HydrophobicContact CB-CG 4.36Å; F189-Y241 CarbonylContact C-O 3.5Å; F189-Y241 WeakPolarHBondContact CA-O 3.41Å; G190-Y241 PolarHBondContact N-O 3.45Å; Y241-Y247 AromaticContact CD2-CD1 3.4Å; Y241-Y247 HydrophobicContact CD2-CD1 3.4Å; Y241-Y247 AromaticContact CD2-CD2 3.84Å; Y241-Y247 HydrophobicContact CD2-CD2 3.84Å; Y241-Y247 AromaticContact CD2-CE1 3.78Å; Y241-Y247 HydrophobicContact CD2-CE1 3.78Å; Y241-Y247 HydrophobicContact CD2-CE2 4.11Å; Y241-Y247 AromaticContact CD2-CG 3.47Å; Y241-Y247 HydrophobicContact CD2-CG 3.47Å; Y241-Y247 VanDerWaalsContact CD2-CG 3.47Å; Y241-Y247 AromaticContact CE2-CD1 3.93Å; Y241-Y247 HydrophobicContact CE2-CD1 3.93Å; Y241-Y247 HydrophobicContact CE2-CG 4.03Å; Y241-Y247 HydrophobicContact CG-CD1 4.21Å; Y241-Y247 HydrophobicContact CG-CE1 4.14Å; Y241-Y247 HydrophobicContact CG-CE2 4.5Å; Y241-Y247 HydrophobicContact CG-CG 4.5Å
242	L	89.4	Confident	81.8	Confident	55 Å²	55	30.8 Å²	30.8	29%	0.288	19%	0.193	S	C	.	.			trans	-118.1	19.6	-179.5	-59.4	175.4	0	0	0	113.5	V152 F189 P240 Q244	V152-L242 HydrophobicContact CG1-CD1 3.31Å; F189-L242 HydrophobicContact CE1-CD2 4.27Å; F189-L242 VanDerWaalsContact CE2-C 3.41Å; F189-L242 WeakPolarHBondContact CE2-O 3.45Å; F189-L242 HydrophobicContact CZ-CD2 4.25Å; P240-L242 HydrophobicContact CB-CD2 4.29Å; P240-L242 HydrophobicContact CB-CG 4.39Å; P240-L242 HydrophobicContact CG-CD1 4.09Å; P240-L242 HydrophobicContact CG-CD2 4.13Å; P240-L242 HydrophobicContact CG-CG 3.99Å; L242-Q244 VanDerWaalsContact C-N 3.26Å; L242-Q244 HydrophobicContact CB-CG 4.2Å
243	G	87.3	Confident	84.1	Confident	40 Å²	40	29.2 Å²	29.2	41%	0.412	18%	0.177	S	C	.	.	S	Bend	trans	78	11.7	-173.7	0	0	0	0	0	113.9
244	Q	88.8	Confident	86.1	Confident	25 Å²	25	26.9 Å²	26.9	12%	0.117	17%	0.167	C	C	.	.			trans	-59	138.8	-179.6	-58.4	148.1	-61.9	0	0	111.4	V152 K154 V155 P240 L242 G246 Y247	V152-Q244 PolarHBondContact O-NE2 2.87Å; K154-Q244 PolarHBondContact O-NE2 2.98Å; V155-Q244 HydrophobicContact CG1-CB 3.37Å; V155-Q244 VanDerWaalsContact CG1-CD 3.48Å; V155-Q244 HydrophobicContact CG1-CG 4.02Å; P240-Q244 PolarHBondContact O-OE1 2.79Å; L242-Q244 VanDerWaalsContact C-N 3.26Å; L242-Q244 HydrophobicContact CB-CG 4.2Å; Q244-G246 PolarHBondContact O-N 3.01Å; Q244-Y247 WeakPolarHBondContact O-CB 3.25Å; Q244-Y247 PolarHBondContact O-N 2.8Å
245	A	87.4	Confident	88	Confident	95 Å²	95	24.7 Å²	24.7	79%	0.785	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	129.4	179.8	0	0	0	0	0	111.2	Y247	A245-Y247 VanDerWaalsContact C-N 3.34Å
246	G	88.9	Confident	89.2	Confident	25 Å²	25	23.3 Å²	23.3	26%	0.258	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	9.6	-179.6	0	0	0	0	0	114.9	Q244 L248	Q244-G246 PolarHBondContact O-N 3.01Å; G246-L248 PolarHBondContact O-N 3.08Å
247	Y	91.5	Very high	90.4	Very high	15 Å²	15	27.1 Å²	27.1	6%	0.059	17%	0.166	C	C	.	.			trans	-58.6	122	175	178.6	-86.7	0	0	0	112.3	V155 K187 Y238 Y241 Q244 A245	V155-Y247 HydrophobicContact CG1-CD2 4Å; V155-Y247 HydrophobicContact CG1-CG 4.48Å; K187-Y247 HydrophobicContact CD-CD1 3.86Å; K187-Y247 HydrophobicContact CD-CE1 3.79Å; K187-Y247 HydrophobicContact CG-CE1 4Å; K187-Y247 PolarHBondContact NZ-O 2.95Å; Y238-Y247 WeakPolarHBondContact O-CE2 3.48Å; Y238-Y247 PolarHBondContact O-OH 3.43Å; Y241-Y247 AromaticContact CD2-CD1 3.4Å; Y241-Y247 HydrophobicContact CD2-CD1 3.4Å; Y241-Y247 AromaticContact CD2-CD2 3.84Å; Y241-Y247 HydrophobicContact CD2-CD2 3.84Å; Y241-Y247 AromaticContact CD2-CE1 3.78Å; Y241-Y247 HydrophobicContact CD2-CE1 3.78Å; Y241-Y247 HydrophobicContact CD2-CE2 4.11Å; Y241-Y247 AromaticContact CD2-CG 3.47Å; Y241-Y247 HydrophobicContact CD2-CG 3.47Å; Y241-Y247 VanDerWaalsContact CD2-CG 3.47Å; Y241-Y247 AromaticContact CE2-CD1 3.93Å; Y241-Y247 HydrophobicContact CE2-CD1 3.93Å; Y241-Y247 HydrophobicContact CE2-CG 4.03Å; Y241-Y247 HydrophobicContact CG-CD1 4.21Å; Y241-Y247 HydrophobicContact CG-CE1 4.14Å; Y241-Y247 HydrophobicContact CG-CE2 4.5Å; Y241-Y247 HydrophobicContact CG-CG 4.5Å; Q244-Y247 WeakPolarHBondContact O-CB 3.25Å; Q244-Y247 PolarHBondContact O-N 2.8Å; A245-Y247 VanDerWaalsContact C-N 3.34Å
