A0A077ZFU4_TRITR Loading...

Programmed cell death protein 2

AlphaFold DB , UniProt , Accession A0A077ZFU4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 367 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	41.7	Very low	40.7	Very low	234 Å²	234	161.9 Å²	161.9	100%	1.153	73%	0.729	S	S	*	*				0	-6.9	0	-78.1	174.3	169	0	0	116.1
2	K	43.5	Very low	40.7	Very low	189 Å²	189	157.3 Å²	157.3	82%	0.822	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-9.3	-177	-72.8	-176.7	176.2	179.8	0	117.1	T5	K2-T5 PolarHBondContact O-OG1 2.85Å
3	I	44.4	Very low	40.8	Very low	150 Å²	150	151.8 Å²	151.8	77%	0.769	69%	0.691	S	S	*	*	H	α-helix	trans	-81.2	-22.8	-176.3	-59.4	174.1	0	0	0	111.7
4	H	37.4	Very low	40.5	Very low	151 Å²	151	154.4 Å²	154.4	70%	0.699	70%	0.7	S	S	*	*	H	α-helix	trans	-71.7	-38.4	-176.2	-118.9	55.5	0	0	0	113.1	K6 R7 V8	H4-K6 PolarHBondContact O-N 2.92Å; H4-R7 PolarHBondContact O-N 3.32Å; H4-V8 VanDerWaalsContact O-CG2 3.25Å; H4-V8 WeakPolarHBondContact O-CG2 3.34Å; H4-V8 PolarHBondContact O-N 3.12Å; H4-V8 VanDerWaalsContact O-N 3.12Å
5	T	40.8	Very low	40.4	Very low	98 Å²	98	155.7 Å²	155.7	60%	0.601	71%	0.708	S	S	*	*	H	α-helix	trans	-67.2	-39.2	-175.5	47.9	0	0	0	0	113.7	K2 R9	K2-T5 PolarHBondContact O-OG1 2.85Å; T5-R9 PolarHBondContact O-N 3.43Å; T5-R9 VanDerWaalsContact O-N 3.1Å
6	K	40.9	Very low	40.6	Very low	155 Å²	155	149.9 Å²	149.9	67%	0.674	68%	0.683	S	S	*	*	H	α-helix	trans	-69.4	-37.1	177.5	-79	-172.9	176.7	-177.1	0	113	H4 R10	H4-K6 PolarHBondContact O-N 2.92Å; K6-R10 WeakPolarHBondContact O-CG 3.41Å; K6-R10 PolarHBondContact O-N 3.32Å; K6-R10 VanDerWaalsContact O-N 3.08Å
7	R	36.2	Very low	41.3	Very low	192 Å²	192	145.7 Å²	145.7	73%	0.725	68%	0.681	S	S	*	*	H	α-helix	trans	-71.9	-33.1	179.7	-158.9	175.1	-177	175.3	-0	111.5	H4 K11	H4-R7 PolarHBondContact O-N 3.32Å; R7-K11 PolarHBondContact O-N 3.31Å; R7-K11 VanDerWaalsContact O-N 3.1Å
8	V	40.9	Very low	42.6	Very low	77 Å²	77	147.6 Å²	147.6	47%	0.467	69%	0.686	S	S	.	*	H	α-helix	trans	-66.3	-48.5	172	174.4	0	0	0	0	110.9	H4 R10 K11 M12	H4-V8 VanDerWaalsContact O-CG2 3.25Å; H4-V8 WeakPolarHBondContact O-CG2 3.34Å; H4-V8 PolarHBondContact O-N 3.12Å; H4-V8 VanDerWaalsContact O-N 3.12Å; V8-R10 VanDerWaalsContact C-N 3.34Å; V8-R10 PolarHBondContact O-N 3.48Å; V8-K11 PolarHBondContact O-N 3.19Å; V8-M12 HydrophobicContact CG1-SD 4.1Å; V8-M12 WeakPolarHBondContact O-CG 3.5Å; V8-M12 PolarHBondContact O-N 3.48Å
9	R	43	Very low	44.9	Very low	197 Å²	197	141.8 Å²	141.8	74%	0.743	66%	0.664	S	S	*	*	H	α-helix	trans	-55.3	-44.3	173.4	-95.5	-177	173.6	168.9	-1.7	112.7	T5 M12 I13	T5-R9 PolarHBondContact O-N 3.43Å; T5-R9 VanDerWaalsContact O-N 3.1Å; R9-M12 PolarHBondContact O-N 3.09Å; R9-I13 WeakPolarHBondContact O-CG1 3.42Å; R9-I13 PolarHBondContact O-N 3.1Å; R9-I13 VanDerWaalsContact O-N 3.14Å
10	R	42.3	Very low	47.3	Very low	176 Å²	176	135.7 Å²	135.7	66%	0.664	64%	0.637	S	S	*	*	H	α-helix	trans	-67.2	-34.8	179.1	-75.9	-179.7	174.5	173.9	-3.4	114.6	K6 V8	K6-R10 WeakPolarHBondContact O-CG 3.41Å; K6-R10 PolarHBondContact O-N 3.32Å; K6-R10 VanDerWaalsContact O-N 3.08Å; V8-R10 VanDerWaalsContact C-N 3.34Å; V8-R10 PolarHBondContact O-N 3.48Å
11	K	36.1	Very low	49.6	Very low	162 Å²	162	131.5 Å²	131.5	70%	0.704	62%	0.617	S	S	*	*	H	α-helix	trans	-71.2	-35.3	174.9	-100.9	-172.4	173.2	-172.9	0	111.7	R7 V8 K14	R7-K11 PolarHBondContact O-N 3.31Å; R7-K11 VanDerWaalsContact O-N 3.1Å; V8-K11 PolarHBondContact O-N 3.19Å; K11-K14 PolarHBondContact O-N 3.29Å
12	M	40.8	Very low	52.2	Low	107 Å²	107	120.6 Å²	120.6	53%	0.527	56%	0.563	S	S	.	*	H	α-helix	trans	-62.5	-44	173.9	-67.6	176.1	109	0	0	110.7	V8 R9 K14 Q15 M16	V8-M12 HydrophobicContact CG1-SD 4.1Å; V8-M12 WeakPolarHBondContact O-CG 3.5Å; V8-M12 PolarHBondContact O-N 3.48Å; R9-M12 PolarHBondContact O-N 3.09Å; M12-K14 VanDerWaalsContact C-N 3.29Å; M12-K14 PolarHBondContact O-N 3.46Å; M12-Q15 PolarHBondContact O-N 3.23Å; M12-Q15 VanDerWaalsContact O-N 3.08Å; M12-M16 VanDerWaalsContact C-SD 3.57Å; M12-M16 HydrophobicContact CB-SD 3.96Å; M12-M16 WeakPolarHBondContact O-CB 3.5Å; M12-M16 WeakPolarHBondContact O-CG 3.42Å; M12-M16 PolarHBondContact O-N 3.47Å
13	I	41.9	Very low	54.8	Low	85 Å²	85	111.6 Å²	111.6	44%	0.436	52%	0.524	S	S	.	.	H	α-helix	trans	-55.8	-38.5	178.2	-66.4	165.2	0	0	0	113	R9 M16 A17	R9-I13 WeakPolarHBondContact O-CG1 3.42Å; R9-I13 PolarHBondContact O-N 3.1Å; R9-I13 VanDerWaalsContact O-N 3.14Å; I13-M16 PolarHBondContact O-N 2.86Å; I13-A17 PolarHBondContact O-N 3.12Å
14	K	37.3	Very low	57.3	Low	188 Å²	188	106.2 Å²	106.2	82%	0.817	50%	0.495	S	S	*	.	H	α-helix	trans	-70.5	-29.9	178.9	-97.2	-172.4	175.1	-173.3	0	114.4	K11 M12	K11-K14 PolarHBondContact O-N 3.29Å; M12-K14 VanDerWaalsContact C-N 3.29Å; M12-K14 PolarHBondContact O-N 3.46Å
15	Q	39.1	Very low	60.2	Low	174 Å²	174	99.8 Å²	99.8	81%	0.813	47%	0.466	S	S	*	.	H	α-helix	trans	-82.3	-27.2	171	-91	179.1	-20.7	0	0	111.8	M12 A17	M12-Q15 PolarHBondContact O-N 3.23Å; M12-Q15 VanDerWaalsContact O-N 3.08Å; Q15-A17 VanDerWaalsContact C-N 3.3Å; Q15-A17 PolarHBondContact O-N 3.34Å
16	M	43.9	Very low	62.8	Low	64 Å²	64	97.3 Å²	97.3	32%	0.315	45%	0.451	S	S	.	.	H	α-helix	trans	-71.4	-16.5	179.3	-72.8	165.7	124.2	0	0	114.5	M12 I13 K18 S19 V211	M12-M16 VanDerWaalsContact C-SD 3.57Å; M12-M16 HydrophobicContact CB-SD 3.96Å; M12-M16 WeakPolarHBondContact O-CB 3.5Å; M12-M16 WeakPolarHBondContact O-CG 3.42Å; M12-M16 PolarHBondContact O-N 3.47Å; I13-M16 PolarHBondContact O-N 2.86Å; M16-K18 PolarHBondContact O-N 3.28Å; M16-S19 WeakPolarHBondContact CA-OG 3.33Å; M16-S19 PolarHBondContact O-N 2.95Å; M16-S19 PolarHBondContact O-OG 3.01Å; M16-S19 VanDerWaalsContact O-OG 3.12Å; M16-V211 HydrophobicContact CE-CG2 3.69Å
17	A	51.7	Low	65.4	Low	78 Å²	78	95.3 Å²	95.3	65%	0.645	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-8.1	178.6	0	0	0	0	0	114.6	I13 Q15	I13-A17 PolarHBondContact O-N 3.12Å; Q15-A17 VanDerWaalsContact C-N 3.3Å; Q15-A17 PolarHBondContact O-N 3.34Å
18	K	65.6	Low	68.1	Low	180 Å²	180	87.7 Å²	87.7	78%	0.783	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-14.7	173.3	-69.1	-171.2	175.5	-173.4	0	115.1	M16 Q284	M16-K18 PolarHBondContact O-N 3.28Å; K18-Q284 PolarHBondContact O-NE2 3.42Å
19	S	86.1	Confident	70.6	Confident	38 Å²	38	90.5 Å²	90.5	27%	0.266	44%	0.438	S	S	.	.	S	Bend	trans	-85.7	139.8	-177.3	53.9	0	0	0	0	111.1	M16	M16-S19 WeakPolarHBondContact CA-OG 3.33Å; M16-S19 PolarHBondContact O-N 2.95Å; M16-S19 PolarHBondContact O-OG 3.01Å; M16-S19 VanDerWaalsContact O-OG 3.12Å
20	V	92.6	Very high	72.8	Confident	18 Å²	18	85.3 Å²	85.3	11%	0.109	43%	0.432	C	S	.	.			trans	-76.4	138.2	171.5	-179.9	0	0	0	0	108.8	L22 E212 R282 Q284	V20-L22 HydrophobicContact CG1-CD2 4.02Å; V20-E212 HydrophobicContact CB-CB 4.11Å; V20-E212 WeakPolarHBondContact CB-OE2 3.44Å; V20-E212 HydrophobicContact CG1-CB 4.48Å; V20-E212 VanDerWaalsContact O-CB 3.3Å; V20-E212 WeakPolarHBondContact O-CB 3.23Å; V20-E212 PolarHBondContact O-N 3.27Å; V20-R282 HydrophobicContact CG1-CB 4.13Å; V20-Q284 HydrophobicContact CG2-CB 4.26Å; V20-Q284 HydrophobicContact CG2-CG 4.31Å
21	E	95.7	Very high	75.1	Confident	49 Å²	49	78.4 Å²	78.4	23%	0.229	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130	171.4	-65.1	178.1	154.4	0	0	109.7	E210 R282 Y283	E21-E210 CarbonylContact C-O 3.52Å; E21-E210 VanDerWaalsContact CA-O 3.29Å; E21-E210 WeakPolarHBondContact CA-O 3.29Å; E21-R282 CarbonylContact O-C 3.5Å; E21-R282 WeakPolarHBondContact O-CA 3.22Å; E21-Y283 PolarHBondContact N-O 3.07Å; E21-Y283 PolarHBondContact O-N 3.45Å
22	L	96.7	Very high	77.9	Confident	4 Å²	4	73 Å²	73	2%	0.021	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.3	177.2	-52	-171	0	0	0	109.2	V20 F24 T209 E210 E212 N276 Q279 I281 R282	V20-L22 HydrophobicContact CG1-CD2 4.02Å; L22-F24 HydrophobicContact CB-CE2 3.68Å; L22-F24 HydrophobicContact CB-CZ 3.81Å; L22-F24 HydrophobicContact CD1-CZ 4.14Å; L22-T209 CarbonylContact O-C 3.56Å; L22-T209 VanDerWaalsContact O-CA 3.23Å; L22-T209 WeakPolarHBondContact O-CA 3.23Å; L22-E210 PolarHBondContact N-O 2.84Å; L22-E210 PolarHBondContact O-N 2.94Å; L22-E212 HydrophobicContact CD1-CB 4.21Å; L22-E212 HydrophobicContact CD1-CG 4.02Å; L22-E212 HydrophobicContact CD2-CB 4.05Å; L22-E212 HydrophobicContact CD2-CG 4.2Å; L22-E212 HydrophobicContact CG-CB 3.88Å; L22-E212 HydrophobicContact CG-CG 4.18Å; L22-N276 HydrophobicContact CD1-CB 3.65Å; L22-Q279 HydrophobicContact CB-CB 4.46Å; L22-I281 CarbonylContact C-O 3.17Å; L22-I281 WeakPolarHBondContact CA-O 3.24Å; L22-R282 HydrophobicContact CD2-CB 4.46Å; L22-R282 HydrophobicContact CD2-CG 3.87Å; L22-R282 VanDerWaalsContact CD2-NH1 3.26Å
23	G	97.5	Very high	80.5	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	139.6	173	0	0	0	0	0	111.7	V208 V280 I281	G23-V208 CarbonylContact C-O 3.57Å; G23-V208 VanDerWaalsContact CA-O 3.29Å; G23-V208 WeakPolarHBondContact CA-O 3.42Å; G23-V280 VanDerWaalsContact O-CG2 3.26Å; G23-V280 WeakPolarHBondContact O-CG2 3.41Å; G23-V280 PolarHBondContact O-N 3.48Å; G23-I281 PolarHBondContact N-O 3.23Å; G23-I281 PolarHBondContact O-N 3.1Å
24	F	97.7	Very high	83.1	Confident	37 Å²	37	65 Å²	65	16%	0.162	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.7	178.5	-58.3	-84.5	0	0	0	110.6	L22 I207 V208 E210 N276 E278 Q279	L22-F24 HydrophobicContact CB-CE2 3.68Å; L22-F24 HydrophobicContact CB-CZ 3.81Å; L22-F24 HydrophobicContact CD1-CZ 4.14Å; F24-I207 WeakPolarHBondContact O-CA 3.25Å; F24-V208 PolarHBondContact N-O 3.04Å; F24-V208 PolarHBondContact O-N 3.41Å; F24-E210 HydrophobicContact CE2-CB 4.31Å; F24-E210 HydrophobicContact CE2-CG 4.44Å; F24-N276 HydrophobicContact CE1-CB 4.49Å; F24-N276 HydrophobicContact CZ-CB 4.39Å; F24-E278 HydrophobicContact CD1-CB 4.46Å; F24-Q279 HydrophobicContact CE1-CB 4.09Å; F24-Q279 HydrophobicContact CZ-CB 4.49Å
25	I	97.6	Very high	85.8	Confident	17 Å²	17	56.9 Å²	56.9	9%	0.087	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	126	178.5	-65.7	-65.1	0	0	0	110	F42 Y205 E206 I207 V280 L320 Y323	I25-F42 HydrophobicContact CD1-CB 3.65Å; I25-F42 HydrophobicContact CD1-CG 4.17Å; I25-Y205 VanDerWaalsContact CG2-CB 3.5Å; I25-Y205 HydrophobicContact CG2-CD1 3.94Å; I25-Y205 HydrophobicContact CG2-CD2 3.95Å; I25-Y205 HydrophobicContact CG2-CG 3.55Å; I25-E206 WeakPolarHBondContact CA-O 3.45Å; I25-I207 HydrophobicContact CD1-CG1 3.87Å; I25-V280 HydrophobicContact CD1-CG2 4Å; I25-V280 HydrophobicContact CG1-CB 4.3Å; I25-V280 HydrophobicContact CG1-CG1 3.75Å; I25-V280 HydrophobicContact CG1-CG2 3.79Å; I25-L320 HydrophobicContact CD1-CD1 3.83Å; I25-L320 HydrophobicContact CG1-CD1 4.08Å; I25-Y323 HydrophobicContact CB-CD1 4.23Å; I25-Y323 HydrophobicContact CB-CD2 4.32Å; I25-Y323 HydrophobicContact CB-CE1 3.85Å; I25-Y323 HydrophobicContact CB-CE2 3.94Å; I25-Y323 HydrophobicContact CB-CG 4.45Å; I25-Y323 HydrophobicContact CG1-CD1 4.47Å; I25-Y323 HydrophobicContact CG1-CD2 3.9Å; I25-Y323 HydrophobicContact CG1-CE1 4.46Å; I25-Y323 HydrophobicContact CG1-CE2 3.88Å; I25-Y323 HydrophobicContact CG1-CG 4.2Å; I25-Y323 HydrophobicContact CG2-CD1 3.63Å; I25-Y323 HydrophobicContact CG2-CE1 3.47Å; I25-Y323 VanDerWaalsContact CG2-CE1 3.47Å; I25-Y323 HydrophobicContact CG2-CE2 4.38Å; I25-Y323 HydrophobicContact CG2-CG 4.15Å
26	T	96.1	Very high	88.5	Confident	46 Å²	46	49.2 Å²	49.2	28%	0.282	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.7	174.7	58.8	0	0	0	0	111.1	E206 V208	T26-E206 PolarHBondContact N-O 3.28Å; T26-E206 PolarHBondContact O-N 3Å; T26-V208 HydrophobicContact CG2-CB 4.43Å; T26-V208 HydrophobicContact CG2-CG2 4.05Å; T26-V208 WeakPolarHBondContact OG1-CG2 3.25Å
27	P	95.6	Very high	91	Very high	112 Å²	112	47.9 Å²	47.9	73%	0.727	28%	0.277	S	S	*	.			trans	-56.4	139.6	167	-21.9	33.4	0	0	0	110.9
28	S	92.8	Very high	93.1	Very high	33 Å²	33	45 Å²	45	23%	0.231	25%	0.249	C	C	.	.			trans	-148.9	150.5	177.7	-160.4	0	0	0	0	109.8	N32 E206	S28-N32 WeakPolarHBondContact OG-CB 3.3Å; S28-N32 PolarHBondContact OG-ND2 3.38Å; S28-E206 VanDerWaalsContact CB-OE2 3.25Å; S28-E206 WeakPolarHBondContact CB-OE2 3.26Å; S28-E206 PolarHBondContact OG-OE2 3.08Å
29	E	91.8	Very high	94.6	Very high	136 Å²	136	36.9 Å²	36.9	64%	0.636	22%	0.215	S	C	*	.			trans	-65.4	141.1	174.7	-66.9	-88.9	104.7	0	0	109.8	C31 N32	E29-C31 PolarHBondContact O-N 3.22Å; E29-N32 WeakPolarHBondContact O-CB 3.49Å; E29-N32 PolarHBondContact O-N 2.94Å
30	S	90.7	Very high	95.2	Very high	88 Å²	88	36.2 Å²	36.2	62%	0.615	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.2	-179.8	-60.5	0	0	0	0	113.4	N32 L33	S30-N32 VanDerWaalsContact C-N 3.26Å; S30-N32 PolarHBondContact O-N 3.1Å; S30-L33 PolarHBondContact O-N 3.41Å
31	C	90.6	Very high	95.5	Very high	31 Å²	31	35.4 Å²	35.4	21%	0.209	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.5	174.5	51.1	0	0	0	0	113.6	E29 L33 F37 C132	E29-C31 PolarHBondContact O-N 3.22Å; C31-L33 VanDerWaalsContact C-N 3.35Å; C31-F37 VanDerWaalsContact O-CD2 3.29Å; C31-F37 WeakPolarHBondContact O-CD2 3.19Å; C31-F37 WeakPolarHBondContact O-CE2 3.34Å; C31-C132 HydrophobicContact CB-CB 4.06Å; C31-C132 WeakPolarHBondContact CB-SG 3.42Å; C31-C132 WeakPolarHBondContact SG-CB 3.43Å; C31-C132 CovalentContact SG-SG 2.04Å; C31-C132 PolarHBondContact SG-SG 3.33Å
32	N	93.6	Very high	95.6	Very high	47 Å²	47	33 Å²	33	25%	0.251	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-26.6	173.9	-65.6	-34.1	0	0	0	112.3	S28 E29 S30 P131 C132	S28-N32 WeakPolarHBondContact OG-CB 3.3Å; S28-N32 PolarHBondContact OG-ND2 3.38Å; E29-N32 WeakPolarHBondContact O-CB 3.49Å; E29-N32 PolarHBondContact O-N 2.94Å; S30-N32 VanDerWaalsContact C-N 3.26Å; S30-N32 PolarHBondContact O-N 3.1Å; N32-P131 VanDerWaalsContact OD1-CB 3.3Å; N32-P131 WeakPolarHBondContact OD1-CB 3.39Å; N32-P131 VanDerWaalsContact OD1-CG 3.25Å; N32-P131 WeakPolarHBondContact OD1-CG 3.44Å; N32-C132 PolarHBondContact OD1-SG 2.89Å
33	L	96.3	Very high	95.5	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	16.4	-168.5	-55.6	-177.1	0	0	0	113.6	S30 C31 P39 K41 E204 E206	S30-L33 PolarHBondContact O-N 3.41Å; C31-L33 VanDerWaalsContact C-N 3.35Å; L33-P39 HydrophobicContact CD2-CB 4Å; L33-K41 HydrophobicContact CB-CD 4.19Å; L33-K41 HydrophobicContact CD2-CB 4.22Å; L33-E204 HydrophobicContact CD1-CG 3.64Å; L33-E206 HydrophobicContact CD2-CB 3.93Å; L33-E206 HydrophobicContact CD2-CG 4.12Å
34	A	95.2	Very high	95.4	Very high	19 Å²	19	33.2 Å²	33.2	16%	0.157	20%	0.197	C	C	.	.	S	Bend	trans	-84.1	152.9	178.2	0	0	0	0	0	112.8	P36 F37 P39 V140	A34-P36 VanDerWaalsContact O-N 3.16Å; A34-F37 HydrophobicContact CB-CD2 4.04Å; A34-F37 HydrophobicContact CB-CE2 4.14Å; A34-F37 PolarHBondContact O-N 2.72Å; A34-P39 WeakPolarHBondContact O-CD 3.46Å; A34-V140 HydrophobicContact CB-CG1 4.25Å; A34-V140 HydrophobicContact CB-CG2 3.64Å
35	S	95.7	Very high	95.4	Very high	17 Å²	17	35.3 Å²	35.3	12%	0.119	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-44.5	-43.9	179.7	-74.9	0	0	0	0	116.7	F37 F38 A47 W48	S35-F37 PolarHBondContact O-N 3.23Å; S35-F38 PolarHBondContact O-N 2.93Å; S35-A47 VanDerWaalsContact OG-CA 3.32Å; S35-A47 WeakPolarHBondContact OG-CA 3.47Å; S35-W48 WeakPolarHBondContact CB-O 3.17Å; S35-W48 PolarHBondContact OG-N 3.34Å; S35-W48 VanDerWaalsContact OG-N 3.15Å; S35-W48 PolarHBondContact OG-O 3.49Å
36	P	95.1	Very high	95.3	Very high	14 Å²	14	35 Å²	35	9%	0.091	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-60.8	-18.4	-178.4	-20.4	30.3	0	0	0	115.1	A34 F38 Y124 A139 V140 V143	A34-P36 VanDerWaalsContact O-N 3.16Å; P36-F38 WeakPolarHBondContact O-CE2 3.47Å; P36-Y124 HydrophobicContact CB-CD1 4.39Å; P36-A139 HydrophobicContact CB-CB 4.32Å; P36-A139 HydrophobicContact CG-CB 4.44Å; P36-V140 HydrophobicContact CG-CG2 3.97Å; P36-V143 HydrophobicContact CG-CB 4.1Å; P36-V143 HydrophobicContact CG-CG1 4.48Å; P36-V143 HydrophobicContact CG-CG2 3.87Å
37	F	95.8	Very high	95.4	Very high	36 Å²	36	33.1 Å²	33.1	16%	0.158	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-102.4	1.2	-175.2	-48.6	-57.9	0	0	0	113	C31 A34 S35 P131 V140	C31-F37 VanDerWaalsContact O-CD2 3.29Å; C31-F37 WeakPolarHBondContact O-CD2 3.19Å; C31-F37 WeakPolarHBondContact O-CE2 3.34Å; A34-F37 HydrophobicContact CB-CD2 4.04Å; A34-F37 HydrophobicContact CB-CE2 4.14Å; A34-F37 PolarHBondContact O-N 2.72Å; S35-F37 PolarHBondContact O-N 3.23Å; F37-P131 HydrophobicContact CD1-CB 4.17Å; F37-P131 HydrophobicContact CD2-CB 3.81Å; F37-P131 HydrophobicContact CE1-CB 4.13Å; F37-P131 HydrophobicContact CE2-CB 3.76Å; F37-P131 HydrophobicContact CG-CB 4.03Å; F37-P131 HydrophobicContact CZ-CB 3.93Å; F37-V140 HydrophobicContact CE2-CG2 3.7Å; F37-V140 HydrophobicContact CZ-CG2 4.1Å
38	F	96.2	Very high	95.5	Very high	16 Å²	16	28 Å²	28	7%	0.07	16%	0.161	C	C	.	.			trans	49.4	53.3	176.1	-45.3	-71.4	0	0	0	113.8	S35 P36 L49 Y76 H87 M89 Y124	S35-F38 PolarHBondContact O-N 2.93Å; P36-F38 WeakPolarHBondContact O-CE2 3.47Å; F38-L49 HydrophobicContact CD1-CD1 3.72Å; F38-L49 HydrophobicContact CE1-CD1 3.6Å; F38-Y76 HydrophobicContact CB-CD2 3.73Å; F38-Y76 HydrophobicContact CB-CE2 3.94Å; F38-Y76 HydrophobicContact CB-CG 4.14Å; F38-Y76 HydrophobicContact CG-CD2 4.44Å; F38-Y76 HydrophobicContact CG-CE2 4.22Å; F38-Y76 WeakPolarHBondContact O-CB 3.39Å; F38-H87 AromaticContact CE2-CE1 3.62Å; F38-H87 AromaticContact CZ-CE1 3.72Å; F38-H87 AromaticContact CZ-NE2 3.84Å; F38-M89 HydrophobicContact CB-CE 3.98Å; F38-Y124 HydrophobicContact CE1-CD1 4.17Å; F38-Y124 AromaticContact CE1-CD2 3.69Å; F38-Y124 HydrophobicContact CE1-CD2 3.69Å; F38-Y124 HydrophobicContact CE1-CE1 4.26Å; F38-Y124 AromaticContact CE1-CE2 3.79Å; F38-Y124 HydrophobicContact CE1-CE2 3.79Å; F38-Y124 AromaticContact CE1-CG 3.88Å; F38-Y124 HydrophobicContact CE1-CG 3.88Å; F38-Y124 HydrophobicContact CZ-CD1 4.1Å; F38-Y124 AromaticContact CZ-CD2 3.89Å; F38-Y124 HydrophobicContact CZ-CD2 3.89Å; F38-Y124 HydrophobicContact CZ-CE2 4.42Å; F38-Y124 AromaticContact CZ-CG 3.7Å; F38-Y124 HydrophobicContact CZ-CG 3.7Å
39	P	97.1	Very high	95.7	Very high	10 Å²	10	26.5 Å²	26.5	7%	0.065	15%	0.15	C	C	.	.			trans	-70.8	145	-171.7	31.6	-38.5	0	0	0	112.1	L33 A34 K41 A47 Q74	L33-P39 HydrophobicContact CD2-CB 4Å; A34-P39 WeakPolarHBondContact O-CD 3.46Å; P39-K41 HydrophobicContact CB-CB 4.49Å; P39-K41 HydrophobicContact CB-CD 4.37Å; P39-K41 HydrophobicContact CG-CD 3.83Å; P39-K41 HydrophobicContact CG-CG 4.36Å; P39-A47 HydrophobicContact CG-CB 3.85Å; P39-Q74 PolarHBondContact O-NE2 3.16Å
40	C	98.4	Very high	95.8	Very high	25 Å²	25	20.2 Å²	20.2	17%	0.169	12%	0.121	C	C	.	.			trans	-82.8	119.7	153.5	-64.9	0	0	0	0	107.4	Q74 I75 Y76 I207	C40-Q74 WeakPolarHBondContact CA-O 3.4Å; C40-I75 HydrophobicContact CB-CD1 4.43Å; C40-Y76 PolarHBondContact SG-N 3.08Å; C40-I207 HydrophobicContact CB-CB 4.06Å; C40-I207 WeakPolarHBondContact CB-O 3.38Å; C40-I207 PolarHBondContact O-N 2.79Å
41	K	98.3	Very high	96	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	153.9	-173.4	64.1	-176.3	-66.2	-83.4	0	112.7	L33 P39 G43 K45 A47 L73 Q74 E204 Y205	L33-K41 HydrophobicContact CB-CD 4.19Å; L33-K41 HydrophobicContact CD2-CB 4.22Å; P39-K41 HydrophobicContact CB-CB 4.49Å; P39-K41 HydrophobicContact CB-CD 4.37Å; P39-K41 HydrophobicContact CG-CD 3.83Å; P39-K41 HydrophobicContact CG-CG 4.36Å; K41-G43 PolarHBondContact NZ-O 2.84Å; K41-K45 PolarHBondContact NZ-O 3.22Å; K41-A47 HydrophobicContact CD-CB 4.26Å; K41-L73 CarbonylContact O-C 3.6Å; K41-L73 WeakPolarHBondContact O-CA 3.17Å; K41-L73 VanDerWaalsContact O-CB 3.29Å; K41-L73 WeakPolarHBondContact O-CB 3.49Å; K41-Q74 HydrophobicContact CD-CG 4.33Å; K41-Q74 HydrophobicContact CG-CG 3.57Å; K41-Q74 PolarHBondContact N-O 3.42Å; K41-Q74 PolarHBondContact O-N 3.04Å; K41-E204 WeakPolarHBondContact CE-OE1 3.4Å; K41-E204 IonicContact NZ-OE1 3.18Å; K41-E204 PolarHBondContact NZ-OE1 3.4Å; K41-Y205 CarbonylContact C-O 3.59Å; K41-Y205 VanDerWaalsContact CA-O 3.27Å; K41-Y205 WeakPolarHBondContact CA-O 3.46Å; K41-Y205 VanDerWaalsContact CB-O 3.27Å; K41-Y205 WeakPolarHBondContact CB-O 3.31Å
42	F	98	Very high	96	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143.4	169.1	164.3	-92.3	0	0	0	110.1	I25 L72 F202 P203 E204 Y205 I207 L320 Y323 M324	I25-F42 HydrophobicContact CD1-CB 3.65Å; I25-F42 HydrophobicContact CD1-CG 4.17Å; F42-L72 HydrophobicContact CD2-CD1 3.96Å; F42-L72 WeakPolarHBondContact CD2-O 3.16Å; F42-L72 HydrophobicContact CE2-CD1 3.57Å; F42-F202 HydrophobicContact CE1-CB 4.02Å; F42-F202 HydrophobicContact CE2-CB 4.39Å; F42-F202 HydrophobicContact CE2-CG 4.47Å; F42-F202 HydrophobicContact CZ-CB 3.77Å; F42-F202 HydrophobicContact CZ-CG 4.1Å; F42-P203 VanDerWaalsContact CD1-O 3.29Å; F42-P203 WeakPolarHBondContact CD1-O 3.46Å; F42-P203 VanDerWaalsContact CE1-O 3.27Å; F42-P203 WeakPolarHBondContact CE1-O 2.87Å; F42-E204 WeakPolarHBondContact O-CA 3.36Å; F42-Y205 AromaticContact CD1-CD2 3.83Å; F42-Y205 HydrophobicContact CD1-CD2 3.83Å; F42-Y205 HydrophobicContact CE1-CD2 4.13Å; F42-Y205 PolarHBondContact N-O 2.83Å; F42-Y205 PolarHBondContact O-N 3.46Å; F42-I207 HydrophobicContact CB-CD1 4.22Å; F42-I207 HydrophobicContact CB-CG1 4.3Å; F42-L320 HydrophobicContact CB-CD1 4.4Å; F42-L320 HydrophobicContact CD2-CD1 3.54Å; F42-L320 HydrophobicContact CD2-CD2 3.95Å; F42-L320 HydrophobicContact CD2-CG 3.94Å; F42-L320 HydrophobicContact CE2-CD1 3.89Å; F42-L320 HydrophobicContact CE2-CD2 4.14Å; F42-L320 HydrophobicContact CE2-CG 3.91Å; F42-L320 HydrophobicContact CG-CD1 3.98Å; F42-Y323 WeakPolarHBondContact CE1-O 3.44Å; F42-Y323 WeakPolarHBondContact CZ-O 3.29Å; F42-M324 HydrophobicContact CE2-CE 4.13Å; F42-M324 HydrophobicContact CE2-CG 4.12Å; F42-M324 HydrophobicContact CZ-CG 3.92Å
43	G	96.4	Very high	95.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	60.4	-163.2	175.3	0	0	0	0	0	115.1	K41 F71 L72 P203	K41-G43 PolarHBondContact NZ-O 2.84Å; G43-F71 WeakPolarHBondContact O-CD1 3.45Å; G43-F71 WeakPolarHBondContact O-CE1 3.25Å; G43-L72 PolarHBondContact N-O 3Å; G43-P203 WeakPolarHBondContact CA-O 3.44Å
44	G	95.3	Very high	95.9	Very high	8 Å²	8	20.5 Å²	20.5	8%	0.082	12%	0.119	C	C	.	.	S	Bend	trans	64.4	-155.7	-171.4	0	0	0	0	0	113.6	F71 L201 F202 E204	G44-F71 WeakPolarHBondContact O-CD1 3.28Å; G44-L201 WeakPolarHBondContact O-CD2 3.46Å; G44-F202 PolarHBondContact N-O 2.9Å; G44-E204 WeakPolarHBondContact CA-OE1 3.47Å
45	K	96	Very high	96	Very high	80 Å²	80	20 Å²	20	35%	0.348	11%	0.113	S	C	.	.	S	Bend	trans	-88.5	152.8	172	-69.7	178.9	-178.9	170.7	0	109.9	K41 A47 E152 L201	K41-K45 PolarHBondContact NZ-O 3.22Å; K45-A47 PolarHBondContact O-N 3.28Å; K45-E152 WeakPolarHBondContact CE-O 3.42Å; K45-E152 PolarHBondContact NZ-O 2.51Å; K45-L201 HydrophobicContact CG-CD1 3.67Å
46	P	97.3	Very high	96	Very high	11 Å²	11	21.2 Å²	21.2	7%	0.071	12%	0.122	C	C	.	.			trans	-61.1	131.2	173.5	-19.2	30.2	0	0	0	111.1	W48 F71 Y91 F93 C154	P46-W48 VanDerWaalsContact C-N 3.3Å; P46-W48 HydrophobicContact CB-CD2 3.73Å; P46-W48 VanDerWaalsContact CB-CE2 3.49Å; P46-W48 HydrophobicContact CB-CE3 4.02Å; P46-W48 HydrophobicContact CB-CG 4.33Å; P46-W48 HydrophobicContact CB-CH2 3.98Å; P46-W48 HydrophobicContact CB-CZ2 3.65Å; P46-W48 HydrophobicContact CB-CZ3 4.14Å; P46-W48 HydrophobicContact CG-CH2 4Å; P46-W48 HydrophobicContact CG-CZ2 3.53Å; P46-W48 PolarHBondContact O-N 3.26Å; P46-F71 HydrophobicContact CB-CD2 4.17Å; P46-F71 HydrophobicContact CB-CE2 4.16Å; P46-F71 HydrophobicContact CB-CG 4.42Å; P46-F71 HydrophobicContact CB-CZ 4.4Å; P46-F71 HydrophobicContact CG-CB 4Å; P46-F71 HydrophobicContact CG-CD1 4.22Å; P46-F71 HydrophobicContact CG-CD2 3.74Å; P46-F71 HydrophobicContact CG-CE2 4.24Å; P46-F71 HydrophobicContact CG-CG 3.71Å; P46-Y91 HydrophobicContact CB-CD1 4.16Å; P46-Y91 HydrophobicContact CB-CE1 4.18Å; P46-F93 HydrophobicContact CG-CE1 4.32Å; P46-F93 HydrophobicContact CG-CZ 4.01Å; P46-C154 WeakPolarHBondContact CD-O 3.09Å
47	A	97	Very high	96	Very high	7 Å²	7	22 Å²	22	6%	0.058	12%	0.124	C	C	.	.			trans	-82.6	82.7	162.8	0	0	0	0	0	107.4	S35 P39 K41 K45 Q74 Y91	S35-A47 VanDerWaalsContact OG-CA 3.32Å; S35-A47 WeakPolarHBondContact OG-CA 3.47Å; P39-A47 HydrophobicContact CG-CB 3.85Å; K41-A47 HydrophobicContact CD-CB 4.26Å; K45-A47 PolarHBondContact O-N 3.28Å; A47-Q74 PolarHBondContact O-NE2 3.11Å; A47-Y91 PolarHBondContact O-OH 3.44Å
48	W	97.4	Very high	95.9	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.015	14%	0.143	C	C	.	.			trans	-57.1	144.5	-178.3	-66.5	121.6	0	0	0	111.9	S35 P46 L51 I54 P55 Y91 F93 Y124 G155 I156 Y355	S35-W48 WeakPolarHBondContact CB-O 3.17Å; S35-W48 PolarHBondContact OG-N 3.34Å; S35-W48 VanDerWaalsContact OG-N 3.15Å; S35-W48 PolarHBondContact OG-O 3.49Å; P46-W48 VanDerWaalsContact C-N 3.3Å; P46-W48 HydrophobicContact CB-CD2 3.73Å; P46-W48 VanDerWaalsContact CB-CE2 3.49Å; P46-W48 HydrophobicContact CB-CE3 4.02Å; P46-W48 HydrophobicContact CB-CG 4.33Å; P46-W48 HydrophobicContact CB-CH2 3.98Å; P46-W48 HydrophobicContact CB-CZ2 3.65Å; P46-W48 HydrophobicContact CB-CZ3 4.14Å; P46-W48 HydrophobicContact CG-CH2 4Å; P46-W48 HydrophobicContact CG-CZ2 3.53Å; P46-W48 PolarHBondContact O-N 3.26Å; W48-L51 HydrophobicContact CB-CD2 4.12Å; W48-I54 HydrophobicContact CB-CD1 4.27Å; W48-I54 HydrophobicContact CD2-CD1 4.49Å; W48-I54 HydrophobicContact CD2-CG1 4.26Å; W48-I54 HydrophobicContact CD2-CG2 4.13Å; W48-I54 VanDerWaalsContact CE2-CG2 3.5Å; W48-I54 HydrophobicContact CG-CD1 3.87Å; W48-I54 HydrophobicContact CG-CG1 4.07Å; W48-I54 HydrophobicContact CH2-CG2 4.36Å; W48-I54 HydrophobicContact CZ2-CG2 3.63Å; W48-P55 HydrophobicContact CH2-CB 4.49Å; W48-P55 HydrophobicContact CH2-CG 3.83Å; W48-P55 HydrophobicContact CZ3-CG 4.16Å; W48-Y91 VanDerWaalsContact C-OH 3.26Å; W48-Y91 VanDerWaalsContact CA-OH 3.27Å; W48-Y91 WeakPolarHBondContact CA-OH 3.4Å; W48-Y91 HydrophobicContact CE3-CD1 4Å; W48-Y91 HydrophobicContact CE3-CD2 4.47Å; W48-Y91 AromaticContact CE3-CE1 3.67Å; W48-Y91 HydrophobicContact CE3-CE1 3.67Å; W48-Y91 HydrophobicContact CE3-CE2 4.17Å; W48-Y91 HydrophobicContact CE3-CG 4.39Å; W48-Y91 AromaticContact CE3-CZ 3.76Å; W48-Y91 AromaticContact CZ3-CD1 3.78Å; W48-Y91 HydrophobicContact CZ3-CD1 3.78Å; W48-Y91 HydrophobicContact CZ3-CD2 4.15Å; W48-Y91 AromaticContact CZ3-CE1 3.96Å; W48-Y91 HydrophobicContact CZ3-CE1 3.96Å; W48-Y91 HydrophobicContact CZ3-CE2 4.3Å; W48-Y91 AromaticContact CZ3-CG 3.89Å; W48-Y91 HydrophobicContact CZ3-CG 3.89Å; W48-F93 HydrophobicContact CH2-CE2 4.12Å; W48-F93 AromaticContact CH2-CZ 3.6Å; W48-F93 HydrophobicContact CH2-CZ 3.6Å; W48-F93 HydrophobicContact CZ2-CZ 4.24Å; W48-F93 HydrophobicContact CZ3-CZ 4.45Å; W48-Y124 PolarHBondContact O-OH 2.83Å; W48-G155 PolarHBondContact NE1-O 2.72Å; W48-I156 HydrophobicContact CZ2-CG2 4.24Å; W48-Y355 HydrophobicContact CE3-CD1 4.34Å; W48-Y355 AromaticContact CE3-CE1 3.36Å; W48-Y355 HydrophobicContact CE3-CE1 3.36Å; W48-Y355 AromaticContact CE3-CZ 3.5Å; W48-Y355 VanDerWaalsContact CE3-CZ 3.5Å; W48-Y355 VanDerWaalsContact CE3-OH 3.27Å; W48-Y355 AromaticContact CZ3-CD1 3.97Å; W48-Y355 HydrophobicContact CZ3-CD1 3.97Å; W48-Y355 AromaticContact CZ3-CE1 3.42Å; W48-Y355 HydrophobicContact CZ3-CE1 3.42Å; W48-Y355 VanDerWaalsContact CZ3-CE1 3.42Å; W48-Y355 AromaticContact CZ3-CZ 3.93Å