248	L	91.2	Very high	91.2	Very high	13 Å²	13	30.5 Å²	30.5	7%	0.068	19%	0.189	C	C	.	.			trans	-119.3	125.1	173.1	-66	175.6	0	0	0	109.6	Y128 V131 G246	Y128-L248 HydrophobicContact CD1-CB 4.16Å; Y128-L248 HydrophobicContact CD1-CD1 3.67Å; Y128-L248 HydrophobicContact CD1-CD2 4.42Å; Y128-L248 HydrophobicContact CD1-CG 4.31Å; Y128-L248 HydrophobicContact CD2-CD2 4.38Å; Y128-L248 HydrophobicContact CE1-CB 3.79Å; Y128-L248 HydrophobicContact CE1-CD1 4.14Å; Y128-L248 HydrophobicContact CE1-CD2 4.28Å; Y128-L248 HydrophobicContact CE1-CG 4.3Å; Y128-L248 HydrophobicContact CE2-CD2 4.24Å; Y128-L248 HydrophobicContact CG-CD1 3.92Å; Y128-L248 HydrophobicContact CG-CD2 4.44Å; V131-L248 HydrophobicContact CB-CD1 3.5Å; V131-L248 HydrophobicContact CB-CG 4.37Å; V131-L248 HydrophobicContact CG1-CD1 3.66Å; V131-L248 HydrophobicContact CG1-CG 4.34Å; V131-L248 HydrophobicContact CG2-CD1 3.74Å; V131-L248 HydrophobicContact CG2-CD2 4.48Å; V131-L248 HydrophobicContact CG2-CG 4.14Å; G246-L248 PolarHBondContact O-N 3.08Å
249	G	90	Very high	91.6	Very high	6 Å²	6	30.4 Å²	30.4	6%	0.062	19%	0.19	C	C	.	.			trans	-75	151.3	175.6	0	0	0	0	0	110.1	Y128	Y128-G249 PolarHBondContact OH-O 2.96Å
250	P	90.8	Very high	92	Very high	11 Å²	11	35.2 Å²	35.2	7%	0.071	21%	0.211	C	C	.	.			trans	-65.6	144.8	174.6	28.2	-33.4	0	0	0	111.2	F158 Y235 Y238 Y239	F158-P250 HydrophobicContact CD2-CB 4.34Å; F158-P250 HydrophobicContact CE2-CB 4.31Å; Y235-P250 HydrophobicContact CD1-CB 3.17Å; Y235-P250 HydrophobicContact CD1-CG 3.72Å; Y235-P250 HydrophobicContact CE1-CB 3.2Å; Y235-P250 HydrophobicContact CE1-CG 4.22Å; Y235-P250 HydrophobicContact CG-CB 4.32Å; Y238-P250 HydrophobicContact CD2-CB 4.38Å; Y238-P250 HydrophobicContact CG-CB 4.4Å; Y238-P250 HydrophobicContact CG-CG 4.37Å; Y239-P250 HydrophobicContact CE2-CG 3.95Å; Y239-P250 WeakPolarHBondContact OH-CG 3.19Å
251	I	93.2	Very high	92.2	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148	177.9	52.1	170	0	0	0	110.2	Y124 L125 Y128 F158 L160 L163 L183 K184	Y124-I251 HydrophobicContact CE1-CG2 4.23Å; L125-I251 HydrophobicContact CD2-CD1 3.61Å; Y128-I251 HydrophobicContact CE1-CD1 4.25Å; Y128-I251 HydrophobicContact CE1-CG1 4.34Å; Y128-I251 HydrophobicContact CE1-CG2 4.49Å; Y128-I251 WeakPolarHBondContact OH-CG2 3.26Å; F158-I251 HydrophobicContact CD1-CD1 4.24Å; F158-I251 HydrophobicContact CD1-CG1 3.81Å; F158-I251 HydrophobicContact CE1-CD1 3.77Å; F158-I251 HydrophobicContact CE1-CG1 3.21Å; F158-I251 HydrophobicContact CE2-CG1 4.49Å; F158-I251 HydrophobicContact CZ-CG1 3.61Å; F158-I251 VanDerWaalsContact CZ-O 3.32Å; F158-I251 WeakPolarHBondContact CZ-O 3.39Å; L160-I251 HydrophobicContact CD2-CD1 4.23Å; L163-I251 HydrophobicContact CD1-CD1 3.79Å; L163-I251 HydrophobicContact CD2-CD1 4.09Å; L163-I251 HydrophobicContact CD2-CG1 4.1Å; L163-I251 HydrophobicContact CG-CD1 4.48Å; L183-I251 WeakPolarHBondContact O-CA 3.34Å; K184-I251 HydrophobicContact CB-CG2 4.03Å
252	V	92.6	Very high	92.4	Very high	26 Å²	26	39.5 Å²	39.5	16%	0.158	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.2	176.4	179.7	0	0	0	0	107.6	L182 L183 V206 Y224 Y225	L182-V252 CarbonylContact C-O 3.31Å; L183-V252 PolarHBondContact N-O 3.31Å; L183-V252 PolarHBondContact O-N 3.27Å; V206-V252 HydrophobicContact CG2-CB 4.06Å; V206-V252 HydrophobicContact CG2-CG1 3.77Å; V206-V252 HydrophobicContact CG2-CG2 4.19Å; Y224-V252 HydrophobicContact CD1-CG1 4.45Å; Y225-V252 CarbonylContact O-C 3.5Å; Y225-V252 WeakPolarHBondContact O-CA 3.28Å