49	L	96.6	Very high	95.8	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.151	C	C	.	.	S	Bend	trans	-96.4	-70.9	178.5	177.6	69.6	0	0	0	108.8	F38 L51 H87 M89 Y91 S115 L117 Y124 Y355	F38-L49 HydrophobicContact CD1-CD1 3.72Å; F38-L49 HydrophobicContact CE1-CD1 3.6Å; L49-L51 PolarHBondContact O-N 3.34Å; L49-H87 HydrophobicContact CD1-CB 3.78Å; L49-H87 HydrophobicContact CD2-CB 4.18Å; L49-M89 HydrophobicContact CB-CB 4.14Å; L49-M89 HydrophobicContact CD2-CB 3.96Å; L49-Y91 WeakPolarHBondContact CB-OH 3.26Å; L49-Y91 PolarHBondContact N-OH 3.01Å; L49-S115 WeakPolarHBondContact CD2-O 3.18Å; L49-L117 HydrophobicContact CD1-CD1 3.85Å; L49-L117 HydrophobicContact CD1-CG 4.42Å; L49-L117 HydrophobicContact CD2-CG 4.34Å; L49-L117 HydrophobicContact CG-CD1 3.76Å; L49-L117 HydrophobicContact CG-CG 4.01Å; L49-Y124 WeakPolarHBondContact CA-OH 3.06Å; L49-Y124 HydrophobicContact CD1-CE2 3.93Å; L49-Y124 WeakPolarHBondContact O-CE2 3.27Å; L49-Y124 PolarHBondContact O-OH 2.8Å; L49-Y355 PolarHBondContact N-OH 3Å
50	N	95.1	Very high	95.8	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.027	15%	0.148	C	C	.	.	S	Bend	trans	-76.2	115.1	169.8	-169.3	-28.9	0	0	0	109.1	A52 S115 L117 F123 S352 Y355	N50-A52 PolarHBondContact O-N 3.24Å; N50-A52 WeakPolarHBondContact OD1-CA 3.34Å; N50-A52 WeakPolarHBondContact OD1-CB 3.5Å; N50-A52 PolarHBondContact OD1-N 2.97Å; N50-A52 PolarHBondContact OD1-O 2.99Å; N50-S115 VanDerWaalsContact CB-OG 3.32Å; N50-S115 WeakPolarHBondContact CB-OG 2.91Å; N50-L117 HydrophobicContact CB-CD2 4.36Å; N50-F123 HydrophobicContact CB-CE2 4.41Å; N50-F123 WeakPolarHBondContact OD1-CE2 3.39Å; N50-F123 WeakPolarHBondContact OD1-CZ 3.33Å; N50-S352 PolarHBondContact ND2-O 3.38Å; N50-Y355 HydrophobicContact CB-CE2 4.14Å; N50-Y355 PolarHBondContact N-OH 3.44Å; N50-Y355 WeakPolarHBondContact O-CE2 3.3Å; N50-Y355 PolarHBondContact O-OH 3.36Å
51	L	94.1	Very high	95.6	Very high	14 Å²	14	28.6 Å²	28.6	7%	0.073	15%	0.154	C	C	.	.	S	Bend	trans	-80.3	-8.2	-177.2	-49.1	-178	0	0	0	112.4	W48 L49 F123 Y124 V143 L146	W48-L51 HydrophobicContact CB-CD2 4.12Å; L49-L51 PolarHBondContact O-N 3.34Å; L51-F123 HydrophobicContact CB-CD1 3.7Å; L51-F123 HydrophobicContact CB-CE1 3.91Å; L51-F123 HydrophobicContact CB-CG 4.22Å; L51-F123 HydrophobicContact CD1-CB 3.88Å; L51-F123 HydrophobicContact CD1-CD1 3.88Å; L51-F123 HydrophobicContact CD1-CG 4.14Å; L51-F123 HydrophobicContact CG-CB 3.98Å; L51-F123 HydrophobicContact CG-CD1 3.79Å; L51-F123 HydrophobicContact CG-CE1 4.48Å; L51-F123 HydrophobicContact CG-CG 3.9Å; L51-Y124 WeakPolarHBondContact CD2-OH 3.19Å; L51-V143 HydrophobicContact CD1-CG1 3.8Å; L51-V143 HydrophobicContact CD2-CG1 4.31Å; L51-L146 HydrophobicContact CD1-CB 3.73Å; L51-L146 HydrophobicContact CD1-CD1 3.99Å; L51-L146 HydrophobicContact CD1-CG 4.5Å
52	A	90.9	Very high	95.4	Very high	38 Å²	38	28.6 Å²	28.6	31%	0.314	15%	0.154	S	C	.	.	S	Bend	trans	-93.7	156.7	167.9	0	0	0	0	0	110.8	N50 I54 F123	N50-A52 PolarHBondContact O-N 3.24Å; N50-A52 WeakPolarHBondContact OD1-CA 3.34Å; N50-A52 WeakPolarHBondContact OD1-CB 3.5Å; N50-A52 PolarHBondContact OD1-N 2.97Å; N50-A52 PolarHBondContact OD1-O 2.99Å; A52-I54 PolarHBondContact O-N 3.43Å; A52-I54 VanDerWaalsContact O-N 3.1Å; A52-F123 HydrophobicContact CB-CZ 4.04Å
53	N	92.3	Very high	95.1	Very high	114 Å²	114	31.1 Å²	31.1	61%	0.61	18%	0.181	S	C	*	.	S	Bend	trans	54.3	33	172.3	-57.1	-46.6	0	0	0	114.8	Q353 R354 Y355	N53-Q353 PolarHBondContact ND2-O 3.36Å; N53-R354 HydrophobicContact CB-CB 4.24Å; N53-Y355 VanDerWaalsContact O-CD2 3.3Å; N53-Y355 WeakPolarHBondContact O-CD2 3.38Å
54	I	96.1	Very high	94.8	Very high	12 Å²	12	34.1 Å²	34.1	6%	0.062	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-54.9	139.7	175.9	-71.1	169.4	0	0	0	110	W48 A52 S56 L150 F157 Y355	W48-I54 HydrophobicContact CB-CD1 4.27Å; W48-I54 HydrophobicContact CD2-CD1 4.49Å; W48-I54 HydrophobicContact CD2-CG1 4.26Å; W48-I54 HydrophobicContact CD2-CG2 4.13Å; W48-I54 VanDerWaalsContact CE2-CG2 3.5Å; W48-I54 HydrophobicContact CG-CD1 3.87Å; W48-I54 HydrophobicContact CG-CG1 4.07Å; W48-I54 HydrophobicContact CH2-CG2 4.36Å; W48-I54 HydrophobicContact CZ2-CG2 3.63Å; A52-I54 PolarHBondContact O-N 3.43Å; A52-I54 VanDerWaalsContact O-N 3.1Å; I54-S56 PolarHBondContact O-N 3.31Å; I54-L150 HydrophobicContact CD1-CD2 3.46Å; I54-L150 VanDerWaalsContact CD1-CD2 3.46Å; I54-L150 HydrophobicContact CG2-CD2 4.44Å; I54-F157 HydrophobicContact CB-CB 4.28Å; I54-F157 HydrophobicContact CG2-CB 4.18Å; I54-F157 VanDerWaalsContact O-CB 3.32Å; I54-F157 WeakPolarHBondContact O-CB 3.27Å; I54-Y355 HydrophobicContact CG1-CE2 4.29Å
55	P	96.5	Very high	94.6	Very high	7 Å²	7	35.5 Å²	35.5	5%	0.045	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-50.9	136.9	-179.9	-30	37	0	0	0	113.1	W48 L60 F113 I156 F157 Y355	W48-P55 HydrophobicContact CH2-CB 4.49Å; W48-P55 HydrophobicContact CH2-CG 3.83Å; W48-P55 HydrophobicContact CZ3-CG 4.16Å; P55-L60 HydrophobicContact CB-CD1 4Å; P55-L60 HydrophobicContact CB-CG 4.29Å; P55-F113 HydrophobicContact CB-CE2 4.24Å; P55-F113 HydrophobicContact CB-CZ 4.42Å; P55-F113 HydrophobicContact CG-CD2 4.18Å; P55-F113 HydrophobicContact CG-CE2 4.26Å; P55-F113 HydrophobicContact CG-CG 4.38Å; P55-I156 WeakPolarHBondContact O-CB 3.36Å; P55-F157 WeakPolarHBondContact O-CB 3.47Å; P55-F157 PolarHBondContact O-N 3.39Å; P55-F157 VanDerWaalsContact O-N 3.09Å; P55-Y355 HydrophobicContact CG-CD1 4.11Å; P55-Y355 HydrophobicContact CG-CD2 4.25Å; P55-Y355 HydrophobicContact CG-CG 3.82Å
56	S	95.6	Very high	94.5	Very high	43 Å²	43	35.4 Å²	35.4	30%	0.301	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-89.9	165.8	178.6	72.6	0	0	0	0	111.6	I54 E58 S59 L60	I54-S56 PolarHBondContact O-N 3.31Å; S56-E58 VanDerWaalsContact C-N 3.26Å; S56-E58 PolarHBondContact O-N 3.01Å; S56-S59 PolarHBondContact N-OG 3.01Å; S56-S59 PolarHBondContact O-N 3.46Å; S56-S59 VanDerWaalsContact O-N 3.13Å; S56-S59 PolarHBondContact O-OG 3Å; S56-S59 PolarHBondContact OG-N 2.87Å; S56-L60 PolarHBondContact O-N 3.15Å
57	Y	95.3	Very high	94.2	Very high	32 Å²	32	38.1 Å²	38.1	13%	0.125	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-46	172.1	-178.4	-95.1	0	0	0	112.7	S59 L60 K61 P68	Y57-S59 VanDerWaalsContact C-N 3.32Å; Y57-S59 PolarHBondContact O-N 3.14Å; Y57-L60 CarbonylContact O-C 3.5Å; Y57-L60 PolarHBondContact O-N 3.48Å; Y57-L60 VanDerWaalsContact O-N 3.14Å; Y57-K61 HydrophobicContact CE1-CG 4.42Å; Y57-K61 PolarHBondContact O-N 3.32Å; Y57-P68 HydrophobicContact CD2-CB 4.03Å; Y57-P68 HydrophobicContact CD2-CG 4.47Å; Y57-P68 HydrophobicContact CE2-CB 3.6Å; Y57-P68 HydrophobicContact CE2-CG 3.6Å; Y57-P68 WeakPolarHBondContact OH-CD 3.39Å
58	E	94.4	Very high	93.9	Very high	122 Å²	122	39.2 Å²	39.2	57%	0.57	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-62.5	-38.6	-179.5	-65.5	-57.8	133	0	0	112.4	S56 L60 K61	S56-E58 VanDerWaalsContact C-N 3.26Å; S56-E58 PolarHBondContact O-N 3.01Å; E58-L60 PolarHBondContact O-N 2.93Å; E58-K61 VanDerWaalsContact OE1-CE 3.28Å; E58-K61 WeakPolarHBondContact OE1-CE 3.24Å; E58-K61 IonicContact OE1-NZ 3.06Å; E58-K61 PolarHBondContact OE1-NZ 3.41Å; E58-K61 VanDerWaalsContact OE2-CE 3.27Å; E58-K61 WeakPolarHBondContact OE2-CE 3.35Å; E58-K61 IonicContact OE2-NZ 3.55Å; E58-K61 PolarHBondContact OE2-NZ 3.47Å
59	S	94.3	Very high	93.8	Very high	32 Å²	32	39.6 Å²	39.6	22%	0.224	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-70.6	-17.4	178.8	71.1	0	0	0	0	114	S56 Y57	S56-S59 PolarHBondContact N-OG 3.01Å; S56-S59 PolarHBondContact O-N 3.46Å; S56-S59 VanDerWaalsContact O-N 3.13Å; S56-S59 PolarHBondContact O-OG 3Å; S56-S59 PolarHBondContact OG-N 2.87Å; Y57-S59 VanDerWaalsContact C-N 3.32Å; Y57-S59 PolarHBondContact O-N 3.14Å
60	L	96	Very high	93.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-110.9	13.4	-175	-80	170.3	0	0	0	113.4	P55 S56 Y57 E58 M69 F93 F113 I156	P55-L60 HydrophobicContact CB-CD1 4Å; P55-L60 HydrophobicContact CB-CG 4.29Å; S56-L60 PolarHBondContact O-N 3.15Å; Y57-L60 CarbonylContact O-C 3.5Å; Y57-L60 PolarHBondContact O-N 3.48Å; Y57-L60 VanDerWaalsContact O-N 3.14Å; E58-L60 PolarHBondContact O-N 2.93Å; L60-M69 HydrophobicContact CD2-CE 4.48Å; L60-M69 VanDerWaalsContact O-CE 3.32Å; L60-M69 WeakPolarHBondContact O-CE 3.39Å; L60-M69 PolarHBondContact O-N 2.71Å; L60-F93 HydrophobicContact CD1-CD1 4.1Å; L60-F93 HydrophobicContact CD1-CE1 3.9Å; L60-F93 HydrophobicContact CD1-CZ 4.27Å; L60-F93 HydrophobicContact CD2-CB 3.71Å; L60-F93 HydrophobicContact CD2-CD1 3.55Å; L60-F93 HydrophobicContact CD2-CD2 3.65Å; L60-F93 HydrophobicContact CD2-CE1 4.06Å; L60-F93 HydrophobicContact CD2-CE2 4.14Å; L60-F93 HydrophobicContact CD2-CG 3.34Å; L60-F93 HydrophobicContact CD2-CZ 4.35Å; L60-F93 HydrophobicContact CG-CD1 4.49Å; L60-F113 HydrophobicContact CD2-CD2 4.46Å; L60-F113 HydrophobicContact CD2-CE2 3.69Å; L60-F113 HydrophobicContact CG-CE2 4.23Å; L60-I156 HydrophobicContact CD1-CB 4.24Å; L60-I156 HydrophobicContact CD1-CD1 3.9Å; L60-I156 HydrophobicContact CD1-CG2 3.7Å
61	K	95	Very high	93.9	Very high	70 Å²	70	40.3 Å²	40.3	30%	0.304	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-68.5	132.4	169.7	-72.1	-178.4	175.3	167.6	0	110.1	Y57 E58 G63	Y57-K61 HydrophobicContact CE1-CG 4.42Å; Y57-K61 PolarHBondContact O-N 3.32Å; E58-K61 VanDerWaalsContact OE1-CE 3.28Å; E58-K61 WeakPolarHBondContact OE1-CE 3.24Å; E58-K61 IonicContact OE1-NZ 3.06Å; E58-K61 PolarHBondContact OE1-NZ 3.41Å; E58-K61 VanDerWaalsContact OE2-CE 3.27Å; E58-K61 WeakPolarHBondContact OE2-CE 3.35Å; E58-K61 IonicContact OE2-NZ 3.55Å; E58-K61 PolarHBondContact OE2-NZ 3.47Å; K61-G63 PolarHBondContact O-N 2.86Å
62	C	94.5	Very high	94	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.238	C	C	.	.			trans	-58.5	127.9	168.4	174.8	0	0	0	0	109	Q64 C65 S66 T67 M69 C95	C62-Q64 PolarHBondContact O-N 3.28Å; C62-Q64 PolarHBondContact SG-N 3.46Å; C62-Q64 VanDerWaalsContact SG-N 3.43Å; C62-C65 VanDerWaalsContact SG-SG 3.69Å; C62-S66 WeakPolarHBondContact O-CA 3.39Å; C62-S66 PolarHBondContact O-N 3.14Å; C62-T67 VanDerWaalsContact CB-O 3.3Å; C62-T67 WeakPolarHBondContact CB-O 3.3Å; C62-T67 PolarHBondContact N-O 2.84Å; C62-M69 HydrophobicContact CB-CG 4.07Å; C62-C95 HydrophobicContact CB-CB 3.9Å; C62-C95 VanDerWaalsContact SG-SG 3.65Å
63	G	90.7	Very high	94.4	Very high	54 Å²	54	38 Å²	38	56%	0.557	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	2.2	179.9	0	0	0	0	0	114.1	K61 N108	K61-G63 PolarHBondContact O-N 2.86Å; G63-N108 PolarHBondContact N-O 2.81Å
64	Q	90.3	Very high	94.7	Very high	62 Å²	62	32.5 Å²	32.5	29%	0.29	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-56.5	174	-57.1	-170.9	-1.3	0	0	112.6	C62 C100 S106 N108	C62-Q64 PolarHBondContact O-N 3.28Å; C62-Q64 PolarHBondContact SG-N 3.46Å; C62-Q64 VanDerWaalsContact SG-N 3.43Å; Q64-C100 VanDerWaalsContact OE1-CB 3.24Å; Q64-C100 PolarHBondContact OE1-O 3.18Å; Q64-S106 PolarHBondContact NE2-O 2.93Å; Q64-N108 HydrophobicContact CG-CB 3.81Å
65	C	92.2	Very high	94.8	Very high	38 Å²	38	32.3 Å²	32.3	26%	0.257	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-2.7	-175	66.8	0	0	0	0	113.8	C62 T67 C95 C100	C62-C65 VanDerWaalsContact SG-SG 3.69Å; C65-T67 PolarHBondContact O-N 3.13Å; C65-T67 VanDerWaalsContact SG-CB 3.57Å; C65-T67 PolarHBondContact SG-OG1 3.2Å; C65-C95 PolarHBondContact SG-SG 3.08Å; C65-C100 VanDerWaalsContact SG-SG 3.64Å
66	S	92.4	Very high	94.9	Very high	78 Å²	78	34.9 Å²	34.9	55%	0.545	20%	0.203	S	C	.	.			trans	60.4	2.5	-176	-57.3	0	0	0	0	116	C62	C62-S66 WeakPolarHBondContact O-CA 3.39Å; C62-S66 PolarHBondContact O-N 3.14Å
67	T	90.6	Very high	95	Very high	68 Å²	68	32.9 Å²	32.9	42%	0.417	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-69.8	142.2	170.9	-50.8	0	0	0	0	109.8	C62 C65 M69	C62-T67 VanDerWaalsContact CB-O 3.3Å; C62-T67 WeakPolarHBondContact CB-O 3.3Å; C62-T67 PolarHBondContact N-O 2.84Å; C65-T67 PolarHBondContact O-N 3.13Å; C65-T67 VanDerWaalsContact SG-CB 3.57Å; C65-T67 PolarHBondContact SG-OG1 3.2Å; T67-M69 PolarHBondContact O-N 3.13Å
68	P	92	Very high	95	Very high	30 Å²	30	34 Å²	34	20%	0.195	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-58.9	136.8	175.3	26.9	-38.9	0	0	0	111.3	Y57	Y57-P68 HydrophobicContact CD2-CB 4.03Å; Y57-P68 HydrophobicContact CD2-CG 4.47Å; Y57-P68 HydrophobicContact CE2-CB 3.6Å; Y57-P68 HydrophobicContact CE2-CG 3.6Å; Y57-P68 WeakPolarHBondContact OH-CD 3.39Å
69	M	95.1	Very high	95	Very high	11 Å²	11	28.6 Å²	28.6	5%	0.054	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-77.5	148.5	173	-69.3	179.2	-74.3	0	0	111	L60 C62 T67 F93 L94 C95 T111	L60-M69 HydrophobicContact CD2-CE 4.48Å; L60-M69 VanDerWaalsContact O-CE 3.32Å; L60-M69 WeakPolarHBondContact O-CE 3.39Å; L60-M69 PolarHBondContact O-N 2.71Å; C62-M69 HydrophobicContact CB-CG 4.07Å; T67-M69 PolarHBondContact O-N 3.13Å; M69-F93 HydrophobicContact CB-CB 3.9Å; M69-L94 CarbonylContact C-O 3.57Å; M69-L94 VanDerWaalsContact CA-O 3.26Å; M69-L94 WeakPolarHBondContact CA-O 3.49Å; M69-L94 VanDerWaalsContact CB-O 3.3Å; M69-L94 WeakPolarHBondContact CB-O 3.19Å; M69-C95 HydrophobicContact CG-CB 4.13Å; M69-T111 HydrophobicContact CE-CG2 4.37Å; M69-T111 WeakPolarHBondContact CE-OG1 3.31Å
70	T	95.3	Very high	94.8	Very high	18 Å²	18	32.8 Å²	32.8	11%	0.11	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	141.6	176.4	-58.9	0	0	0	0	109.5	L72 F93 L94 K96 L200 F202	T70-L72 PolarHBondContact O-N 3.31Å; T70-F93 CarbonylContact O-C 3.57Å; T70-F93 VanDerWaalsContact O-CA 3.27Å; T70-F93 WeakPolarHBondContact O-CA 3.3Å; T70-L94 PolarHBondContact N-O 3.43Å; T70-L94 PolarHBondContact O-N 3.06Å; T70-K96 WeakPolarHBondContact OG1-CD 3.39Å; T70-L200 WeakPolarHBondContact CG2-O 3.33Å; T70-F202 HydrophobicContact CG2-CD2 4Å; T70-F202 HydrophobicContact CG2-CE2 3.93Å
71	F	97.6	Very high	94.6	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	123	171.2	176.9	-113.6	0	0	0	110.4	G43 G44 P46 L73 Q74 Y91 F93 F202	G43-F71 WeakPolarHBondContact O-CD1 3.45Å; G43-F71 WeakPolarHBondContact O-CE1 3.25Å; G44-F71 WeakPolarHBondContact O-CD1 3.28Å; P46-F71 HydrophobicContact CB-CD2 4.17Å; P46-F71 HydrophobicContact CB-CE2 4.16Å; P46-F71 HydrophobicContact CB-CG 4.42Å; P46-F71 HydrophobicContact CB-CZ 4.4Å; P46-F71 HydrophobicContact CG-CB 4Å; P46-F71 HydrophobicContact CG-CD1 4.22Å; P46-F71 HydrophobicContact CG-CD2 3.74Å; P46-F71 HydrophobicContact CG-CE2 4.24Å; P46-F71 HydrophobicContact CG-CG 3.71Å; F71-L73 VanDerWaalsContact CE2-C 3.41Å; F71-L73 WeakPolarHBondContact CE2-O 3.48Å; F71-Q74 HydrophobicContact CE2-CB 4.05Å; F71-Q74 HydrophobicContact CZ-CB 3.79Å; F71-Q74 HydrophobicContact CZ-CG 3.87Å; F71-Y91 AromaticContact CE2-CD1 3.9Å; F71-Y91 HydrophobicContact CE2-CD1 3.9Å; F71-F93 VanDerWaalsContact CA-CD1 3.45Å; F71-F93 HydrophobicContact CB-CD1 3.99Å; F71-F93 HydrophobicContact CB-CE1 3.64Å; F71-F93 HydrophobicContact CB-CZ 4.3Å; F71-F93 HydrophobicContact CD2-CD1 4.48Å; F71-F93 AromaticContact CD2-CE1 3.97Å; F71-F93 HydrophobicContact CD2-CE1 3.97Å; F71-F93 HydrophobicContact CD2-CE2 4.19Å; F71-F93 AromaticContact CD2-CZ 3.78Å; F71-F93 HydrophobicContact CD2-CZ 3.78Å; F71-F93 HydrophobicContact CG-CE1 4.28Å; F71-F93 HydrophobicContact CG-CZ 4.48Å; F71-F202 VanDerWaalsContact O-CD2 3.3Å; F71-F202 WeakPolarHBondContact O-CD2 3.39Å
72	L	97.7	Very high	94.6	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-59.3	179.4	175.1	66.7	0	0	0	111.1	F42 G43 T70 V92 L94 F202 I316 L320 M324	F42-L72 HydrophobicContact CD2-CD1 3.96Å; F42-L72 WeakPolarHBondContact CD2-O 3.16Å; F42-L72 HydrophobicContact CE2-CD1 3.57Å; G43-L72 PolarHBondContact N-O 3Å; T70-L72 PolarHBondContact O-N 3.31Å; L72-V92 HydrophobicContact CB-CB 4.44Å; L72-V92 HydrophobicContact CB-CG1 4.39Å; L72-V92 WeakPolarHBondContact CB-O 3.19Å; L72-V92 HydrophobicContact CD2-CB 4.43Å; L72-V92 HydrophobicContact CD2-CG1 3.9Å; L72-V92 PolarHBondContact N-O 3.35Å; L72-L94 HydrophobicContact CB-CD2 4.35Å; L72-L94 HydrophobicContact CB-CG 4.26Å; L72-L94 HydrophobicContact CD1-CD2 3.78Å; L72-L94 HydrophobicContact CD1-CG 4.43Å; L72-L94 HydrophobicContact CD2-CD2 3.92Å; L72-L94 HydrophobicContact CG-CD2 4.21Å; L72-F202 HydrophobicContact CD1-CD2 4.24Å; L72-F202 HydrophobicContact CD1-CE2 4.04Å; L72-I316 HydrophobicContact CD2-CD1 3.77Å; L72-L320 HydrophobicContact CD1-CD2 4.03Å; L72-L320 HydrophobicContact CD2-CD2 4.29Å; L72-L320 HydrophobicContact CG-CD2 4.31Å; L72-M324 HydrophobicContact CD1-CE 3.44Å; L72-M324 VanDerWaalsContact CD1-CE 3.44Å; L72-M324 HydrophobicContact CD1-SD 4.19Å
73	L	98.6	Very high	94.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	165.2	-174.5	63.2	83.3	0	0	0	111	K41 F71 I75 V92 I207 I281 F314 I316 L320	K41-L73 CarbonylContact O-C 3.6Å; K41-L73 WeakPolarHBondContact O-CA 3.17Å; K41-L73 VanDerWaalsContact O-CB 3.29Å; K41-L73 WeakPolarHBondContact O-CB 3.49Å; F71-L73 VanDerWaalsContact CE2-C 3.41Å; F71-L73 WeakPolarHBondContact CE2-O 3.48Å; L73-I75 HydrophobicContact CD1-CD1 4.19Å; L73-I75 HydrophobicContact CD1-CG1 3.84Å; L73-V92 HydrophobicContact CD1-CB 4.09Å; L73-V92 HydrophobicContact CD1-CG2 3.66Å; L73-V92 HydrophobicContact CG-CB 4.12Å; L73-V92 HydrophobicContact CG-CG2 4.22Å; L73-V92 PolarHBondContact N-O 3.01Å; L73-V92 PolarHBondContact O-N 3.39Å; L73-I207 HydrophobicContact CB-CD1 4.14Å; L73-I281 HydrophobicContact CD2-CD1 3.86Å; L73-F314 HydrophobicContact CD1-CE2 4.25Å; L73-F314 HydrophobicContact CD1-CZ 4.32Å; L73-I316 HydrophobicContact CD2-CD1 4.02Å; L73-I316 HydrophobicContact CD2-CG1 4.22Å; L73-I316 HydrophobicContact CD2-CG2 4.44Å; L73-L320 HydrophobicContact CD2-CD2 3.74Å
74	Q	98.6	Very high	94.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	148.2	168	63.6	-175.2	78.2	0	0	111.4	P39 C40 K41 A47 F71 M89 L90 Y91	P39-Q74 PolarHBondContact O-NE2 3.16Å; C40-Q74 WeakPolarHBondContact CA-O 3.4Å; K41-Q74 HydrophobicContact CD-CG 4.33Å; K41-Q74 HydrophobicContact CG-CG 3.57Å; K41-Q74 PolarHBondContact N-O 3.42Å; K41-Q74 PolarHBondContact O-N 3.04Å; A47-Q74 PolarHBondContact O-NE2 3.11Å; F71-Q74 HydrophobicContact CE2-CB 4.05Å; F71-Q74 HydrophobicContact CZ-CB 3.79Å; F71-Q74 HydrophobicContact CZ-CG 3.87Å; Q74-M89 HydrophobicContact CB-CG 4.32Å; Q74-M89 HydrophobicContact CB-SD 4.27Å; Q74-M89 HydrophobicContact CG-SD 4.34Å; Q74-L90 CarbonylContact C-O 3.54Å; Q74-L90 WeakPolarHBondContact CA-O 3.16Å; Q74-L90 WeakPolarHBondContact CB-O 3.33Å; Q74-Y91 HydrophobicContact CB-CD1 3.77Å; Q74-Y91 HydrophobicContact CB-CE1 4Å; Q74-Y91 HydrophobicContact CB-CG 4.42Å
75	I	98.7	Very high	95.1	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.036	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.3	179.7	-55.8	-63.8	0	0	0	109.1	C40 L73 A77 M89 L90 I207 I281 Y283 F314	C40-I75 HydrophobicContact CB-CD1 4.43Å; L73-I75 HydrophobicContact CD1-CD1 4.19Å; L73-I75 HydrophobicContact CD1-CG1 3.84Å; I75-A77 HydrophobicContact CG2-CB 4.36Å; I75-A77 PolarHBondContact O-N 3.23Å; I75-M89 WeakPolarHBondContact O-CA 3.45Å; I75-M89 VanDerWaalsContact O-SD 3.32Å; I75-L90 PolarHBondContact N-O 2.97Å; I75-L90 PolarHBondContact O-N 3.2Å; I75-I207 HydrophobicContact CD1-CD1 3.96Å; I75-I281 HydrophobicContact CD1-CG1 4.41Å; I75-Y283 HydrophobicContact CG2-CD2 4.2Å; I75-Y283 HydrophobicContact CG2-CE2 4.24Å; I75-F314 HydrophobicContact CG1-CE1 4.46Å; I75-F314 HydrophobicContact CG1-CE2 4.29Å; I75-F314 HydrophobicContact CG1-CZ 4.13Å
76	Y	98.1	Very high	95.2	Very high	62 Å²	62	37.3 Å²	37.3	24%	0.243	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	112.3	169.5	-178.3	-109.4	0	0	0	109.2	F38 C40 P78 F86 H87 M89	F38-Y76 HydrophobicContact CB-CD2 3.73Å; F38-Y76 HydrophobicContact CB-CE2 3.94Å; F38-Y76 HydrophobicContact CB-CG 4.14Å; F38-Y76 HydrophobicContact CG-CD2 4.44Å; F38-Y76 HydrophobicContact CG-CE2 4.22Å; F38-Y76 WeakPolarHBondContact O-CB 3.39Å; C40-Y76 PolarHBondContact SG-N 3.08Å; Y76-P78 HydrophobicContact CD1-CG 4.36Å; Y76-P78 HydrophobicContact CE1-CB 4.26Å; Y76-P78 HydrophobicContact CE1-CG 3.8Å; Y76-F86 PolarHBondContact OH-O 3.15Å; Y76-H87 HydrophobicContact CE2-CB 4.09Å; Y76-H87 AromaticContact CE2-ND1 3.68Å; Y76-H87 AromaticContact CZ-ND1 3.72Å; Y76-H87 PolarHBondContact OH-ND1 2.84Å; Y76-M89 VanDerWaalsContact CA-SD 3.51Å; Y76-M89 HydrophobicContact CD2-CE 3.79Å; Y76-M89 HydrophobicContact CD2-SD 4.42Å; Y76-M89 HydrophobicContact CG-CE 4.36Å; Y76-M89 PolarHBondContact N-SD 2.96Å; Y76-M89 VanDerWaalsContact N-SD 3.37Å
77	A	96.8	Very high	95.4	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.008	20%	0.2	C	C	.	.			trans	-135.5	68.1	-168.8	0	0	0	0	0	109.9	I75 R88 L90 Y283	I75-A77 HydrophobicContact CG2-CB 4.36Å; I75-A77 PolarHBondContact O-N 3.23Å; A77-R88 CarbonylContact C-O 3.53Å; A77-R88 PolarHBondContact N-O 2.59Å; A77-R88 VanDerWaalsContact O-CB 3.26Å; A77-R88 WeakPolarHBondContact O-CB 3.3Å; A77-R88 VanDerWaalsContact O-CD 3.25Å; A77-R88 WeakPolarHBondContact O-CD 3.5Å; A77-R88 VanDerWaalsContact O-CG 3.25Å; A77-R88 WeakPolarHBondContact O-CG 3.39Å; A77-R88 PolarHBondContact O-NH1 2.91Å; A77-L90 HydrophobicContact CB-CD1 4.16Å; A77-Y283 HydrophobicContact CB-CE2 3.88Å; A77-Y283 WeakPolarHBondContact CB-OH 3.35Å
78	P	95.8	Very high	95.7	Very high	54 Å²	54	30.9 Å²	30.9	35%	0.351	18%	0.18	S	C	.	.			trans	-60.3	151.4	-176.3	28.6	-36.4	0	0	0	111.7	Y76 F86	Y76-P78 HydrophobicContact CD1-CG 4.36Å; Y76-P78 HydrophobicContact CE1-CB 4.26Å; Y76-P78 HydrophobicContact CE1-CG 3.8Å; P78-F86 VanDerWaalsContact CB-O 3.31Å; P78-F86 WeakPolarHBondContact CB-O 3.45Å
79	D	94.9	Very high	96	Very high	10 Å²	10	29.5 Å²	29.5	5%	0.053	17%	0.171	C	C	.	.			trans	-122.4	97	175.2	-171.5	-10.5	0	0	0	110.4	S81 V82 A85 R285 S347	D79-S81 PolarHBondContact O-N 3.43Å; D79-S81 VanDerWaalsContact O-N 3.08Å; D79-S81 WeakPolarHBondContact OD1-CB 3.21Å; D79-S81 PolarHBondContact OD1-N 3.08Å; D79-S81 PolarHBondContact OD1-OG 2.79Å; D79-V82 PolarHBondContact O-N 3.45Å; D79-V82 VanDerWaalsContact O-N 3.1Å; D79-V82 VanDerWaalsContact O-O 3.05Å; D79-A85 HydrophobicContact CB-CB 3.84Å; D79-A85 PolarHBondContact N-O 2.75Å; D79-R285 IonicContact OD1-NH1 2.66Å; D79-R285 IonicContact OD2-CZ 3.33Å; D79-R285 VanDerWaalsContact OD2-CZ 3.31Å; D79-R285 IonicContact OD2-NH1 3.54Å; D79-R285 PolarHBondContact OD2-NH1 3.29Å; D79-R285 IonicContact OD2-NH2 3.52Å; D79-R285 PolarHBondContact OD2-NH2 2.93Å; D79-R285 VanDerWaalsContact OD2-NH2 3.11Å; D79-S347 WeakPolarHBondContact OD2-CB 3.47Å; D79-S347 PolarHBondContact OD2-OG 3.31Å
80	D	90.7	Very high	96.2	Very high	119 Å²	119	29 Å²	29	64%	0.636	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.2	-179.7	-78.5	-23.1	0	0	0	113.4
81	S	91.7	Very high	96.4	Very high	99 Å²	99	28.1 Å²	28.1	69%	0.692	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-15.6	178	74.2	0	0	0	0	113.4	D79	D79-S81 PolarHBondContact O-N 3.43Å; D79-S81 VanDerWaalsContact O-N 3.08Å; D79-S81 WeakPolarHBondContact OD1-CB 3.21Å; D79-S81 PolarHBondContact OD1-N 3.08Å; D79-S81 PolarHBondContact OD1-OG 2.79Å
82	V	94.3	Very high	96.4	Very high	28 Å²	28	28 Å²	28	17%	0.17	16%	0.163	C	C	.	.			trans	-127	115.1	-176.5	179.4	0	0	0	0	109.8	D79 S84 A85	D79-V82 PolarHBondContact O-N 3.45Å; D79-V82 VanDerWaalsContact O-N 3.1Å; D79-V82 VanDerWaalsContact O-O 3.05Å; V82-S84 VanDerWaalsContact C-N 3.27Å; V82-S84 VanDerWaalsContact CG1-OG 3.3Å; V82-S84 WeakPolarHBondContact CG1-OG 3.17Å; V82-S84 PolarHBondContact O-N 3.22Å; V82-A85 HydrophobicContact CB-CB 3.94Å; V82-A85 HydrophobicContact CG1-CB 4.03Å; V82-A85 CarbonylContact O-C 3.45Å; V82-A85 WeakPolarHBondContact O-CA 2.94Å; V82-A85 PolarHBondContact O-N 2.9Å
83	S	94	Very high	96.4	Very high	108 Å²	108	27.9 Å²	27.9	76%	0.755	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-61.8	-31.9	-173.7	57.8	0	0	0	0	114	A85 P118	S83-A85 PolarHBondContact O-N 2.8Å; S83-P118 WeakPolarHBondContact O-CA 3.41Å
84	S	95.4	Very high	96.2	Very high	12 Å²	12	28 Å²	28	8%	0.084	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-73.7	-13.8	175.3	68.4	0	0	0	0	113.4	V82 Q116 L117 D349	V82-S84 VanDerWaalsContact C-N 3.27Å; V82-S84 VanDerWaalsContact CG1-OG 3.3Å; V82-S84 WeakPolarHBondContact CG1-OG 3.17Å; V82-S84 PolarHBondContact O-N 3.22Å; S84-Q116 WeakPolarHBondContact O-CB 3.38Å; S84-L117 CarbonylContact O-C 3.56Å; S84-L117 WeakPolarHBondContact O-CA 3.2Å; S84-L117 PolarHBondContact O-N 2.99Å; S84-D349 VanDerWaalsContact CB-OD1 3.23Å; S84-D349 WeakPolarHBondContact CB-OD1 3.21Å; S84-D349 PolarHBondContact OG-OD1 3.36Å
85	A	96.2	Very high	96	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-108.6	20.9	-178.5	0	0	0	0	0	113	D79 V82 S83 H87 R88 Q116	D79-A85 HydrophobicContact CB-CB 3.84Å; D79-A85 PolarHBondContact N-O 2.75Å; V82-A85 HydrophobicContact CB-CB 3.94Å; V82-A85 HydrophobicContact CG1-CB 4.03Å; V82-A85 CarbonylContact O-C 3.45Å; V82-A85 WeakPolarHBondContact O-CA 2.94Å; V82-A85 PolarHBondContact O-N 2.9Å; S83-A85 PolarHBondContact O-N 2.8Å; A85-H87 VanDerWaalsContact C-N 3.27Å; A85-H87 CarbonylContact O-C 3.55Å; A85-H87 PolarHBondContact O-N 2.88Å; A85-R88 HydrophobicContact CB-CB 4.28Å; A85-Q116 HydrophobicContact CB-CB 4.41Å; A85-Q116 HydrophobicContact CB-CG 4.08Å