253	A	95	Very high	92.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	135.2	172.7	0	0	0	0	0	110.7	L163 C166 L182 Y224 Y225	L163-A253 HydrophobicContact CD2-CB 4.1Å; C166-A253 HydrophobicContact CB-CB 3.66Å; L182-A253 HydrophobicContact CD2-CB 3.66Å; Y224-A253 CarbonylContact C-O 3.59Å; Y224-A253 WeakPolarHBondContact CA-O 3.44Å; Y225-A253 PolarHBondContact N-O 3.33Å; Y225-A253 PolarHBondContact O-N 2.93Å
254	V	95.4	Very high	93	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	114.2	172.5	-174.5	0	0	0	0	107.8	C180 V181 L183 L222 A223 Y224 F256	C180-V254 CarbonylContact C-O 3.6Å; C180-V254 VanDerWaalsContact CA-O 3.31Å; C180-V254 WeakPolarHBondContact CA-O 3.2Å; V181-V254 PolarHBondContact N-O 3.49Å; V181-V254 PolarHBondContact O-N 2.94Å; L183-V254 HydrophobicContact CD1-CG2 3.52Å; L183-V254 HydrophobicContact CG-CG2 3.9Å; L222-V254 HydrophobicContact CB-CG1 4.45Å; L222-V254 HydrophobicContact CD1-CG1 4.4Å; L222-V254 HydrophobicContact CD2-CG1 4.26Å; A223-V254 CarbonylContact O-C 3.34Å; A223-V254 WeakPolarHBondContact O-CA 3.41Å; Y224-V254 HydrophobicContact CD1-CG1 4.45Å; Y224-V254 HydrophobicContact CD1-CG2 3.7Å; Y224-V254 HydrophobicContact CE1-CB 4.5Å; Y224-V254 HydrophobicContact CE1-CG1 4.09Å; Y224-V254 HydrophobicContact CE1-CG2 3.67Å; V254-F256 HydrophobicContact CG1-CE2 4.16Å
255	E	95.9	Very high	93.4	Very high	23 Å²	23	39 Å²	39	11%	0.107	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.7	175.7	178.5	-174.5	-150.5	0	0	109.4	L222 A223 Y225 K257	L222-E255 WeakPolarHBondContact CA-O 3.13Å; A223-E255 HydrophobicContact CB-CB 4.34Å; A223-E255 PolarHBondContact N-O 2.82Å; A223-E255 PolarHBondContact O-N 3.25Å; Y225-E255 HydrophobicContact CD2-CB 4.4Å; Y225-E255 HydrophobicContact CE2-CB 3.75Å; Y225-E255 VanDerWaalsContact CE2-OE2 3.24Å; Y225-E255 WeakPolarHBondContact CE2-OE2 3.42Å; Y225-E255 PolarHBondContact OH-OE2 2.86Å; E255-K257 HydrophobicContact CG-CG 4.19Å; E255-K257 PolarHBondContact O-N 3.41Å
256	F	96.2	Very high	93.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	100.1	173.1	-67.9	-105	0	0	0	108.1	T178 P179 V181 I219 L222 V254 P259 V267 F284 I286	T178-F256 CarbonylContact C-O 3.57Å; T178-F256 WeakPolarHBondContact CA-O 3.36Å; T178-F256 VanDerWaalsContact CB-O 3.28Å; T178-F256 WeakPolarHBondContact CB-O 3.28Å; P179-F256 HydrophobicContact CG-CB 4.12Å; P179-F256 WeakPolarHBondContact O-CD2 3.49Å; P179-F256 PolarHBondContact O-N 3.03Å; V181-F256 HydrophobicContact CB-CE2 4.13Å; V181-F256 HydrophobicContact CG2-CD2 4.35Å; V181-F256 HydrophobicContact CG2-CE2 3.69Å; I219-F256 HydrophobicContact CD1-CE1 3.88Å; I219-F256 HydrophobicContact CG1-CD1 3.9Å; I219-F256 HydrophobicContact CG1-CE1 3.69Å; L222-F256 HydrophobicContact CD2-CB 4.35Å; L222-F256 HydrophobicContact CD2-CD1 3.45Å; L222-F256 VanDerWaalsContact CD2-CD1 3.45Å; L222-F256 HydrophobicContact CD2-CD2 4.4Å; L222-F256 HydrophobicContact CD2-CE1 3.72Å; L222-F256 HydrophobicContact CD2-CG 3.82Å; L222-F256 HydrophobicContact CD2-CZ 4.3Å; V254-F256 HydrophobicContact CG1-CE2 4.16Å; F256-P259 HydrophobicContact CB-CG 4.25Å; F256-P259 WeakPolarHBondContact O-CD 3.5Å; F256-V267 HydrophobicContact CE1-CG1 4.38Å; F256-V267 HydrophobicContact CE1-CG2 3.78Å; F256-V267 HydrophobicContact CZ-CG1 4.14Å; F256-V267 HydrophobicContact CZ-CG2 4.05Å; F256-F284 HydrophobicContact CE2-CE2 4.48Å; F256-F284 HydrophobicContact CE2-CZ 4.31Å; F256-F284 HydrophobicContact CZ-CE2 4.01Å; F256-F284 AromaticContact CZ-CZ 3.84Å; F256-F284 HydrophobicContact CZ-CZ 3.84Å; F256-I286 HydrophobicContact CD2-CD1 4.36Å; F256-I286 HydrophobicContact CE1-CG2 4.38Å; F256-I286 HydrophobicContact CG-CD1 4.45Å
257	K	94.8	Very high	94.2	Very high	95 Å²	95	35.5 Å²	35.5	41%	0.413	19%	0.192	S	C	.	.	S	Bend	trans	-77.1	-29.4	-171.6	-71.7	-175.8	164.1	176.1	0	114	T178 S221 A223 E255	T178-K257 WeakPolarHBondContact CG2-O 3.3Å; S221-K257 WeakPolarHBondContact O-CB 3.32Å; S221-K257 PolarHBondContact O-N 3.34Å; S221-K257 WeakPolarHBondContact OG-CB 3.22Å; A223-K257 HydrophobicContact CB-CD 4.22Å; A223-K257 HydrophobicContact CB-CG 4.49Å; E255-K257 HydrophobicContact CG-CG 4.19Å; E255-K257 PolarHBondContact O-N 3.41Å