86	F	95.4	Very high	95.6	Very high	72 Å²	72	30.4 Å²	30.4	32%	0.316	17%	0.173	S	C	.	.	S	Bend	trans	-54.4	-45.5	174.9	179.2	-90.4	0	0	0	111.7	Y76 P78 L117 R119	Y76-F86 PolarHBondContact OH-O 3.15Å; P78-F86 VanDerWaalsContact CB-O 3.31Å; P78-F86 WeakPolarHBondContact CB-O 3.45Å; F86-L117 PolarHBondContact N-O 3.47Å; F86-R119 HydrophobicContact CB-CB 4.25Å; F86-R119 VanDerWaalsContact CD1-CA 3.44Å; F86-R119 HydrophobicContact CD1-CB 3.57Å; F86-R119 HydrophobicContact CD1-CG 4.02Å; F86-R119 HydrophobicContact CD2-CB 3.98Å; F86-R119 HydrophobicContact CE1-CB 3.83Å; F86-R119 HydrophobicContact CE1-CG 3.72Å; F86-R119 HydrophobicContact CE2-CB 4.23Å; F86-R119 HydrophobicContact CE2-CG 4.27Å; F86-R119 HydrophobicContact CG-CB 3.64Å; F86-R119 HydrophobicContact CG-CG 4.4Å; F86-R119 HydrophobicContact CZ-CB 4.16Å; F86-R119 HydrophobicContact CZ-CG 3.87Å
87	H	96	Very high	95.1	Very high	11 Å²	11	30 Å²	30	5%	0.051	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.3	158.2	-61.1	-58.2	0	0	0	107.6	F38 L49 Y76 A85 Q116 L117	F38-H87 AromaticContact CE2-CE1 3.62Å; F38-H87 AromaticContact CZ-CE1 3.72Å; F38-H87 AromaticContact CZ-NE2 3.84Å; L49-H87 HydrophobicContact CD1-CB 3.78Å; L49-H87 HydrophobicContact CD2-CB 4.18Å; Y76-H87 HydrophobicContact CE2-CB 4.09Å; Y76-H87 AromaticContact CE2-ND1 3.68Å; Y76-H87 AromaticContact CZ-ND1 3.72Å; Y76-H87 PolarHBondContact OH-ND1 2.84Å; A85-H87 VanDerWaalsContact C-N 3.27Å; A85-H87 CarbonylContact O-C 3.55Å; A85-H87 PolarHBondContact O-N 2.88Å; H87-Q116 CarbonylContact O-C 3.49Å; H87-Q116 WeakPolarHBondContact O-CA 3.19Å; H87-L117 HydrophobicContact CB-CB 4.32Å; H87-L117 PolarHBondContact N-O 2.73Å; H87-L117 PolarHBondContact O-N 2.88Å
88	R	97.8	Very high	94.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	128.7	176.2	171.7	177.1	176.8	-69.8	-1.2	108	A77 A85 R114 S115 Q116 E313 T343	A77-R88 CarbonylContact C-O 3.53Å; A77-R88 PolarHBondContact N-O 2.59Å; A77-R88 VanDerWaalsContact O-CB 3.26Å; A77-R88 WeakPolarHBondContact O-CB 3.3Å; A77-R88 VanDerWaalsContact O-CD 3.25Å; A77-R88 WeakPolarHBondContact O-CD 3.5Å; A77-R88 VanDerWaalsContact O-CG 3.25Å; A77-R88 WeakPolarHBondContact O-CG 3.39Å; A77-R88 PolarHBondContact O-NH1 2.91Å; A85-R88 HydrophobicContact CB-CB 4.28Å; R88-R114 HydrophobicContact CG-CG 4.25Å; R88-S115 WeakPolarHBondContact CA-O 3.21Å; R88-Q116 HydrophobicContact CB-CG 3.92Å; R88-Q116 VanDerWaalsContact CD-OE1 3.24Å; R88-Q116 HydrophobicContact CG-CG 3.76Å; R88-E313 IonicContact CZ-OE1 2.68Å; R88-E313 VanDerWaalsContact CZ-OE1 3.32Å; R88-E313 IonicContact CZ-OE2 3.85Å; R88-E313 IonicContact NH1-OE1 3.25Å; R88-E313 PolarHBondContact NH1-OE1 2.86Å; R88-E313 IonicContact NH1-OE2 2.82Å; R88-E313 PolarHBondContact NH1-OE2 3.44Å; R88-E313 IonicContact NH2-OE1 3.24Å; R88-E313 PolarHBondContact NH2-OE1 2.84Å; R88-E313 IonicContact NH2-OE2 3.86Å; R88-E313 PolarHBondContact NH2-OE2 3.12Å; R88-T343 PolarHBondContact NH2-OG1 3Å
89	M	98.3	Very high	94	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.5	-174.5	-165.6	76.4	69.4	0	0	109.5	F38 L49 Q74 I75 Y76 Y91 R114 S115	F38-M89 HydrophobicContact CB-CE 3.98Å; L49-M89 HydrophobicContact CB-CB 4.14Å; L49-M89 HydrophobicContact CD2-CB 3.96Å; Q74-M89 HydrophobicContact CB-CG 4.32Å; Q74-M89 HydrophobicContact CB-SD 4.27Å; Q74-M89 HydrophobicContact CG-SD 4.34Å; I75-M89 WeakPolarHBondContact O-CA 3.45Å; I75-M89 VanDerWaalsContact O-SD 3.32Å; Y76-M89 VanDerWaalsContact CA-SD 3.51Å; Y76-M89 HydrophobicContact CD2-CE 3.79Å; Y76-M89 HydrophobicContact CD2-SD 4.42Å; Y76-M89 HydrophobicContact CG-CE 4.36Å; Y76-M89 PolarHBondContact N-SD 2.96Å; Y76-M89 VanDerWaalsContact N-SD 3.37Å; M89-Y91 HydrophobicContact CB-CD2 4.48Å; M89-Y91 HydrophobicContact CB-CE2 3.65Å; M89-Y91 HydrophobicContact CG-CD2 4.17Å; M89-Y91 HydrophobicContact CG-CE1 4.01Å; M89-Y91 HydrophobicContact CG-CE2 3.46Å; M89-Y91 VanDerWaalsContact CG-CE2 3.46Å; M89-Y91 WeakPolarHBondContact CG-OH 3.34Å; M89-R114 WeakPolarHBondContact O-CA 3.31Å; M89-S115 PolarHBondContact N-O 3.07Å; M89-S115 PolarHBondContact O-N 2.83Å
90	L	98.6	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.8	174.2	-58.5	171.8	0	0	0	108.2	Q74 I75 A77 F113 R114 E313 F314 T343	Q74-L90 CarbonylContact C-O 3.54Å; Q74-L90 WeakPolarHBondContact CA-O 3.16Å; Q74-L90 WeakPolarHBondContact CB-O 3.33Å; I75-L90 PolarHBondContact N-O 2.97Å; I75-L90 PolarHBondContact O-N 3.2Å; A77-L90 HydrophobicContact CB-CD1 4.16Å; L90-F113 CarbonylContact C-O 3.52Å; L90-F113 WeakPolarHBondContact CA-O 3.2Å; L90-R114 HydrophobicContact CD2-CB 3.76Å; L90-R114 HydrophobicContact CD2-CG 3.81Å; L90-E313 VanDerWaalsContact CD1-CD 3.46Å; L90-E313 HydrophobicContact CD1-CG 4.2Å; L90-E313 WeakPolarHBondContact CD1-OE2 3.27Å; L90-F314 HydrophobicContact CB-CE1 4.25Å; L90-F314 HydrophobicContact CD1-CD1 4.04Å; L90-F314 HydrophobicContact CD1-CE1 3.58Å; L90-T343 HydrophobicContact CD1-CG2 4.16Å; L90-T343 HydrophobicContact CD2-CG2 3.89Å
91	Y	98.7	Very high	93.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127	179.1	-60.4	-93.9	0	0	0	108.9	P46 A47 W48 L49 F71 Q74 M89 V112 F113 Y355	P46-Y91 HydrophobicContact CB-CD1 4.16Å; P46-Y91 HydrophobicContact CB-CE1 4.18Å; A47-Y91 PolarHBondContact O-OH 3.44Å; W48-Y91 VanDerWaalsContact C-OH 3.26Å; W48-Y91 VanDerWaalsContact CA-OH 3.27Å; W48-Y91 WeakPolarHBondContact CA-OH 3.4Å; W48-Y91 HydrophobicContact CE3-CD1 4Å; W48-Y91 HydrophobicContact CE3-CD2 4.47Å; W48-Y91 AromaticContact CE3-CE1 3.67Å; W48-Y91 HydrophobicContact CE3-CE1 3.67Å; W48-Y91 HydrophobicContact CE3-CE2 4.17Å; W48-Y91 HydrophobicContact CE3-CG 4.39Å; W48-Y91 AromaticContact CE3-CZ 3.76Å; W48-Y91 AromaticContact CZ3-CD1 3.78Å; W48-Y91 HydrophobicContact CZ3-CD1 3.78Å; W48-Y91 HydrophobicContact CZ3-CD2 4.15Å; W48-Y91 AromaticContact CZ3-CE1 3.96Å; W48-Y91 HydrophobicContact CZ3-CE1 3.96Å; W48-Y91 HydrophobicContact CZ3-CE2 4.3Å; W48-Y91 AromaticContact CZ3-CG 3.89Å; W48-Y91 HydrophobicContact CZ3-CG 3.89Å; L49-Y91 WeakPolarHBondContact CB-OH 3.26Å; L49-Y91 PolarHBondContact N-OH 3.01Å; F71-Y91 AromaticContact CE2-CD1 3.9Å; F71-Y91 HydrophobicContact CE2-CD1 3.9Å; Q74-Y91 HydrophobicContact CB-CD1 3.77Å; Q74-Y91 HydrophobicContact CB-CE1 4Å; Q74-Y91 HydrophobicContact CB-CG 4.42Å; M89-Y91 HydrophobicContact CB-CD2 4.48Å; M89-Y91 HydrophobicContact CB-CE2 3.65Å; M89-Y91 HydrophobicContact CG-CD2 4.17Å; M89-Y91 HydrophobicContact CG-CE1 4.01Å; M89-Y91 HydrophobicContact CG-CE2 3.46Å; M89-Y91 VanDerWaalsContact CG-CE2 3.46Å; M89-Y91 WeakPolarHBondContact CG-OH 3.34Å; Y91-V112 CarbonylContact O-C 3.49Å; Y91-V112 VanDerWaalsContact O-CA 3.27Å; Y91-V112 WeakPolarHBondContact O-CA 3.5Å; Y91-F113 PolarHBondContact N-O 3.14Å; Y91-F113 PolarHBondContact O-N 2.87Å; Y91-Y355 HydrophobicContact CD2-CD1 4.18Å; Y91-Y355 AromaticContact CD2-CE1 3.91Å; Y91-Y355 HydrophobicContact CD2-CE1 3.91Å; Y91-Y355 HydrophobicContact CE2-CD1 4.27Å; Y91-Y355 AromaticContact CE2-CE1 3.6Å; Y91-Y355 HydrophobicContact CE2-CE1 3.6Å
92	V	98.4	Very high	93	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.6	178.5	-173	0	0	0	0	108.9	L72 L73 V110 V112 F314 I316	L72-V92 HydrophobicContact CB-CB 4.44Å; L72-V92 HydrophobicContact CB-CG1 4.39Å; L72-V92 WeakPolarHBondContact CB-O 3.19Å; L72-V92 HydrophobicContact CD2-CB 4.43Å; L72-V92 HydrophobicContact CD2-CG1 3.9Å; L72-V92 PolarHBondContact N-O 3.35Å; L73-V92 HydrophobicContact CD1-CB 4.09Å; L73-V92 HydrophobicContact CD1-CG2 3.66Å; L73-V92 HydrophobicContact CG-CB 4.12Å; L73-V92 HydrophobicContact CG-CG2 4.22Å; L73-V92 PolarHBondContact N-O 3.01Å; L73-V92 PolarHBondContact O-N 3.39Å; V92-V110 HydrophobicContact CG1-CG1 3.8Å; V92-V112 HydrophobicContact CG1-CG2 4.4Å; V92-V112 HydrophobicContact CG2-CG1 4.44Å; V92-V112 HydrophobicContact CG2-CG2 4.22Å; V92-F314 HydrophobicContact CG2-CE2 4.48Å; V92-F314 HydrophobicContact CG2-CZ 3.9Å; V92-I316 HydrophobicContact CG1-CD1 3.99Å; V92-I316 HydrophobicContact CG2-CD1 4.41Å
93	F	97.9	Very high	92	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.1	174.3	-66.6	-100	0	0	0	108.9	P46 W48 L60 M69 T70 F71 V110 T111 F113 I156	P46-F93 HydrophobicContact CG-CE1 4.32Å; P46-F93 HydrophobicContact CG-CZ 4.01Å; W48-F93 HydrophobicContact CH2-CE2 4.12Å; W48-F93 AromaticContact CH2-CZ 3.6Å; W48-F93 HydrophobicContact CH2-CZ 3.6Å; W48-F93 HydrophobicContact CZ2-CZ 4.24Å; W48-F93 HydrophobicContact CZ3-CZ 4.45Å; L60-F93 HydrophobicContact CD1-CD1 4.1Å; L60-F93 HydrophobicContact CD1-CE1 3.9Å; L60-F93 HydrophobicContact CD1-CZ 4.27Å; L60-F93 HydrophobicContact CD2-CB 3.71Å; L60-F93 HydrophobicContact CD2-CD1 3.55Å; L60-F93 HydrophobicContact CD2-CD2 3.65Å; L60-F93 HydrophobicContact CD2-CE1 4.06Å; L60-F93 HydrophobicContact CD2-CE2 4.14Å; L60-F93 HydrophobicContact CD2-CG 3.34Å; L60-F93 HydrophobicContact CD2-CZ 4.35Å; L60-F93 HydrophobicContact CG-CD1 4.49Å; M69-F93 HydrophobicContact CB-CB 3.9Å; T70-F93 CarbonylContact O-C 3.57Å; T70-F93 VanDerWaalsContact O-CA 3.27Å; T70-F93 WeakPolarHBondContact O-CA 3.3Å; F71-F93 VanDerWaalsContact CA-CD1 3.45Å; F71-F93 HydrophobicContact CB-CD1 3.99Å; F71-F93 HydrophobicContact CB-CE1 3.64Å; F71-F93 HydrophobicContact CB-CZ 4.3Å; F71-F93 HydrophobicContact CD2-CD1 4.48Å; F71-F93 AromaticContact CD2-CE1 3.97Å; F71-F93 HydrophobicContact CD2-CE1 3.97Å; F71-F93 HydrophobicContact CD2-CE2 4.19Å; F71-F93 AromaticContact CD2-CZ 3.78Å; F71-F93 HydrophobicContact CD2-CZ 3.78Å; F71-F93 HydrophobicContact CG-CE1 4.28Å; F71-F93 HydrophobicContact CG-CZ 4.48Å; F93-V110 CarbonylContact O-C 3.02Å; F93-V110 WeakPolarHBondContact O-CA 3.28Å; F93-T111 PolarHBondContact N-O 3.22Å; F93-T111 PolarHBondContact O-N 3.28Å; F93-F113 HydrophobicContact CD2-CD2 4.15Å; F93-F113 HydrophobicContact CE2-CD2 4.17Å; F93-I156 HydrophobicContact CE1-CG2 4.34Å
94	L	95.3	Very high	90.9	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	156	177.9	74.2	64.8	0	0	0	113.1	M69 T70 L72 K96 W101 N109 V110 F202 M324 W336	M69-L94 CarbonylContact C-O 3.57Å; M69-L94 VanDerWaalsContact CA-O 3.26Å; M69-L94 WeakPolarHBondContact CA-O 3.49Å; M69-L94 VanDerWaalsContact CB-O 3.3Å; M69-L94 WeakPolarHBondContact CB-O 3.19Å; T70-L94 PolarHBondContact N-O 3.43Å; T70-L94 PolarHBondContact O-N 3.06Å; L72-L94 HydrophobicContact CB-CD2 4.35Å; L72-L94 HydrophobicContact CB-CG 4.26Å; L72-L94 HydrophobicContact CD1-CD2 3.78Å; L72-L94 HydrophobicContact CD1-CG 4.43Å; L72-L94 HydrophobicContact CD2-CD2 3.92Å; L72-L94 HydrophobicContact CG-CD2 4.21Å; L94-K96 HydrophobicContact CD1-CG 4.28Å; L94-W101 HydrophobicContact CB-CH2 4.28Å; L94-W101 HydrophobicContact CB-CZ2 3.92Å; L94-W101 HydrophobicContact CD1-CZ2 4.08Å; L94-W101 HydrophobicContact CD2-CH2 4.07Å; L94-W101 HydrophobicContact CD2-CZ2 3.86Å; L94-W101 HydrophobicContact CG-CZ2 4.19Å; L94-N109 CarbonylContact C-O 3.41Å; L94-N109 WeakPolarHBondContact CA-O 3.09Å; L94-V110 HydrophobicContact CB-CG2 4.28Å; L94-F202 HydrophobicContact CD1-CE2 4.11Å; L94-F202 HydrophobicContact CD1-CZ 3.89Å; L94-F202 HydrophobicContact CG-CE2 4.26Å; L94-F202 HydrophobicContact CG-CZ 4.45Å; L94-M324 HydrophobicContact CD2-SD 4.36Å; L94-W336 HydrophobicContact CD2-CH2 3.79Å; L94-W336 HydrophobicContact CD2-CZ3 3.98Å
95	C	93.5	Very high	89.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.			trans	-83	124.4	175.4	-170.1	0	0	0	0	110.5	C62 C65 M69 N97 C100 W101 N109	C62-C95 HydrophobicContact CB-CB 3.9Å; C62-C95 VanDerWaalsContact SG-SG 3.65Å; C65-C95 PolarHBondContact SG-SG 3.08Å; M69-C95 HydrophobicContact CG-CB 4.13Å; C95-N97 PolarHBondContact O-N 3.16Å; C95-N97 VanDerWaalsContact SG-CB 3.55Å; C95-N97 PolarHBondContact SG-N 2.91Å; C95-N97 VanDerWaalsContact SG-N 3.45Å; C95-C100 HydrophobicContact CB-CB 4.5Å; C95-W101 PolarHBondContact O-NE1 2.98Å; C95-N109 HydrophobicContact CB-CB 3.94Å; C95-N109 PolarHBondContact N-O 3.12Å
96	K	89.4	Confident	87.5	Confident	58 Å²	58	42.2 Å²	42.2	25%	0.252	21%	0.212	S	C	.	.			trans	-75	-7.3	173.6	-73.1	-176	165.1	-177	0	113.9	T70 L94 K98 L200 F202 L326	T70-K96 WeakPolarHBondContact OG1-CD 3.39Å; L94-K96 HydrophobicContact CD1-CG 4.28Å; K96-K98 PolarHBondContact O-N 3.04Å; K96-K98 VanDerWaalsContact O-N 3.12Å; K96-L200 PolarHBondContact NZ-O 3.5Å; K96-F202 HydrophobicContact CD-CE1 4.44Å; K96-F202 HydrophobicContact CD-CZ 4.3Å; K96-F202 HydrophobicContact CG-CZ 4.06Å; K96-L326 HydrophobicContact CD-CD2 4.37Å
97	N	87.9	Confident	86.2	Confident	55 Å²	55	39.7 Å²	39.7	29%	0.294	20%	0.202	S	C	.	.			trans	-73.1	108.4	178.7	-171.7	-22	0	0	0	110.3	C95 T99 C100	C95-N97 PolarHBondContact O-N 3.16Å; C95-N97 VanDerWaalsContact SG-CB 3.55Å; C95-N97 PolarHBondContact SG-N 2.91Å; C95-N97 VanDerWaalsContact SG-N 3.45Å; N97-T99 PolarHBondContact O-N 2.95Å; N97-T99 VanDerWaalsContact O-N 3.16Å; N97-T99 PolarHBondContact OD1-N 3.28Å; N97-T99 PolarHBondContact OD1-OG1 2.92Å; N97-C100 WeakPolarHBondContact O-CB 3.34Å; N97-C100 PolarHBondContact O-N 2.91Å
98	K	83.5	Confident	85.7	Confident	44 Å²	44	42.6 Å²	42.6	19%	0.191	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-40.7	-44.2	173	-70.5	-170.8	-163.3	-175.8	0	115.4	K96 C100 W101 T328 D330 C332	K96-K98 PolarHBondContact O-N 3.04Å; K96-K98 VanDerWaalsContact O-N 3.12Å; K98-C100 PolarHBondContact O-N 3.46Å; K98-C100 VanDerWaalsContact O-N 3.08Å; K98-W101 PolarHBondContact O-N 2.93Å; K98-T328 WeakPolarHBondContact CE-OG1 3.22Å; K98-T328 VanDerWaalsContact NZ-CG2 3.32Å; K98-T328 PolarHBondContact NZ-OG1 2.75Å; K98-D330 IonicContact NZ-OD2 2.59Å; K98-D330 PolarHBondContact NZ-OD2 2.93Å; K98-C332 WeakPolarHBondContact CA-O 3.14Å; K98-C332 HydrophobicContact CB-CB 4.35Å; K98-C332 WeakPolarHBondContact CB-O 3.29Å; K98-C332 WeakPolarHBondContact CD-O 3.47Å; K98-C332 WeakPolarHBondContact CG-O 3.24Å
99	T	86.3	Confident	85.4	Confident	75 Å²	75	42.7 Å²	42.7	46%	0.46	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-63.4	-20	-178.5	63.5	0	0	0	0	112.9	N97 W101	N97-T99 PolarHBondContact O-N 2.95Å; N97-T99 VanDerWaalsContact O-N 3.16Å; N97-T99 PolarHBondContact OD1-N 3.28Å; N97-T99 PolarHBondContact OD1-OG1 2.92Å; T99-W101 VanDerWaalsContact C-N 3.34Å
100	C	89.3	Confident	85.2	Confident	4 Å²	4	43 Å²	43	3%	0.027	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-81.5	-9.1	177.3	-60.5	0	0	0	0	114.6	Q64 C65 C95 N97 K98 N109	Q64-C100 VanDerWaalsContact OE1-CB 3.24Å; Q64-C100 PolarHBondContact OE1-O 3.18Å; C65-C100 VanDerWaalsContact SG-SG 3.64Å; C95-C100 HydrophobicContact CB-CB 4.5Å; N97-C100 WeakPolarHBondContact O-CB 3.34Å; N97-C100 PolarHBondContact O-N 2.91Å; K98-C100 PolarHBondContact O-N 3.46Å; K98-C100 VanDerWaalsContact O-N 3.08Å; C100-N109 HydrophobicContact CB-CB 3.82Å; C100-N109 PolarHBondContact O-ND2 3.46Å
101	W	86	Confident	85.1	Confident	9 Å²	9	43.9 Å²	43.9	3%	0.034	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-100	-4.5	-178.4	-67.8	92.6	0	0	0	114.4	L94 C95 K98 T99 N109 V110 V334 D335 W336 K362	L94-W101 HydrophobicContact CB-CH2 4.28Å; L94-W101 HydrophobicContact CB-CZ2 3.92Å; L94-W101 HydrophobicContact CD1-CZ2 4.08Å; L94-W101 HydrophobicContact CD2-CH2 4.07Å; L94-W101 HydrophobicContact CD2-CZ2 3.86Å; L94-W101 HydrophobicContact CG-CZ2 4.19Å; C95-W101 PolarHBondContact O-NE1 2.98Å; K98-W101 PolarHBondContact O-N 2.93Å; T99-W101 VanDerWaalsContact C-N 3.34Å; W101-N109 VanDerWaalsContact CE3-ND2 3.3Å; W101-N109 WeakPolarHBondContact CZ2-ND2 3.27Å; W101-N109 WeakPolarHBondContact CZ3-ND2 3.1Å; W101-V110 HydrophobicContact CH2-CG2 3.7Å; W101-V110 HydrophobicContact CZ2-CG2 4.42Å; W101-V110 HydrophobicContact CZ3-CG2 4.34Å; W101-V334 HydrophobicContact CD2-CG1 3.97Å; W101-V334 HydrophobicContact CE3-CG1 4.5Å; W101-V334 HydrophobicContact CG-CB 4.49Å; W101-V334 HydrophobicContact CG-CG1 4.4Å; W101-V334 HydrophobicContact CH2-CG1 4.32Å; W101-V334 HydrophobicContact CZ2-CG1 3.77Å; W101-D335 VanDerWaalsContact CE3-O 3.23Å; W101-W336 AromaticContact CE3-CE3 3.78Å; W101-W336 HydrophobicContact CE3-CE3 3.78Å; W101-W336 HydrophobicContact CE3-CZ3 4.21Å; W101-W336 AromaticContact CH2-CE3 3.55Å; W101-W336 HydrophobicContact CH2-CE3 3.55Å; W101-W336 HydrophobicContact CH2-CH2 4.36Å; W101-W336 AromaticContact CH2-CZ3 3.31Å; W101-W336 HydrophobicContact CH2-CZ3 3.31Å; W101-W336 HydrophobicContact CZ2-CE3 4.4Å; W101-W336 AromaticContact CZ2-CZ3 3.9Å; W101-W336 HydrophobicContact CZ2-CZ3 3.9Å; W101-W336 HydrophobicContact CZ3-CD2 4.22Å; W101-W336 AromaticContact CZ3-CE3 3.18Å; W101-W336 HydrophobicContact CZ3-CE3 3.18Å; W101-W336 AromaticContact CZ3-CZ3 3.51Å; W101-W336 HydrophobicContact CZ3-CZ3 3.51Å; W101-K362 HydrophobicContact CE3-CD 3.64Å; W101-K362 HydrophobicContact CZ3-CD 3.56Å; W101-K362 PolarHBondContact O-NZ 3.33Å
102	K	80.5	Confident	85.1	Confident	107 Å²	107	43.9 Å²	43.9	47%	0.465	23%	0.226	S	C	.	.	S	Bend	trans	-55.1	141.6	173.7	-65.7	-173.6	175.5	-171.4	0	110.7	K104	K102-K104 PolarHBondContact O-N 2.75Å; K102-K104 VanDerWaalsContact O-N 3.16Å
103	P	72.9	Confident	85.1	Confident	75 Å²	75	44.2 Å²	44.2	49%	0.487	23%	0.228	S	C	.	.	S	Bend	trans	-52	118.9	-178.5	-28.1	34.7	0	0	0	112.7	D364	P103-D364 WeakPolarHBondContact CA-OD2 2.98Å
104	K	71.1	Confident	85.1	Confident	125 Å²	125	44.2 Å²	44.2	54%	0.543	23%	0.227	S	C	.	.			trans	-156	154	179.6	-66.9	-176.1	-174.6	172.9	0	109.9	K102 S106	K102-K104 PolarHBondContact O-N 2.75Å; K102-K104 VanDerWaalsContact O-N 3.16Å; K104-S106 PolarHBondContact O-N 2.8Å
105	Q	58.7	Low	85.2	Confident	183 Å²	183	44.1 Å²	44.1	86%	0.855	23%	0.227	S	C	*	.	S	Bend	trans	-70	-25.4	-179.1	-69.5	178.8	-1.6	0	0	114.8
106	S	63	Low	85.4	Confident	65 Å²	65	44.1 Å²	44.1	46%	0.455	23%	0.227	S	C	.	.			trans	-110.2	117.5	-172.9	-171.4	0	0	0	0	112.7	Q64 K104 N108	Q64-S106 PolarHBondContact NE2-O 2.93Å; K104-S106 PolarHBondContact O-N 2.8Å; S106-N108 PolarHBondContact O-N 3.43Å; S106-N108 PolarHBondContact OG-OD1 2.88Å
107	V	67.1	Low	85.8	Confident	18 Å²	18	41.7 Å²	41.7	11%	0.109	22%	0.217	C	C	.	.			trans	-88.3	83.4	177.2	-170	0	0	0	0	110.3	N109 V110 K362	V107-N109 VanDerWaalsContact C-N 3.33Å; V107-N109 WeakPolarHBondContact CG1-OD1 3.5Å; V107-V110 HydrophobicContact CG1-CB 3.78Å; V107-V110 HydrophobicContact CG1-CG2 3.83Å; V107-K362 HydrophobicContact CB-CB 4.48Å; V107-K362 HydrophobicContact CG1-CB 4.22Å; V107-K362 HydrophobicContact CG2-CB 3.4Å; V107-K362 VanDerWaalsContact CG2-CB 3.4Å; V107-K362 VanDerWaalsContact CG2-N 3.3Å
108	N	85.5	Confident	86.1	Confident	73 Å²	73	41.5 Å²	41.5	39%	0.39	22%	0.218	S	C	.	.			trans	-97.7	7.9	172.7	-62.6	-6.9	0	0	0	111.9	G63 Q64 S106	G63-N108 PolarHBondContact N-O 2.81Å; Q64-N108 HydrophobicContact CG-CB 3.81Å; S106-N108 PolarHBondContact O-N 3.43Å; S106-N108 PolarHBondContact OG-OD1 2.88Å
109	N	91.7	Very high	86.6	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.011	23%	0.231	C	C	.	.	S	Bend	trans	-106	0	-177.5	66.4	-48.7	0	0	0	113.2	L94 C95 C100 W101 V107	L94-N109 CarbonylContact C-O 3.41Å; L94-N109 WeakPolarHBondContact CA-O 3.09Å; C95-N109 HydrophobicContact CB-CB 3.94Å; C95-N109 PolarHBondContact N-O 3.12Å; C100-N109 HydrophobicContact CB-CB 3.82Å; C100-N109 PolarHBondContact O-ND2 3.46Å; W101-N109 VanDerWaalsContact CE3-ND2 3.3Å; W101-N109 WeakPolarHBondContact CZ2-ND2 3.27Å; W101-N109 WeakPolarHBondContact CZ3-ND2 3.1Å; V107-N109 VanDerWaalsContact C-N 3.33Å; V107-N109 WeakPolarHBondContact CG1-OD1 3.5Å
110	V	94.8	Very high	87	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	142.1	171.1	-178.4	0	0	0	0	107.8	V92 F93 L94 W101 V107 V339 S360	V92-V110 HydrophobicContact CG1-CG1 3.8Å; F93-V110 CarbonylContact O-C 3.02Å; F93-V110 WeakPolarHBondContact O-CA 3.28Å; L94-V110 HydrophobicContact CB-CG2 4.28Å; W101-V110 HydrophobicContact CH2-CG2 3.7Å; W101-V110 HydrophobicContact CZ2-CG2 4.42Å; W101-V110 HydrophobicContact CZ3-CG2 4.34Å; V107-V110 HydrophobicContact CG1-CB 3.78Å; V107-V110 HydrophobicContact CG1-CG2 3.83Å; V110-V339 HydrophobicContact CG1-CG1 4.28Å; V110-S360 PolarHBondContact O-OG 3.16Å
111	T	96.3	Very high	87.3	Confident	20 Å²	20	48.6 Å²	48.6	12%	0.123	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	136.1	175.3	-73.1	0	0	0	0	109.6	M69 F93 F113	M69-T111 HydrophobicContact CE-CG2 4.37Å; M69-T111 WeakPolarHBondContact CE-OG1 3.31Å; F93-T111 PolarHBondContact N-O 3.22Å; F93-T111 PolarHBondContact O-N 3.28Å; T111-F113 HydrophobicContact CG2-CD2 4.04Å; T111-F113 HydrophobicContact CG2-CE2 3.5Å; T111-F113 HydrophobicContact CG2-CZ 3.84Å
112	V	97.6	Very high	87.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.6	-179.5	-172.9	0	0	0	0	109.3	Y91 V92 I341 K357 E358	Y91-V112 CarbonylContact O-C 3.49Å; Y91-V112 VanDerWaalsContact O-CA 3.27Å; Y91-V112 WeakPolarHBondContact O-CA 3.5Å; V92-V112 HydrophobicContact CG1-CG2 4.4Å; V92-V112 HydrophobicContact CG2-CG1 4.44Å; V92-V112 HydrophobicContact CG2-CG2 4.22Å; V112-I341 HydrophobicContact CB-CG2 4.39Å; V112-I341 HydrophobicContact CG1-CG2 3.81Å; V112-I341 HydrophobicContact CG2-CD1 3.66Å; V112-I341 HydrophobicContact CG2-CG1 4.33Å; V112-I341 HydrophobicContact CG2-CG2 4.07Å; V112-K357 WeakPolarHBondContact O-CA 3.29Å; V112-E358 HydrophobicContact CB-CB 4.12Å; V112-E358 HydrophobicContact CG1-CB 4.02Å; V112-E358 PolarHBondContact O-N 3.43Å
113	F	98.2	Very high	88.2	Confident	7 Å²	7	52.1 Å²	52.1	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.1	171.7	-70.9	-75.4	0	0	0	110.9	P55 L60 L90 Y91 F93 T111 Y355 L356 K357	P55-F113 HydrophobicContact CB-CE2 4.24Å; P55-F113 HydrophobicContact CB-CZ 4.42Å; P55-F113 HydrophobicContact CG-CD2 4.18Å; P55-F113 HydrophobicContact CG-CE2 4.26Å; P55-F113 HydrophobicContact CG-CG 4.38Å; L60-F113 HydrophobicContact CD2-CD2 4.46Å; L60-F113 HydrophobicContact CD2-CE2 3.69Å; L60-F113 HydrophobicContact CG-CE2 4.23Å; L90-F113 CarbonylContact C-O 3.52Å; L90-F113 WeakPolarHBondContact CA-O 3.2Å; Y91-F113 PolarHBondContact N-O 3.14Å; Y91-F113 PolarHBondContact O-N 2.87Å; F93-F113 HydrophobicContact CD2-CD2 4.15Å; F93-F113 HydrophobicContact CE2-CD2 4.17Å; T111-F113 HydrophobicContact CG2-CD2 4.04Å; T111-F113 HydrophobicContact CG2-CE2 3.5Å; T111-F113 HydrophobicContact CG2-CZ 3.84Å; F113-Y355 HydrophobicContact CB-CD1 4.18Å; F113-L356 CarbonylContact C-O 3.55Å; F113-L356 VanDerWaalsContact CA-O 3.29Å; F113-L356 WeakPolarHBondContact CA-O 3.14Å; F113-K357 HydrophobicContact CD1-CG 3.95Å; F113-K357 HydrophobicContact CE1-CD 4.32Å; F113-K357 HydrophobicContact CE1-CG 3.4Å; F113-K357 HydrophobicContact CZ-CG 4.06Å
114	R	98.2	Very high	89.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	133.8	167.1	-175.5	-173.4	75.6	-170.6	15.2	110.2	R88 M89 L90 Q116 S347 C348 A351 Y355 L356 E358	R88-R114 HydrophobicContact CG-CG 4.25Å; M89-R114 WeakPolarHBondContact O-CA 3.31Å; L90-R114 HydrophobicContact CD2-CB 3.76Å; L90-R114 HydrophobicContact CD2-CG 3.81Å; R114-Q116 VanDerWaalsContact CD-OE1 3.31Å; R114-Q116 HydrophobicContact CG-CG 4.19Å; R114-S347 VanDerWaalsContact NH2-C 3.29Å; R114-C348 PolarHBondContact NH2-O 3.06Å; R114-C348 PolarHBondContact NH2-SG 3.41Å; R114-A351 HydrophobicContact CG-CB 4.44Å; R114-Y355 WeakPolarHBondContact O-CA 3.5Å; R114-L356 PolarHBondContact N-O 3Å; R114-L356 PolarHBondContact O-N 2.88Å; R114-E358 HydrophobicContact CB-CG 3.75Å; R114-E358 WeakPolarHBondContact CD-OE1 3.14Å; R114-E358 IonicContact CZ-OE1 3.68Å; R114-E358 IonicContact NE-OE1 2.73Å; R114-E358 IonicContact NH1-OE1 2.75Å; R114-E358 PolarHBondContact NH1-OE1 3.11Å
115	S	98	Very high	90	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.3	167.3	-177.7	0	0	0	0	109.7	L49 N50 R88 M89 Y355	L49-S115 WeakPolarHBondContact CD2-O 3.18Å; N50-S115 VanDerWaalsContact CB-OG 3.32Å; N50-S115 WeakPolarHBondContact CB-OG 2.91Å; R88-S115 WeakPolarHBondContact CA-O 3.21Å; M89-S115 PolarHBondContact N-O 3.07Å; M89-S115 PolarHBondContact O-N 2.83Å; S115-Y355 VanDerWaalsContact CB-CE1 3.47Å
116	Q	97.4	Very high	91.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.6	-175.9	-64.9	179.4	166.5	0	0	110.6	S84 A85 H87 R88 R114 S347 C348 A351 S352	S84-Q116 WeakPolarHBondContact O-CB 3.38Å; A85-Q116 HydrophobicContact CB-CB 4.41Å; A85-Q116 HydrophobicContact CB-CG 4.08Å; H87-Q116 CarbonylContact O-C 3.49Å; H87-Q116 WeakPolarHBondContact O-CA 3.19Å; R88-Q116 HydrophobicContact CB-CG 3.92Å; R88-Q116 VanDerWaalsContact CD-OE1 3.24Å; R88-Q116 HydrophobicContact CG-CG 3.76Å; R114-Q116 VanDerWaalsContact CD-OE1 3.31Å; R114-Q116 HydrophobicContact CG-CG 4.19Å; Q116-S347 PolarHBondContact NE2-O 2.85Å; Q116-S347 PolarHBondContact OE1-O 2.77Å; Q116-C348 PolarHBondContact NE2-O 3.24Å; Q116-A351 HydrophobicContact CB-CB 4.11Å; Q116-A351 HydrophobicContact CG-CB 3.84Å; Q116-A351 PolarHBondContact N-O 3.24Å; Q116-S352 WeakPolarHBondContact O-CA 3.43Å
117	L	96.9	Very high	92.4	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	142.9	170.2	-67.8	173.6	0	0	0	110.4	L49 N50 S84 F86 H87 N121 F123 Y124	L49-L117 HydrophobicContact CD1-CD1 3.85Å; L49-L117 HydrophobicContact CD1-CG 4.42Å; L49-L117 HydrophobicContact CD2-CG 4.34Å; L49-L117 HydrophobicContact CG-CD1 3.76Å; L49-L117 HydrophobicContact CG-CG 4.01Å; N50-L117 HydrophobicContact CB-CD2 4.36Å; S84-L117 CarbonylContact O-C 3.56Å; S84-L117 WeakPolarHBondContact O-CA 3.2Å; S84-L117 PolarHBondContact O-N 2.99Å; F86-L117 PolarHBondContact N-O 3.47Å; H87-L117 HydrophobicContact CB-CB 4.32Å; H87-L117 PolarHBondContact N-O 2.73Å; H87-L117 PolarHBondContact O-N 2.88Å; L117-N121 HydrophobicContact CB-CB 4.23Å; L117-N121 HydrophobicContact CD1-CB 4.39Å; L117-N121 HydrophobicContact CD2-CB 4.37Å; L117-F123 HydrophobicContact CD1-CD2 3.66Å; L117-F123 HydrophobicContact CD1-CE2 4.41Å; L117-F123 HydrophobicContact CD2-CD2 3.91Å; L117-F123 HydrophobicContact CD2-CE2 3.89Å; L117-F123 HydrophobicContact CG-CD2 4.47Å; L117-Y124 HydrophobicContact CD1-CD2 3.98Å; L117-Y124 HydrophobicContact CD1-CE2 3.79Å
118	P	95.9	Very high	93.1	Very high	51 Å²	51	53.5 Å²	53.5	33%	0.331	26%	0.263	S	S	.	.			trans	-64.7	163.9	167.3	27.8	-32.9	0	0	0	111.1	S83 I120 N121	S83-P118 WeakPolarHBondContact O-CA 3.41Å; P118-I120 VanDerWaalsContact C-N 3.26Å; P118-I120 WeakPolarHBondContact CG-O 3.35Å; P118-I120 PolarHBondContact O-N 3.11Å; P118-N121 PolarHBondContact O-ND2 3.28Å
119	R	94	Very high	93.3	Very high	121 Å²	121	52 Å²	52	46%	0.457	26%	0.257	S	S	.	.	S	Bend	trans	-54.7	-41.6	179.7	179.2	172.7	170	-173.1	-8.5	113.4	F86 E126	F86-R119 HydrophobicContact CB-CB 4.25Å; F86-R119 VanDerWaalsContact CD1-CA 3.44Å; F86-R119 HydrophobicContact CD1-CB 3.57Å; F86-R119 HydrophobicContact CD1-CG 4.02Å; F86-R119 HydrophobicContact CD2-CB 3.98Å; F86-R119 HydrophobicContact CE1-CB 3.83Å; F86-R119 HydrophobicContact CE1-CG 3.72Å; F86-R119 HydrophobicContact CE2-CB 4.23Å; F86-R119 HydrophobicContact CE2-CG 4.27Å; F86-R119 HydrophobicContact CG-CB 3.64Å; F86-R119 HydrophobicContact CG-CG 4.4Å; F86-R119 HydrophobicContact CZ-CB 4.16Å; F86-R119 HydrophobicContact CZ-CG 3.87Å; R119-E126 HydrophobicContact CG-CG 4.32Å; R119-E126 IonicContact CZ-OE1 3.11Å; R119-E126 VanDerWaalsContact CZ-OE1 3.24Å; R119-E126 IonicContact NE-OE1 3.45Å; R119-E126 PolarHBondContact NE-OE1 2.83Å; R119-E126 IonicContact NH2-OE1 2.7Å; R119-E126 PolarHBondContact NH2-OE1 3.25Å
120	I	94.3	Very high	93.4	Very high	127 Å²	127	58.9 Å²	58.9	65%	0.651	29%	0.289	S	S	*	.	S	Bend	trans	-101.6	118	173.2	-60.5	171.4	0	0	0	106	P118	P118-I120 VanDerWaalsContact C-N 3.26Å; P118-I120 WeakPolarHBondContact CG-O 3.35Å; P118-I120 PolarHBondContact O-N 3.11Å
121	N	94.3	Very high	93.3	Very high	25 Å²	25	60.8 Å²	60.8	13%	0.134	30%	0.302	C	S	.	.			trans	-146.8	170.4	-177.3	62.3	79.6	0	0	0	110.3	L117 P118 F123 Y124	L117-N121 HydrophobicContact CB-CB 4.23Å; L117-N121 HydrophobicContact CD1-CB 4.39Å; L117-N121 HydrophobicContact CD2-CB 4.37Å; P118-N121 PolarHBondContact O-ND2 3.28Å; N121-F123 VanDerWaalsContact C-N 3.28Å; N121-F123 PolarHBondContact O-N 2.62Å; N121-F123 PolarHBondContact OD1-N 3.04Å; N121-Y124 PolarHBondContact OD1-N 3.39Å
122	D	93	Very high	93.1	Very high	151 Å²	151	62.6 Å²	62.6	81%	0.807	32%	0.315	S	S	*	.	S	Bend	trans	-78.8	-10.2	-173.1	-60.9	-32	0	0	0	114
123	F	94.1	Very high	93	Very high	39 Å²	39	64.3 Å²	64.3	17%	0.171	33%	0.325	C	S	.	.	S	Bend	trans	-104.8	-40.2	-167.8	-54.3	-58.1	0	0	0	113	N50 L51 A52 L117 N121 L146	N50-F123 HydrophobicContact CB-CE2 4.41Å; N50-F123 WeakPolarHBondContact OD1-CE2 3.39Å; N50-F123 WeakPolarHBondContact OD1-CZ 3.33Å; L51-F123 HydrophobicContact CB-CD1 3.7Å; L51-F123 HydrophobicContact CB-CE1 3.91Å; L51-F123 HydrophobicContact CB-CG 4.22Å; L51-F123 HydrophobicContact CD1-CB 3.88Å; L51-F123 HydrophobicContact CD1-CD1 3.88Å; L51-F123 HydrophobicContact CD1-CG 4.14Å; L51-F123 HydrophobicContact CG-CB 3.98Å; L51-F123 HydrophobicContact CG-CD1 3.79Å; L51-F123 HydrophobicContact CG-CE1 4.48Å; L51-F123 HydrophobicContact CG-CG 3.9Å; A52-F123 HydrophobicContact CB-CZ 4.04Å; L117-F123 HydrophobicContact CD1-CD2 3.66Å; L117-F123 HydrophobicContact CD1-CE2 4.41Å; L117-F123 HydrophobicContact CD2-CD2 3.91Å; L117-F123 HydrophobicContact CD2-CE2 3.89Å; L117-F123 HydrophobicContact CG-CD2 4.47Å; N121-F123 VanDerWaalsContact C-N 3.28Å; N121-F123 PolarHBondContact O-N 2.62Å; N121-F123 PolarHBondContact OD1-N 3.04Å; F123-L146 HydrophobicContact CD1-CD1 4.47Å
124	Y	94.6	Very high	92.8	Very high	12 Å²	12	68.8 Å²	68.8	5%	0.047	36%	0.355	C	S	.	.	S	Bend	trans	-120.1	144.3	-174	-55.1	-74.8	0	0	0	112.3	P36 F38 W48 L49 L51 L117 N121 V143	P36-Y124 HydrophobicContact CB-CD1 4.39Å; F38-Y124 HydrophobicContact CE1-CD1 4.17Å; F38-Y124 AromaticContact CE1-CD2 3.69Å; F38-Y124 HydrophobicContact CE1-CD2 3.69Å; F38-Y124 HydrophobicContact CE1-CE1 4.26Å; F38-Y124 AromaticContact CE1-CE2 3.79Å; F38-Y124 HydrophobicContact CE1-CE2 3.79Å; F38-Y124 AromaticContact CE1-CG 3.88Å; F38-Y124 HydrophobicContact CE1-CG 3.88Å; F38-Y124 HydrophobicContact CZ-CD1 4.1Å; F38-Y124 AromaticContact CZ-CD2 3.89Å; F38-Y124 HydrophobicContact CZ-CD2 3.89Å; F38-Y124 HydrophobicContact CZ-CE2 4.42Å; F38-Y124 AromaticContact CZ-CG 3.7Å; F38-Y124 HydrophobicContact CZ-CG 3.7Å; W48-Y124 PolarHBondContact O-OH 2.83Å; L49-Y124 WeakPolarHBondContact CA-OH 3.06Å; L49-Y124 HydrophobicContact CD1-CE2 3.93Å; L49-Y124 WeakPolarHBondContact O-CE2 3.27Å; L49-Y124 PolarHBondContact O-OH 2.8Å; L51-Y124 WeakPolarHBondContact CD2-OH 3.19Å; L117-Y124 HydrophobicContact CD1-CD2 3.98Å; L117-Y124 HydrophobicContact CD1-CE2 3.79Å; N121-Y124 PolarHBondContact OD1-N 3.39Å; Y124-V143 HydrophobicContact CD1-CG2 3.84Å; Y124-V143 HydrophobicContact CE1-CG1 4.15Å; Y124-V143 HydrophobicContact CE1-CG2 3.79Å
125	P	87.3	Confident	92.6	Very high	60 Å²	60	74.7 Å²	74.7	39%	0.39	38%	0.383	S	S	.	.			trans	-66	141.8	172.4	29.4	-33.9	0	0	0	110.7	K127	P125-K127 VanDerWaalsContact C-N 3.25Å; P125-K127 PolarHBondContact O-N 3.19Å
126	E	86	Confident	92.4	Very high	105 Å²	105	74.7 Å²	74.7	49%	0.491	38%	0.383	S	S	.	.	S	Bend	trans	-61.8	-37.1	175.2	-170.4	-167.3	164.6	0	0	111.8	R119 Q128	R119-E126 HydrophobicContact CG-CG 4.32Å; R119-E126 IonicContact CZ-OE1 3.11Å; R119-E126 VanDerWaalsContact CZ-OE1 3.24Å; R119-E126 IonicContact NE-OE1 3.45Å; R119-E126 PolarHBondContact NE-OE1 2.83Å; R119-E126 IonicContact NH2-OE1 2.7Å; R119-E126 PolarHBondContact NH2-OE1 3.25Å; E126-Q128 PolarHBondContact O-N 2.73Å
127	K	85.7	Confident	92.3	Very high	178 Å²	178	78.4 Å²	78.4	77%	0.774	40%	0.402	S	S	*	.	S	Bend	trans	-80.4	108.7	175.4	-173.6	-177.5	176.5	-170.6	0	109	P125	P125-K127 VanDerWaalsContact C-N 3.25Å; P125-K127 PolarHBondContact O-N 3.19Å
128	Q	81.7	Confident	92.1	Very high	139 Å²	139	81 Å²	81	65%	0.65	42%	0.424	S	S	*	.			trans	-60.6	136.3	171.2	-70.1	-176.7	-30.7	0	0	110.8	E126	E126-Q128 PolarHBondContact O-N 2.73Å
129	T	89.6	Confident	92	Very high	43 Å²	43	79 Å²	79	26%	0.264	41%	0.413	S	S	.	.			trans	-105	161	170.4	50.7	0	0	0	0	109.5	E135	T129-E135 HydrophobicContact CG2-CB 4.04Å
130	E	93.2	Very high	92	Very high	146 Å²	146	74.6 Å²	74.6	68%	0.682	40%	0.399	S	S	*	.			trans	-86.2	139.3	176.1	-70.3	176.5	-172.5	0	0	110.1	T133 G136	E130-T133 HydrophobicContact CB-CG2 3.86Å; E130-T133 PolarHBondContact O-OG1 3.12Å; E130-G136 WeakPolarHBondContact O-CA 3.22Å
131	P	93.4	Very high	91.9	Very high	46 Å²	46	73.4 Å²	73.4	30%	0.299	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	158.1	175.7	28	-33.9	0	0	0	111.3	N32 F37 T133	N32-P131 VanDerWaalsContact OD1-CB 3.3Å; N32-P131 WeakPolarHBondContact OD1-CB 3.39Å; N32-P131 VanDerWaalsContact OD1-CG 3.25Å; N32-P131 WeakPolarHBondContact OD1-CG 3.44Å; F37-P131 HydrophobicContact CD1-CB 4.17Å; F37-P131 HydrophobicContact CD2-CB 3.81Å; F37-P131 HydrophobicContact CE1-CB 4.13Å; F37-P131 HydrophobicContact CE2-CB 3.76Å; F37-P131 HydrophobicContact CG-CB 4.03Å; F37-P131 HydrophobicContact CZ-CB 3.93Å; P131-T133 PolarHBondContact O-N 2.89Å
132	C	91.6	Very high	91.9	Very high	59 Å²	59	78.7 Å²	78.7	40%	0.399	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	15.1	176.8	-41.1	0	0	0	0	114.9	C31 N32	C31-C132 HydrophobicContact CB-CB 4.06Å; C31-C132 WeakPolarHBondContact CB-SG 3.42Å; C31-C132 WeakPolarHBondContact SG-CB 3.43Å; C31-C132 CovalentContact SG-SG 2.04Å; C31-C132 PolarHBondContact SG-SG 3.33Å; N32-C132 PolarHBondContact OD1-SG 2.89Å
133	T	95.5	Very high	91.9	Very high	35 Å²	35	71.7 Å²	71.7	22%	0.215	38%	0.382	C	S	.	.	S	Bend	trans	-99	162.2	169	65.4	0	0	0	0	110.8	E130 P131 E135 G136 N137	E130-T133 HydrophobicContact CB-CG2 3.86Å; E130-T133 PolarHBondContact O-OG1 3.12Å; P131-T133 PolarHBondContact O-N 2.89Å; T133-E135 VanDerWaalsContact C-N 3.27Å; T133-E135 PolarHBondContact O-N 3.35Å; T133-G136 PolarHBondContact O-N 2.81Å; T133-G136 VanDerWaalsContact O-N 3.16Å; T133-G136 PolarHBondContact OG1-N 2.65Å; T133-N137 WeakPolarHBondContact O-CB 3.26Å; T133-N137 VanDerWaalsContact O-CG 3.28Å; T133-N137 PolarHBondContact O-N 3.38Å; T133-N137 PolarHBondContact O-ND2 3.45Å
134	P	94.9	Very high	91.6	Very high	102 Å²	102	75 Å²	75	66%	0.662	40%	0.401	S	S	*	.	H	α-helix	trans	-53.6	-42.5	172.7	-27	36.2	0	0	0	113.2	N137 A138	P134-N137 PolarHBondContact O-N 3.42Å; P134-A138 WeakPolarHBondContact O-CB 3.29Å; P134-A138 PolarHBondContact O-N 2.79Å
135	E	93.7	Very high	91.5	Very high	124 Å²	124	77.8 Å²	77.8	58%	0.579	43%	0.426	S	S	*	.	H	α-helix	trans	-68	-39.5	177.1	-63.8	73.8	-162.8	0	0	111.9	T129 T133 A138 A139	T129-E135 HydrophobicContact CG2-CB 4.04Å; T133-E135 VanDerWaalsContact C-N 3.27Å; T133-E135 PolarHBondContact O-N 3.35Å; E135-A138 PolarHBondContact O-N 2.84Å; E135-A139 PolarHBondContact O-N 3.16Å
136	G	94.1	Very high	91.7	Very high	0 Å²	0	78.5 Å²	78.5	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-60.2	-48.7	173.1	0	0	0	0	0	111.9	E130 T133 A138 A139 V140	E130-G136 WeakPolarHBondContact O-CA 3.22Å; T133-G136 PolarHBondContact O-N 2.81Å; T133-G136 VanDerWaalsContact O-N 3.16Å; T133-G136 PolarHBondContact OG1-N 2.65Å; G136-A138 VanDerWaalsContact C-N 3.34Å; G136-A138 PolarHBondContact O-N 2.63Å; G136-A139 WeakPolarHBondContact O-CB 3.27Å; G136-A139 PolarHBondContact O-N 2.97Å; G136-A139 VanDerWaalsContact O-N 3.11Å; G136-V140 WeakPolarHBondContact O-CG2 3.32Å; G136-V140 PolarHBondContact O-N 3Å
137	N	94	Very high	91.7	Very high	78 Å²	78	74.5 Å²	74.5	42%	0.417	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-41.2	178	-69.4	-23.4	0	0	0	111.7	T133 P134 A139 V140 V141	T133-N137 WeakPolarHBondContact O-CB 3.26Å; T133-N137 VanDerWaalsContact O-CG 3.28Å; T133-N137 PolarHBondContact O-N 3.38Å; T133-N137 PolarHBondContact O-ND2 3.45Å; P134-N137 PolarHBondContact O-N 3.42Å; N137-A139 VanDerWaalsContact C-N 3.31Å; N137-A139 PolarHBondContact O-N 3.07Å; N137-V140 PolarHBondContact O-N 2.66Å; N137-V141 WeakPolarHBondContact O-CG2 3.45Å; N137-V141 PolarHBondContact O-N 3.18Å
138	A	94.1	Very high	91.5	Very high	59 Å²	59	74 Å²	74	49%	0.488	41%	0.407	S	S	.	.	H	α-helix	trans	-61.5	-39.3	174	0	0	0	0	0	112.2	P134 E135 G136 V141 K142	P134-A138 WeakPolarHBondContact O-CB 3.29Å; P134-A138 PolarHBondContact O-N 2.79Å; E135-A138 PolarHBondContact O-N 2.84Å; G136-A138 VanDerWaalsContact C-N 3.34Å; G136-A138 PolarHBondContact O-N 2.63Å; A138-V141 PolarHBondContact O-N 3.33Å; A138-K142 WeakPolarHBondContact O-CB 3.3Å; A138-K142 PolarHBondContact O-N 2.86Å
139	A	93.5	Very high	92	Very high	11 Å²	11	74 Å²	74	9%	0.091	40%	0.402	C	S	.	.	H	α-helix	trans	-63.9	-41.2	175.1	0	0	0	0	0	112.1	P36 E135 G136 N137 K142 V143	P36-A139 HydrophobicContact CB-CB 4.32Å; P36-A139 HydrophobicContact CG-CB 4.44Å; E135-A139 PolarHBondContact O-N 3.16Å; G136-A139 WeakPolarHBondContact O-CB 3.27Å; G136-A139 PolarHBondContact O-N 2.97Å; G136-A139 VanDerWaalsContact O-N 3.11Å; N137-A139 VanDerWaalsContact C-N 3.31Å; N137-A139 PolarHBondContact O-N 3.07Å; A139-K142 PolarHBondContact O-N 2.82Å; A139-V143 PolarHBondContact O-N 3.41Å
140	V	93.3	Very high	92.3	Very high	28 Å²	28	74 Å²	74	17%	0.17	40%	0.399	C	S	.	.	H	α-helix	trans	-60.8	-49.2	174.9	175	0	0	0	0	111.1	A34 P36 F37 G136 N137 K142 V143 L144	A34-V140 HydrophobicContact CB-CG1 4.25Å; A34-V140 HydrophobicContact CB-CG2 3.64Å; P36-V140 HydrophobicContact CG-CG2 3.97Å; F37-V140 HydrophobicContact CE2-CG2 3.7Å; F37-V140 HydrophobicContact CZ-CG2 4.1Å; G136-V140 WeakPolarHBondContact O-CG2 3.32Å; G136-V140 PolarHBondContact O-N 3Å; N137-V140 PolarHBondContact O-N 2.66Å; V140-K142 VanDerWaalsContact C-N 3.3Å; V140-K142 PolarHBondContact O-N 3.33Å; V140-V143 PolarHBondContact O-N 2.97Å; V140-L144 HydrophobicContact CG1-CD1 3.84Å; V140-L144 HydrophobicContact CG1-CG 4.25Å; V140-L144 WeakPolarHBondContact O-CB 3.34Å; V140-L144 WeakPolarHBondContact O-CG 3.27Å; V140-L144 PolarHBondContact O-N 2.74Å
141	V	92.8	Very high	92.4	Very high	102 Å²	102	67 Å²	67	62%	0.618	37%	0.367	S	S	*	.	H	α-helix	trans	-58.3	-43.5	178	172	0	0	0	0	111.2	N137 A138 L144 A145	N137-V141 WeakPolarHBondContact O-CG2 3.45Å; N137-V141 PolarHBondContact O-N 3.18Å; A138-V141 PolarHBondContact O-N 3.33Å; V141-L144 PolarHBondContact O-N 2.8Å; V141-A145 PolarHBondContact O-N 3.35Å
142	K	93	Very high	92.4	Very high	135 Å²	135	67.6 Å²	67.6	59%	0.587	37%	0.366	S	S	*	.	H	α-helix	trans	-60.7	-46.8	177.6	-173.3	-177.7	178.7	-174.4	0	111.8	A138 A139 V140 A145 L146	A138-K142 WeakPolarHBondContact O-CB 3.3Å; A138-K142 PolarHBondContact O-N 2.86Å; A139-K142 PolarHBondContact O-N 2.82Å; V140-K142 VanDerWaalsContact C-N 3.3Å; V140-K142 PolarHBondContact O-N 3.33Å; K142-A145 PolarHBondContact O-N 2.81Å; K142-L146 PolarHBondContact O-N 3.44Å
143	V	93	Very high	92.5	Very high	4 Å²	4	65.2 Å²	65.2	2%	0.024	35%	0.349	C	S	.	.	H	α-helix	trans	-65.5	-42.4	178.5	162.8	0	0	0	0	111.6	P36 L51 Y124 A139 V140 A145 L146 C147	P36-V143 HydrophobicContact CG-CB 4.1Å; P36-V143 HydrophobicContact CG-CG1 4.48Å; P36-V143 HydrophobicContact CG-CG2 3.87Å; L51-V143 HydrophobicContact CD1-CG1 3.8Å; L51-V143 HydrophobicContact CD2-CG1 4.31Å; Y124-V143 HydrophobicContact CD1-CG2 3.84Å; Y124-V143 HydrophobicContact CE1-CG1 4.15Å; Y124-V143 HydrophobicContact CE1-CG2 3.79Å; A139-V143 PolarHBondContact O-N 3.41Å; V140-V143 PolarHBondContact O-N 2.97Å; V143-A145 VanDerWaalsContact C-N 3.26Å; V143-A145 PolarHBondContact O-N 3.14Å; V143-L146 WeakPolarHBondContact O-CB 3.26Å; V143-L146 PolarHBondContact O-N 3.09Å; V143-C147 PolarHBondContact O-N 3.23Å; V143-C147 PolarHBondContact O-SG 2.97Å
144	L	89.5	Confident	92.5	Very high	109 Å²	109	64.4 Å²	64.4	57%	0.571	34%	0.344	S	S	*	.	H	α-helix	trans	-61.2	-33.8	175.9	-72.5	174.6	0	0	0	112.7	V140 V141 L146 C147	V140-L144 HydrophobicContact CG1-CD1 3.84Å; V140-L144 HydrophobicContact CG1-CG 4.25Å; V140-L144 WeakPolarHBondContact O-CB 3.34Å; V140-L144 WeakPolarHBondContact O-CG 3.27Å; V140-L144 PolarHBondContact O-N 2.74Å; V141-L144 PolarHBondContact O-N 2.8Å; L144-L146 VanDerWaalsContact C-N 3.26Å; L144-L146 PolarHBondContact O-N 3.01Å; L144-C147 WeakPolarHBondContact O-CB 3.45Å; L144-C147 PolarHBondContact O-N 3.21Å
145	A	91.3	Very high	92.5	Very high	70 Å²	70	59.7 Å²	59.7	58%	0.579	31%	0.314	S	S	*	.	H	α-helix	trans	-67.8	-25.3	175.6	0	0	0	0	0	113.4	V141 K142 V143	V141-A145 PolarHBondContact O-N 3.35Å; K142-A145 PolarHBondContact O-N 2.81Å; V143-A145 VanDerWaalsContact C-N 3.26Å; V143-A145 PolarHBondContact O-N 3.14Å
146	L	92	Very high	92.7	Very high	76 Å²	76	54.1 Å²	54.1	40%	0.398	29%	0.289	S	S	.	.	H	α-helix	trans	-78.6	-32.3	173.5	-60.5	176.1	0	0	0	111.7	L51 F123 K142 V143 L144 K148	L51-L146 HydrophobicContact CD1-CB 3.73Å; L51-L146 HydrophobicContact CD1-CD1 3.99Å; L51-L146 HydrophobicContact CD1-CG 4.5Å; F123-L146 HydrophobicContact CD1-CD1 4.47Å; K142-L146 PolarHBondContact O-N 3.44Å; V143-L146 WeakPolarHBondContact O-CB 3.26Å; V143-L146 PolarHBondContact O-N 3.09Å; L144-L146 VanDerWaalsContact C-N 3.26Å; L144-L146 PolarHBondContact O-N 3.01Å; L146-K148 VanDerWaalsContact C-N 3.29Å; L146-K148 PolarHBondContact O-N 3.25Å
147	C	85.4	Confident	92.8	Very high	21 Å²	21	57.8 Å²	57.8	14%	0.142	31%	0.305	C	S	.	.			trans	-70.9	77.2	176.3	-69.2	0	0	0	0	112.2	V143 L144 L150	V143-C147 PolarHBondContact O-N 3.23Å; V143-C147 PolarHBondContact O-SG 2.97Å; L144-C147 WeakPolarHBondContact O-CB 3.45Å; L144-C147 PolarHBondContact O-N 3.21Å; C147-L150 HydrophobicContact CB-CD1 3.73Å; C147-L150 HydrophobicContact CB-CG 4.16Å
148	K	81.7	Confident	92.9	Very high	166 Å²	166	54 Å²	54	72%	0.722	29%	0.285	S	S	*	.			trans	-80.2	140.3	172.8	-61.9	-178.5	-176.2	177.6	0	109.7	L146	L146-K148 VanDerWaalsContact C-N 3.29Å; L146-K148 PolarHBondContact O-N 3.25Å
149	R	92.7	Very high	93	Very high	141 Å²	141	54.3 Å²	54.3	53%	0.532	28%	0.282	S	S	.	.	S	Bend	trans	62.8	55.7	170.4	-48.7	-172.1	-163.2	-159.5	4.4	114.3	F157 A158	R149-F157 HydrophobicContact CB-CE2 4.41Å; R149-A158 WeakPolarHBondContact CB-O 3.03Å; R149-A158 WeakPolarHBondContact O-CB 3.3Å; R149-A158 PolarHBondContact O-N 2.96Å
150	L	95.5	Very high	93.1	Very high	41 Å²	41	56.5 Å²	56.5	22%	0.215	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-96.8	144.7	167.3	-58.5	-172.5	0	0	0	110.9	I54 C147 E152 I156 H169	I54-L150 HydrophobicContact CD1-CD2 3.46Å; I54-L150 VanDerWaalsContact CD1-CD2 3.46Å; I54-L150 HydrophobicContact CG2-CD2 4.44Å; C147-L150 HydrophobicContact CB-CD1 3.73Å; C147-L150 HydrophobicContact CB-CG 4.16Å; L150-E152 PolarHBondContact O-N 3.11Å; L150-I156 CarbonylContact C-O 3.57Å; L150-I156 WeakPolarHBondContact CA-O 3.33Å; L150-H169 WeakPolarHBondContact O-CB 3.35Å
151	C	95.8	Very high	93.2	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	30%	0.304	C	S	.	.			trans	-66.8	129.4	177.1	-177.6	0	0	0	0	110.7	L153 C154 G155 I156 A158 H169 C171 H175	C151-L153 PolarHBondContact O-N 3.07Å; C151-L153 VanDerWaalsContact O-N 3.16Å; C151-C154 VanDerWaalsContact SG-SG 3.69Å; C151-G155 WeakPolarHBondContact O-CA 3.39Å; C151-G155 PolarHBondContact O-N 3.45Å; C151-I156 PolarHBondContact N-O 2.81Å; C151-A158 HydrophobicContact CB-CB 4.15Å; C151-H169 CarbonylContact C-O 3.53Å; C151-H169 WeakPolarHBondContact CA-O 3.37Å; C151-C171 HydrophobicContact CB-CB 3.92Å; C151-C171 PolarHBondContact SG-N 2.84Å; C151-H175 PolarHBondContact SG-ND1 2.8Å
152	E	93.6	Very high	93.3	Very high	57 Å²	57	55.2 Å²	55.2	27%	0.266	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.5	179	-71.2	-64.5	174.4	0	0	113.2	K45 L150 A168 H169 Y170	K45-E152 WeakPolarHBondContact CE-O 3.42Å; K45-E152 PolarHBondContact NZ-O 2.51Å; L150-E152 PolarHBondContact O-N 3.11Å; E152-A168 HydrophobicContact CG-CB 4.01Å; E152-H169 PolarHBondContact N-O 3.19Å; E152-Y170 HydrophobicContact CB-CE1 4.28Å
153	L	93.8	Very high	93.3	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.052	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-41.6	-177.4	-62.4	-176	0	0	0	114.2	C151 H175 L178 H179 L182 L200 L201	C151-L153 PolarHBondContact O-N 3.07Å; C151-L153 VanDerWaalsContact O-N 3.16Å; L153-H175 HydrophobicContact CD1-CB 3.94Å; L153-H175 VanDerWaalsContact CD1-O 3.26Å; L153-H175 WeakPolarHBondContact CD1-O 3.13Å; L153-L178 HydrophobicContact CD1-CB 3.97Å; L153-L178 HydrophobicContact CD1-CD2 3.85Å; L153-L178 HydrophobicContact CD1-CG 3.96Å; L153-H179 HydrophobicContact CD1-CB 4.09Å; L153-H179 HydrophobicContact CD2-CB 3.97Å; L153-H179 HydrophobicContact CG-CB 4.07Å; L153-L182 HydrophobicContact CD2-CD1 4.42Å; L153-L200 HydrophobicContact CB-CD1 3.96Å; L153-L200 HydrophobicContact CD1-CD1 3.88Å; L153-L201 WeakPolarHBondContact O-CD1 3.39Å
154	C	95.1	Very high	93.2	Very high	17 Å²	17	57.5 Å²	57.5	12%	0.115	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-9	-171.7	65	0	0	0	0	115.4	P46 C151 I156 H175	P46-C154 WeakPolarHBondContact CD-O 3.09Å; C151-C154 VanDerWaalsContact SG-SG 3.69Å; C154-I156 VanDerWaalsContact C-N 3.29Å; C154-I156 PolarHBondContact O-N 2.9Å; C154-I156 VanDerWaalsContact SG-CG1 3.57Å; C154-H175 VanDerWaalsContact SG-CE1 3.55Å
155	G	95.3	Very high	93.4	Very high	3 Å²	3	54.1 Å²	54.1	3%	0.031	29%	0.287	C	S	.	.			trans	76.2	3.9	177.1	0	0	0	0	0	116	W48 C151	W48-G155 PolarHBondContact NE1-O 2.72Å; C151-G155 WeakPolarHBondContact O-CA 3.39Å; C151-G155 PolarHBondContact O-N 3.45Å
156	I	96.5	Very high	93.4	Very high	7 Å²	7	56.7 Å²	56.7	4%	0.036	29%	0.287	C	S	.	.	S	Bend	trans	-84.1	173.7	175.5	81.8	-174.2	0	0	0	111.3	W48 P55 L60 F93 L150 C151 C154 A158 C171	W48-I156 HydrophobicContact CZ2-CG2 4.24Å; P55-I156 WeakPolarHBondContact O-CB 3.36Å; L60-I156 HydrophobicContact CD1-CB 4.24Å; L60-I156 HydrophobicContact CD1-CD1 3.9Å; L60-I156 HydrophobicContact CD1-CG2 3.7Å; F93-I156 HydrophobicContact CE1-CG2 4.34Å; L150-I156 CarbonylContact C-O 3.57Å; L150-I156 WeakPolarHBondContact CA-O 3.33Å; C151-I156 PolarHBondContact N-O 2.81Å; C154-I156 VanDerWaalsContact C-N 3.29Å; C154-I156 PolarHBondContact O-N 2.9Å; C154-I156 VanDerWaalsContact SG-CG1 3.57Å; I156-A158 PolarHBondContact O-N 2.9Å; I156-C171 HydrophobicContact CD1-CB 3.71Å; I156-C171 HydrophobicContact CG1-CB 3.52Å
157	F	96.7	Very high	93.3	Very high	77 Å²	77	56.9 Å²	56.9	34%	0.338	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-57.8	134.2	-179.1	175.6	-105.4	0	0	0	112.5	I54 P55 R149 P159 C171	I54-F157 HydrophobicContact CB-CB 4.28Å; I54-F157 HydrophobicContact CG2-CB 4.18Å; I54-F157 VanDerWaalsContact O-CB 3.32Å; I54-F157 WeakPolarHBondContact O-CB 3.27Å; P55-F157 WeakPolarHBondContact O-CB 3.47Å; P55-F157 PolarHBondContact O-N 3.39Å; P55-F157 VanDerWaalsContact O-N 3.09Å; R149-F157 HydrophobicContact CB-CE2 4.41Å; F157-P159 HydrophobicContact CE1-CB 4.06Å; F157-P159 HydrophobicContact CE1-CG 4.42Å; F157-C171 WeakPolarHBondContact O-CA 3.3Å; F157-C171 VanDerWaalsContact O-CB 3.26Å; F157-C171 WeakPolarHBondContact O-CB 3.35Å
158	A	96.6	Very high	93.7	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.29	C	S	.	.			trans	-124	97.1	-172.5	0	0	0	0	0	113.4	R149 C151 I156 N160 H169 Y170	R149-A158 WeakPolarHBondContact CB-O 3.03Å; R149-A158 WeakPolarHBondContact O-CB 3.3Å; R149-A158 PolarHBondContact O-N 2.96Å; C151-A158 HydrophobicContact CB-CB 4.15Å; I156-A158 PolarHBondContact O-N 2.9Å; A158-N160 VanDerWaalsContact C-N 3.29Å; A158-N160 PolarHBondContact O-N 3.07Å; A158-H169 HydrophobicContact CB-CB 3.72Å; A158-Y170 WeakPolarHBondContact CA-O 3.23Å; A158-Y170 WeakPolarHBondContact CB-O 3.22Å
159	P	95.3	Very high	94.4	Very high	65 Å²	65	50 Å²	50	42%	0.422	26%	0.264	S	S	.	.			trans	-74.3	-21.4	178.5	30	-33.3	0	0	0	112.9	F157	F157-P159 HydrophobicContact CE1-CB 4.06Å; F157-P159 HydrophobicContact CE1-CG 4.42Å
160	N	95.8	Very high	94.6	Very high	56 Å²	56	43.3 Å²	43.3	30%	0.299	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	155.1	-177.9	-52	-68.7	0	0	0	110.9	A158 H169 Y170	A158-N160 VanDerWaalsContact C-N 3.29Å; A158-N160 PolarHBondContact O-N 3.07Å; N160-H169 CarbonylContact O-C 3.5Å; N160-H169 VanDerWaalsContact O-CA 3.32Å; N160-H169 WeakPolarHBondContact O-CA 3.5Å; N160-Y170 WeakPolarHBondContact CB-O 3.32Å; N160-Y170 PolarHBondContact N-O 3.18Å; N160-Y170 PolarHBondContact ND2-O 2.82Å; N160-Y170 PolarHBondContact O-N 2.96Å
161	F	95.4	Very high	94.6	Very high	98 Å²	98	41.7 Å²	41.7	43%	0.43	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	160.3	174.4	57.6	-90.6	0	0	0	111	G163 Q166 A168	F161-G163 PolarHBondContact O-N 2.87Å; F161-Q166 HydrophobicContact CD2-CB 4.07Å; F161-Q166 HydrophobicContact CD2-CG 3.99Å; F161-Q166 HydrophobicContact CE2-CB 4.39Å; F161-Q166 HydrophobicContact CE2-CG 3.93Å; F161-A168 CarbonylContact C-O 3.53Å; F161-A168 VanDerWaalsContact CA-O 3.24Å; F161-A168 WeakPolarHBondContact CA-O 3.39Å
162	C	95.5	Very high	94.6	Very high	5 Å²	5	42 Å²	42	3%	0.034	23%	0.233	C	C	.	.			trans	-65.9	117.6	174.4	-178.6	0	0	0	0	109.8	K164 Q166 A168 Y170 H184 C188	C162-K164 PolarHBondContact O-N 3.12Å; C162-K164 VanDerWaalsContact O-N 3.09Å; C162-Q166 WeakPolarHBondContact O-CA 3.47Å; C162-Q166 PolarHBondContact O-N 3.06Å; C162-A168 HydrophobicContact CB-CB 4.23Å; C162-A168 PolarHBondContact N-O 3.45Å; C162-Y170 HydrophobicContact CB-CE2 4.08Å; C162-H184 PolarHBondContact SG-NE2 2.9Å; C162-H184 VanDerWaalsContact SG-NE2 3.44Å; C162-C188 VanDerWaalsContact SG-SG 3.64Å
163	G	92.4	Very high	94.6	Very high	58 Å²	58	45.6 Å²	45.6	60%	0.598	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.9	-179.7	0	0	0	0	0	114.5	F161	F161-G163 PolarHBondContact O-N 2.87Å
164	K	92.2	Very high	94.5	Very high	130 Å²	130	50.1 Å²	50.1	57%	0.565	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-59.5	180	-174	179.9	-177.3	-164	0	112.5	C162 S189	C162-K164 PolarHBondContact O-N 3.12Å; C162-K164 VanDerWaalsContact O-N 3.09Å; K164-S189 WeakPolarHBondContact CE-OG 3.16Å; K164-S189 PolarHBondContact NZ-OG 3.32Å
165	C	92.6	Very high	94.5	Very high	37 Å²	37	50.1 Å²	50.1	25%	0.25	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-21.7	-178.5	67.2	0	0	0	0	114.4	S167 C188	C165-S167 PolarHBondContact O-N 2.89Å; C165-S167 PolarHBondContact SG-OG 2.8Å; C165-C188 WeakPolarHBondContact CB-O 3.35Å
166	Q	91.6	Very high	94.4	Very high	124 Å²	124	52.9 Å²	52.9	58%	0.579	28%	0.279	S	S	*	.	S	Bend	trans	56	0.9	-173.3	-52.2	-176	8.2	0	0	115.9	F161 C162 H169	F161-Q166 HydrophobicContact CD2-CB 4.07Å; F161-Q166 HydrophobicContact CD2-CG 3.99Å; F161-Q166 HydrophobicContact CE2-CB 4.39Å; F161-Q166 HydrophobicContact CE2-CG 3.93Å; C162-Q166 WeakPolarHBondContact O-CA 3.47Å; C162-Q166 PolarHBondContact O-N 3.06Å; Q166-H169 PolarHBondContact O-CE1 2.84Å
167	S	90.4	Very high	94.3	Very high	81 Å²	81	60.8 Å²	60.8	57%	0.566	31%	0.308	S	S	*	.			trans	-89.2	-36.1	179.7	59.2	0	0	0	0	112.7	C165 H169	C165-S167 PolarHBondContact O-N 2.89Å; C165-S167 PolarHBondContact SG-OG 2.8Å; S167-H169 PolarHBondContact O-CE1 3.05Å; S167-H169 PolarHBondContact O-ND1 3.23Å
168	A	93.6	Very high	94.1	Very high	3 Å²	3	59.9 Å²	59.9	3%	0.025	31%	0.307	C	S	.	.			trans	-84.7	128.6	179.5	0	0	0	0	0	111.2	E152 F161 C162 Y170	E152-A168 HydrophobicContact CG-CB 4.01Å; F161-A168 CarbonylContact C-O 3.53Å; F161-A168 VanDerWaalsContact CA-O 3.24Å; F161-A168 WeakPolarHBondContact CA-O 3.39Å; C162-A168 HydrophobicContact CB-CB 4.23Å; C162-A168 PolarHBondContact N-O 3.45Å; A168-Y170 HydrophobicContact CB-CE2 4.15Å; A168-Y170 VanDerWaalsContact CB-OH 3.29Å; A168-Y170 WeakPolarHBondContact CB-OH 3.45Å; A168-Y170 WeakPolarHBondContact O-CE2 3.44Å
169	H	96.1	Very high	93.9	Very high	39 Å²	39	61 Å²	61	18%	0.181	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	149.1	-175.1	-69	73.4	0	0	0	112	L150 C151 E152 A158 N160 Q166 S167	L150-H169 WeakPolarHBondContact O-CB 3.35Å; C151-H169 CarbonylContact C-O 3.53Å; C151-H169 WeakPolarHBondContact CA-O 3.37Å; E152-H169 PolarHBondContact N-O 3.19Å; A158-H169 HydrophobicContact CB-CB 3.72Å; N160-H169 CarbonylContact O-C 3.5Å; N160-H169 VanDerWaalsContact O-CA 3.32Å; N160-H169 WeakPolarHBondContact O-CA 3.5Å; Q166-H169 PolarHBondContact O-CE1 2.84Å; S167-H169 PolarHBondContact O-CE1 3.05Å; S167-H169 PolarHBondContact O-ND1 3.23Å
170	Y	96.4	Very high	93.8	Very high	1 Å²	1	62.2 Å²	62.2	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	134.8	-174.5	-49.4	-75.5	0	0	0	113.2	E152 A158 N160 C162 A168 S172 Q176 H179 H184	E152-Y170 HydrophobicContact CB-CE1 4.28Å; A158-Y170 WeakPolarHBondContact CA-O 3.23Å; A158-Y170 WeakPolarHBondContact CB-O 3.22Å; N160-Y170 WeakPolarHBondContact CB-O 3.32Å; N160-Y170 PolarHBondContact N-O 3.18Å; N160-Y170 PolarHBondContact ND2-O 2.82Å; N160-Y170 PolarHBondContact O-N 2.96Å; C162-Y170 HydrophobicContact CB-CE2 4.08Å; A168-Y170 HydrophobicContact CB-CE2 4.15Å; A168-Y170 VanDerWaalsContact CB-OH 3.29Å; A168-Y170 WeakPolarHBondContact CB-OH 3.45Å; A168-Y170 WeakPolarHBondContact O-CE2 3.44Å; Y170-S172 WeakPolarHBondContact CB-O 3.44Å; Y170-S172 PolarHBondContact O-N 2.93Å; Y170-Q176 HydrophobicContact CD1-CB 4.07Å; Y170-Q176 HydrophobicContact CD2-CB 3.57Å; Y170-Q176 HydrophobicContact CD2-CG 3.56Å; Y170-Q176 HydrophobicContact CE2-CB 4.07Å; Y170-Q176 HydrophobicContact CE2-CG 3.65Å; Y170-Q176 HydrophobicContact CG-CB 3.55Å; Y170-Q176 HydrophobicContact CG-CG 4.09Å; Y170-H179 HydrophobicContact CD1-CB 4.46Å; Y170-H179 HydrophobicContact CE1-CB 3.6Å; Y170-H179 AromaticContact CE1-CG 3.82Å; Y170-H179 AromaticContact CE1-ND1 3.33Å; Y170-H179 VanDerWaalsContact CE1-ND1 3.33Å; Y170-H179 WeakPolarHBondContact CE1-ND1 3.45Å; Y170-H179 AromaticContact CZ-ND1 3.54Å; Y170-H179 PolarHBondContact OH-ND1 2.61Å; Y170-H184 PolarHBondContact OH-CD2 3.47Å; Y170-H184 PolarHBondContact OH-NE2 2.94Å