258	S	93.6	Very high	94.4	Very high	77 Å²	77	37 Å²	37	54%	0.538	20%	0.199	S	C	.	.	S	Bend	trans	-149.1	56.3	-176.1	-52.6	0	0	0	0	112.1	G220	G220-S258 WeakPolarHBondContact CA-O 3.42Å
259	P	95.3	Very high	94.6	Very high	12 Å²	12	36.4 Å²	36.4	8%	0.078	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-65.3	142	173	30.6	-34.2	0	0	0	109.7	F256 K261 I265 V288	F256-P259 HydrophobicContact CB-CG 4.25Å; F256-P259 WeakPolarHBondContact O-CD 3.5Å; P259-K261 PolarHBondContact O-N 3.06Å; P259-I265 HydrophobicContact CB-CD1 3.95Å; P259-V288 HydrophobicContact CB-CG2 4.46Å; P259-V288 HydrophobicContact CG-CG2 3.98Å
260	K	95.5	Very high	94.7	Very high	113 Å²	113	38 Å²	38	49%	0.491	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-66.6	128.2	174.2	-170.7	175.3	-175.4	173.1	0	109.9	N218 V263	N218-K260 HydrophobicContact CB-CB 4.06Å; N218-K260 HydrophobicContact CB-CD 4.29Å; N218-K260 WeakPolarHBondContact O-CB 3.3Å; N218-K260 PolarHBondContact O-N 3.47Å; N218-K260 WeakPolarHBondContact OD1-CD 3.3Å; N218-K260 PolarHBondContact OD1-NZ 3.39Å; K260-V263 HydrophobicContact CD-CG2 4.09Å; K260-V263 HydrophobicContact CG-CG2 4.25Å
261	K	94.4	Very high	94.7	Very high	116 Å²	116	38.5 Å²	38.5	50%	0.504	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	153	-179.7	-62.2	-169.9	176.7	-166.3	0	112.5	P259 V263 V288	P259-K261 PolarHBondContact O-N 3.06Å; K261-V263 PolarHBondContact O-N 3.43Å; K261-V288 CarbonylContact C-O 3.6Å; K261-V288 WeakPolarHBondContact CA-O 3.24Å
262	S	93.2	Very high	94.5	Very high	81 Å²	81	40.6 Å²	40.6	57%	0.566	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	27.5	176.9	-42.4	0	0	0	0	114.6	V288	S262-V288 PolarHBondContact N-O 2.9Å
263	V	94.5	Very high	94.2	Very high	46 Å²	46	39.6 Å²	39.6	28%	0.279	22%	0.215	S	C	.	.	S	Bend	trans	-132.7	132.1	176.4	178.1	0	0	0	0	108.8	K260 K261 I265	K260-V263 HydrophobicContact CD-CG2 4.09Å; K260-V263 HydrophobicContact CG-CG2 4.25Å; K261-V263 PolarHBondContact O-N 3.43Å; V263-I265 PolarHBondContact O-N 2.82Å
264	T	95.5	Very high	93.8	Very high	61 Å²	61	40 Å²	40	37%	0.374	22%	0.217	S	C	.	.			trans	-74.2	123.7	170.8	-53.3	0	0	0	0	109.5	L103 E285 M287	L103-T264 HydrophobicContact CD1-CG2 4.32Å; T264-E285 HydrophobicContact CG2-CB 4.09Å; T264-E285 HydrophobicContact CG2-CG 4.26Å; T264-M287 PolarHBondContact OG1-SD 3.27Å; T264-M287 VanDerWaalsContact OG1-SD 3.36Å
265	I	96.7	Very high	93.4	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.1	179.4	-57.9	157.2	0	0	0	107.9	D215 N218 I219 P259 V263 V267 E285 I286	D215-I265 HydrophobicContact CB-CG2 4.24Å; N218-I265 HydrophobicContact CB-CD1 4.26Å; N218-I265 HydrophobicContact CB-CG1 3.83Å; N218-I265 VanDerWaalsContact O-CD1 3.27Å; N218-I265 WeakPolarHBondContact O-CD1 3.44Å; I219-I265 HydrophobicContact CB-CG2 3.97Å; I219-I265 HydrophobicContact CG1-CG2 4.24Å; P259-I265 HydrophobicContact CB-CD1 3.95Å; V263-I265 PolarHBondContact O-N 2.82Å; I265-V267 HydrophobicContact CG2-CG2 4.07Å; I265-E285 WeakPolarHBondContact O-CA 3.46Å; I265-I286 HydrophobicContact CB-CG2 3.87Å; I265-I286 HydrophobicContact CD1-CG2 4.35Å; I265-I286 HydrophobicContact CG2-CG2 4.43Å; I265-I286 PolarHBondContact N-O 3.04Å; I265-I286 PolarHBondContact O-N 3.45Å
266	L	96.6	Very high	93	Very high	48 Å²	48	45.1 Å²	45.1	25%	0.251	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	112.6	173	-67.3	152.9	0	0	0	109.2	G210 Q211 D215 E285	G210-L266 CarbonylContact C-O 3.39Å; G210-L266 WeakPolarHBondContact CA-O 3.39Å; Q211-L266 HydrophobicContact CB-CB 3.7Å; Q211-L266 PolarHBondContact N-O 3.27Å; D215-L266 WeakPolarHBondContact CB-O 3.46Å; D215-L266 PolarHBondContact OD1-N 2.75Å; L266-E285 HydrophobicContact CD2-CG 3.44Å; L266-E285 VanDerWaalsContact CD2-CG 3.44Å; L266-E285 HydrophobicContact CG-CG 4.32Å