171	C	96.1	Very high	93.6	Very high	6 Å²	6	65.9 Å²	65.9	4%	0.041	33%	0.328	C	S	.	.	S	Bend	trans	-68	-25.4	175	66.2	0	0	0	0	112.7	C151 I156 F157 H175	C151-C171 HydrophobicContact CB-CB 3.92Å; C151-C171 PolarHBondContact SG-N 2.84Å; I156-C171 HydrophobicContact CD1-CB 3.71Å; I156-C171 HydrophobicContact CG1-CB 3.52Å; F157-C171 WeakPolarHBondContact O-CA 3.3Å; F157-C171 VanDerWaalsContact O-CB 3.26Å; F157-C171 WeakPolarHBondContact O-CB 3.35Å; C171-H175 PolarHBondContact SG-ND1 2.73Å
172	S	95	Very high	93.2	Very high	8 Å²	8	63.7 Å²	63.7	6%	0.056	32%	0.32	C	S	.	.	S	Bend	trans	-153.6	168.8	-179.4	86	0	0	0	0	111.9	Y170 E174 H175 Q176	Y170-S172 WeakPolarHBondContact CB-O 3.44Å; Y170-S172 PolarHBondContact O-N 2.93Å; S172-E174 VanDerWaalsContact C-N 3.28Å; S172-E174 WeakPolarHBondContact CB-OE2 3.07Å; S172-E174 PolarHBondContact O-N 2.91Å; S172-E174 PolarHBondContact OG-N 2.87Å; S172-E174 PolarHBondContact OG-OE2 3.3Å; S172-H175 PolarHBondContact O-N 2.71Å; S172-H175 PolarHBondContact OG-N 3.03Å; S172-Q176 PolarHBondContact O-N 2.89Å
173	K	94.5	Very high	92.9	Very high	133 Å²	133	64 Å²	64	58%	0.578	32%	0.323	S	S	*	.	H	α-helix	trans	-67.7	-31.5	176.7	-70.5	-178.1	179.6	176.1	0	111.9	Q176 R177	K173-Q176 PolarHBondContact O-N 2.84Å; K173-R177 WeakPolarHBondContact O-CG 3.34Å; K173-R177 PolarHBondContact O-N 2.86Å
174	E	92.7	Very high	92.9	Very high	104 Å²	104	61.7 Å²	61.7	49%	0.486	30%	0.297	S	S	.	.	H	α-helix	trans	-62.1	-48.5	176.7	-59.5	72.6	-159.6	0	0	110.3	S172 Q176 R177 L178	S172-E174 VanDerWaalsContact C-N 3.28Å; S172-E174 WeakPolarHBondContact CB-OE2 3.07Å; S172-E174 PolarHBondContact O-N 2.91Å; S172-E174 PolarHBondContact OG-N 2.87Å; S172-E174 PolarHBondContact OG-OE2 3.3Å; E174-Q176 VanDerWaalsContact C-N 3.34Å; E174-Q176 PolarHBondContact O-N 3.32Å; E174-R177 PolarHBondContact O-N 3.14Å; E174-L178 WeakPolarHBondContact O-CB 3.4Å; E174-L178 PolarHBondContact O-N 3.32Å
175	H	93.7	Very high	92.8	Very high	18 Å²	18	62 Å²	62	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-35.3	176.7	-78.5	-160.6	0	0	0	112.6	C151 L153 C154 C171 S172 L178 H179	C151-H175 PolarHBondContact SG-ND1 2.8Å; L153-H175 HydrophobicContact CD1-CB 3.94Å; L153-H175 VanDerWaalsContact CD1-O 3.26Å; L153-H175 WeakPolarHBondContact CD1-O 3.13Å; C154-H175 VanDerWaalsContact SG-CE1 3.55Å; C171-H175 PolarHBondContact SG-ND1 2.73Å; S172-H175 PolarHBondContact O-N 2.71Å; S172-H175 PolarHBondContact OG-N 3.03Å; H175-L178 PolarHBondContact O-N 2.83Å; H175-H179 WeakPolarHBondContact O-CB 3.29Å; H175-H179 PolarHBondContact O-N 3.47Å
176	Q	94.6	Very high	92.6	Very high	61 Å²	61	67.9 Å²	67.9	29%	0.285	32%	0.323	S	S	.	.	H	α-helix	trans	-61.6	-47.3	173.3	-178.7	173	0.9	0	0	112	Y170 S172 K173 E174 W180	Y170-Q176 HydrophobicContact CD1-CB 4.07Å; Y170-Q176 HydrophobicContact CD2-CB 3.57Å; Y170-Q176 HydrophobicContact CD2-CG 3.56Å; Y170-Q176 HydrophobicContact CE2-CB 4.07Å; Y170-Q176 HydrophobicContact CE2-CG 3.65Å; Y170-Q176 HydrophobicContact CG-CB 3.55Å; Y170-Q176 HydrophobicContact CG-CG 4.09Å; S172-Q176 PolarHBondContact O-N 2.89Å; K173-Q176 PolarHBondContact O-N 2.84Å; E174-Q176 VanDerWaalsContact C-N 3.34Å; E174-Q176 PolarHBondContact O-N 3.32Å; Q176-W180 WeakPolarHBondContact O-CB 3.22Å; Q176-W180 PolarHBondContact O-N 3.41Å
177	R	94.2	Very high	92.4	Very high	173 Å²	173	63.5 Å²	63.5	65%	0.653	30%	0.302	S	S	*	.	H	α-helix	trans	-64.3	-42.6	178	-71.8	173.1	-178.2	177.5	-0.3	111.8	K173 E174 W180 N181	K173-R177 WeakPolarHBondContact O-CG 3.34Å; K173-R177 PolarHBondContact O-N 2.86Å; E174-R177 PolarHBondContact O-N 3.14Å; R177-W180 WeakPolarHBondContact O-CB 3.3Å; R177-W180 PolarHBondContact O-N 2.81Å; R177-N181 PolarHBondContact O-N 2.96Å; R177-N181 VanDerWaalsContact O-N 3.09Å; R177-N181 PolarHBondContact O-ND2 3.4Å
178	L	92	Very high	92.4	Very high	58 Å²	58	60.2 Å²	60.2	30%	0.304	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-49.4	178.3	179.9	59.3	0	0	0	111	L153 E174 H175 W180 N181 L182 L200	L153-L178 HydrophobicContact CD1-CB 3.97Å; L153-L178 HydrophobicContact CD1-CD2 3.85Å; L153-L178 HydrophobicContact CD1-CG 3.96Å; E174-L178 WeakPolarHBondContact O-CB 3.4Å; E174-L178 PolarHBondContact O-N 3.32Å; H175-L178 PolarHBondContact O-N 2.83Å; L178-W180 VanDerWaalsContact C-N 3.3Å; L178-W180 PolarHBondContact O-N 3.3Å; L178-N181 PolarHBondContact O-N 3.12Å; L178-N181 VanDerWaalsContact O-N 3.15Å; L178-L182 HydrophobicContact CD1-CD1 4.04Å; L178-L182 HydrophobicContact CD1-CG 4.1Å; L178-L182 HydrophobicContact CG-CD1 3.88Å; L178-L182 HydrophobicContact CG-CG 4.36Å; L178-L182 WeakPolarHBondContact O-CG 3.3Å; L178-L182 PolarHBondContact O-N 3.13Å; L178-L200 HydrophobicContact CD2-CD1 3.63Å; L178-L200 HydrophobicContact CD2-CD2 3.96Å; L178-L200 HydrophobicContact CD2-CG 3.78Å
179	H	93	Very high	91.9	Very high	23 Å²	23	64.3 Å²	64.3	11%	0.106	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-38.9	178	-171.7	-144.1	0	0	0	112.3	L153 Y170 H175 N181 L182 G183 H184	L153-H179 HydrophobicContact CD1-CB 4.09Å; L153-H179 HydrophobicContact CD2-CB 3.97Å; L153-H179 HydrophobicContact CG-CB 4.07Å; Y170-H179 HydrophobicContact CD1-CB 4.46Å; Y170-H179 HydrophobicContact CE1-CB 3.6Å; Y170-H179 AromaticContact CE1-CG 3.82Å; Y170-H179 AromaticContact CE1-ND1 3.33Å; Y170-H179 VanDerWaalsContact CE1-ND1 3.33Å; Y170-H179 WeakPolarHBondContact CE1-ND1 3.45Å; Y170-H179 AromaticContact CZ-ND1 3.54Å; Y170-H179 PolarHBondContact OH-ND1 2.61Å; H175-H179 WeakPolarHBondContact O-CB 3.29Å; H175-H179 PolarHBondContact O-N 3.47Å; H179-N181 VanDerWaalsContact C-N 3.3Å; H179-N181 PolarHBondContact O-N 2.84Å; H179-L182 PolarHBondContact O-N 2.75Å; H179-G183 PolarHBondContact O-N 3.29Å; H179-H184 AromaticContact CE1-CG 3.67Å; H179-H184 AromaticContact CE1-ND1 3.73Å; H179-H184 AromaticContact ND1-CG 3.63Å; H179-H184 VanDerWaalsContact O-CB 3.24Å; H179-H184 WeakPolarHBondContact O-CB 3.24Å; H179-H184 PolarHBondContact O-N 3.04Å
180	W	92.7	Very high	90.8	Very high	91 Å²	91	65.6 Å²	65.6	35%	0.345	32%	0.321	S	S	.	.	I	π-helix	trans	-55.4	-45.1	174.1	-172.2	-99.3	0	0	0	112.4	Q176 R177 L178 H184 K185 C188	Q176-W180 WeakPolarHBondContact O-CB 3.22Å; Q176-W180 PolarHBondContact O-N 3.41Å; R177-W180 WeakPolarHBondContact O-CB 3.3Å; R177-W180 PolarHBondContact O-N 2.81Å; L178-W180 VanDerWaalsContact C-N 3.3Å; L178-W180 PolarHBondContact O-N 3.3Å; W180-H184 AromaticContact CE3-CD2 3.82Å; W180-K185 HydrophobicContact CD2-CB 3.92Å; W180-K185 HydrophobicContact CD2-CG 4.49Å; W180-K185 HydrophobicContact CE3-CB 4.38Å; W180-K185 HydrophobicContact CG-CB 4.35Å; W180-K185 HydrophobicContact CH2-CB 4.35Å; W180-K185 HydrophobicContact CH2-CG 4.23Å; W180-K185 HydrophobicContact CZ2-CB 3.89Å; W180-K185 HydrophobicContact CZ2-CD 4.18Å; W180-K185 HydrophobicContact CZ2-CG 3.58Å; W180-K185 WeakPolarHBondContact O-CB 3.32Å; W180-K185 PolarHBondContact O-N 2.78Å; W180-C188 HydrophobicContact CZ3-CB 4.26Å
181	N	90.7	Very high	89.4	Confident	133 Å²	133	71.9 Å²	71.9	71%	0.711	37%	0.365	S	S	*	.	I	π-helix	trans	-75.7	-30.4	-179.8	-67.6	-16.8	0	0	0	113.2	R177 L178 H179 G183	R177-N181 PolarHBondContact O-N 2.96Å; R177-N181 VanDerWaalsContact O-N 3.09Å; R177-N181 PolarHBondContact O-ND2 3.4Å; L178-N181 PolarHBondContact O-N 3.12Å; L178-N181 VanDerWaalsContact O-N 3.15Å; H179-N181 VanDerWaalsContact C-N 3.3Å; H179-N181 PolarHBondContact O-N 2.84Å; N181-G183 VanDerWaalsContact C-N 3.32Å; N181-G183 PolarHBondContact O-N 2.73Å
182	L	88.3	Confident	87.4	Confident	52 Å²	52	79.9 Å²	79.9	27%	0.272	40%	0.399	S	S	.	.	I	π-helix	trans	-72.9	-21.4	179.4	-74.4	174.4	0	0	0	113.5	L153 L178 H179 F196	L153-L182 HydrophobicContact CD2-CD1 4.42Å; L178-L182 HydrophobicContact CD1-CD1 4.04Å; L178-L182 HydrophobicContact CD1-CG 4.1Å; L178-L182 HydrophobicContact CG-CD1 3.88Å; L178-L182 HydrophobicContact CG-CG 4.36Å; L178-L182 WeakPolarHBondContact O-CG 3.3Å; L178-L182 PolarHBondContact O-N 3.13Å; H179-L182 PolarHBondContact O-N 2.75Å; L182-F196 WeakPolarHBondContact O-CD1 3.26Å; L182-F196 WeakPolarHBondContact O-CE1 3.48Å; L182-F196 WeakPolarHBondContact O-CZ 3.4Å
183	G	88.4	Confident	85.6	Confident	10 Å²	10	87.3 Å²	87.3	10%	0.103	43%	0.43	C	S	.	.	I	π-helix	trans	159.8	-21.1	177.4	0	0	0	0	0	114.6	H179 N181 K185 Q186 E187	H179-G183 PolarHBondContact O-N 3.29Å; N181-G183 VanDerWaalsContact C-N 3.32Å; N181-G183 PolarHBondContact O-N 2.73Å; G183-K185 PolarHBondContact O-N 2.84Å; G183-Q186 PolarHBondContact O-N 2.58Å; G183-E187 PolarHBondContact O-N 2.71Å
184	H	91.4	Very high	83.6	Confident	10 Å²	10	87.8 Å²	87.8	5%	0.046	43%	0.434	C	S	.	.	I	π-helix	trans	-58.7	-26.8	-174.9	-176.3	58.3	0	0	0	113.1	C162 Y170 H179 W180 Q186 E187 C188	C162-H184 PolarHBondContact SG-NE2 2.9Å; C162-H184 VanDerWaalsContact SG-NE2 3.44Å; Y170-H184 PolarHBondContact OH-CD2 3.47Å; Y170-H184 PolarHBondContact OH-NE2 2.94Å; H179-H184 AromaticContact CE1-CG 3.67Å; H179-H184 AromaticContact CE1-ND1 3.73Å; H179-H184 AromaticContact ND1-CG 3.63Å; H179-H184 VanDerWaalsContact O-CB 3.24Å; H179-H184 WeakPolarHBondContact O-CB 3.24Å; H179-H184 PolarHBondContact O-N 3.04Å; W180-H184 AromaticContact CE3-CD2 3.82Å; H184-Q186 PolarHBondContact O-N 2.8Å; H184-E187 PolarHBondContact O-N 3.25Å; H184-C188 WeakPolarHBondContact O-CA 3.49Å; H184-C188 WeakPolarHBondContact O-CB 3.49Å; H184-C188 PolarHBondContact O-N 2.65Å
185	K	90.5	Very high	81.6	Confident	137 Å²	137	91 Å²	91	60%	0.596	46%	0.455	S	S	*	.	H	α-helix	trans	-52	-39.1	173.1	-179.3	175	-178.2	-174.2	0	113.2	W180 G183	W180-K185 HydrophobicContact CD2-CB 3.92Å; W180-K185 HydrophobicContact CD2-CG 4.49Å; W180-K185 HydrophobicContact CE3-CB 4.38Å; W180-K185 HydrophobicContact CG-CB 4.35Å; W180-K185 HydrophobicContact CH2-CB 4.35Å; W180-K185 HydrophobicContact CH2-CG 4.23Å; W180-K185 HydrophobicContact CZ2-CB 3.89Å; W180-K185 HydrophobicContact CZ2-CD 4.18Å; W180-K185 HydrophobicContact CZ2-CG 3.58Å; W180-K185 WeakPolarHBondContact O-CB 3.32Å; W180-K185 PolarHBondContact O-N 2.78Å; G183-K185 PolarHBondContact O-N 2.84Å
186	Q	88.9	Confident	79.6	Confident	161 Å²	161	94.7 Å²	94.7	75%	0.752	47%	0.471	S	S	*	.	H	α-helix	trans	-86.5	-38.1	-177.9	-55.2	-179.7	23.6	0	0	111.3	G183 H184 S190	G183-Q186 PolarHBondContact O-N 2.58Å; H184-Q186 PolarHBondContact O-N 2.8Å; Q186-S190 PolarHBondContact O-OG 3.23Å
187	E	87.4	Confident	77.8	Confident	31 Å²	31	101.3 Å²	101.3	15%	0.145	50%	0.499	C	S	.	.	H	α-helix	trans	-79.1	-21	-179	-58.9	-178.9	159.5	0	0	113.6	G183 H184 S189 S190 E194	G183-E187 PolarHBondContact O-N 2.71Å; H184-E187 PolarHBondContact O-N 3.25Å; E187-S189 PolarHBondContact O-N 2.92Å; E187-S190 CarbonylContact O-C 3.56Å; E187-S190 PolarHBondContact O-N 3.07Å; E187-E194 WeakPolarHBondContact OE1-CB 3.49Å; E187-E194 PolarHBondContact OE1-N 3.25Å
188	C	90.3	Very high	76.4	Confident	13 Å²	13	94.7 Å²	94.7	9%	0.088	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.8	-172.2	-178.4	0	0	0	0	113.1	C162 C165 W180 H184	C162-C188 VanDerWaalsContact SG-SG 3.64Å; C165-C188 WeakPolarHBondContact CB-O 3.35Å; W180-C188 HydrophobicContact CZ3-CB 4.26Å; H184-C188 WeakPolarHBondContact O-CA 3.49Å; H184-C188 WeakPolarHBondContact O-CB 3.49Å; H184-C188 PolarHBondContact O-N 2.65Å
189	S	82.6	Confident	75.7	Confident	88 Å²	88	97.3 Å²	97.3	62%	0.615	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-1.7	174.5	-70.7	0	0	0	0	114	K164 E187	K164-S189 WeakPolarHBondContact CE-OG 3.16Å; K164-S189 PolarHBondContact NZ-OG 3.32Å; E187-S189 PolarHBondContact O-N 2.92Å
190	S	74.1	Confident	75.4	Confident	67 Å²	67	98.4 Å²	98.4	47%	0.469	50%	0.504	S	S	.	.	S	Bend	trans	-111.3	138.9	-173.8	-54.7	0	0	0	0	109.8	Q186 E187 K192	Q186-S190 PolarHBondContact O-OG 3.23Å; E187-S190 CarbonylContact O-C 3.56Å; E187-S190 PolarHBondContact O-N 3.07Å; S190-K192 PolarHBondContact O-N 2.65Å
191	S	65.5	Low	75.4	Confident	133 Å²	133	95.4 Å²	95.4	93%	0.93	49%	0.494	S	S	*	.	S	Bend	trans	-74.4	1.6	174.2	-52.6	0	0	0	0	113.6
192	K	55.8	Low	75.5	Confident	173 Å²	173	89.3 Å²	89.3	75%	0.752	46%	0.461	S	S	*	.			trans	-90	118.4	177.9	-67.1	-172.9	178.9	-175.9	0	109	S190	S190-K192 PolarHBondContact O-N 2.65Å
193	K	55.5	Low	75.8	Confident	164 Å²	164	88.7 Å²	88.7	71%	0.713	46%	0.46	S	S	*	.			trans	-98	113.9	166.7	-66.6	-172.7	174.4	-165.6	0	107.2
194	E	52.9	Low	76.1	Confident	143 Å²	143	91.4 Å²	91.4	67%	0.668	47%	0.47	S	S	*	.			trans	-80.3	140.7	164.1	-70.3	-165.5	165.4	0	0	109.5	E187 F196	E187-E194 WeakPolarHBondContact OE1-CB 3.49Å; E187-E194 PolarHBondContact OE1-N 3.25Å; E194-F196 VanDerWaalsContact C-N 3.34Å; E194-F196 HydrophobicContact CB-CD2 4.33Å; E194-F196 HydrophobicContact CB-CE2 3.99Å; E194-F196 PolarHBondContact O-N 2.97Å
195	N	51.3	Low	76.4	Confident	172 Å²	172	94.2 Å²	94.2	92%	0.92	48%	0.481	S	S	*	.			trans	-77.1	87.3	174.8	-90.9	-10	0	0	0	109	K197	N195-K197 PolarHBondContact O-N 2.84Å
196	F	52.5	Low	76.8	Confident	96 Å²	96	90.6 Å²	90.6	42%	0.421	47%	0.466	S	S	.	.			trans	-67.9	130.2	169.4	-78	-84.2	0	0	0	110.4	L182 E194 S198	L182-F196 WeakPolarHBondContact O-CD1 3.26Å; L182-F196 WeakPolarHBondContact O-CE1 3.48Å; L182-F196 WeakPolarHBondContact O-CZ 3.4Å; E194-F196 VanDerWaalsContact C-N 3.34Å; E194-F196 HydrophobicContact CB-CD2 4.33Å; E194-F196 HydrophobicContact CB-CE2 3.99Å; E194-F196 PolarHBondContact O-N 2.97Å; F196-S198 PolarHBondContact O-N 3.4Å; F196-S198 VanDerWaalsContact O-N 3.07Å
197	K	55.2	Low	77.2	Confident	200 Å²	200	83.1 Å²	83.1	87%	0.87	43%	0.432	S	S	*	.			trans	-60.7	113.1	164.8	-87.4	-172.3	173.8	-173.3	0	107.9	N195 V199	N195-K197 PolarHBondContact O-N 2.84Å; K197-V199 PolarHBondContact O-N 2.81Å; K197-V199 VanDerWaalsContact O-N 3.1Å
198	S	66.6	Low	77.7	Confident	34 Å²	34	84 Å²	84	24%	0.238	44%	0.439	C	S	.	.			trans	-70.2	108.7	-178.8	-177.6	0	0	0	0	109.9	F196 L200 L201	F196-S198 PolarHBondContact O-N 3.4Å; F196-S198 VanDerWaalsContact O-N 3.07Å; S198-L200 PolarHBondContact O-N 3.36Å; S198-L201 PolarHBondContact O-N 2.53Å; S198-L201 WeakPolarHBondContact OG-CG 3.11Å
199	V	76.8	Confident	77.9	Confident	113 Å²	113	86.5 Å²	86.5	69%	0.685	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.1	174	-174.5	0	0	0	0	111.9	K197	K197-V199 PolarHBondContact O-N 2.81Å; K197-V199 VanDerWaalsContact O-N 3.1Å
200	L	85.4	Confident	78.5	Confident	45 Å²	45	88 Å²	88	24%	0.236	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-29.6	-178.6	-67.9	-176.4	0	0	0	114	T70 K96 L153 L178 S198	T70-L200 WeakPolarHBondContact CG2-O 3.33Å; K96-L200 PolarHBondContact NZ-O 3.5Å; L153-L200 HydrophobicContact CB-CD1 3.96Å; L153-L200 HydrophobicContact CD1-CD1 3.88Å; L178-L200 HydrophobicContact CD2-CD1 3.63Å; L178-L200 HydrophobicContact CD2-CD2 3.96Å; L178-L200 HydrophobicContact CD2-CG 3.78Å; S198-L200 PolarHBondContact O-N 3.36Å
201	L	92.8	Very high	79.4	Confident	28 Å²	28	87.9 Å²	87.9	15%	0.147	45%	0.447	C	S	.	.	S	Bend	trans	-91.5	153.7	-172.6	-61.8	178.6	0	0	0	110.9	G44 K45 L153 S198	G44-L201 WeakPolarHBondContact O-CD2 3.46Å; K45-L201 HydrophobicContact CG-CD1 3.67Å; L153-L201 WeakPolarHBondContact O-CD1 3.39Å; S198-L201 PolarHBondContact O-N 2.53Å; S198-L201 WeakPolarHBondContact OG-CG 3.11Å
202	F	93.9	Very high	80.7	Confident	5 Å²	5	82.5 Å²	82.5	2%	0.022	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-75.2	154.9	164.3	-64.1	-61.2	0	0	0	110	F42 G44 T70 F71 L72 L94 K96 M324 L326	F42-F202 HydrophobicContact CE1-CB 4.02Å; F42-F202 HydrophobicContact CE2-CB 4.39Å; F42-F202 HydrophobicContact CE2-CG 4.47Å; F42-F202 HydrophobicContact CZ-CB 3.77Å; F42-F202 HydrophobicContact CZ-CG 4.1Å; G44-F202 PolarHBondContact N-O 2.9Å; T70-F202 HydrophobicContact CG2-CD2 4Å; T70-F202 HydrophobicContact CG2-CE2 3.93Å; F71-F202 VanDerWaalsContact O-CD2 3.3Å; F71-F202 WeakPolarHBondContact O-CD2 3.39Å; L72-F202 HydrophobicContact CD1-CD2 4.24Å; L72-F202 HydrophobicContact CD1-CE2 4.04Å; L94-F202 HydrophobicContact CD1-CE2 4.11Å; L94-F202 HydrophobicContact CD1-CZ 3.89Å; L94-F202 HydrophobicContact CG-CE2 4.26Å; L94-F202 HydrophobicContact CG-CZ 4.45Å; K96-F202 HydrophobicContact CD-CE1 4.44Å; K96-F202 HydrophobicContact CD-CZ 4.3Å; K96-F202 HydrophobicContact CG-CZ 4.06Å; F202-M324 HydrophobicContact CD1-CB 3.92Å; F202-M324 HydrophobicContact CD1-CG 4.31Å; F202-M324 VanDerWaalsContact CD1-O 3.24Å; F202-M324 WeakPolarHBondContact CD1-O 3.29Å; F202-M324 HydrophobicContact CE1-CB 3.72Å; F202-M324 HydrophobicContact CE1-CG 4.1Å; F202-M324 HydrophobicContact CE1-SD 4.19Å; F202-M324 HydrophobicContact CZ-SD 4.13Å; F202-L326 HydrophobicContact CE1-CD1 4.36Å; F202-L326 HydrophobicContact CE1-CD2 3.95Å; F202-L326 HydrophobicContact CE1-CG 4.19Å
203	P	93.4	Very high	82.1	Confident	39 Å²	39	82.4 Å²	82.4	25%	0.253	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-52.4	145.9	169.3	-25	35.1	0	0	0	111.6	F42 G43 Y205 D325	F42-P203 VanDerWaalsContact CD1-O 3.29Å; F42-P203 WeakPolarHBondContact CD1-O 3.46Å; F42-P203 VanDerWaalsContact CE1-O 3.27Å; F42-P203 WeakPolarHBondContact CE1-O 2.87Å; G43-P203 WeakPolarHBondContact CA-O 3.44Å; P203-Y205 HydrophobicContact CB-CD2 4.26Å; P203-Y205 HydrophobicContact CB-CE2 3.58Å; P203-D325 HydrophobicContact CG-CB 3.86Å
204	E	95.4	Very high	83.2	Confident	67 Å²	67	76.9 Å²	76.9	31%	0.313	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-98.4	125.3	-173	-170.8	171.4	-109.1	0	0	111.2	L33 K41 F42 G44	L33-E204 HydrophobicContact CD1-CG 3.64Å; K41-E204 WeakPolarHBondContact CE-OE1 3.4Å; K41-E204 IonicContact NZ-OE1 3.18Å; K41-E204 PolarHBondContact NZ-OE1 3.4Å; F42-E204 WeakPolarHBondContact O-CA 3.36Å; G44-E204 WeakPolarHBondContact CA-OE1 3.47Å
205	Y	97.6	Very high	84.1	Confident	70 Å²	70	74.9 Å²	74.9	28%	0.275	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	158.3	178.7	-61.8	-81	0	0	0	111.6	I25 K41 F42 P203 Y323	I25-Y205 VanDerWaalsContact CG2-CB 3.5Å; I25-Y205 HydrophobicContact CG2-CD1 3.94Å; I25-Y205 HydrophobicContact CG2-CD2 3.95Å; I25-Y205 HydrophobicContact CG2-CG 3.55Å; K41-Y205 CarbonylContact C-O 3.59Å; K41-Y205 VanDerWaalsContact CA-O 3.27Å; K41-Y205 WeakPolarHBondContact CA-O 3.46Å; K41-Y205 VanDerWaalsContact CB-O 3.27Å; K41-Y205 WeakPolarHBondContact CB-O 3.31Å; F42-Y205 AromaticContact CD1-CD2 3.83Å; F42-Y205 HydrophobicContact CD1-CD2 3.83Å; F42-Y205 HydrophobicContact CE1-CD2 4.13Å; F42-Y205 PolarHBondContact N-O 2.83Å; F42-Y205 PolarHBondContact O-N 3.46Å; P203-Y205 HydrophobicContact CB-CD2 4.26Å; P203-Y205 HydrophobicContact CB-CE2 3.58Å; Y205-Y323 HydrophobicContact CD2-CD1 4.42Å; Y205-Y323 HydrophobicContact CE2-CD1 4.11Å
206	E	98.2	Very high	84.9	Confident	61 Å²	61	73.8 Å²	73.8	29%	0.285	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	145.8	171.2	-169.3	167.8	179.9	0	0	110.7	I25 T26 S28 L33 V208	I25-E206 WeakPolarHBondContact CA-O 3.45Å; T26-E206 PolarHBondContact N-O 3.28Å; T26-E206 PolarHBondContact O-N 3Å; S28-E206 VanDerWaalsContact CB-OE2 3.25Å; S28-E206 WeakPolarHBondContact CB-OE2 3.26Å; S28-E206 PolarHBondContact OG-OE2 3.08Å; L33-E206 HydrophobicContact CD2-CB 3.93Å; L33-E206 HydrophobicContact CD2-CG 4.12Å; E206-V208 HydrophobicContact CG-CG2 4.15Å
207	I	98.5	Very high	85.2	Confident	4 Å²	4	77.8 Å²	77.8	2%	0.021	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	107.8	169.2	-61.3	169.2	0	0	0	107.6	F24 I25 C40 F42 L73 I75 I281	F24-I207 WeakPolarHBondContact O-CA 3.25Å; I25-I207 HydrophobicContact CD1-CG1 3.87Å; C40-I207 HydrophobicContact CB-CB 4.06Å; C40-I207 WeakPolarHBondContact CB-O 3.38Å; C40-I207 PolarHBondContact O-N 2.79Å; F42-I207 HydrophobicContact CB-CD1 4.22Å; F42-I207 HydrophobicContact CB-CG1 4.3Å; L73-I207 HydrophobicContact CB-CD1 4.14Å; I75-I207 HydrophobicContact CD1-CD1 3.96Å; I207-I281 HydrophobicContact CG2-CG1 4.45Å
208	V	97.3	Very high	85	Confident	50 Å²	50	73.3 Å²	73.3	30%	0.303	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	135.9	175.8	178.8	0	0	0	0	109	G23 F24 T26 E206	G23-V208 CarbonylContact C-O 3.57Å; G23-V208 VanDerWaalsContact CA-O 3.29Å; G23-V208 WeakPolarHBondContact CA-O 3.42Å; F24-V208 PolarHBondContact N-O 3.04Å; F24-V208 PolarHBondContact O-N 3.41Å; T26-V208 HydrophobicContact CG2-CB 4.43Å; T26-V208 HydrophobicContact CG2-CG2 4.05Å; T26-V208 WeakPolarHBondContact OG1-CG2 3.25Å; E206-V208 HydrophobicContact CG-CG2 4.15Å
209	T	95.3	Very high	84	Confident	65 Å²	65	79.9 Å²	79.9	40%	0.399	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140	-177.8	49.3	0	0	0	0	112	L22	L22-T209 CarbonylContact O-C 3.56Å; L22-T209 VanDerWaalsContact O-CA 3.23Å; L22-T209 WeakPolarHBondContact O-CA 3.23Å
210	E	94	Very high	82.2	Confident	120 Å²	120	80.1 Å²	80.1	56%	0.561	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	148.8	177	-58.6	-173.8	176.4	0	0	110.4	E21 L22 F24 E212	E21-E210 CarbonylContact C-O 3.52Å; E21-E210 VanDerWaalsContact CA-O 3.29Å; E21-E210 WeakPolarHBondContact CA-O 3.29Å; L22-E210 PolarHBondContact N-O 2.84Å; L22-E210 PolarHBondContact O-N 2.94Å; F24-E210 HydrophobicContact CE2-CB 4.31Å; F24-E210 HydrophobicContact CE2-CG 4.44Å; E210-E212 PolarHBondContact O-N 3.26Å
211	V	94.2	Very high	79.9	Confident	63 Å²	63	87 Å²	87	38%	0.382	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	130.2	177.9	178.4	0	0	0	0	109.7	M16 Q213	M16-V211 HydrophobicContact CE-CG2 3.69Å; V211-Q213 PolarHBondContact O-N 3.05Å
212	E	91.7	Very high	77.6	Confident	21 Å²	21	95.2 Å²	95.2	10%	0.098	47%	0.472	C	S	.	.			trans	-64.6	124.2	178.3	-175	172	-142.8	0	0	111.8	V20 L22 E210 F214 R272 R282	V20-E212 HydrophobicContact CB-CB 4.11Å; V20-E212 WeakPolarHBondContact CB-OE2 3.44Å; V20-E212 HydrophobicContact CG1-CB 4.48Å; V20-E212 VanDerWaalsContact O-CB 3.3Å; V20-E212 WeakPolarHBondContact O-CB 3.23Å; V20-E212 PolarHBondContact O-N 3.27Å; L22-E212 HydrophobicContact CD1-CB 4.21Å; L22-E212 HydrophobicContact CD1-CG 4.02Å; L22-E212 HydrophobicContact CD2-CB 4.05Å; L22-E212 HydrophobicContact CD2-CG 4.2Å; L22-E212 HydrophobicContact CG-CB 3.88Å; L22-E212 HydrophobicContact CG-CG 4.18Å; E210-E212 PolarHBondContact O-N 3.26Å; E212-F214 HydrophobicContact CG-CB 4.32Å; E212-R272 VanDerWaalsContact CD-NE 3.27Å; E212-R272 IonicContact OE1-CZ 2.62Å; E212-R272 IonicContact OE1-NE 3.37Å; E212-R272 PolarHBondContact OE1-NE 2.81Å; E212-R272 IonicContact OE1-NH2 2.63Å; E212-R272 IonicContact OE2-CZ 3.7Å; E212-R272 IonicContact OE2-NE 2.79Å; E212-R272 PolarHBondContact OE2-NE 2.92Å; E212-R272 IonicContact OE2-NH2 2.65Å; E212-R272 PolarHBondContact OE2-NH2 2.95Å; E212-R282 IonicContact OE1-CZ 2.65Å; E212-R282 VanDerWaalsContact OE1-CZ 3.23Å; E212-R282 IonicContact OE1-NH1 3.89Å; E212-R282 PolarHBondContact OE1-NH1 3.2Å; E212-R282 IonicContact OE1-NH2 3.32Å; E212-R282 PolarHBondContact OE1-NH2 2.62Å; E212-R282 IonicContact OE2-CZ 2.71Å; E212-R282 IonicContact OE2-NH1 3.52Å; E212-R282 IonicContact OE2-NH2 3.31Å; E212-R282 PolarHBondContact OE2-NH2 2.85Å
213	Q	85.2	Confident	75.5	Confident	170 Å²	170	98 Å²	98	79%	0.794	49%	0.492	S	S	*	.			trans	-104.3	97	169.2	-61.5	-178.4	20.2	0	0	108.4	V211	V211-Q213 PolarHBondContact O-N 3.05Å
214	F	79	Confident	73.4	Confident	48 Å²	48	100.9 Å²	100.9	21%	0.211	51%	0.51	C	S	.	.			trans	-106.9	131.4	177.9	-179.1	-107.1	0	0	0	111.9	E212 E216 R272 Q275	E212-F214 HydrophobicContact CG-CB 4.32Å; F214-E216 HydrophobicContact CD1-CG 4.02Å; F214-E216 HydrophobicContact CE1-CB 4.22Å; F214-E216 HydrophobicContact CE1-CG 3.26Å; F214-E216 HydrophobicContact CZ-CG 4.04Å; F214-R272 VanDerWaalsContact CD1-CZ 3.49Å; F214-R272 HydrophobicContact CE2-CB 4.33Å; F214-R272 HydrophobicContact CE2-CG 4.37Å; F214-Q275 HydrophobicContact CD2-CG 4.32Å; F214-Q275 VanDerWaalsContact CD2-NE2 3.26Å; F214-Q275 HydrophobicContact CE2-CG 4.4Å
215	T	72.1	Confident	71.6	Confident	102 Å²	102	105 Å²	105	63%	0.626	53%	0.529	S	S	*	.			trans	-112.6	118.8	167.5	38.3	0	0	0	0	109.2	K217 Q275	T215-K217 PolarHBondContact O-N 2.93Å; T215-Q275 PolarHBondContact O-NE2 3.35Å
216	E	67.3	Low	69.5	Low	149 Å²	149	108.5 Å²	108.5	70%	0.696	55%	0.545	S	S	*	.			trans	-63.4	113.2	168.2	-78.3	-173.9	176.6	0	0	108.1	F214 S218	F214-E216 HydrophobicContact CD1-CG 4.02Å; F214-E216 HydrophobicContact CE1-CB 4.22Å; F214-E216 HydrophobicContact CE1-CG 3.26Å; F214-E216 HydrophobicContact CZ-CG 4.04Å; E216-S218 VanDerWaalsContact C-N 3.27Å; E216-S218 PolarHBondContact O-N 3.29Å
217	K	60.6	Low	67.2	Low	179 Å²	179	114.5 Å²	114.5	78%	0.778	57%	0.565	S	S	*	*			trans	-64.4	97	164.8	-69.4	-177.9	-177.1	173.1	0	106.2	T215 K219	T215-K217 PolarHBondContact O-N 2.93Å; K217-K219 PolarHBondContact O-N 3.45Å
218	S	49.1	Very low	64.7	Low	106 Å²	106	119.3 Å²	119.3	74%	0.741	59%	0.589	S	S	*	*			trans	-53.8	111.9	170	44.5	0	0	0	0	106.9	E216 P220	E216-S218 VanDerWaalsContact C-N 3.27Å; E216-S218 PolarHBondContact O-N 3.29Å; S218-P220 WeakPolarHBondContact O-CD 3.26Å
219	K	47.1	Very low	63.2	Low	172 Å²	172	120.9 Å²	120.9	75%	0.748	59%	0.593	S	S	*	*			trans	-56.1	126.2	166.8	-74.4	-177	178.9	173.5	0	105	K217 E221	K217-K219 PolarHBondContact O-N 3.45Å; K219-E221 PolarHBondContact O-N 2.97Å
220	P	37.7	Very low	61.4	Low	119 Å²	119	120.5 Å²	120.5	77%	0.773	60%	0.597	S	S	*	*			trans	-54.5	118.5	172.3	20.9	-29.4	0	0	0	106.4	S218 R222	S218-P220 WeakPolarHBondContact O-CD 3.26Å; P220-R222 PolarHBondContact O-N 2.82Å
221	E	37.4	Very low	59.6	Low	188 Å²	188	121.8 Å²	121.8	88%	0.879	60%	0.597	S	S	*	*			trans	-51.4	115.9	176.4	-80.2	-175.3	136	0	0	106.7	K219 S223	K219-E221 PolarHBondContact O-N 2.97Å; E221-S223 PolarHBondContact O-N 2.85Å; E221-S223 VanDerWaalsContact O-N 3.08Å
222	R	45.4	Very low	58.2	Low	201 Å²	201	126.1 Å²	126.1	76%	0.758	61%	0.607	S	S	*	*			trans	-58.6	122	172.1	-77.5	-177.9	177.5	-176.3	-1.1	105.9	P220 K226	P220-R222 PolarHBondContact O-N 2.82Å; R222-K226 HydrophobicContact CB-CB 4.44Å
223	S	49	Very low	56.8	Low	64 Å²	64	130.6 Å²	130.6	45%	0.448	63%	0.628	S	S	.	*			trans	-47.5	144.5	-179.9	61.4	0	0	0	0	110.5	E221 E225 K226 R227	E221-S223 PolarHBondContact O-N 2.85Å; E221-S223 VanDerWaalsContact O-N 3.08Å; S223-E225 PolarHBondContact O-N 3.13Å; S223-K226 PolarHBondContact O-N 3.24Å; S223-R227 PolarHBondContact O-N 3.24Å
224	T	48.7	Very low	55.5	Low	100 Å²	100	129.6 Å²	129.6	61%	0.613	62%	0.618	S	S	*	*	H	α-helix	trans	-48.2	-35.8	179.2	-31.5	0	0	0	0	111.3	K226 R227 M228	T224-K226 PolarHBondContact O-N 3.39Å; T224-R227 WeakPolarHBondContact O-CB 3.43Å; T224-R227 PolarHBondContact O-N 2.78Å; T224-R227 VanDerWaalsContact O-N 3.15Å; T224-M228 HydrophobicContact CG2-CE 3.8Å; T224-M228 WeakPolarHBondContact O-CG 3.41Å; T224-M228 PolarHBondContact O-N 3.27Å
225	E	57.6	Low	54	Low	154 Å²	154	132 Å²	132	72%	0.72	63%	0.631	S	S	*	*	H	α-helix	trans	-52.9	-50	172.5	-155.5	111.6	-141.4	0	0	113.6	S223 R227 M228 E229	S223-E225 PolarHBondContact O-N 3.13Å; E225-R227 VanDerWaalsContact C-N 3.31Å; E225-R227 PolarHBondContact O-N 2.79Å; E225-M228 PolarHBondContact O-N 3.27Å; E225-E229 PolarHBondContact O-N 3.43Å
226	K	54.6	Low	53.5	Low	143 Å²	143	129.9 Å²	129.9	62%	0.622	62%	0.624	S	S	*	*	H	α-helix	trans	-68.4	-29	178.4	-76.6	-175.8	176.7	178	0	112.4	R222 S223 T224 A230	R222-K226 HydrophobicContact CB-CB 4.44Å; S223-K226 PolarHBondContact O-N 3.24Å; T224-K226 PolarHBondContact O-N 3.39Å; K226-A230 PolarHBondContact O-N 3.09Å
227	R	50.5	Low	52.9	Low	187 Å²	187	128.1 Å²	128.1	71%	0.706	62%	0.619	S	S	*	*	H	α-helix	trans	-70	-42.8	172.6	-76.9	175.8	91.8	153.6	1.7	111.1	S223 T224 E225 E229 A230 Y231	S223-R227 PolarHBondContact O-N 3.24Å; T224-R227 WeakPolarHBondContact O-CB 3.43Å; T224-R227 PolarHBondContact O-N 2.78Å; T224-R227 VanDerWaalsContact O-N 3.15Å; E225-R227 VanDerWaalsContact C-N 3.31Å; E225-R227 PolarHBondContact O-N 2.79Å; R227-E229 VanDerWaalsContact C-N 3.34Å; R227-A230 PolarHBondContact O-N 2.83Å; R227-Y231 PolarHBondContact O-N 3.43Å; R227-Y231 VanDerWaalsContact O-N 3.11Å
228	M	44.7	Very low	52.5	Low	104 Å²	104	122.6 Å²	122.6	51%	0.512	60%	0.6	S	S	.	*	H	α-helix	trans	-65.3	-38.2	177.6	-68.2	-172	-162.9	0	0	111.7	T224 E225 Y231 R232	T224-M228 HydrophobicContact CG2-CE 3.8Å; T224-M228 WeakPolarHBondContact O-CG 3.41Å; T224-M228 PolarHBondContact O-N 3.27Å; E225-M228 PolarHBondContact O-N 3.27Å; M228-Y231 WeakPolarHBondContact O-CB 3.42Å; M228-Y231 PolarHBondContact O-N 3.09Å; M228-R232 WeakPolarHBondContact O-CG 3.37Å; M228-R232 PolarHBondContact O-N 3.41Å
229	E	66.1	Low	52.7	Low	84 Å²	84	124.3 Å²	124.3	39%	0.393	60%	0.601	S	S	.	*	H	α-helix	trans	-66.2	-43.7	177.7	-170.1	56	-151.3	0	0	112.5	E225 R227 Y231 R232 Q233	E225-E229 PolarHBondContact O-N 3.43Å; R227-E229 VanDerWaalsContact C-N 3.34Å; E229-Y231 VanDerWaalsContact C-N 3.26Å; E229-Y231 PolarHBondContact O-N 2.82Å; E229-R232 PolarHBondContact O-N 3.35Å; E229-R232 IonicContact OE2-NH1 3.22Å; E229-R232 PolarHBondContact OE2-NH1 3.49Å; E229-Q233 WeakPolarHBondContact O-CG 3.2Å; E229-Q233 PolarHBondContact O-N 2.97Å
230	A	57.1	Low	52.9	Low	57 Å²	57	123 Å²	123	47%	0.471	60%	0.601	S	S	.	*	H	α-helix	trans	-61.3	-35.8	174.3	0	0	0	0	0	112.2	K226 R227 Y234	K226-A230 PolarHBondContact O-N 3.09Å; R227-A230 PolarHBondContact O-N 2.83Å; A230-Y234 PolarHBondContact O-N 3.19Å; A230-Y234 VanDerWaalsContact O-N 3.1Å
231	Y	55.8	Low	53.3	Low	147 Å²	147	121.4 Å²	121.4	58%	0.576	59%	0.593	S	S	*	*	H	α-helix	trans	-68.2	-41.7	175.2	-175.5	-100	0	0	0	112.3	R227 M228 E229 Q233 Y234 M235	R227-Y231 PolarHBondContact O-N 3.43Å; R227-Y231 VanDerWaalsContact O-N 3.11Å; M228-Y231 WeakPolarHBondContact O-CB 3.42Å; M228-Y231 PolarHBondContact O-N 3.09Å; E229-Y231 VanDerWaalsContact C-N 3.26Å; E229-Y231 PolarHBondContact O-N 2.82Å; Y231-Q233 VanDerWaalsContact C-N 3.34Å; Y231-Q233 PolarHBondContact O-N 3.25Å; Y231-Y234 PolarHBondContact O-N 3.11Å; Y231-M235 HydrophobicContact CD1-CG 4.06Å; Y231-M235 HydrophobicContact CE1-CG 3.66Å; Y231-M235 HydrophobicContact CE1-SD 4.22Å; Y231-M235 HydrophobicContact CE2-CG 4.4Å; Y231-M235 HydrophobicContact CE2-SD 4.43Å; Y231-M235 WeakPolarHBondContact O-CG 3.48Å; Y231-M235 PolarHBondContact O-N 3.48Å
232	R	65	Low	53.4	Low	154 Å²	154	118.3 Å²	118.3	58%	0.581	59%	0.587	S	S	*	*	H	α-helix	trans	-59.7	-43.5	174.6	-73.1	175.6	-173.9	152.2	-1.4	111.9	M228 E229 Y234 M235 A236	M228-R232 WeakPolarHBondContact O-CG 3.37Å; M228-R232 PolarHBondContact O-N 3.41Å; E229-R232 PolarHBondContact O-N 3.35Å; E229-R232 IonicContact OE2-NH1 3.22Å; E229-R232 PolarHBondContact OE2-NH1 3.49Å; R232-Y234 VanDerWaalsContact C-N 3.35Å; R232-M235 PolarHBondContact O-N 3.47Å; R232-A236 WeakPolarHBondContact O-CB 3.46Å; R232-A236 PolarHBondContact O-N 3.34Å
233	Q	61.9	Low	53	Low	114 Å²	114	114.6 Å²	114.6	53%	0.533	59%	0.586	S	S	.	*	H	α-helix	trans	-64.2	-39.3	177.4	-70.4	176.4	2.5	0	0	112.2	E229 Y231 A236 N237	E229-Q233 WeakPolarHBondContact O-CG 3.2Å; E229-Q233 PolarHBondContact O-N 2.97Å; Y231-Q233 VanDerWaalsContact C-N 3.34Å; Y231-Q233 PolarHBondContact O-N 3.25Å; Q233-A236 PolarHBondContact O-N 2.9Å; Q233-N237 PolarHBondContact O-N 3.45Å; Q233-N237 PolarHBondContact O-ND2 3.37Å
234	Y	58.4	Low	52.4	Low	150 Å²	150	121 Å²	121	59%	0.588	61%	0.606	S	S	*	*	H	α-helix	trans	-63.7	-48	174.6	179.1	-99	0	0	0	111.8	A230 Y231 R232 A236 N237 V238	A230-Y234 PolarHBondContact O-N 3.19Å; A230-Y234 VanDerWaalsContact O-N 3.1Å; Y231-Y234 PolarHBondContact O-N 3.11Å; R232-Y234 VanDerWaalsContact C-N 3.35Å; Y234-A236 VanDerWaalsContact C-N 3.28Å; Y234-A236 PolarHBondContact O-N 3.29Å; Y234-N237 PolarHBondContact O-N 2.89Å; Y234-N237 VanDerWaalsContact O-N 3.1Å; Y234-V238 HydrophobicContact CD1-CG2 4.18Å; Y234-V238 HydrophobicContact CE1-CG2 3.77Å; Y234-V238 HydrophobicContact CE2-CG2 4.2Å; Y234-V238 WeakPolarHBondContact O-CG2 3.35Å; Y234-V238 PolarHBondContact O-N 3.08Å; Y234-V238 VanDerWaalsContact O-N 3.09Å
235	M	47.2	Very low	51.6	Low	98 Å²	98	123 Å²	123	48%	0.483	61%	0.613	S	S	.	*	H	α-helix	trans	-60.3	-37.5	178.1	-69.7	-66.2	-66.7	0	0	112.3	Y231 R232 N237 V238 D239	Y231-M235 HydrophobicContact CD1-CG 4.06Å; Y231-M235 HydrophobicContact CE1-CG 3.66Å; Y231-M235 HydrophobicContact CE1-SD 4.22Å; Y231-M235 HydrophobicContact CE2-CG 4.4Å; Y231-M235 HydrophobicContact CE2-SD 4.43Å; Y231-M235 WeakPolarHBondContact O-CG 3.48Å; Y231-M235 PolarHBondContact O-N 3.48Å; R232-M235 PolarHBondContact O-N 3.47Å; M235-N237 VanDerWaalsContact C-N 3.33Å; M235-N237 PolarHBondContact O-N 3.28Å; M235-V238 PolarHBondContact O-N 3.19Å; M235-D239 PolarHBondContact O-N 3.3Å
236	A	63.3	Low	50.6	Low	58 Å²	58	125.5 Å²	125.5	48%	0.479	62%	0.622	S	S	.	*	H	α-helix	trans	-66.1	-32.4	176.1	0	0	0	0	0	113.2	R232 Q233 Y234	R232-A236 WeakPolarHBondContact O-CB 3.46Å; R232-A236 PolarHBondContact O-N 3.34Å; Q233-A236 PolarHBondContact O-N 2.9Å; Y234-A236 VanDerWaalsContact C-N 3.28Å; Y234-A236 PolarHBondContact O-N 3.29Å
237	N	54.2	Low	49.5	Very low	111 Å²	111	123.5 Å²	123.5	59%	0.594	63%	0.626	S	S	*	*	H	α-helix	trans	-80.6	-29.5	179.5	-69.3	-17.6	0	0	0	112.8	Q233 Y234 M235 L240	Q233-N237 PolarHBondContact O-N 3.45Å; Q233-N237 PolarHBondContact O-ND2 3.37Å; Y234-N237 PolarHBondContact O-N 2.89Å; Y234-N237 VanDerWaalsContact O-N 3.1Å; M235-N237 VanDerWaalsContact C-N 3.33Å; M235-N237 PolarHBondContact O-N 3.28Å; N237-L240 PolarHBondContact O-N 3.1Å
238	V	52.3	Low	48.6	Very low	63 Å²	63	124.8 Å²	124.8	38%	0.382	64%	0.637	S	S	.	*	H	α-helix	trans	-69.7	-36.1	178.2	174.3	0	0	0	0	111	Y234 M235 L240 S241	Y234-V238 HydrophobicContact CD1-CG2 4.18Å; Y234-V238 HydrophobicContact CE1-CG2 3.77Å; Y234-V238 HydrophobicContact CE2-CG2 4.2Å; Y234-V238 WeakPolarHBondContact O-CG2 3.35Å; Y234-V238 PolarHBondContact O-N 3.08Å; Y234-V238 VanDerWaalsContact O-N 3.09Å; M235-V238 PolarHBondContact O-N 3.19Å; V238-L240 PolarHBondContact O-N 3.08Å; V238-L240 VanDerWaalsContact O-N 3.12Å; V238-S241 PolarHBondContact O-N 3.4Å; V238-S241 PolarHBondContact O-OG 3.43Å
239	D	52.6	Low	48.1	Very low	142 Å²	142	125.2 Å²	125.2	76%	0.759	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-16.3	-179.2	-140.4	16.4	0	0	0	113.4	M235	M235-D239 PolarHBondContact O-N 3.3Å
240	L	52.2	Low	46.5	Very low	144 Å²	144	131.6 Å²	131.6	75%	0.754	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-9.5	178.8	-83.7	155.7	0	0	0	114.7	N237 V238	N237-L240 PolarHBondContact O-N 3.1Å; V238-L240 PolarHBondContact O-N 3.08Å; V238-L240 VanDerWaalsContact O-N 3.12Å
241	S	45.1	Very low	45.8	Very low	87 Å²	87	130.8 Å²	130.8	61%	0.608	66%	0.664	S	S	*	*			trans	-110.6	11.6	-171.8	61.9	0	0	0	0	115.7	V238 T243	V238-S241 PolarHBondContact O-N 3.4Å; V238-S241 PolarHBondContact O-OG 3.43Å; S241-T243 PolarHBondContact O-N 2.76Å
242	V	40.2	Very low	45.4	Very low	123 Å²	123	127 Å²	127	75%	0.745	66%	0.664	S	S	*	*			trans	-80.7	53.8	172.8	-164.9	0	0	0	0	111.5
243	T	37	Very low	44.5	Very low	122 Å²	122	127.5 Å²	127.5	75%	0.748	67%	0.673	S	S	*	*			trans	-145.3	128.9	153.7	48.2	0	0	0	0	110.3	S241	S241-T243 PolarHBondContact O-N 2.76Å
244	K	35.8	Very low	43.5	Very low	199 Å²	199	128.2 Å²	128.2	87%	0.865	68%	0.676	S	S	*	*	S	Bend	trans	90.8	91.5	168.9	-62.8	-176.3	174.5	178.8	0	118.6
245	D	33.1	Very low	42.7	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	68%	0.68	S	S	*	*				83.7	94.6	113.4	-120.8	-7.5	0	0	0	120.6	S247	D245-S247 PolarHBondContact O-N 2.88Å
246	K	35.5	Very low	42.7	Very low	206 Å²	206	127.7 Å²	127.7	90%	0.896	68%	0.681	S	S	*	*			trans	11.9	91.5	133.4	-61.1	178.3	-179.5	176.2	0	117.1
247	S	32.1	Very low	42	Very low	102 Å²	102	127.4 Å²	127.4	71%	0.713	68%	0.676	S	S	*	*			trans	-137.2	133.3	148.5	176.6	0	0	0	0	108.2	D245 T249	D245-S247 PolarHBondContact O-N 2.88Å; S247-T249 VanDerWaalsContact C-N 3.29Å; S247-T249 PolarHBondContact O-N 3.23Å; S247-T249 PolarHBondContact O-OG1 3.44Å
248	K	31	Very low	41.3	Very low	214 Å²	214	128.2 Å²	128.2	93%	0.93	68%	0.678	S	S	*	*			trans	-68.1	83.6	-175.1	-70.1	175.5	175.2	178.3	0	109.9
249	T	34.4	Very low	41.4	Very low	113 Å²	113	128.8 Å²	128.8	69%	0.693	68%	0.684	S	S	*	*			trans	-97.5	125.3	173.7	-45.4	0	0	0	0	107.4	S247 G251	S247-T249 VanDerWaalsContact C-N 3.29Å; S247-T249 PolarHBondContact O-N 3.23Å; S247-T249 PolarHBondContact O-OG1 3.44Å; T249-G251 PolarHBondContact O-N 3.46Å
250	Y	32.8	Very low	41.5	Very low	217 Å²	217	127.5 Å²	127.5	85%	0.851	67%	0.672	S	S	*	*			trans	-43.5	132	167.4	-74.2	-89.3	0	0	0	108.8	A252	Y250-A252 PolarHBondContact O-N 3.03Å; Y250-A252 VanDerWaalsContact O-N 3.12Å
251	G	42.2	Very low	41.5	Very low	40 Å²	40	124.7 Å²	124.7	41%	0.412	66%	0.655	S	S	.	*			trans	-50.7	119.9	-160.9	0	0	0	0	0	111.2	T249 E253 E254 L255	T249-G251 PolarHBondContact O-N 3.46Å; G251-E253 PolarHBondContact O-N 3.36Å; G251-E254 PolarHBondContact O-N 2.84Å; G251-L255 PolarHBondContact O-N 2.92Å
252	A	48.3	Very low	42.1	Very low	69 Å²	69	122.7 Å²	122.7	57%	0.57	64%	0.644	S	S	*	*	H	α-helix	trans	-52.3	-27.6	174.5	0	0	0	0	0	111.6	Y250 E256	Y250-A252 PolarHBondContact O-N 3.03Å; Y250-A252 VanDerWaalsContact O-N 3.12Å; A252-E256 VanDerWaalsContact O-CB 3.23Å; A252-E256 WeakPolarHBondContact O-CB 3.39Å; A252-E256 WeakPolarHBondContact O-CG 3.18Å; A252-E256 PolarHBondContact O-N 3.2Å
253	E	44.2	Very low	43.3	Very low	164 Å²	164	120.3 Å²	120.3	77%	0.766	63%	0.627	S	S	*	*	H	α-helix	trans	-62.4	-40.1	173.1	-64.8	-173.7	161.2	0	0	113.6	G251 S257	G251-E253 PolarHBondContact O-N 3.36Å; E253-S257 WeakPolarHBondContact O-CB 3.35Å; E253-S257 PolarHBondContact O-N 2.89Å; E253-S257 PolarHBondContact O-OG 3.37Å
254	E	41.7	Very low	44.9	Very low	128 Å²	128	120.8 Å²	120.8	60%	0.598	62%	0.618	S	S	*	*	H	α-helix	trans	-75.6	-38.7	-178.9	-157.5	173.1	-161.6	0	0	110.7	G251 S257 M258	G251-E254 PolarHBondContact O-N 2.84Å; E254-S257 WeakPolarHBondContact CA-OG 3.27Å; E254-S257 PolarHBondContact O-N 2.82Å; E254-S257 PolarHBondContact O-OG 3.26Å; E254-M258 WeakPolarHBondContact O-CB 3.32Å; E254-M258 VanDerWaalsContact O-CG 3.22Å; E254-M258 WeakPolarHBondContact O-CG 3.29Å; E254-M258 PolarHBondContact O-N 2.92Å
255	L	41.9	Very low	46.5	Very low	130 Å²	130	113.9 Å²	113.9	68%	0.681	59%	0.591	S	S	*	*	H	α-helix	trans	-66.3	-41.4	171.7	-170	77.7	0	0	0	111.5	G251 S259	G251-L255 PolarHBondContact O-N 2.92Å; L255-S259 VanDerWaalsContact O-CB 3.24Å; L255-S259 WeakPolarHBondContact O-CB 3.41Å; L255-S259 PolarHBondContact O-N 3.19Å
256	E	47.8	Very low	48.3	Very low	107 Å²	107	110 Å²	110	50%	0.5	57%	0.567	S	S	.	*	H	α-helix	trans	-67	-38.9	175.4	-89.1	-163.2	-178.3	0	0	112.3	A252 S259 K260	A252-E256 VanDerWaalsContact O-CB 3.23Å; A252-E256 WeakPolarHBondContact O-CB 3.39Å; A252-E256 WeakPolarHBondContact O-CG 3.18Å; A252-E256 PolarHBondContact O-N 3.2Å; E256-S259 PolarHBondContact O-N 2.8Å; E256-K260 VanDerWaalsContact O-CB 3.3Å; E256-K260 WeakPolarHBondContact O-CB 3.16Å; E256-K260 WeakPolarHBondContact O-CD 3.27Å; E256-K260 WeakPolarHBondContact O-CG 3.37Å; E256-K260 PolarHBondContact O-N 2.84Å; E256-K260 IonicContact OE2-NZ 2.72Å; E256-K260 PolarHBondContact OE2-NZ 2.91Å
257	S	47.3	Very low	50.2	Low	53 Å²	53	105.3 Å²	105.3	37%	0.371	55%	0.547	S	S	.	.	H	α-helix	trans	-65.9	-45.4	177.8	63.9	0	0	0	0	110.6	E253 E254 S259 K260 E261	E253-S257 WeakPolarHBondContact O-CB 3.35Å; E253-S257 PolarHBondContact O-N 2.89Å; E253-S257 PolarHBondContact O-OG 3.37Å; E254-S257 WeakPolarHBondContact CA-OG 3.27Å; E254-S257 PolarHBondContact O-N 2.82Å; E254-S257 PolarHBondContact O-OG 3.26Å; S257-S259 PolarHBondContact O-N 3.45Å; S257-K260 PolarHBondContact O-N 2.82Å; S257-E261 WeakPolarHBondContact O-CG 3.44Å; S257-E261 PolarHBondContact O-N 2.95Å
258	M	41	Very low	52.3	Low	127 Å²	127	104.8 Å²	104.8	63%	0.626	53%	0.533	S	S	*	.	H	α-helix	trans	-61.4	-43.1	175.1	-70.9	-178.9	77.2	0	0	111.8	E254 E261 A262	E254-M258 WeakPolarHBondContact O-CB 3.32Å; E254-M258 VanDerWaalsContact O-CG 3.22Å; E254-M258 WeakPolarHBondContact O-CG 3.29Å; E254-M258 PolarHBondContact O-N 2.92Å; M258-E261 PolarHBondContact O-N 2.88Å; M258-A262 WeakPolarHBondContact O-CB 3.38Å; M258-A262 PolarHBondContact O-N 3.06Å
259	S	53.4	Low	54.5	Low	75 Å²	75	94.8 Å²	94.8	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-44	176.9	179.6	0	0	0	0	111.8	L255 E256 S257 E261 D263	L255-S259 VanDerWaalsContact O-CB 3.24Å; L255-S259 WeakPolarHBondContact O-CB 3.41Å; L255-S259 PolarHBondContact O-N 3.19Å; E256-S259 PolarHBondContact O-N 2.8Å; S257-S259 PolarHBondContact O-N 3.45Å; S259-E261 VanDerWaalsContact C-N 3.33Å; S259-E261 PolarHBondContact O-N 3.21Å; S259-D263 WeakPolarHBondContact O-CB 3.21Å; S259-D263 PolarHBondContact O-N 2.86Å; S259-D263 VanDerWaalsContact O-N 3.14Å
260	K	54.7	Low	56.6	Low	116 Å²	116	95.7 Å²	95.7	50%	0.504	48%	0.481	S	S	.	.	H	α-helix	trans	-65.2	-33.9	178.2	-75.6	167.5	-170.2	157.9	0	112.6	E256 S257 K264	E256-K260 VanDerWaalsContact O-CB 3.3Å; E256-K260 WeakPolarHBondContact O-CB 3.16Å; E256-K260 WeakPolarHBondContact O-CD 3.27Å; E256-K260 WeakPolarHBondContact O-CG 3.37Å; E256-K260 PolarHBondContact O-N 2.84Å; E256-K260 IonicContact OE2-NZ 2.72Å; E256-K260 PolarHBondContact OE2-NZ 2.91Å; S257-K260 PolarHBondContact O-N 2.82Å; K260-K264 WeakPolarHBondContact O-CG 3.37Å; K260-K264 PolarHBondContact O-N 3.42Å
261	E	52.6	Low	59	Low	85 Å²	85	87.4 Å²	87.4	40%	0.397	46%	0.457	S	S	.	.	H	α-helix	trans	-77.6	-46.2	178.9	-73.6	-170.2	175.6	0	0	113.2	S257 M258 S259 D263 K264 D265 Q294	S257-E261 WeakPolarHBondContact O-CG 3.44Å; S257-E261 PolarHBondContact O-N 2.95Å; M258-E261 PolarHBondContact O-N 2.88Å; S259-E261 VanDerWaalsContact C-N 3.33Å; S259-E261 PolarHBondContact O-N 3.21Å; E261-D263 PolarHBondContact O-N 3.1Å; E261-K264 WeakPolarHBondContact O-CA 3.37Å; E261-K264 WeakPolarHBondContact O-CB 3.35Å; E261-K264 PolarHBondContact O-N 2.87Å; E261-D265 PolarHBondContact O-N 2.88Å; E261-D265 VanDerWaalsContact O-N 3.13Å; E261-Q294 PolarHBondContact OE2-NE2 2.61Å
262	A	56.9	Low	60.9	Low	44 Å²	44	87.7 Å²	87.7	36%	0.364	45%	0.445	S	S	.	.	H	α-helix	trans	-55.1	-37.9	172.5	0	0	0	0	0	111.3	M258 K264 F266	M258-A262 WeakPolarHBondContact O-CB 3.38Å; M258-A262 PolarHBondContact O-N 3.06Å; A262-K264 VanDerWaalsContact C-N 3.34Å; A262-K264 PolarHBondContact O-N 2.69Å; A262-F266 WeakPolarHBondContact O-CB 3.39Å; A262-F266 PolarHBondContact O-N 3.3Å; A262-F266 VanDerWaalsContact O-N 3.13Å
263	D	66.3	Low	62.6	Low	74 Å²	74	85.8 Å²	85.8	40%	0.396	43%	0.426	S	S	.	.	H	α-helix	trans	-64.2	-33.1	173.5	-114.3	25.3	0	0	0	113.7	S259 E261 K267	S259-D263 WeakPolarHBondContact O-CB 3.21Å; S259-D263 PolarHBondContact O-N 2.86Å; S259-D263 VanDerWaalsContact O-N 3.14Å; E261-D263 PolarHBondContact O-N 3.1Å; D263-K267 VanDerWaalsContact O-CB 3.26Å; D263-K267 WeakPolarHBondContact O-CB 3.21Å; D263-K267 WeakPolarHBondContact O-CD 3.46Å; D263-K267 WeakPolarHBondContact O-CG 3.38Å; D263-K267 PolarHBondContact O-N 3.45Å; D263-K267 VanDerWaalsContact O-N 3.08Å; D263-K267 IonicContact OD2-NZ 2.71Å; D263-K267 PolarHBondContact OD2-NZ 3.41Å
264	K	69.9	Low	64.6	Low	131 Å²	131	84.1 Å²	84.1	57%	0.57	42%	0.418	S	S	*	.	H	α-helix	trans	-71.3	-46.2	178.6	-77.3	171.7	-172.1	171.2	0	110.8	K260 E261 A262 F266 K267 H268	K260-K264 WeakPolarHBondContact O-CG 3.37Å; K260-K264 PolarHBondContact O-N 3.42Å; E261-K264 WeakPolarHBondContact O-CA 3.37Å; E261-K264 WeakPolarHBondContact O-CB 3.35Å; E261-K264 PolarHBondContact O-N 2.87Å; A262-K264 VanDerWaalsContact C-N 3.34Å; A262-K264 PolarHBondContact O-N 2.69Å; K264-F266 VanDerWaalsContact C-N 3.34Å; K264-K267 PolarHBondContact O-N 3.34Å; K264-H268 WeakPolarHBondContact O-CB 3.5Å; K264-H268 PolarHBondContact O-N 2.81Å
265	D	68.4	Low	66.8	Low	55 Å²	55	80.5 Å²	80.5	29%	0.294	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-42.6	-178.4	-66.2	-37.1	0	0	0	110.8	E261 K267 H268 F269 Q294	E261-D265 PolarHBondContact O-N 2.88Å; E261-D265 VanDerWaalsContact O-N 3.13Å; D265-K267 VanDerWaalsContact C-N 3.35Å; D265-K267 PolarHBondContact O-N 2.82Å; D265-H268 PolarHBondContact O-N 2.81Å; D265-F269 VanDerWaalsContact O-CB 3.27Å; D265-F269 WeakPolarHBondContact O-CB 3.47Å; D265-F269 PolarHBondContact O-N 3.19Å; D265-Q294 WeakPolarHBondContact OD2-CG 3.49Å; D265-Q294 PolarHBondContact OD2-NE2 3.24Å; D265-Q294 VanDerWaalsContact OD2-NE2 3.14Å
266	F	71.7	Confident	69.1	Low	59 Å²	59	76.4 Å²	76.4	26%	0.259	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-37.8	174.9	-170.5	-122.1	0	0	0	112.8	A262 K264 R270 A292 Y365	A262-F266 WeakPolarHBondContact O-CB 3.39Å; A262-F266 PolarHBondContact O-N 3.3Å; A262-F266 VanDerWaalsContact O-N 3.13Å; K264-F266 VanDerWaalsContact C-N 3.34Å; F266-R270 VanDerWaalsContact CE1-CZ 3.41Å; F266-R270 HydrophobicContact CZ-CG 4.49Å; F266-R270 WeakPolarHBondContact O-CB 3.48Å; F266-R270 WeakPolarHBondContact O-CG 3.39Å; F266-R270 PolarHBondContact O-N 3.1Å; F266-A292 WeakPolarHBondContact CA-O 3.44Å; F266-A292 WeakPolarHBondContact CB-O 3.45Å; F266-A292 HydrophobicContact CD2-CB 4.41Å; F266-A292 WeakPolarHBondContact CD2-O 3.39Å; F266-Y365 HydrophobicContact CE2-CD1 4.3Å
267	K	75.7	Confident	71.2	Confident	108 Å²	108	75 Å²	75	47%	0.47	38%	0.379	S	S	.	.	H	α-helix	trans	-65.1	-39.7	172.9	-77	164.8	-164.3	155.5	0	111.7	D263 K264 D265 A271	D263-K267 VanDerWaalsContact O-CB 3.26Å; D263-K267 WeakPolarHBondContact O-CB 3.21Å; D263-K267 WeakPolarHBondContact O-CD 3.46Å; D263-K267 WeakPolarHBondContact O-CG 3.38Å; D263-K267 PolarHBondContact O-N 3.45Å; D263-K267 VanDerWaalsContact O-N 3.08Å; D263-K267 IonicContact OD2-NZ 2.71Å; D263-K267 PolarHBondContact OD2-NZ 3.41Å; K264-K267 PolarHBondContact O-N 3.34Å; D265-K267 VanDerWaalsContact C-N 3.35Å; D265-K267 PolarHBondContact O-N 2.82Å; K267-A271 WeakPolarHBondContact O-CB 3.45Å; K267-A271 PolarHBondContact O-N 3.44Å
268	H	75.4	Confident	73.4	Confident	91 Å²	91	78.2 Å²	78.2	42%	0.421	39%	0.389	S	S	.	.	H	α-helix	trans	-66.7	-47.6	176.8	-179.3	75.3	0	0	0	111.2	K264 D265 R270 A271 R272	K264-H268 WeakPolarHBondContact O-CB 3.5Å; K264-H268 PolarHBondContact O-N 2.81Å; D265-H268 PolarHBondContact O-N 2.81Å; H268-R270 PolarHBondContact O-N 2.89Å; H268-A271 PolarHBondContact O-N 3.19Å; H268-R272 WeakPolarHBondContact O-CB 3.5Å; H268-R272 PolarHBondContact O-N 3.16Å
269	F	78.2	Confident	75.9	Confident	4 Å²	4	72.3 Å²	72.3	2%	0.018	36%	0.36	C	S	.	.	H	α-helix	trans	-52	-54.1	173.6	179.2	-95.1	0	0	0	111.4	D265 R272 I273 L290 L291 A292 Y365	D265-F269 VanDerWaalsContact O-CB 3.27Å; D265-F269 WeakPolarHBondContact O-CB 3.47Å; D265-F269 PolarHBondContact O-N 3.19Å; F269-R272 PolarHBondContact O-N 3.5Å; F269-I273 HydrophobicContact CD1-CD1 3.72Å; F269-I273 HydrophobicContact CD2-CD1 4.02Å; F269-I273 HydrophobicContact CE1-CD1 3.24Å; F269-I273 HydrophobicContact CE2-CD1 3.57Å; F269-I273 HydrophobicContact CG-CD1 4.09Å; F269-I273 HydrophobicContact CZ-CD1 3.15Å; F269-I273 WeakPolarHBondContact O-CG1 3.32Å; F269-I273 PolarHBondContact O-N 3.04Å; F269-L290 HydrophobicContact CD2-CD1 4.49Å; F269-L290 HydrophobicContact CD2-CD2 4.22Å; F269-L290 HydrophobicContact CD2-CG 3.77Å; F269-L290 HydrophobicContact CE2-CG 4.35Å; F269-L290 WeakPolarHBondContact CE2-O 3.38Å; F269-L291 WeakPolarHBondContact CB-O 3.5Å; F269-L291 WeakPolarHBondContact CD2-O 3.42Å; F269-A292 HydrophobicContact CD1-CB 4.02Å; F269-A292 HydrophobicContact CD2-CB 4.02Å; F269-A292 HydrophobicContact CE1-CB 3.94Å; F269-A292 HydrophobicContact CE2-CB 3.96Å; F269-A292 HydrophobicContact CG-CB 4.06Å; F269-A292 HydrophobicContact CZ-CB 3.91Å; F269-Y365 HydrophobicContact CE1-CE1 4.09Å
270	R	78.6	Confident	78	Confident	133 Å²	133	68.7 Å²	68.7	50%	0.502	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-50.3	177.1	-74.8	-164.4	-166.2	-152.3	4.9	111.9	F266 H268 R272 I273 E274	F266-R270 VanDerWaalsContact CE1-CZ 3.41Å; F266-R270 HydrophobicContact CZ-CG 4.49Å; F266-R270 WeakPolarHBondContact O-CB 3.48Å; F266-R270 WeakPolarHBondContact O-CG 3.39Å; F266-R270 PolarHBondContact O-N 3.1Å; H268-R270 PolarHBondContact O-N 2.89Å; R270-R272 PolarHBondContact O-N 3.48Å; R270-I273 PolarHBondContact O-N 3.49Å; R270-I273 VanDerWaalsContact O-N 3.14Å; R270-E274 VanDerWaalsContact O-CB 3.31Å; R270-E274 WeakPolarHBondContact O-CB 3.43Å; R270-E274 WeakPolarHBondContact O-CG 3.42Å; R270-E274 PolarHBondContact O-N 3.24Å
271	A	81.9	Confident	80.1	Confident	43 Å²	43	63.2 Å²	63.2	36%	0.355	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-32.3	-178.3	0	0	0	0	0	112.8	K267 H268	K267-A271 WeakPolarHBondContact O-CB 3.45Å; K267-A271 PolarHBondContact O-N 3.44Å; H268-A271 PolarHBondContact O-N 3.19Å
272	R	82.8	Confident	82.2	Confident	45 Å²	45	59.9 Å²	59.9	17%	0.17	29%	0.294	C	S	.	.	H	α-helix	trans	-75.5	-43.4	176.1	-170.2	58.7	170.6	-128.6	7.8	112.1	E212 F214 H268 F269 R270 L290	E212-R272 VanDerWaalsContact CD-NE 3.27Å; E212-R272 IonicContact OE1-CZ 2.62Å; E212-R272 IonicContact OE1-NE 3.37Å; E212-R272 PolarHBondContact OE1-NE 2.81Å; E212-R272 IonicContact OE1-NH2 2.63Å; E212-R272 IonicContact OE2-CZ 3.7Å; E212-R272 IonicContact OE2-NE 2.79Å; E212-R272 PolarHBondContact OE2-NE 2.92Å; E212-R272 IonicContact OE2-NH2 2.65Å; E212-R272 PolarHBondContact OE2-NH2 2.95Å; F214-R272 VanDerWaalsContact CD1-CZ 3.49Å; F214-R272 HydrophobicContact CE2-CB 4.33Å; F214-R272 HydrophobicContact CE2-CG 4.37Å; H268-R272 WeakPolarHBondContact O-CB 3.5Å; H268-R272 PolarHBondContact O-N 3.16Å; F269-R272 PolarHBondContact O-N 3.5Å; R270-R272 PolarHBondContact O-N 3.48Å; R272-L290 HydrophobicContact CB-CD1 4.21Å; R272-L290 HydrophobicContact CB-CD2 3.87Å; R272-L290 HydrophobicContact CG-CD1 4.26Å; R272-L290 HydrophobicContact CG-CD2 3.69Å
273	I	85.3	Confident	84.1	Confident	30 Å²	30	59.5 Å²	59.5	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-69.9	-37	179	-69.4	175.1	0	0	0	111.9	F269 R270 Q275 N276 P277 L290 M317	F269-I273 HydrophobicContact CD1-CD1 3.72Å; F269-I273 HydrophobicContact CD2-CD1 4.02Å; F269-I273 HydrophobicContact CE1-CD1 3.24Å; F269-I273 HydrophobicContact CE2-CD1 3.57Å; F269-I273 HydrophobicContact CG-CD1 4.09Å; F269-I273 HydrophobicContact CZ-CD1 3.15Å; F269-I273 WeakPolarHBondContact O-CG1 3.32Å; F269-I273 PolarHBondContact O-N 3.04Å; R270-I273 PolarHBondContact O-N 3.49Å; R270-I273 VanDerWaalsContact O-N 3.14Å; I273-Q275 PolarHBondContact O-N 3Å; I273-N276 CarbonylContact O-C 3Å; I273-N276 PolarHBondContact O-N 3.15Å; I273-P277 WeakPolarHBondContact O-CA 3.48Å; I273-L290 HydrophobicContact CD1-CD2 4.46Å; I273-L290 HydrophobicContact CG1-CD2 4Å; I273-M317 HydrophobicContact CD1-CE 3.5Å; I273-M317 HydrophobicContact CG1-CE 3.83Å
274	E	85.8	Confident	85.5	Confident	128 Å²	128	58 Å²	58	60%	0.598	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.9	-179.4	-81.2	171.5	-169.4	0	0	113.9	R270	R270-E274 VanDerWaalsContact O-CB 3.31Å; R270-E274 WeakPolarHBondContact O-CB 3.43Å; R270-E274 WeakPolarHBondContact O-CG 3.42Å; R270-E274 PolarHBondContact O-N 3.24Å
275	Q	86.8	Confident	86.6	Confident	53 Å²	53	54.9 Å²	54.9	25%	0.248	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-29.9	175	-64.4	-168.2	15.6	0	0	112.6	F214 T215 I273	F214-Q275 HydrophobicContact CD2-CG 4.32Å; F214-Q275 VanDerWaalsContact CD2-NE2 3.26Å; F214-Q275 HydrophobicContact CE2-CG 4.4Å; T215-Q275 PolarHBondContact O-NE2 3.35Å; I273-Q275 PolarHBondContact O-N 3Å
276	N	91.3	Very high	87.8	Confident	44 Å²	44	54.5 Å²	54.5	24%	0.235	27%	0.268	C	S	.	.	S	Bend	trans	-142.2	69.4	-179.2	-64.5	-78	0	0	0	109.1	L22 F24 I273 E278 Q279	L22-N276 HydrophobicContact CD1-CB 3.65Å; F24-N276 HydrophobicContact CE1-CB 4.49Å; F24-N276 HydrophobicContact CZ-CB 4.39Å; I273-N276 CarbonylContact O-C 3Å; I273-N276 PolarHBondContact O-N 3.15Å; N276-E278 PolarHBondContact O-N 3.09Å; N276-Q279 HydrophobicContact CB-CB 4.46Å; N276-Q279 WeakPolarHBondContact O-CB 3.32Å; N276-Q279 VanDerWaalsContact O-CD 3.3Å; N276-Q279 WeakPolarHBondContact O-CG 3.4Å; N276-Q279 PolarHBondContact O-N 3.39Å; N276-Q279 PolarHBondContact O-NE2 2.92Å
277	P	90.6	Very high	88.8	Confident	76 Å²	76	52.2 Å²	52.2	49%	0.494	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-21.7	-171	26.5	-34.9	0	0	0	113.4	I273 Q279	I273-P277 WeakPolarHBondContact O-CA 3.48Å; P277-Q279 VanDerWaalsContact C-N 3.29Å; P277-Q279 PolarHBondContact O-N 3.36Å
278	E	93.5	Very high	89.4	Confident	122 Å²	122	54.4 Å²	54.4	57%	0.57	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-2	-180	-60.1	-175.3	159.4	0	0	113.5	F24 N276 V280 H319	F24-E278 HydrophobicContact CD1-CB 4.46Å; N276-E278 PolarHBondContact O-N 3.09Å; E278-V280 PolarHBondContact O-N 3.28Å; E278-H319 VanDerWaalsContact CA-CD2 3.44Å; E278-H319 WeakPolarHBondContact CA-CD2 3.26Å; E278-H319 PolarHBondContact O-CD2 3.37Å