267	V	96.5	Very high	92.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.4	-178.4	-175.7	0	0	0	0	109.5	C208 I219 F256 I265 N283 F284 I286	C208-V267 HydrophobicContact CB-CG1 4.12Å; I219-V267 HydrophobicContact CD1-CG1 4.1Å; I219-V267 HydrophobicContact CD1-CG2 4Å; I219-V267 HydrophobicContact CG1-CG2 4.49Å; F256-V267 HydrophobicContact CE1-CG1 4.38Å; F256-V267 HydrophobicContact CE1-CG2 3.78Å; F256-V267 HydrophobicContact CZ-CG1 4.14Å; F256-V267 HydrophobicContact CZ-CG2 4.05Å; I265-V267 HydrophobicContact CG2-CG2 4.07Å; V267-N283 WeakPolarHBondContact O-CA 3.42Å; V267-F284 HydrophobicContact CB-CD1 4.42Å; V267-F284 HydrophobicContact CB-CD2 4.18Å; V267-F284 HydrophobicContact CB-CE1 4.1Å; V267-F284 HydrophobicContact CB-CE2 3.83Å; V267-F284 HydrophobicContact CB-CG 4.47Å; V267-F284 HydrophobicContact CB-CZ 3.8Å; V267-F284 HydrophobicContact CG1-CE1 3.83Å; V267-F284 HydrophobicContact CG1-CE2 4.13Å; V267-F284 HydrophobicContact CG1-CZ 3.59Å; V267-F284 HydrophobicContact CG2-CE2 4Å; V267-F284 HydrophobicContact CG2-CZ 4.31Å; V267-F284 PolarHBondContact N-O 2.96Å; V267-F284 PolarHBondContact O-N 2.92Å; V267-F284 VanDerWaalsContact O-O 3.13Å; V267-I286 HydrophobicContact CG2-CG2 3.87Å
268	K	95.5	Very high	92.1	Very high	47 Å²	47	42.9 Å²	42.9	20%	0.204	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138	169.8	62.1	170.8	-176.1	170.7	0	110.8	C208 S209 G210 E281 L282 N283	C208-K268 CarbonylContact C-O 3.49Å; C208-K268 WeakPolarHBondContact CA-O 3.42Å; S209-K268 PolarHBondContact N-O 2.87Å; S209-K268 WeakPolarHBondContact O-CG 3.46Å; S209-K268 PolarHBondContact O-N 3.31Å; S209-K268 VanDerWaalsContact OG-CE 3.22Å; S209-K268 WeakPolarHBondContact OG-CE 3.27Å; S209-K268 WeakPolarHBondContact OG-CG 3.08Å; G210-K268 WeakPolarHBondContact O-CE 3.35Å; K268-E281 HydrophobicContact CB-CB 4.33Å; K268-E281 WeakPolarHBondContact CD-OE1 3.4Å; K268-E281 VanDerWaalsContact CD-OE2 3.22Å; K268-E281 WeakPolarHBondContact CD-OE2 3.41Å; K268-E281 IonicContact NZ-OE1 2.71Å; K268-E281 PolarHBondContact NZ-OE1 3.49Å; K268-E281 IonicContact NZ-OE2 2.92Å; K268-L282 CarbonylContact C-O 3.52Å; K268-L282 VanDerWaalsContact CA-O 3.32Å; K268-L282 WeakPolarHBondContact CA-O 3.3Å; K268-N283 VanDerWaalsContact CB-OD1 3.29Å; K268-N283 WeakPolarHBondContact CB-OD1 3.37Å
269	C	95.5	Very high	91.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.2	178.3	-61.3	0	0	0	0	111	L91 L183 S207 C208 L282	L91-C269 HydrophobicContact CD1-CB 4.37Å; L183-C269 HydrophobicContact CD1-CB 4.37Å; S207-C269 CarbonylContact O-C 3.55Å; S207-C269 VanDerWaalsContact O-CA 3.3Å; S207-C269 WeakPolarHBondContact O-CA 3.48Å; C208-C269 HydrophobicContact CB-CB 4.13Å; C208-C269 WeakPolarHBondContact CB-SG 3.43Å; C208-C269 WeakPolarHBondContact SG-CB 3.4Å; C208-C269 CovalentContact SG-SG 2.04Å; C208-C269 PolarHBondContact SG-SG 2.94Å; C269-L282 HydrophobicContact CB-CB 4.35Å; C269-L282 PolarHBondContact N-O 2.93Å; C269-L282 PolarHBondContact O-N 3.45Å
270	T	92.8	Very high	91.2	Very high	39 Å²	39	51.9 Å²	51.9	24%	0.239	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	149	-175.6	54.9	0	0	0	0	111.6	V206 S207 E281	V206-T270 WeakPolarHBondContact CA-O 3.36Å; S207-T270 PolarHBondContact N-O 3.17Å; S207-T270 PolarHBondContact O-N 2.98Å; S207-T270 PolarHBondContact O-OG1 2.97Å; S207-T270 PolarHBondContact OG-OG1 3.47Å; T270-E281 HydrophobicContact CG2-CB 4.19Å; T270-E281 HydrophobicContact CG2-CG 3.77Å
271	I	90.4	Very high	90.9	Very high	21 Å²	21	50.6 Å²	50.6	11%	0.108	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	130.9	166.9	-57.4	178.4	0	0	0	108	L91 V185 I204 L205 V274 A277	L91-I271 HydrophobicContact CD1-CD1 4.36Å; L91-I271 HydrophobicContact CD1-CG1 3.54Å; L91-I271 HydrophobicContact CD2-CD1 3.73Å; L91-I271 HydrophobicContact CD2-CG1 3.63Å; L91-I271 HydrophobicContact CG-CD1 3.66Å; L91-I271 HydrophobicContact CG-CG1 3.4Å; V185-I271 HydrophobicContact CG2-CD1 4.33Å; I204-I271 HydrophobicContact CG2-CG2 3.67Å; L205-I271 CarbonylContact O-C 3.54Å; L205-I271 WeakPolarHBondContact O-CA 3.42Å; I271-V274 HydrophobicContact CG2-CB 4.23Å; I271-V274 HydrophobicContact CG2-CG2 4.09Å; I271-A277 HydrophobicContact CB-CB 4.27Å; I271-A277 HydrophobicContact CD1-CB 4.16Å; I271-A277 HydrophobicContact CG2-CB 3.92Å
272	S	87.6	Confident	90.9	Very high	45 Å²	45	46.3 Å²	46.3	32%	0.315	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	165.3	172.9	55	0	0	0	0	110.7	L205 V274	L205-S272 VanDerWaalsContact CB-OG 3.24Å; L205-S272 WeakPolarHBondContact CB-OG 3.35Å; L205-S272 PolarHBondContact N-O 3.48Å; L205-S272 VanDerWaalsContact N-O 3.11Å; L205-S272 PolarHBondContact O-N 3.2Å; L205-S272 PolarHBondContact O-OG 2.95Å; S272-V274 VanDerWaalsContact C-N 3.27Å; S272-V274 PolarHBondContact O-N 2.95Å
273	N	86.5	Confident	90.9	Very high	6 Å²	6	45.7 Å²	45.7	3%	0.032	24%	0.24	C	C	.	.	S	Bend	trans	66.3	18	-178.9	-161.3	38.8	0	0	0	115.6	I195 E196 R197 S201 D203 L205	I195-N273 WeakPolarHBondContact CA-O 3.42Å; E196-N273 PolarHBondContact N-O 3.24Å; E196-N273 VanDerWaalsContact N-O 3.1Å; R197-N273 PolarHBondContact N-OD1 3.32Å; S201-N273 PolarHBondContact O-ND2 2.98Å; D203-N273 PolarHBondContact O-ND2 3.02Å; L205-N273 HydrophobicContact CB-CB 4.27Å; L205-N273 HydrophobicContact CD1-CB 3.97Å; L205-N273 HydrophobicContact CG-CB 3.95Å
274	V	87.3	Confident	91	Very high	9 Å²	9	43.7 Å²	43.7	6%	0.055	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-133	125.5	177	-174.1	0	0	0	0	110.5	W191 P193 S194 I195 I204 I271 S272 N276 A277	W191-V274 HydrophobicContact CH2-CG1 4.49Å; W191-V274 HydrophobicContact CZ2-CG1 3.97Å; P193-V274 HydrophobicContact CB-CG1 4.23Å; S194-V274 WeakPolarHBondContact O-CA 3.43Å; I195-V274 HydrophobicContact CD1-CG2 4.41Å; I204-V274 HydrophobicContact CB-CG2 4.06Å; I204-V274 HydrophobicContact CG1-CG2 3.81Å; I204-V274 HydrophobicContact CG2-CG2 3.83Å; I271-V274 HydrophobicContact CG2-CB 4.23Å; I271-V274 HydrophobicContact CG2-CG2 4.09Å; S272-V274 VanDerWaalsContact C-N 3.27Å; S272-V274 PolarHBondContact O-N 2.95Å; V274-N276 WeakPolarHBondContact CG1-OD1 3.48Å; V274-A277 HydrophobicContact CB-CB 3.88Å; V274-A277 HydrophobicContact CG1-CB 3.77Å
275	L	87.2	Confident	90.9	Very high	98 Å²	98	44.1 Å²	44.1	51%	0.513	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-37.3	-178.1	-71.4	173.9	0	0	0	113	S194 E196	S194-L275 PolarHBondContact O-N 2.92Å; E196-L275 HydrophobicContact CB-CD2 4.06Å; E196-L275 HydrophobicContact CB-CG 3.97Å; E196-L275 HydrophobicContact CG-CD2 3.81Å; E196-L275 HydrophobicContact CG-CG 4.24Å
276	N	88.2	Confident	90.9	Very high	32 Å²	32	44 Å²	44	17%	0.171	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	34.1	-176.5	66.9	-28.9	0	0	0	112.6	W191 M192 S194 V274	W191-N276 PolarHBondContact NE1-ND2 3.3Å; W191-N276 VanDerWaalsContact NE1-ND2 3.19Å; W191-N276 PolarHBondContact NE1-O 2.97Å; M192-N276 PolarHBondContact O-ND2 3.39Å; S194-N276 WeakPolarHBondContact CB-OD1 3.27Å; S194-N276 PolarHBondContact N-OD1 3.38Å; V274-N276 WeakPolarHBondContact CG1-OD1 3.48Å
277	A	85.9	Confident	90.8	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.033	22%	0.217	C	C	.	.	S	Bend	trans	-102.7	155.8	169.5	0	0	0	0	0	110	I271 V274 K279	I271-A277 HydrophobicContact CB-CB 4.27Å; I271-A277 HydrophobicContact CD1-CB 4.16Å; I271-A277 HydrophobicContact CG2-CB 3.92Å; V274-A277 HydrophobicContact CB-CB 3.88Å; V274-A277 HydrophobicContact CG1-CB 3.77Å; A277-K279 PolarHBondContact O-N 3.08Å
278	N	85.1	Confident	90.7	Very high	45 Å²	45	42.6 Å²	42.6	24%	0.241	22%	0.218	C	C	.	.			trans	-67.9	129.3	168.6	-166.6	-8.4	0	0	0	108.1	K88 P89 D280	K88-N278 HydrophobicContact CB-CB 4.04Å; P89-N278 WeakPolarHBondContact O-CB 3.4Å; P89-N278 PolarHBondContact O-N 2.83Å; N278-D280 PolarHBondContact ND2-OD2 3.32Å; N278-D280 WeakPolarHBondContact OD1-CB 3.32Å; N278-D280 PolarHBondContact OD1-N 3.1Å; N278-D280 PolarHBondContact OD1-OD1 3.28Å; N278-D280 PolarHBondContact OD1-OD2 3.16Å