279	Q	95.1	Very high	90.2	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.009	26%	0.26	C	S	.	.			trans	-60.8	132.3	177.8	70.9	-171.7	-70.3	0	0	110.6	L22 F24 N276 P277 M317 H319	L22-Q279 HydrophobicContact CB-CB 4.46Å; F24-Q279 HydrophobicContact CE1-CB 4.09Å; F24-Q279 HydrophobicContact CZ-CB 4.49Å; N276-Q279 HydrophobicContact CB-CB 4.46Å; N276-Q279 WeakPolarHBondContact O-CB 3.32Å; N276-Q279 VanDerWaalsContact O-CD 3.3Å; N276-Q279 WeakPolarHBondContact O-CG 3.4Å; N276-Q279 PolarHBondContact O-N 3.39Å; N276-Q279 PolarHBondContact O-NE2 2.92Å; P277-Q279 VanDerWaalsContact C-N 3.29Å; P277-Q279 PolarHBondContact O-N 3.36Å; Q279-M317 HydrophobicContact CG-CB 4.44Å; Q279-M317 HydrophobicContact CG-CE 4.47Å; Q279-M317 HydrophobicContact CG-CG 4.09Å; Q279-M317 WeakPolarHBondContact O-CB 3.42Å; Q279-H319 WeakPolarHBondContact O-CB 3.33Å
280	V	97.1	Very high	90.7	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.			trans	-107.8	-20.2	178.5	-64	0	0	0	0	113.1	G23 I25 E278 M317 H319 L320 Y323	G23-V280 VanDerWaalsContact O-CG2 3.26Å; G23-V280 WeakPolarHBondContact O-CG2 3.41Å; G23-V280 PolarHBondContact O-N 3.48Å; I25-V280 HydrophobicContact CD1-CG2 4Å; I25-V280 HydrophobicContact CG1-CB 4.3Å; I25-V280 HydrophobicContact CG1-CG1 3.75Å; I25-V280 HydrophobicContact CG1-CG2 3.79Å; E278-V280 PolarHBondContact O-N 3.28Å; V280-M317 PolarHBondContact O-N 3.09Å; V280-H319 HydrophobicContact CG1-CB 4.37Å; V280-L320 HydrophobicContact CB-CB 4.01Å; V280-L320 HydrophobicContact CB-CD1 3.79Å; V280-L320 HydrophobicContact CB-CG 4.45Å; V280-L320 HydrophobicContact CG1-CB 4.04Å; V280-L320 HydrophobicContact CG1-CD1 3.9Å; V280-L320 HydrophobicContact CG2-CD1 4.24Å; V280-Y323 HydrophobicContact CG1-CD2 4.46Å; V280-Y323 HydrophobicContact CG1-CE2 4.25Å
281	I	97.7	Very high	91	Very high	1 Å²	1	48 Å²	48	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.3	177.9	-65.3	-71.1	0	0	0	109.1	L22 G23 L73 I75 I207 F314 Q315 I316	L22-I281 CarbonylContact C-O 3.17Å; L22-I281 WeakPolarHBondContact CA-O 3.24Å; G23-I281 PolarHBondContact N-O 3.23Å; G23-I281 PolarHBondContact O-N 3.1Å; L73-I281 HydrophobicContact CD2-CD1 3.86Å; I75-I281 HydrophobicContact CD1-CG1 4.41Å; I207-I281 HydrophobicContact CG2-CG1 4.45Å; I281-F314 HydrophobicContact CD1-CD2 3.87Å; I281-F314 HydrophobicContact CD1-CE2 3.94Å; I281-F314 HydrophobicContact CG2-CB 4.39Å; I281-F314 HydrophobicContact CG2-CD2 4.19Å; I281-Q315 WeakPolarHBondContact CA-O 3.49Å; I281-I316 HydrophobicContact CD1-CB 4.35Å; I281-I316 HydrophobicContact CD1-CG1 3.89Å; I281-I316 HydrophobicContact CD1-CG2 4.49Å
282	R	96.6	Very high	90.9	Very high	14 Å²	14	46 Å²	46	5%	0.053	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	113.6	161	-56	174.3	63.4	82.4	2.9	108.5	V20 E21 L22 E212 F314 Q315 M317	V20-R282 HydrophobicContact CG1-CB 4.13Å; E21-R282 CarbonylContact O-C 3.5Å; E21-R282 WeakPolarHBondContact O-CA 3.22Å; L22-R282 HydrophobicContact CD2-CB 4.46Å; L22-R282 HydrophobicContact CD2-CG 3.87Å; L22-R282 VanDerWaalsContact CD2-NH1 3.26Å; E212-R282 IonicContact OE1-CZ 2.65Å; E212-R282 VanDerWaalsContact OE1-CZ 3.23Å; E212-R282 IonicContact OE1-NH1 3.89Å; E212-R282 PolarHBondContact OE1-NH1 3.2Å; E212-R282 IonicContact OE1-NH2 3.32Å; E212-R282 PolarHBondContact OE1-NH2 2.62Å; E212-R282 IonicContact OE2-CZ 2.71Å; E212-R282 IonicContact OE2-NH1 3.52Å; E212-R282 IonicContact OE2-NH2 3.31Å; E212-R282 PolarHBondContact OE2-NH2 2.85Å; R282-F314 CarbonylContact O-C 3.4Å; R282-F314 WeakPolarHBondContact O-CA 3.33Å; R282-F314 WeakPolarHBondContact O-CB 3.32Å; R282-Q315 HydrophobicContact CB-CG 3.71Å; R282-Q315 HydrophobicContact CG-CG 4.25Å; R282-Q315 PolarHBondContact N-O 3.49Å; R282-Q315 PolarHBondContact O-N 3.27Å; R282-M317 VanDerWaalsContact CD-SD 3.6Å; R282-M317 HydrophobicContact CG-CG 4.01Å; R282-M317 HydrophobicContact CG-SD 3.81Å
283	Y	97.2	Very high	90.6	Very high	37 Å²	37	44.7 Å²	44.7	15%	0.145	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.5	-176.9	-175.1	-84.7	0	0	0	110.2	E21 I75 A77 E313 F314	E21-Y283 PolarHBondContact N-O 3.07Å; E21-Y283 PolarHBondContact O-N 3.45Å; I75-Y283 HydrophobicContact CG2-CD2 4.2Å; I75-Y283 HydrophobicContact CG2-CE2 4.24Å; A77-Y283 HydrophobicContact CB-CE2 3.88Å; A77-Y283 WeakPolarHBondContact CB-OH 3.35Å; Y283-E313 HydrophobicContact CE2-CG 3.8Å; Y283-E313 PolarHBondContact OH-OE1 3.35Å; Y283-F314 HydrophobicContact CD2-CB 3.76Å; Y283-F314 HydrophobicContact CD2-CD1 4.4Å; Y283-F314 HydrophobicContact CD2-CG 4.36Å; Y283-F314 HydrophobicContact CG-CB 4.33Å
284	Q	95.1	Very high	89.7	Confident	43 Å²	43	49 Å²	49	20%	0.201	25%	0.253	C	S	.	.			trans	-161.9	93.1	173.7	-168.2	-173.9	33.5	0	0	109.6	K18 V20 G286 G287 F312 E313	K18-Q284 PolarHBondContact O-NE2 3.42Å; V20-Q284 HydrophobicContact CG2-CB 4.26Å; V20-Q284 HydrophobicContact CG2-CG 4.31Å; Q284-G286 PolarHBondContact O-N 2.98Å; Q284-G287 WeakPolarHBondContact O-CA 3.24Å; Q284-G287 PolarHBondContact O-N 2.89Å; Q284-F312 HydrophobicContact CB-CE1 4.39Å; Q284-F312 VanDerWaalsContact O-CD1 3.31Å; Q284-F312 WeakPolarHBondContact O-CD1 3.37Å; Q284-E313 CarbonylContact C-O 3.58Å; Q284-E313 PolarHBondContact N-O 3.34Å
285	R	94.8	Very high	88.6	Confident	65 Å²	65	44.7 Å²	44.7	25%	0.245	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	126.7	179.6	-166.9	174.5	178.9	-133.1	0.1	112.4	D79 G287 E313 S345 S347	D79-R285 IonicContact OD1-NH1 2.66Å; D79-R285 IonicContact OD2-CZ 3.33Å; D79-R285 VanDerWaalsContact OD2-CZ 3.31Å; D79-R285 IonicContact OD2-NH1 3.54Å; D79-R285 PolarHBondContact OD2-NH1 3.29Å; D79-R285 IonicContact OD2-NH2 3.52Å; D79-R285 PolarHBondContact OD2-NH2 2.93Å; D79-R285 VanDerWaalsContact OD2-NH2 3.11Å; R285-G287 PolarHBondContact O-N 2.89Å; R285-E313 HydrophobicContact CB-CG 4.12Å; R285-E313 WeakPolarHBondContact CD-OE1 3.44Å; R285-E313 HydrophobicContact CG-CG 4.03Å; R285-E313 PolarHBondContact N-O 3.14Å; R285-E313 IonicContact NE-OE1 2.74Å; R285-S345 PolarHBondContact NH2-O 2.79Å; R285-S347 PolarHBondContact NH2-OG 2.95Å
286	G	93.5	Very high	87	Confident	47 Å²	47	48.6 Å²	48.6	49%	0.485	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	7.7	-172.6	0	0	0	0	0	114	Q284 F312	Q284-G286 PolarHBondContact O-N 2.98Å; G286-F312 PolarHBondContact N-O 3.27Å
287	G	91.7	Very high	85.2	Confident	10 Å²	10	52.7 Å²	52.7	10%	0.103	29%	0.288	C	S	.	.			trans	-78.6	-162.1	177	0	0	0	0	0	113.4	Q284 R285	Q284-G287 WeakPolarHBondContact O-CA 3.24Å; Q284-G287 PolarHBondContact O-N 2.89Å; R285-G287 PolarHBondContact O-N 2.89Å
288	Q	89.6	Confident	84.3	Confident	155 Å²	155	51.7 Å²	51.7	72%	0.724	28%	0.276	S	S	*	.			trans	-120.8	138.8	174.8	-66.5	-62.4	-45.1	0	0	110
289	P	90.6	Very high	83.8	Confident	23 Å²	23	52 Å²	52	15%	0.149	29%	0.286	C	S	.	.			trans	-67.8	145.3	175.6	29.6	-34.6	0	0	0	111	L291 F312 Q315 C340	P289-L291 HydrophobicContact CB-CD2 3.86Å; P289-L291 HydrophobicContact CB-CG 4.31Å; P289-L291 HydrophobicContact CG-CD1 4.46Å; P289-L291 HydrophobicContact CG-CD2 3.94Å; P289-L291 HydrophobicContact CG-CG 4.13Å; P289-L291 PolarHBondContact O-N 2.96Å; P289-F312 HydrophobicContact CB-CD2 4.06Å; P289-F312 HydrophobicContact CB-CE2 3.76Å; P289-F312 HydrophobicContact CB-CZ 4.21Å; P289-F312 HydrophobicContact CG-CD2 4.44Å; P289-Q315 VanDerWaalsContact CA-OE1 3.24Å; P289-C340 VanDerWaalsContact CB-SG 3.58Å
290	L	88.5	Confident	83.7	Confident	20 Å²	20	54 Å²	54	11%	0.105	30%	0.297	C	S	.	.			trans	-86	103.3	168	179.9	69.6	0	0	0	108.1	F269 R272 I273 Q315	F269-L290 HydrophobicContact CD2-CD1 4.49Å; F269-L290 HydrophobicContact CD2-CD2 4.22Å; F269-L290 HydrophobicContact CD2-CG 3.77Å; F269-L290 HydrophobicContact CE2-CG 4.35Å; F269-L290 WeakPolarHBondContact CE2-O 3.38Å; R272-L290 HydrophobicContact CB-CD1 4.21Å; R272-L290 HydrophobicContact CB-CD2 3.87Å; R272-L290 HydrophobicContact CG-CD1 4.26Å; R272-L290 HydrophobicContact CG-CD2 3.69Å; I273-L290 HydrophobicContact CD1-CD2 4.46Å; I273-L290 HydrophobicContact CG1-CD2 4Å; L290-Q315 PolarHBondContact O-NE2 2.96Å
291	L	86.5	Confident	83.5	Confident	49 Å²	49	56.6 Å²	56.6	26%	0.257	31%	0.313	S	S	.	.			trans	-96.4	143.9	-174.9	-58.6	-179.1	0	0	0	111.8	F269 P289 T338 W361	F269-L291 WeakPolarHBondContact CB-O 3.5Å; F269-L291 WeakPolarHBondContact CD2-O 3.42Å; P289-L291 HydrophobicContact CB-CD2 3.86Å; P289-L291 HydrophobicContact CB-CG 4.31Å; P289-L291 HydrophobicContact CG-CD1 4.46Å; P289-L291 HydrophobicContact CG-CD2 3.94Å; P289-L291 HydrophobicContact CG-CG 4.13Å; P289-L291 PolarHBondContact O-N 2.96Å; L291-T338 HydrophobicContact CD2-CG2 4.38Å; L291-W361 HydrophobicContact CD2-CH2 4.08Å; L291-W361 HydrophobicContact CD2-CZ3 3.63Å
292	A	79.3	Confident	83.5	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.008	33%	0.331	C	S	.	.	S	Bend	trans	-78.8	-24.6	179.2	0	0	0	0	0	113.2	F266 F269 A337	F266-A292 WeakPolarHBondContact CA-O 3.44Å; F266-A292 WeakPolarHBondContact CB-O 3.45Å; F266-A292 HydrophobicContact CD2-CB 4.41Å; F266-A292 WeakPolarHBondContact CD2-O 3.39Å; F269-A292 HydrophobicContact CD1-CB 4.02Å; F269-A292 HydrophobicContact CD2-CB 4.02Å; F269-A292 HydrophobicContact CE1-CB 3.94Å; F269-A292 HydrophobicContact CE2-CB 3.96Å; F269-A292 HydrophobicContact CG-CB 4.06Å; F269-A292 HydrophobicContact CZ-CB 3.91Å; A292-A337 HydrophobicContact CB-CB 4.01Å
293	S	75.2	Confident	83.5	Confident	19 Å²	19	58.4 Å²	58.4	13%	0.133	33%	0.331	C	S	.	.	S	Bend	trans	-148	163.2	179.5	59.6	0	0	0	0	110.6	T295 Q363	S293-T295 PolarHBondContact O-N 2.9Å; S293-Q363 PolarHBondContact O-NE2 3.44Å; S293-Q363 PolarHBondContact OG-NE2 3.05Å
294	Q	67.1	Low	83.4	Confident	119 Å²	119	64.1 Å²	64.1	56%	0.556	36%	0.359	S	S	*	.			trans	-66.7	101.7	164.7	-64.5	-161.6	11.7	0	0	108.7	E261 D265	E261-Q294 PolarHBondContact OE2-NE2 2.61Å; D265-Q294 WeakPolarHBondContact OD2-CG 3.49Å; D265-Q294 PolarHBondContact OD2-NE2 3.24Å; D265-Q294 VanDerWaalsContact OD2-NE2 3.14Å
295	T	63.2	Low	83.5	Confident	39 Å²	39	66.1 Å²	66.1	24%	0.239	37%	0.368	C	S	.	.			trans	-89.7	141.2	167.9	32.4	0	0	0	0	110	S293 W361 Q363	S293-T295 PolarHBondContact O-N 2.9Å; T295-W361 HydrophobicContact CG2-CH2 3.88Å; T295-W361 HydrophobicContact CG2-CZ2 3.81Å; T295-W361 VanDerWaalsContact OG1-CH2 3.24Å; T295-W361 WeakPolarHBondContact OG1-CH2 3.46Å; T295-Q363 HydrophobicContact CG2-CG 4.01Å; T295-Q363 VanDerWaalsContact CG2-NE2 3.31Å; T295-Q363 PolarHBondContact OG1-NE2 2.63Å
296	N	53.6	Low	83.6	Confident	135 Å²	135	66 Å²	66	72%	0.722	38%	0.376	S	S	*	.			trans	-46.8	143.6	171.4	-80.8	-21.4	0	0	0	110.8	F298	N296-F298 PolarHBondContact O-N 3.27Å
297	P	53.7	Low	83.7	Confident	130 Å²	130	66.3 Å²	66.3	84%	0.844	38%	0.38	S	S	*	.			trans	-59.3	114	173.2	23.6	-30.9	0	0	0	108.9
298	F	70.5	Confident	84	Confident	54 Å²	54	67 Å²	67	24%	0.237	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-93.1	138	169.2	56.5	-78	0	0	0	108.2	N296 I300 Y342 Y359 W361	N296-F298 PolarHBondContact O-N 3.27Å; F298-I300 HydrophobicContact CD2-CD1 3.49Å; F298-I300 VanDerWaalsContact CD2-CD1 3.49Å; F298-I300 HydrophobicContact CE2-CD1 3.07Å; F298-I300 HydrophobicContact CE2-CG1 4.39Å; F298-I300 HydrophobicContact CZ-CD1 3.98Å; F298-I300 PolarHBondContact O-N 2.81Å; F298-Y342 AromaticContact CE2-CE2 3.95Å; F298-Y342 HydrophobicContact CE2-CE2 3.95Å; F298-Y342 HydrophobicContact CZ-CE2 4.05Å; F298-Y342 AromaticContact CZ-CZ 3.99Å; F298-Y342 WeakPolarHBondContact CZ-OH 3.34Å; F298-Y359 HydrophobicContact CD2-CE1 4.14Å; F298-Y359 HydrophobicContact CE2-CE1 4.09Å; F298-W361 AromaticContact CD1-CD1 4Å; F298-W361 HydrophobicContact CD1-CD2 4.01Å; F298-W361 AromaticContact CD1-CE2 3.45Å; F298-W361 VanDerWaalsContact CD1-CE2 3.45Å; F298-W361 HydrophobicContact CD1-CG 4.31Å; F298-W361 HydrophobicContact CD1-CH2 4.46Å; F298-W361 AromaticContact CD1-CZ2 3.72Å; F298-W361 HydrophobicContact CD1-CZ2 3.72Å; F298-W361 AromaticContact CD1-NE1 3.47Å; F298-W361 HydrophobicContact CD2-CB 4.22Å; F298-W361 AromaticContact CD2-CD1 3.46Å; F298-W361 VanDerWaalsContact CD2-CD1 3.46Å; F298-W361 HydrophobicContact CD2-CD2 4.24Å; F298-W361 AromaticContact CD2-CG 3.73Å; F298-W361 HydrophobicContact CD2-CG 3.73Å; F298-W361 AromaticContact CD2-NE1 3.82Å; F298-W361 AromaticContact CE1-CD2 3.39Å; F298-W361 HydrophobicContact CE1-CD2 3.39Å; F298-W361 AromaticContact CE1-CE2 3.22Å; F298-W361 AromaticContact CE1-CE3 3.74Å; F298-W361 HydrophobicContact CE1-CE3 3.74Å; F298-W361 AromaticContact CE1-CG 3.94Å; F298-W361 HydrophobicContact CE1-CG 3.94Å; F298-W361 AromaticContact CE1-CH2 3.76Å; F298-W361 HydrophobicContact CE1-CH2 3.76Å; F298-W361 AromaticContact CE1-CZ2 3.43Å; F298-W361 HydrophobicContact CE1-CZ2 3.43Å; F298-W361 VanDerWaalsContact CE1-CZ2 3.43Å; F298-W361 AromaticContact CE1-CZ3 3.91Å; F298-W361 HydrophobicContact CE1-CZ3 3.91Å; F298-W361 AromaticContact CE1-NE1 3.69Å; F298-W361 HydrophobicContact CE2-CB 3.5Å; F298-W361 VanDerWaalsContact CE2-CB 3.5Å; F298-W361 AromaticContact CE2-CD1 3.49Å; F298-W361 VanDerWaalsContact CE2-CD1 3.49Å; F298-W361 AromaticContact CE2-CD2 3.59Å; F298-W361 HydrophobicContact CE2-CD2 3.59Å; F298-W361 HydrophobicContact CE2-CE3 4.24Å; F298-W361 AromaticContact CE2-CG 3.22Å; F298-W361 HydrophobicContact CE2-CG 3.22Å; F298-W361 AromaticContact CE2-NE1 3.96Å; F298-W361 AromaticContact CG-CD1 3.72Å; F298-W361 HydrophobicContact CG-CD2 4.42Å; F298-W361 HydrophobicContact CG-CG 4.24Å; F298-W361 AromaticContact CG-NE1 3.57Å; F298-W361 HydrophobicContact CZ-CB 3.92Å; F298-W361 AromaticContact CZ-CD1 3.84Å; F298-W361 AromaticContact CZ-CD2 3.15Å; F298-W361 HydrophobicContact CZ-CD2 3.15Å; F298-W361 AromaticContact CZ-CE2 3.55Å; F298-W361 AromaticContact CZ-CE3 3.45Å; F298-W361 HydrophobicContact CZ-CE3 3.45Å; F298-W361 VanDerWaalsContact CZ-CE3 3.45Å; F298-W361 AromaticContact CZ-CG 3.38Å; F298-W361 HydrophobicContact CZ-CG 3.38Å; F298-W361 HydrophobicContact CZ-CH2 4.33Å; F298-W361 HydrophobicContact CZ-CZ2 4.13Å; F298-W361 HydrophobicContact CZ-CZ3 4.03Å; F298-W361 AromaticContact CZ-NE1 3.93Å
299	T	84.4	Confident	84.4	Confident	129 Å²	129	66 Å²	66	79%	0.791	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-77.3	116.6	178	-53.7	0	0	0	0	109	P301	T299-P301 VanDerWaalsContact O-CD 3.29Å; T299-P301 WeakPolarHBondContact O-CD 3.34Å
300	I	90.9	Very high	84.6	Confident	45 Å²	45	65.7 Å²	65.7	23%	0.231	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-71.9	117.2	170.9	-50.5	-61.6	0	0	0	108.2	F298 R310 Y342 Y359	F298-I300 HydrophobicContact CD2-CD1 3.49Å; F298-I300 VanDerWaalsContact CD2-CD1 3.49Å; F298-I300 HydrophobicContact CE2-CD1 3.07Å; F298-I300 HydrophobicContact CE2-CG1 4.39Å; F298-I300 HydrophobicContact CZ-CD1 3.98Å; F298-I300 PolarHBondContact O-N 2.81Å; I300-R310 HydrophobicContact CG2-CB 3.73Å; I300-Y342 HydrophobicContact CD1-CD1 3.8Å; I300-Y342 HydrophobicContact CD1-CD2 3.87Å; I300-Y342 HydrophobicContact CD1-CE1 3.71Å; I300-Y342 HydrophobicContact CD1-CE2 3.77Å; I300-Y342 HydrophobicContact CD1-CG 3.9Å; I300-Y342 HydrophobicContact CG1-CD1 4.03Å; I300-Y342 HydrophobicContact CG1-CE1 4.06Å; I300-Y342 HydrophobicContact CG1-CG 4.47Å; I300-Y342 HydrophobicContact CG2-CD1 4.22Å; I300-Y342 HydrophobicContact CG2-CG 4.17Å; I300-Y359 HydrophobicContact CD1-CD1 3.97Å; I300-Y359 HydrophobicContact CD1-CE1 3.77Å; I300-Y359 HydrophobicContact CG2-CD1 4.04Å
301	P	93.9	Very high	85	Confident	53 Å²	53	67.4 Å²	67.4	34%	0.344	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-65.2	144.3	175.6	24.8	-30.4	0	0	0	110.5	T299 R310 Y359	T299-P301 VanDerWaalsContact O-CD 3.29Å; T299-P301 WeakPolarHBondContact O-CD 3.34Å; P301-R310 WeakPolarHBondContact O-CD 3.36Å; P301-R310 PolarHBondContact O-NH1 3.17Å; P301-Y359 HydrophobicContact CG-CD2 3.54Å; P301-Y359 HydrophobicContact CG-CE2 3.8Å; P301-Y359 HydrophobicContact CG-CG 4.03Å
302	A	97	Very high	85.4	Confident	47 Å²	47	65.7 Å²	65.7	39%	0.388	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-66.3	163.4	173.6	0	0	0	0	0	112	E304 R310	A302-E304 PolarHBondContact O-N 3.15Å; A302-R310 PolarHBondContact O-NH1 3.35Å
303	C	97.4	Very high	86.3	Confident	6 Å²	6	65.6 Å²	65.6	4%	0.041	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-56.4	121.4	175.3	-174	0	0	0	0	110.8	E305 C306 G307 A308 C344	C303-E305 PolarHBondContact O-N 2.82Å; C303-E305 VanDerWaalsContact O-N 3.14Å; C303-C306 VanDerWaalsContact SG-SG 3.6Å; C303-G307 VanDerWaalsContact O-CA 3.3Å; C303-G307 WeakPolarHBondContact O-CA 3.43Å; C303-G307 PolarHBondContact O-N 3.39Å; C303-A308 VanDerWaalsContact CB-O 3.28Å; C303-A308 WeakPolarHBondContact CB-O 3.38Å; C303-A308 PolarHBondContact N-O 2.69Å; C303-C344 HydrophobicContact CB-CB 3.65Å; C303-C344 VanDerWaalsContact SG-CB 3.57Å; C303-C344 VanDerWaalsContact SG-SG 3.68Å
304	E	95.4	Very high	87.3	Confident	157 Å²	157	64.7 Å²	64.7	73%	0.734	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.6	179.9	-67.1	172.9	-154.2	0	0	113.1	A302	A302-E304 PolarHBondContact O-N 3.15Å
305	E	96.1	Very high	88.7	Confident	86 Å²	86	59.1 Å²	59.1	40%	0.402	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-43.6	-177.4	-170.4	70.2	167.3	0	0	113.7	C303 R354 L356	C303-E305 PolarHBondContact O-N 2.82Å; C303-E305 VanDerWaalsContact O-N 3.14Å; E305-R354 IonicContact OE1-CZ 2.84Å; E305-R354 IonicContact OE1-NH2 3.23Å; E305-R354 PolarHBondContact OE1-NH2 2.68Å; E305-R354 IonicContact OE2-CZ 3.44Å; E305-R354 IonicContact OE2-NH2 2.89Å; E305-R354 PolarHBondContact OE2-NH2 2.87Å; E305-L356 HydrophobicContact CB-CD1 3.89Å; E305-L356 HydrophobicContact CG-CD1 3.96Å; E305-L356 HydrophobicContact CG-CD2 4.46Å
306	C	96.6	Very high	90.3	Very high	61 Å²	61	57.3 Å²	57.3	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-5.2	-171.9	67.7	0	0	0	0	114.1	C303 A308 C348	C303-C306 VanDerWaalsContact SG-SG 3.6Å; C306-A308 PolarHBondContact O-N 3.49Å; C306-A308 VanDerWaalsContact SG-CB 3.53Å; C306-C348 HydrophobicContact CB-CB 3.77Å; C306-C348 VanDerWaalsContact SG-CB 3.6Å; C306-C348 VanDerWaalsContact SG-SG 3.67Å
307	G	97.4	Very high	92.2	Very high	55 Å²	55	51 Å²	51	57%	0.567	30%	0.297	S	S	*	.			trans	74.6	-3.7	-177.4	0	0	0	0	0	115.5	C303	C303-G307 VanDerWaalsContact O-CA 3.3Å; C303-G307 WeakPolarHBondContact O-CA 3.43Å; C303-G307 PolarHBondContact O-N 3.39Å
308	A	97.5	Very high	93.9	Very high	24 Å²	24	45.7 Å²	45.7	20%	0.198	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-64.7	147.3	176.5	0	0	0	0	0	111.6	C303 C306 A346	C303-A308 VanDerWaalsContact CB-O 3.28Å; C303-A308 WeakPolarHBondContact CB-O 3.38Å; C303-A308 PolarHBondContact N-O 2.69Å; C306-A308 PolarHBondContact O-N 3.49Å; C306-A308 VanDerWaalsContact SG-CB 3.53Å; A308-A346 HydrophobicContact CB-CB 3.86Å
309	E	97	Very high	94.9	Very high	135 Å²	135	45.6 Å²	45.6	63%	0.631	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-60.4	153.8	174.7	67.9	-176.2	160.5	0	0	111.6	S345	E309-S345 VanDerWaalsContact O-CB 3.25Å; E309-S345 WeakPolarHBondContact O-CB 3.14Å; E309-S345 PolarHBondContact O-N 3.07Å; E309-S345 PolarHBondContact O-OG 2.8Å
310	R	96.5	Very high	95.4	Very high	16 Å²	16	39.4 Å²	39.4	6%	0.06	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	137.2	172.8	-64.7	-175	170.5	107.4	-6.7	110.1	I300 P301 A302 T343 K357 E358	I300-R310 HydrophobicContact CG2-CB 3.73Å; P301-R310 WeakPolarHBondContact O-CD 3.36Å; P301-R310 PolarHBondContact O-NH1 3.17Å; A302-R310 PolarHBondContact O-NH1 3.35Å; R310-T343 CarbonylContact C-O 3.47Å; R310-T343 WeakPolarHBondContact CA-O 3.34Å; R310-T343 WeakPolarHBondContact CB-O 3.4Å; R310-K357 PolarHBondContact NH2-O 3.25Å; R310-E358 IonicContact NE-OE2 3.15Å; R310-E358 PolarHBondContact NE-OE2 3.48Å
311	L	95.6	Very high	95.3	Very high	55 Å²	55	39.2 Å²	39.2	29%	0.288	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	149.3	175.9	-59.1	175.1	0	0	0	109.6	E313 Y342 T343	L311-E313 PolarHBondContact O-N 3.46Å; L311-Y342 CarbonylContact O-C 3.45Å; L311-Y342 WeakPolarHBondContact O-CA 3.13Å; L311-T343 PolarHBondContact N-O 3.43Å; L311-T343 PolarHBondContact O-N 2.88Å
312	F	95.5	Very high	95.2	Very high	13 Å²	13	41.2 Å²	41.2	6%	0.057	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	135.7	163.2	173.4	-102.9	0	0	0	109.5	Q284 G286 P289 F314 Q315 C340 Y342	Q284-F312 HydrophobicContact CB-CE1 4.39Å; Q284-F312 VanDerWaalsContact O-CD1 3.31Å; Q284-F312 WeakPolarHBondContact O-CD1 3.37Å; G286-F312 PolarHBondContact N-O 3.27Å; P289-F312 HydrophobicContact CB-CD2 4.06Å; P289-F312 HydrophobicContact CB-CE2 3.76Å; P289-F312 HydrophobicContact CB-CZ 4.21Å; P289-F312 HydrophobicContact CG-CD2 4.44Å; F312-F314 VanDerWaalsContact CE2-C 3.48Å; F312-F314 WeakPolarHBondContact CE2-O 3.5Å; F312-Q315 HydrophobicContact CE2-CB 4.07Å; F312-Q315 HydrophobicContact CZ-CB 4.14Å; F312-Q315 HydrophobicContact CZ-CG 4.23Å; F312-C340 HydrophobicContact CD2-CB 4.34Å; F312-C340 HydrophobicContact CE2-CB 4.2Å; F312-Y342 HydrophobicContact CB-CD1 4.1Å; F312-Y342 HydrophobicContact CB-CE1 3.81Å; F312-Y342 HydrophobicContact CD2-CE1 4.41Å
313	E	97	Very high	94.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-50.6	177.7	-169.3	159.1	-161	0	0	113.5	R88 L90 Y283 Q284 R285 L311 I341 T343	R88-E313 IonicContact CZ-OE1 2.68Å; R88-E313 VanDerWaalsContact CZ-OE1 3.32Å; R88-E313 IonicContact CZ-OE2 3.85Å; R88-E313 IonicContact NH1-OE1 3.25Å; R88-E313 PolarHBondContact NH1-OE1 2.86Å; R88-E313 IonicContact NH1-OE2 2.82Å; R88-E313 PolarHBondContact NH1-OE2 3.44Å; R88-E313 IonicContact NH2-OE1 3.24Å; R88-E313 PolarHBondContact NH2-OE1 2.84Å; R88-E313 IonicContact NH2-OE2 3.86Å; R88-E313 PolarHBondContact NH2-OE2 3.12Å; L90-E313 VanDerWaalsContact CD1-CD 3.46Å; L90-E313 HydrophobicContact CD1-CG 4.2Å; L90-E313 WeakPolarHBondContact CD1-OE2 3.27Å; Y283-E313 HydrophobicContact CE2-CG 3.8Å; Y283-E313 PolarHBondContact OH-OE1 3.35Å; Q284-E313 CarbonylContact C-O 3.58Å; Q284-E313 PolarHBondContact N-O 3.34Å; R285-E313 HydrophobicContact CB-CG 4.12Å; R285-E313 WeakPolarHBondContact CD-OE1 3.44Å; R285-E313 HydrophobicContact CG-CG 4.03Å; R285-E313 PolarHBondContact N-O 3.14Å; R285-E313 IonicContact NE-OE1 2.74Å; L311-E313 PolarHBondContact O-N 3.46Å; E313-I341 PolarHBondContact N-O 3.03Å; E313-T343 HydrophobicContact CB-CG2 4.26Å; E313-T343 WeakPolarHBondContact OE2-CB 3.27Å; E313-T343 WeakPolarHBondContact OE2-CG2 3.44Å; E313-T343 PolarHBondContact OE2-OG1 3.18Å
314	F	97.8	Very high	94.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	165.4	175	70.1	-85.6	0	0	0	110.8	L73 I75 L90 V92 I281 R282 Y283 F312 I316 I341	L73-F314 HydrophobicContact CD1-CE2 4.25Å; L73-F314 HydrophobicContact CD1-CZ 4.32Å; I75-F314 HydrophobicContact CG1-CE1 4.46Å; I75-F314 HydrophobicContact CG1-CE2 4.29Å; I75-F314 HydrophobicContact CG1-CZ 4.13Å; L90-F314 HydrophobicContact CB-CE1 4.25Å; L90-F314 HydrophobicContact CD1-CD1 4.04Å; L90-F314 HydrophobicContact CD1-CE1 3.58Å; V92-F314 HydrophobicContact CG2-CE2 4.48Å; V92-F314 HydrophobicContact CG2-CZ 3.9Å; I281-F314 HydrophobicContact CD1-CD2 3.87Å; I281-F314 HydrophobicContact CD1-CE2 3.94Å; I281-F314 HydrophobicContact CG2-CB 4.39Å; I281-F314 HydrophobicContact CG2-CD2 4.19Å; R282-F314 CarbonylContact O-C 3.4Å; R282-F314 WeakPolarHBondContact O-CA 3.33Å; R282-F314 WeakPolarHBondContact O-CB 3.32Å; Y283-F314 HydrophobicContact CD2-CB 3.76Å; Y283-F314 HydrophobicContact CD2-CD1 4.4Å; Y283-F314 HydrophobicContact CD2-CG 4.36Å; Y283-F314 HydrophobicContact CG-CB 4.33Å; F312-F314 VanDerWaalsContact CE2-C 3.48Å; F312-F314 WeakPolarHBondContact CE2-O 3.5Å; F314-I316 HydrophobicContact CD2-CG1 4.37Å; F314-I316 HydrophobicContact CE2-CD1 4.42Å; F314-I316 HydrophobicContact CE2-CG1 3.9Å; F314-I341 HydrophobicContact CD1-CB 3.96Å; F314-I341 HydrophobicContact CD1-CG1 4.31Å; F314-I341 HydrophobicContact CD1-CG2 4.28Å; F314-I341 HydrophobicContact CD2-CG1 4.11Å; F314-I341 HydrophobicContact CE1-CB 3.71Å; F314-I341 HydrophobicContact CE1-CG1 3.8Å; F314-I341 HydrophobicContact CE1-CG2 3.72Å; F314-I341 HydrophobicContact CE2-CB 4.31Å; F314-I341 HydrophobicContact CE2-CG1 3.59Å; F314-I341 HydrophobicContact CG-CB 4.37Å; F314-I341 HydrophobicContact CG-CG1 4.46Å; F314-I341 HydrophobicContact CZ-CB 3.92Å; F314-I341 HydrophobicContact CZ-CG1 3.43Å; F314-I341 VanDerWaalsContact CZ-CG1 3.43Å; F314-I341 HydrophobicContact CZ-CG2 4.13Å; F314-I341 PolarHBondContact O-N 3.06Å
315	Q	95.6	Very high	93.9	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.4	170.9	60.8	-175.5	65.5	0	0	111.6	I281 R282 P289 L290 F312 M317 T338 V339	I281-Q315 WeakPolarHBondContact CA-O 3.49Å; R282-Q315 HydrophobicContact CB-CG 3.71Å; R282-Q315 HydrophobicContact CG-CG 4.25Å; R282-Q315 PolarHBondContact N-O 3.49Å; R282-Q315 PolarHBondContact O-N 3.27Å; P289-Q315 VanDerWaalsContact CA-OE1 3.24Å; L290-Q315 PolarHBondContact O-NE2 2.96Å; F312-Q315 HydrophobicContact CE2-CB 4.07Å; F312-Q315 HydrophobicContact CZ-CB 4.14Å; F312-Q315 HydrophobicContact CZ-CG 4.23Å; Q315-M317 HydrophobicContact CG-SD 3.78Å; Q315-M317 PolarHBondContact NE2-SD 3.12Å; Q315-T338 WeakPolarHBondContact CB-OG1 3.37Å; Q315-V339 CarbonylContact C-O 3.54Å; Q315-V339 VanDerWaalsContact CA-O 3.27Å; Q315-V339 WeakPolarHBondContact CA-O 3.03Å
316	I	96.2	Very high	92.9	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	129.4	173.1	-51.4	174.2	0	0	0	107.8	L72 L73 V92 I281 F314 L320 W336 T338 V339	L72-I316 HydrophobicContact CD2-CD1 3.77Å; L73-I316 HydrophobicContact CD2-CD1 4.02Å; L73-I316 HydrophobicContact CD2-CG1 4.22Å; L73-I316 HydrophobicContact CD2-CG2 4.44Å; V92-I316 HydrophobicContact CG1-CD1 3.99Å; V92-I316 HydrophobicContact CG2-CD1 4.41Å; I281-I316 HydrophobicContact CD1-CB 4.35Å; I281-I316 HydrophobicContact CD1-CG1 3.89Å; I281-I316 HydrophobicContact CD1-CG2 4.49Å; F314-I316 HydrophobicContact CD2-CG1 4.37Å; F314-I316 HydrophobicContact CE2-CD1 4.42Å; F314-I316 HydrophobicContact CE2-CG1 3.9Å; I316-L320 HydrophobicContact CG2-CB 4.34Å; I316-L320 HydrophobicContact CG2-CD2 3.54Å; I316-W336 HydrophobicContact CG2-CZ2 4.19Å; I316-T338 WeakPolarHBondContact O-CA 3.25Å; I316-T338 PolarHBondContact O-OG1 3.43Å; I316-T338 VanDerWaalsContact O-OG1 3.12Å; I316-V339 HydrophobicContact CB-CB 4.14Å; I316-V339 HydrophobicContact CD1-CB 4.3Å; I316-V339 HydrophobicContact CD1-CG1 4.42Å; I316-V339 HydrophobicContact CG1-CB 4.46Å; I316-V339 PolarHBondContact N-O 3.32Å; I316-V339 PolarHBondContact O-N 3.32Å; I316-V339 VanDerWaalsContact O-N 3.11Å