279	K	84.5	Confident	90.4	Very high	162 Å²	162	43 Å²	43	70%	0.704	22%	0.222	S	C	*	.			trans	-84.4	-3.5	176.3	-67.4	-171.4	177.5	-176.4	0	112.4	A277	A277-K279 PolarHBondContact O-N 3.08Å
280	D	86.1	Confident	90.2	Very high	115 Å²	115	45.2 Å²	45.2	62%	0.615	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-59.1	138.8	173.1	-65.1	-19.2	0	0	0	110.8	N278	N278-D280 PolarHBondContact ND2-OD2 3.32Å; N278-D280 WeakPolarHBondContact OD1-CB 3.32Å; N278-D280 PolarHBondContact OD1-N 3.1Å; N278-D280 PolarHBondContact OD1-OD1 3.28Å; N278-D280 PolarHBondContact OD1-OD2 3.16Å
281	E	89.5	Confident	90	Very high	86 Å²	86	45.5 Å²	45.5	40%	0.402	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-81.3	132.1	-178.6	-47.1	-175.8	140.8	0	0	109.4	K268 T270	K268-E281 HydrophobicContact CB-CB 4.33Å; K268-E281 WeakPolarHBondContact CD-OE1 3.4Å; K268-E281 VanDerWaalsContact CD-OE2 3.22Å; K268-E281 WeakPolarHBondContact CD-OE2 3.41Å; K268-E281 IonicContact NZ-OE1 2.71Å; K268-E281 PolarHBondContact NZ-OE1 3.49Å; K268-E281 IonicContact NZ-OE2 2.92Å; T270-E281 HydrophobicContact CG2-CB 4.19Å; T270-E281 HydrophobicContact CG2-CG 3.77Å
282	L	93.1	Very high	90	Very high	27 Å²	27	46.9 Å²	46.9	14%	0.141	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	120.3	167.7	169.2	70.7	0	0	0	108.8	L91 F93 L183 K268 C269	L91-L282 HydrophobicContact CB-CB 3.88Å; L91-L282 HydrophobicContact CB-CD2 3.86Å; L91-L282 HydrophobicContact CB-CG 4.42Å; F93-L282 HydrophobicContact CB-CD2 3.97Å; F93-L282 HydrophobicContact CD1-CD1 3.82Å; F93-L282 HydrophobicContact CD1-CD2 3.94Å; F93-L282 HydrophobicContact CD1-CG 4.23Å; F93-L282 HydrophobicContact CE1-CD1 4.26Å; F93-L282 HydrophobicContact CG-CD2 4.37Å; L183-L282 HydrophobicContact CD2-CD2 3.94Å; K268-L282 CarbonylContact C-O 3.52Å; K268-L282 VanDerWaalsContact CA-O 3.32Å; K268-L282 WeakPolarHBondContact CA-O 3.3Å; C269-L282 HydrophobicContact CB-CB 4.35Å; C269-L282 PolarHBondContact N-O 2.93Å; C269-L282 PolarHBondContact O-N 3.45Å
283	N	94.7	Very high	90.2	Very high	68 Å²	68	47 Å²	47	36%	0.364	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.9	-178	-58.3	-42.4	0	0	0	111.7	V267 K268	V267-N283 WeakPolarHBondContact O-CA 3.42Å; K268-N283 VanDerWaalsContact CB-OD1 3.29Å; K268-N283 WeakPolarHBondContact CB-OD1 3.37Å
284	F	95.1	Very high	90.4	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	162	170.5	66.1	-91.1	0	0	0	110.9	F93 S102 I104 V181 F256 V267	F93-F284 HydrophobicContact CD1-CB 4.41Å; F93-F284 HydrophobicContact CD1-CD1 4.33Å; F93-F284 HydrophobicContact CD2-CG 4.4Å; F93-F284 HydrophobicContact CE1-CB 3.76Å; F93-F284 HydrophobicContact CE1-CD1 4.49Å; F93-F284 HydrophobicContact CE1-CG 4.39Å; F93-F284 HydrophobicContact CE2-CB 3.94Å; F93-F284 HydrophobicContact CE2-CG 4.18Å; F93-F284 HydrophobicContact CG-CD1 4.32Å; F93-F284 HydrophobicContact CZ-CB 3.48Å; F93-F284 VanDerWaalsContact CZ-CB 3.48Å; F93-F284 HydrophobicContact CZ-CG 4.16Å; S102-F284 WeakPolarHBondContact O-CB 3.37Å; I104-F284 HydrophobicContact CD1-CD2 4.37Å; V181-F284 HydrophobicContact CB-CZ 4.34Å; V181-F284 HydrophobicContact CG1-CE1 4.33Å; V181-F284 HydrophobicContact CG1-CE2 4.42Å; V181-F284 HydrophobicContact CG1-CZ 3.96Å; V181-F284 HydrophobicContact CG2-CE2 4.04Å; V181-F284 HydrophobicContact CG2-CZ 4.16Å; F256-F284 HydrophobicContact CE2-CE2 4.48Å; F256-F284 HydrophobicContact CE2-CZ 4.31Å; F256-F284 HydrophobicContact CZ-CE2 4.01Å; F256-F284 AromaticContact CZ-CZ 3.84Å; F256-F284 HydrophobicContact CZ-CZ 3.84Å; V267-F284 HydrophobicContact CB-CD1 4.42Å; V267-F284 HydrophobicContact CB-CD2 4.18Å; V267-F284 HydrophobicContact CB-CE1 4.1Å; V267-F284 HydrophobicContact CB-CE2 3.83Å; V267-F284 HydrophobicContact CB-CG 4.47Å; V267-F284 HydrophobicContact CB-CZ 3.8Å; V267-F284 HydrophobicContact CG1-CE1 3.83Å; V267-F284 HydrophobicContact CG1-CE2 4.13Å; V267-F284 HydrophobicContact CG1-CZ 3.59Å; V267-F284 HydrophobicContact CG2-CE2 4Å; V267-F284 HydrophobicContact CG2-CZ 4.31Å; V267-F284 PolarHBondContact N-O 2.96Å; V267-F284 PolarHBondContact O-N 2.92Å; V267-F284 VanDerWaalsContact O-O 3.13Å
285	E	95.2	Very high	90.6	Very high	69 Å²	69	52.3 Å²	52.3	32%	0.322	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.9	-178.8	-71.7	168	-145.1	0	0	109.9	S102 L103 I104 T264 I265 L266	S102-E285 PolarHBondContact O-N 3.17Å; L103-E285 CarbonylContact C-O 3.58Å; L103-E285 WeakPolarHBondContact CA-O 3.4Å; L103-E285 HydrophobicContact CB-CB 4.31Å; L103-E285 HydrophobicContact CD1-CB 3.58Å; I104-E285 PolarHBondContact N-O 3.11Å; T264-E285 HydrophobicContact CG2-CB 4.09Å; T264-E285 HydrophobicContact CG2-CG 4.26Å; I265-E285 WeakPolarHBondContact O-CA 3.46Å; L266-E285 HydrophobicContact CD2-CG 3.44Å; L266-E285 VanDerWaalsContact CD2-CG 3.44Å; L266-E285 HydrophobicContact CG-CG 4.32Å
286	I	95.3	Very high	90.8	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134	174	-165.9	165.2	0	0	0	110.6	I104 P179 F256 I265 V267 V288	I104-I286 HydrophobicContact CB-CG1 4.19Å; I104-I286 HydrophobicContact CG2-CG1 4.27Å; I104-I286 CarbonylContact O-C 3.5Å; I104-I286 WeakPolarHBondContact O-CA 3.22Å; P179-I286 HydrophobicContact CB-CD1 4.11Å; P179-I286 HydrophobicContact CG-CD1 3.4Å; P179-I286 VanDerWaalsContact CG-CD1 3.4Å; P179-I286 HydrophobicContact CG-CG1 4.48Å; F256-I286 HydrophobicContact CD2-CD1 4.36Å; F256-I286 HydrophobicContact CE1-CG2 4.38Å; F256-I286 HydrophobicContact CG-CD1 4.45Å; I265-I286 HydrophobicContact CB-CG2 3.87Å; I265-I286 HydrophobicContact CD1-CG2 4.35Å; I265-I286 HydrophobicContact CG2-CG2 4.43Å; I265-I286 PolarHBondContact N-O 3.04Å; I265-I286 PolarHBondContact O-N 3.45Å; V267-I286 HydrophobicContact CG2-CG2 3.87Å; I286-V288 HydrophobicContact CG1-CG2 4.46Å
287	M	94.9	Very high	91	Very high	16 Å²	16	50.3 Å²	50.3	8%	0.079	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	117.8	173.8	-166.6	173.9	86.3	0	0	109.5	I104 R105 Y106 T264 D289	I104-M287 PolarHBondContact O-N 3.08Å; R105-M287 WeakPolarHBondContact CA-O 3.44Å; R105-M287 HydrophobicContact CG-CB 4.48Å; R105-M287 HydrophobicContact CG-CE 3.72Å; R105-M287 VanDerWaalsContact NH2-CE 3.31Å; Y106-M287 PolarHBondContact N-O 3.15Å; T264-M287 PolarHBondContact OG1-SD 3.27Å; T264-M287 VanDerWaalsContact OG1-SD 3.36Å; M287-D289 WeakPolarHBondContact CE-OD1 3.45Å; M287-D289 WeakPolarHBondContact CE-OD2 3.45Å
288	V	94.5	Very high	91.5	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	109	176.5	-174.7	0	0	0	0	107.5	Y106 P179 P259 K261 S262 I286	Y106-V288 HydrophobicContact CE1-CG2 3.78Å; Y106-V288 HydrophobicContact CE2-CG1 4.15Å; P179-V288 HydrophobicContact CG-CG2 4.11Å; P259-V288 HydrophobicContact CB-CG2 4.46Å; P259-V288 HydrophobicContact CG-CG2 3.98Å; K261-V288 CarbonylContact C-O 3.6Å; K261-V288 WeakPolarHBondContact CA-O 3.24Å; S262-V288 PolarHBondContact N-O 2.9Å; I286-V288 HydrophobicContact CG1-CG2 4.46Å
289	D	89.8	Confident	92.1	Very high	56 Å²	56	55 Å²	55	30%	0.299	27%	0.269	S	S	.	.			trans	-77.1	0	175.1	-75.3	-30	0	0	0	110.8	R105 Y106 S107 A108 M287	R105-D289 IonicContact CZ-OD2 2.94Å; R105-D289 IonicContact NE-OD2 3.61Å; R105-D289 PolarHBondContact NE-OD2 3.18Å; R105-D289 VanDerWaalsContact NE-OD2 3.17Å; R105-D289 IonicContact NH2-OD1 3.49Å; R105-D289 IonicContact NH2-OD2 3.17Å; R105-D289 PolarHBondContact NH2-OD2 3.16Å; Y106-D289 PolarHBondContact O-N 3.19Å; S107-D289 VanDerWaalsContact CA-O 3.29Å; S107-D289 WeakPolarHBondContact CA-O 3.33Å; S107-D289 PolarHBondContact OG-O 3.13Å; A108-D289 PolarHBondContact N-O 2.96Å; A108-D289 VanDerWaalsContact N-O 3.16Å; M287-D289 WeakPolarHBondContact CE-OD1 3.45Å; M287-D289 WeakPolarHBondContact CE-OD2 3.45Å

Retrieved 289 of 289 residues in 91.9 ms (Link to these results)

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