317	M	93.8	Very high	91	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	23%	0.234	C	C	.	.			trans	-96.9	153.5	-173.8	-56.6	-58.9	-65.3	0	0	111	I273 Q279 V280 R282 Q315 H319 L320 W336	I273-M317 HydrophobicContact CD1-CE 3.5Å; I273-M317 HydrophobicContact CG1-CE 3.83Å; Q279-M317 HydrophobicContact CG-CB 4.44Å; Q279-M317 HydrophobicContact CG-CE 4.47Å; Q279-M317 HydrophobicContact CG-CG 4.09Å; Q279-M317 WeakPolarHBondContact O-CB 3.42Å; V280-M317 PolarHBondContact O-N 3.09Å; R282-M317 VanDerWaalsContact CD-SD 3.6Å; R282-M317 HydrophobicContact CG-CG 4.01Å; R282-M317 HydrophobicContact CG-SD 3.81Å; Q315-M317 HydrophobicContact CG-SD 3.78Å; Q315-M317 PolarHBondContact NE2-SD 3.12Å; M317-H319 PolarHBondContact O-N 3.29Å; M317-L320 WeakPolarHBondContact O-CB 3.38Å; M317-L320 PolarHBondContact O-N 3.33Å; M317-W336 PolarHBondContact O-NE1 3.05Å
318	P	89.6	Confident	88.8	Confident	20 Å²	20	42.8 Å²	42.8	13%	0.13	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-60.1	-29.9	-177.5	-28	37.8	0	0	0	114.1	L320 L321 A337 Y365	P318-L320 PolarHBondContact O-N 3.08Å; P318-L321 WeakPolarHBondContact O-CB 3.21Å; P318-L321 VanDerWaalsContact O-CG 3.26Å; P318-L321 WeakPolarHBondContact O-CG 2.99Å; P318-L321 PolarHBondContact O-N 3.1Å; P318-A337 WeakPolarHBondContact CD-O 3.37Å; P318-A337 WeakPolarHBondContact CG-O 3.25Å; P318-Y365 WeakPolarHBondContact CB-OH 3.46Å; P318-Y365 HydrophobicContact CG-CE2 4.4Å; P318-Y365 WeakPolarHBondContact CG-OH 3.43Å
319	H	92.4	Very high	86.3	Confident	51 Å²	51	48.9 Å²	48.9	24%	0.236	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-59.6	-22.3	-179.7	-165.5	75.7	0	0	0	112.5	E278 Q279 V280 M317 L321 T322 Y323	E278-H319 VanDerWaalsContact CA-CD2 3.44Å; E278-H319 WeakPolarHBondContact CA-CD2 3.26Å; E278-H319 PolarHBondContact O-CD2 3.37Å; Q279-H319 WeakPolarHBondContact O-CB 3.33Å; V280-H319 HydrophobicContact CG1-CB 4.37Å; M317-H319 PolarHBondContact O-N 3.29Å; H319-L321 PolarHBondContact O-N 3.18Å; H319-T322 PolarHBondContact O-N 2.71Å; H319-T322 PolarHBondContact O-OG1 3.38Å; H319-Y323 AromaticContact CD2-CE2 3.71Å; H319-Y323 AromaticContact NE2-CE2 3.79Å
320	L	93.9	Very high	83.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-61.7	-26.3	175.2	-167.6	67.2	0	0	0	113.1	I25 F42 L72 L73 V280 I316 M317 P318 T322 Y323 M324	I25-L320 HydrophobicContact CD1-CD1 3.83Å; I25-L320 HydrophobicContact CG1-CD1 4.08Å; F42-L320 HydrophobicContact CB-CD1 4.4Å; F42-L320 HydrophobicContact CD2-CD1 3.54Å; F42-L320 HydrophobicContact CD2-CD2 3.95Å; F42-L320 HydrophobicContact CD2-CG 3.94Å; F42-L320 HydrophobicContact CE2-CD1 3.89Å; F42-L320 HydrophobicContact CE2-CD2 4.14Å; F42-L320 HydrophobicContact CE2-CG 3.91Å; F42-L320 HydrophobicContact CG-CD1 3.98Å; L72-L320 HydrophobicContact CD1-CD2 4.03Å; L72-L320 HydrophobicContact CD2-CD2 4.29Å; L72-L320 HydrophobicContact CG-CD2 4.31Å; L73-L320 HydrophobicContact CD2-CD2 3.74Å; V280-L320 HydrophobicContact CB-CB 4.01Å; V280-L320 HydrophobicContact CB-CD1 3.79Å; V280-L320 HydrophobicContact CB-CG 4.45Å; V280-L320 HydrophobicContact CG1-CB 4.04Å; V280-L320 HydrophobicContact CG1-CD1 3.9Å; V280-L320 HydrophobicContact CG2-CD1 4.24Å; I316-L320 HydrophobicContact CG2-CB 4.34Å; I316-L320 HydrophobicContact CG2-CD2 3.54Å; M317-L320 WeakPolarHBondContact O-CB 3.38Å; M317-L320 PolarHBondContact O-N 3.33Å; P318-L320 PolarHBondContact O-N 3.08Å; L320-T322 PolarHBondContact O-N 3.07Å; L320-Y323 PolarHBondContact O-N 3.19Å; L320-Y323 VanDerWaalsContact O-N 3.13Å; L320-M324 HydrophobicContact CB-CE 4.22Å; L320-M324 HydrophobicContact CD2-CE 3.85Å; L320-M324 HydrophobicContact CG-CE 3.75Å
321	L	90.2	Very high	81.8	Confident	41 Å²	41	56.2 Å²	56.2	22%	0.215	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-58.5	-31.5	179.2	-66.3	169.8	0	0	0	112.4	P318 H319 Y323 M324 V334 W336	P318-L321 WeakPolarHBondContact O-CB 3.21Å; P318-L321 VanDerWaalsContact O-CG 3.26Å; P318-L321 WeakPolarHBondContact O-CG 2.99Å; P318-L321 PolarHBondContact O-N 3.1Å; H319-L321 PolarHBondContact O-N 3.18Å; L321-Y323 PolarHBondContact O-N 3.06Å; L321-M324 HydrophobicContact CD2-CE 4.17Å; L321-M324 HydrophobicContact CD2-SD 4.07Å; L321-M324 PolarHBondContact O-N 2.9Å; L321-V334 HydrophobicContact CD2-CG1 4.05Å; L321-V334 WeakPolarHBondContact CD2-O 3.49Å; L321-W336 HydrophobicContact CD1-CD2 4.46Å; L321-W336 HydrophobicContact CD2-CD2 4.01Å; L321-W336 HydrophobicContact CD2-CE3 3.77Å; L321-W336 HydrophobicContact CD2-CH2 3.37Å; L321-W336 HydrophobicContact CD2-CZ2 3.52Å; L321-W336 HydrophobicContact CD2-CZ3 3.5Å; L321-W336 HydrophobicContact CG-CD2 4.4Å; L321-W336 HydrophobicContact CG-CH2 4.3Å; L321-W336 HydrophobicContact CG-CZ2 3.95Å
322	T	90.6	Very high	79.8	Confident	94 Å²	94	56.3 Å²	56.3	58%	0.577	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-67.2	-21.7	-179.5	67.3	0	0	0	0	112.8	H319 L320	H319-T322 PolarHBondContact O-N 2.71Å; H319-T322 PolarHBondContact O-OG1 3.38Å; L320-T322 PolarHBondContact O-N 3.07Å
323	Y	91.5	Very high	78.6	Confident	57 Å²	57	57.1 Å²	57.1	22%	0.224	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-94.3	-3.6	180	-63.1	-85.1	0	0	0	113.6	I25 F42 Y205 V280 H319 L320 L321 D325	I25-Y323 HydrophobicContact CB-CD1 4.23Å; I25-Y323 HydrophobicContact CB-CD2 4.32Å; I25-Y323 HydrophobicContact CB-CE1 3.85Å; I25-Y323 HydrophobicContact CB-CE2 3.94Å; I25-Y323 HydrophobicContact CB-CG 4.45Å; I25-Y323 HydrophobicContact CG1-CD1 4.47Å; I25-Y323 HydrophobicContact CG1-CD2 3.9Å; I25-Y323 HydrophobicContact CG1-CE1 4.46Å; I25-Y323 HydrophobicContact CG1-CE2 3.88Å; I25-Y323 HydrophobicContact CG1-CG 4.2Å; I25-Y323 HydrophobicContact CG2-CD1 3.63Å; I25-Y323 HydrophobicContact CG2-CE1 3.47Å; I25-Y323 VanDerWaalsContact CG2-CE1 3.47Å; I25-Y323 HydrophobicContact CG2-CE2 4.38Å; I25-Y323 HydrophobicContact CG2-CG 4.15Å; F42-Y323 WeakPolarHBondContact CE1-O 3.44Å; F42-Y323 WeakPolarHBondContact CZ-O 3.29Å; Y205-Y323 HydrophobicContact CD2-CD1 4.42Å; Y205-Y323 HydrophobicContact CE2-CD1 4.11Å; V280-Y323 HydrophobicContact CG1-CD2 4.46Å; V280-Y323 HydrophobicContact CG1-CE2 4.25Å; H319-Y323 AromaticContact CD2-CE2 3.71Å; H319-Y323 AromaticContact NE2-CE2 3.79Å; L320-Y323 PolarHBondContact O-N 3.19Å; L320-Y323 VanDerWaalsContact O-N 3.13Å; L321-Y323 PolarHBondContact O-N 3.06Å; Y323-D325 VanDerWaalsContact C-N 3.3Å; Y323-D325 PolarHBondContact O-N 3.19Å
324	M	88.5	Confident	77.8	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	32%	0.32	C	S	.	.	S	Bend	trans	-78.9	-10.8	-174.1	-62.6	-161.4	-173.1	0	0	114.6	F42 L72 L94 F202 L320 L321 L326 V334 W336	F42-M324 HydrophobicContact CE2-CE 4.13Å; F42-M324 HydrophobicContact CE2-CG 4.12Å; F42-M324 HydrophobicContact CZ-CG 3.92Å; L72-M324 HydrophobicContact CD1-CE 3.44Å; L72-M324 VanDerWaalsContact CD1-CE 3.44Å; L72-M324 HydrophobicContact CD1-SD 4.19Å; L94-M324 HydrophobicContact CD2-SD 4.36Å; F202-M324 HydrophobicContact CD1-CB 3.92Å; F202-M324 HydrophobicContact CD1-CG 4.31Å; F202-M324 VanDerWaalsContact CD1-O 3.24Å; F202-M324 WeakPolarHBondContact CD1-O 3.29Å; F202-M324 HydrophobicContact CE1-CB 3.72Å; F202-M324 HydrophobicContact CE1-CG 4.1Å; F202-M324 HydrophobicContact CE1-SD 4.19Å; F202-M324 HydrophobicContact CZ-SD 4.13Å; L320-M324 HydrophobicContact CB-CE 4.22Å; L320-M324 HydrophobicContact CD2-CE 3.85Å; L320-M324 HydrophobicContact CG-CE 3.75Å; L321-M324 HydrophobicContact CD2-CE 4.17Å; L321-M324 HydrophobicContact CD2-SD 4.07Å; L321-M324 PolarHBondContact O-N 2.9Å; M324-L326 HydrophobicContact CB-CD1 3.98Å; M324-L326 HydrophobicContact CB-CG 3.87Å; M324-L326 PolarHBondContact O-N 3.06Å; M324-L326 VanDerWaalsContact O-N 3.09Å; M324-L326 HydrophobicContact SD-CD1 4.5Å; M324-V334 HydrophobicContact SD-CG1 4.47Å; M324-W336 HydrophobicContact CE-CH2 3.24Å; M324-W336 HydrophobicContact CE-CZ2 3.49Å; M324-W336 VanDerWaalsContact CE-CZ2 3.49Å; M324-W336 HydrophobicContact CE-CZ3 4.45Å; M324-W336 HydrophobicContact SD-CH2 3.82Å
325	D	82.1	Confident	77	Confident	112 Å²	112	61.4 Å²	61.4	60%	0.599	34%	0.339	S	S	*	.			trans	48.8	40.5	177.8	-156.9	30.1	0	0	0	112.3	P203 Y323 D327	P203-D325 HydrophobicContact CG-CB 3.86Å; Y323-D325 VanDerWaalsContact C-N 3.3Å; Y323-D325 PolarHBondContact O-N 3.19Å; D325-D327 PolarHBondContact O-N 2.89Å
326	L	75	Confident	76.6	Confident	62 Å²	62	61.4 Å²	61.4	33%	0.325	34%	0.339	S	S	.	.			trans	-87.6	88.9	177.1	-65.6	174.9	0	0	0	107.2	K96 F202 M324 T328 V334	K96-L326 HydrophobicContact CD-CD2 4.37Å; F202-L326 HydrophobicContact CE1-CD1 4.36Å; F202-L326 HydrophobicContact CE1-CD2 3.95Å; F202-L326 HydrophobicContact CE1-CG 4.19Å; M324-L326 HydrophobicContact CB-CD1 3.98Å; M324-L326 HydrophobicContact CB-CG 3.87Å; M324-L326 PolarHBondContact O-N 3.06Å; M324-L326 VanDerWaalsContact O-N 3.09Å; M324-L326 HydrophobicContact SD-CD1 4.5Å; L326-T328 PolarHBondContact O-N 3.03Å; L326-V334 HydrophobicContact CD1-CB 3.65Å; L326-V334 HydrophobicContact CD1-CG1 4.34Å; L326-V334 HydrophobicContact CD1-CG2 3.52Å
327	D	57.3	Low	76	Confident	147 Å²	147	61.3 Å²	61.3	79%	0.786	34%	0.339	S	S	*	.			trans	-61.6	48.8	-176.5	-90	-25.5	0	0	0	115.3	D325	D325-D327 PolarHBondContact O-N 2.89Å
328	T	51.7	Low	75.7	Confident	66 Å²	66	61.2 Å²	61.2	41%	0.405	34%	0.338	S	S	.	.			trans	-136.1	114.1	-178.1	63.3	0	0	0	0	112.4	K98 L326 D330	K98-T328 WeakPolarHBondContact CE-OG1 3.22Å; K98-T328 VanDerWaalsContact NZ-CG2 3.32Å; K98-T328 PolarHBondContact NZ-OG1 2.75Å; L326-T328 PolarHBondContact O-N 3.03Å; T328-D330 PolarHBondContact O-N 3.01Å; T328-D330 VanDerWaalsContact O-N 3.16Å
329	V	44.5	Very low	75.8	Confident	151 Å²	151	60.4 Å²	60.4	92%	0.915	33%	0.333	S	S	*	.			trans	-69.4	0.4	173.8	-163.2	0	0	0	0	112.2
330	D	47.5	Very low	75.9	Confident	102 Å²	102	58 Å²	58	55%	0.545	32%	0.321	S	S	.	.			trans	-69.5	137	-177.8	-56.7	-29.6	0	0	0	111.6	K98 T328 C332 G333	K98-D330 IonicContact NZ-OD2 2.59Å; K98-D330 PolarHBondContact NZ-OD2 2.93Å; T328-D330 PolarHBondContact O-N 3.01Å; T328-D330 VanDerWaalsContact O-N 3.16Å; D330-C332 PolarHBondContact O-N 3.25Å; D330-G333 PolarHBondContact O-N 3.17Å
331	E	50.7	Low	76	Confident	203 Å²	203	58 Å²	58	95%	0.949	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-12.3	179.9	-62.4	177.8	165.7	0	0	115.4
332	C	54.1	Low	76.3	Confident	58 Å²	58	57 Å²	57	39%	0.392	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	35.6	-179.6	-68.5	0	0	0	0	112.6	K98 D330	K98-C332 WeakPolarHBondContact CA-O 3.14Å; K98-C332 HydrophobicContact CB-CB 4.35Å; K98-C332 WeakPolarHBondContact CB-O 3.29Å; K98-C332 WeakPolarHBondContact CD-O 3.47Å; K98-C332 WeakPolarHBondContact CG-O 3.24Å; D330-C332 PolarHBondContact O-N 3.25Å
333	G	70.1	Confident	76.7	Confident	29 Å²	29	52.5 Å²	52.5	30%	0.299	29%	0.288	S	S	.	.			trans	-52.3	164.4	175.2	0	0	0	0	0	113.6	D330 D335	D330-G333 PolarHBondContact O-N 3.17Å; G333-D335 PolarHBondContact O-N 3.41Å
334	V	80.1	Confident	77	Confident	16 Å²	16	49.8 Å²	49.8	10%	0.097	28%	0.277	C	S	.	.	S	Bend	trans	-62.4	120	166.3	170.7	0	0	0	0	107.6	W101 L321 M324 L326 W336	W101-V334 HydrophobicContact CD2-CG1 3.97Å; W101-V334 HydrophobicContact CE3-CG1 4.5Å; W101-V334 HydrophobicContact CG-CB 4.49Å; W101-V334 HydrophobicContact CG-CG1 4.4Å; W101-V334 HydrophobicContact CH2-CG1 4.32Å; W101-V334 HydrophobicContact CZ2-CG1 3.77Å; L321-V334 HydrophobicContact CD2-CG1 4.05Å; L321-V334 WeakPolarHBondContact CD2-O 3.49Å; M324-V334 HydrophobicContact SD-CG1 4.47Å; L326-V334 HydrophobicContact CD1-CB 3.65Å; L326-V334 HydrophobicContact CD1-CG1 4.34Å; L326-V334 HydrophobicContact CD1-CG2 3.52Å; V334-W336 HydrophobicContact CG1-CE3 4.07Å; V334-W336 HydrophobicContact CG1-CH2 4.08Å; V334-W336 HydrophobicContact CG1-CZ3 3.3Å
335	D	82.2	Confident	77.4	Confident	74 Å²	74	51.4 Å²	51.4	40%	0.396	29%	0.288	S	S	.	.			trans	-149	148.4	-172.4	-168.4	23.5	0	0	0	113.6	W101 G333 K362	W101-D335 VanDerWaalsContact CE3-O 3.23Å; G333-D335 PolarHBondContact O-N 3.41Å; D335-K362 PolarHBondContact O-NZ 2.69Å
336	W	85.9	Confident	78.1	Confident	1 Å²	1	48.3 Å²	48.3	0%	0.004	28%	0.278	C	S	.	.			trans	-162.6	152.9	175.1	55.9	84	0	0	0	112.1	L94 W101 I316 M317 L321 M324 V334 V339 K362	L94-W336 HydrophobicContact CD2-CH2 3.79Å; L94-W336 HydrophobicContact CD2-CZ3 3.98Å; W101-W336 AromaticContact CE3-CE3 3.78Å; W101-W336 HydrophobicContact CE3-CE3 3.78Å; W101-W336 HydrophobicContact CE3-CZ3 4.21Å; W101-W336 AromaticContact CH2-CE3 3.55Å; W101-W336 HydrophobicContact CH2-CE3 3.55Å; W101-W336 HydrophobicContact CH2-CH2 4.36Å; W101-W336 AromaticContact CH2-CZ3 3.31Å; W101-W336 HydrophobicContact CH2-CZ3 3.31Å; W101-W336 HydrophobicContact CZ2-CE3 4.4Å; W101-W336 AromaticContact CZ2-CZ3 3.9Å; W101-W336 HydrophobicContact CZ2-CZ3 3.9Å; W101-W336 HydrophobicContact CZ3-CD2 4.22Å; W101-W336 AromaticContact CZ3-CE3 3.18Å; W101-W336 HydrophobicContact CZ3-CE3 3.18Å; W101-W336 AromaticContact CZ3-CZ3 3.51Å; W101-W336 HydrophobicContact CZ3-CZ3 3.51Å; I316-W336 HydrophobicContact CG2-CZ2 4.19Å; M317-W336 PolarHBondContact O-NE1 3.05Å; L321-W336 HydrophobicContact CD1-CD2 4.46Å; L321-W336 HydrophobicContact CD2-CD2 4.01Å; L321-W336 HydrophobicContact CD2-CE3 3.77Å; L321-W336 HydrophobicContact CD2-CH2 3.37Å; L321-W336 HydrophobicContact CD2-CZ2 3.52Å; L321-W336 HydrophobicContact CD2-CZ3 3.5Å; L321-W336 HydrophobicContact CG-CD2 4.4Å; L321-W336 HydrophobicContact CG-CH2 4.3Å; L321-W336 HydrophobicContact CG-CZ2 3.95Å; M324-W336 HydrophobicContact CE-CH2 3.24Å; M324-W336 HydrophobicContact CE-CZ2 3.49Å; M324-W336 VanDerWaalsContact CE-CZ2 3.49Å; M324-W336 HydrophobicContact CE-CZ3 4.45Å; M324-W336 HydrophobicContact SD-CH2 3.82Å; V334-W336 HydrophobicContact CG1-CE3 4.07Å; V334-W336 HydrophobicContact CG1-CH2 4.08Å; V334-W336 HydrophobicContact CG1-CZ3 3.3Å; W336-V339 HydrophobicContact CB-CG2 4.09Å; W336-V339 HydrophobicContact CD2-CG2 3.98Å; W336-V339 HydrophobicContact CE3-CG2 4.5Å; W336-V339 HydrophobicContact CG-CG2 3.79Å; W336-K362 HydrophobicContact CB-CD 4.02Å; W336-K362 HydrophobicContact CB-CG 3.92Å
337	A	84	Confident	79.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-81.9	-38.9	164	0	0	0	0	0	111.9	A292 P318 Q363 Y365	A292-A337 HydrophobicContact CB-CB 4.01Å; P318-A337 WeakPolarHBondContact CD-O 3.37Å; P318-A337 WeakPolarHBondContact CG-O 3.25Å; A337-Q363 WeakPolarHBondContact CA-O 3.48Å; A337-Q363 WeakPolarHBondContact CB-O 3.35Å; A337-Q363 PolarHBondContact N-O 2.84Å; A337-Y365 HydrophobicContact CB-CD1 3.74Å; A337-Y365 HydrophobicContact CB-CD2 3.86Å; A337-Y365 HydrophobicContact CB-CE1 3.91Å; A337-Y365 HydrophobicContact CB-CE2 4.03Å; A337-Y365 HydrophobicContact CB-CG 3.73Å
338	T	88.5	Confident	80.9	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	153.1	168.8	-169.2	0	0	0	0	110.7	L291 Q315 I316 K362 Q363	L291-T338 HydrophobicContact CD2-CG2 4.38Å; Q315-T338 WeakPolarHBondContact CB-OG1 3.37Å; I316-T338 WeakPolarHBondContact O-CA 3.25Å; I316-T338 PolarHBondContact O-OG1 3.43Å; I316-T338 VanDerWaalsContact O-OG1 3.12Å; T338-K362 WeakPolarHBondContact O-CA 3.34Å; T338-Q363 HydrophobicContact CG2-CB 3.88Å; T338-Q363 PolarHBondContact N-O 2.99Å; T338-Q363 PolarHBondContact O-N 3.38Å
339	V	92	Very high	82.9	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	109.7	167.3	-177.2	0	0	0	0	108.6	V110 Q315 I316 W336 I341 W361 K362	V110-V339 HydrophobicContact CG1-CG1 4.28Å; Q315-V339 CarbonylContact C-O 3.54Å; Q315-V339 VanDerWaalsContact CA-O 3.27Å; Q315-V339 WeakPolarHBondContact CA-O 3.03Å; I316-V339 HydrophobicContact CB-CB 4.14Å; I316-V339 HydrophobicContact CD1-CB 4.3Å; I316-V339 HydrophobicContact CD1-CG1 4.42Å; I316-V339 HydrophobicContact CG1-CB 4.46Å; I316-V339 PolarHBondContact N-O 3.32Å; I316-V339 PolarHBondContact O-N 3.32Å; I316-V339 VanDerWaalsContact O-N 3.11Å; W336-V339 HydrophobicContact CB-CG2 4.09Å; W336-V339 HydrophobicContact CD2-CG2 3.98Å; W336-V339 HydrophobicContact CE3-CG2 4.5Å; W336-V339 HydrophobicContact CG-CG2 3.79Å; V339-I341 HydrophobicContact CG1-CD1 3.9Å; V339-W361 CarbonylContact C-O 3.49Å; V339-W361 VanDerWaalsContact CA-O 3.3Å; V339-W361 WeakPolarHBondContact CA-O 3.46Å; V339-K362 HydrophobicContact CG2-CB 4.38Å; V339-K362 HydrophobicContact CG2-CG 4.24Å
340	C	94.1	Very high	85.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	134.1	178.2	-55.8	0	0	0	0	110.7	P289 F312 Y342 S360 W361	P289-C340 VanDerWaalsContact CB-SG 3.58Å; F312-C340 HydrophobicContact CD2-CB 4.34Å; F312-C340 HydrophobicContact CE2-CB 4.2Å; C340-Y342 HydrophobicContact CB-CD2 4.34Å; C340-Y342 HydrophobicContact CB-CE2 3.54Å; C340-S360 WeakPolarHBondContact O-CA 3.43Å; C340-W361 HydrophobicContact CB-CE3 4.13Å; C340-W361 PolarHBondContact N-O 3Å; C340-W361 PolarHBondContact O-N 3.45Å
341	I	96.3	Very high	87.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.3	177.3	-53.8	-41.2	0	0	0	109.3	V112 E313 F314 V339 T343	V112-I341 HydrophobicContact CB-CG2 4.39Å; V112-I341 HydrophobicContact CG1-CG2 3.81Å; V112-I341 HydrophobicContact CG2-CD1 3.66Å; V112-I341 HydrophobicContact CG2-CG1 4.33Å; V112-I341 HydrophobicContact CG2-CG2 4.07Å; E313-I341 PolarHBondContact N-O 3.03Å; F314-I341 HydrophobicContact CD1-CB 3.96Å; F314-I341 HydrophobicContact CD1-CG1 4.31Å; F314-I341 HydrophobicContact CD1-CG2 4.28Å; F314-I341 HydrophobicContact CD2-CG1 4.11Å; F314-I341 HydrophobicContact CE1-CB 3.71Å; F314-I341 HydrophobicContact CE1-CG1 3.8Å; F314-I341 HydrophobicContact CE1-CG2 3.72Å; F314-I341 HydrophobicContact CE2-CB 4.31Å; F314-I341 HydrophobicContact CE2-CG1 3.59Å; F314-I341 HydrophobicContact CG-CB 4.37Å; F314-I341 HydrophobicContact CG-CG1 4.46Å; F314-I341 HydrophobicContact CZ-CB 3.92Å; F314-I341 HydrophobicContact CZ-CG1 3.43Å; F314-I341 VanDerWaalsContact CZ-CG1 3.43Å; F314-I341 HydrophobicContact CZ-CG2 4.13Å; F314-I341 PolarHBondContact O-N 3.06Å; V339-I341 HydrophobicContact CG1-CD1 3.9Å; I341-T343 HydrophobicContact CG2-CG2 4.06Å
342	Y	96.5	Very high	88.9	Confident	21 Å²	21	21.1 Å²	21.1	8%	0.082	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.7	179.2	-63.1	-98.1	0	0	0	109.9	F298 I300 L311 F312 C340 Y359 W361	F298-Y342 AromaticContact CE2-CE2 3.95Å; F298-Y342 HydrophobicContact CE2-CE2 3.95Å; F298-Y342 HydrophobicContact CZ-CE2 4.05Å; F298-Y342 AromaticContact CZ-CZ 3.99Å; F298-Y342 WeakPolarHBondContact CZ-OH 3.34Å; I300-Y342 HydrophobicContact CD1-CD1 3.8Å; I300-Y342 HydrophobicContact CD1-CD2 3.87Å; I300-Y342 HydrophobicContact CD1-CE1 3.71Å; I300-Y342 HydrophobicContact CD1-CE2 3.77Å; I300-Y342 HydrophobicContact CD1-CG 3.9Å; I300-Y342 HydrophobicContact CG1-CD1 4.03Å; I300-Y342 HydrophobicContact CG1-CE1 4.06Å; I300-Y342 HydrophobicContact CG1-CG 4.47Å; I300-Y342 HydrophobicContact CG2-CD1 4.22Å; I300-Y342 HydrophobicContact CG2-CG 4.17Å; L311-Y342 CarbonylContact O-C 3.45Å; L311-Y342 WeakPolarHBondContact O-CA 3.13Å; F312-Y342 HydrophobicContact CB-CD1 4.1Å; F312-Y342 HydrophobicContact CB-CE1 3.81Å; F312-Y342 HydrophobicContact CD2-CE1 4.41Å; C340-Y342 HydrophobicContact CB-CD2 4.34Å; C340-Y342 HydrophobicContact CB-CE2 3.54Å; Y342-Y359 AromaticContact CD2-CD1 3.95Å; Y342-Y359 HydrophobicContact CD2-CD1 3.95Å; Y342-Y359 HydrophobicContact CG-CD1 4.36Å; Y342-Y359 PolarHBondContact N-O 2.97Å; Y342-Y359 PolarHBondContact O-N 3.4Å; Y342-W361 HydrophobicContact CE2-CB 4.22Å
343	T	97.7	Very high	90.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	155.2	-175	69.2	0	0	0	0	112.3	R88 L90 R310 L311 E313 I341 S345 E358	R88-T343 PolarHBondContact NH2-OG1 3Å; L90-T343 HydrophobicContact CD1-CG2 4.16Å; L90-T343 HydrophobicContact CD2-CG2 3.89Å; R310-T343 CarbonylContact C-O 3.47Å; R310-T343 WeakPolarHBondContact CA-O 3.34Å; R310-T343 WeakPolarHBondContact CB-O 3.4Å; L311-T343 PolarHBondContact N-O 3.43Å; L311-T343 PolarHBondContact O-N 2.88Å; E313-T343 HydrophobicContact CB-CG2 4.26Å; E313-T343 WeakPolarHBondContact OE2-CB 3.27Å; E313-T343 WeakPolarHBondContact OE2-CG2 3.44Å; E313-T343 PolarHBondContact OE2-OG1 3.18Å; I341-T343 HydrophobicContact CG2-CG2 4.06Å; T343-S345 PolarHBondContact O-N 2.85Å; T343-E358 WeakPolarHBondContact CA-OE2 3.13Å; T343-E358 HydrophobicContact CG2-CB 4.04Å; T343-E358 HydrophobicContact CG2-CG 3.87Å
344	C	98	Very high	91.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	123.2	-177.3	154.1	0	0	0	0	112.2	C303 A346 S347 E358	C303-C344 HydrophobicContact CB-CB 3.65Å; C303-C344 VanDerWaalsContact SG-CB 3.57Å; C303-C344 VanDerWaalsContact SG-SG 3.68Å; C344-A346 PolarHBondContact O-N 2.96Å; C344-S347 PolarHBondContact O-N 2.92Å; C344-S347 VanDerWaalsContact O-N 3.09Å; C344-E358 PolarHBondContact N-OE1 2.85Å; C344-E358 PolarHBondContact N-OE2 3.17Å; C344-E358 VanDerWaalsContact N-OE2 3.12Å
345	S	96.7	Very high	92.4	Very high	35 Å²	35	29.1 Å²	29.1	25%	0.245	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-38	-179.4	50.9	0	0	0	0	112.7	R285 E309 T343 S347	R285-S345 PolarHBondContact NH2-O 2.79Å; E309-S345 VanDerWaalsContact O-CB 3.25Å; E309-S345 WeakPolarHBondContact O-CB 3.14Å; E309-S345 PolarHBondContact O-N 3.07Å; E309-S345 PolarHBondContact O-OG 2.8Å; T343-S345 PolarHBondContact O-N 2.85Å; S345-S347 VanDerWaalsContact C-N 3.32Å; S345-S347 PolarHBondContact O-N 2.99Å
346	A	96.7	Very high	93.1	Very high	47 Å²	47	26.1 Å²	26.1	39%	0.388	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-4.4	-177	0	0	0	0	0	114.3	A308 C344 C348	A308-A346 HydrophobicContact CB-CB 3.86Å; C344-A346 PolarHBondContact O-N 2.96Å; A346-C348 PolarHBondContact O-N 3.33Å
347	S	96.2	Very high	93.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.16	C	C	.	.			trans	45.7	40.1	-174.4	-69.3	0	0	0	0	112.6	D79 R114 Q116 R285 C344 S345	D79-S347 WeakPolarHBondContact OD2-CB 3.47Å; D79-S347 PolarHBondContact OD2-OG 3.31Å; R114-S347 VanDerWaalsContact NH2-C 3.29Å; Q116-S347 PolarHBondContact NE2-O 2.85Å; Q116-S347 PolarHBondContact OE1-O 2.77Å; R285-S347 PolarHBondContact NH2-OG 2.95Å; C344-S347 PolarHBondContact O-N 2.92Å; C344-S347 VanDerWaalsContact O-N 3.09Å; S345-S347 VanDerWaalsContact C-N 3.32Å; S345-S347 PolarHBondContact O-N 2.99Å
348	C	96.4	Very high	94.2	Very high	15 Å²	15	31.3 Å²	31.3	10%	0.101	16%	0.163	C	C	.	.			trans	-52.9	148.8	-165.5	65.5	0	0	0	0	115.8	R114 Q116 C306 A346 G350 A351	R114-C348 PolarHBondContact NH2-O 3.06Å; R114-C348 PolarHBondContact NH2-SG 3.41Å; Q116-C348 PolarHBondContact NE2-O 3.24Å; C306-C348 HydrophobicContact CB-CB 3.77Å; C306-C348 VanDerWaalsContact SG-CB 3.6Å; C306-C348 VanDerWaalsContact SG-SG 3.67Å; A346-C348 PolarHBondContact O-N 3.33Å; C348-G350 PolarHBondContact O-N 3.19Å; C348-G350 VanDerWaalsContact O-N 3.08Å; C348-A351 PolarHBondContact O-N 3.48Å
349	D	93.2	Very high	94.5	Very high	100 Å²	100	34.3 Å²	34.3	54%	0.535	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-62.8	-17.9	-170.1	-76	-11.2	0	0	0	115.3	S84 A351 S352	S84-D349 VanDerWaalsContact CB-OD1 3.23Å; S84-D349 WeakPolarHBondContact CB-OD1 3.21Å; S84-D349 PolarHBondContact OG-OD1 3.36Å; D349-A351 PolarHBondContact O-N 3.39Å; D349-S352 VanDerWaalsContact O-CB 3.22Å; D349-S352 WeakPolarHBondContact O-CB 3.42Å; D349-S352 PolarHBondContact O-N 2.7Å; D349-S352 PolarHBondContact O-OG 3Å
350	G	90.1	Very high	94.6	Very high	14 Å²	14	34.6 Å²	34.6	14%	0.144	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-55.8	-27	175.8	0	0	0	0	0	113	C348 S352 Q353 R354	C348-G350 PolarHBondContact O-N 3.19Å; C348-G350 VanDerWaalsContact O-N 3.08Å; G350-S352 PolarHBondContact O-N 2.04Å; G350-Q353 PolarHBondContact O-N 3.22Å; G350-R354 WeakPolarHBondContact O-CG 3.07Å; G350-R354 PolarHBondContact O-N 3.32Å
351	A	90.4	Very high	94.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-72.3	-8.7	175.6	0	0	0	0	0	114.3	R114 Q116 C348 D349 R354 L356	R114-A351 HydrophobicContact CG-CB 4.44Å; Q116-A351 HydrophobicContact CB-CB 4.11Å; Q116-A351 HydrophobicContact CG-CB 3.84Å; Q116-A351 PolarHBondContact N-O 3.24Å; C348-A351 PolarHBondContact O-N 3.48Å; D349-A351 PolarHBondContact O-N 3.39Å; A351-R354 CarbonylContact C-O 3.53Å; A351-R354 VanDerWaalsContact CA-O 3.32Å; A351-R354 WeakPolarHBondContact CA-O 3.25Å; A351-R354 VanDerWaalsContact O-O 3.06Å; A351-L356 HydrophobicContact CB-CD1 3.93Å; A351-L356 HydrophobicContact CB-CG 4.02Å
352	S	88.8	Confident	94.1	Very high	32 Å²	32	36.1 Å²	36.1	22%	0.224	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-75	-25.9	173.7	68.8	0	0	0	0	113	N50 Q116 D349 G350	N50-S352 PolarHBondContact ND2-O 3.38Å; Q116-S352 WeakPolarHBondContact O-CA 3.43Å; D349-S352 VanDerWaalsContact O-CB 3.22Å; D349-S352 WeakPolarHBondContact O-CB 3.42Å; D349-S352 PolarHBondContact O-N 2.7Å; D349-S352 PolarHBondContact O-OG 3Å; G350-S352 PolarHBondContact O-N 2.04Å
353	Q	88	Confident	93.5	Very high	141 Å²	141	35.2 Å²	35.2	66%	0.659	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-25	-176.8	-62.6	-178.6	-1.9	0	0	112.7	N53 G350	N53-Q353 PolarHBondContact ND2-O 3.36Å; G350-Q353 PolarHBondContact O-N 3.22Å
354	R	91.6	Very high	92.6	Very high	114 Å²	114	36.1 Å²	36.1	43%	0.43	18%	0.184	S	C	.	.	S	Bend	trans	-154.3	177.6	-174.2	58.7	178	171.8	144.6	-3.3	111.5	N53 E305 G350 A351 L356	N53-R354 HydrophobicContact CB-CB 4.24Å; E305-R354 IonicContact OE1-CZ 2.84Å; E305-R354 IonicContact OE1-NH2 3.23Å; E305-R354 PolarHBondContact OE1-NH2 2.68Å; E305-R354 IonicContact OE2-CZ 3.44Å; E305-R354 IonicContact OE2-NH2 2.89Å; E305-R354 PolarHBondContact OE2-NH2 2.87Å; G350-R354 WeakPolarHBondContact O-CG 3.07Å; G350-R354 PolarHBondContact O-N 3.32Å; A351-R354 CarbonylContact C-O 3.53Å; A351-R354 VanDerWaalsContact CA-O 3.32Å; A351-R354 WeakPolarHBondContact CA-O 3.25Å; A351-R354 VanDerWaalsContact O-O 3.06Å; R354-L356 HydrophobicContact CG-CD2 3.99Å
355	Y	97.1	Very high	91.2	Very high	16 Å²	16	40.3 Å²	40.3	6%	0.063	20%	0.201	C	C	.	.			trans	-90.2	112.9	175.5	-69	-102	0	0	0	109.3	W48 L49 N50 N53 I54 P55 Y91 F113 R114 S115	W48-Y355 HydrophobicContact CE3-CD1 4.34Å; W48-Y355 AromaticContact CE3-CE1 3.36Å; W48-Y355 HydrophobicContact CE3-CE1 3.36Å; W48-Y355 AromaticContact CE3-CZ 3.5Å; W48-Y355 VanDerWaalsContact CE3-CZ 3.5Å; W48-Y355 VanDerWaalsContact CE3-OH 3.27Å; W48-Y355 AromaticContact CZ3-CD1 3.97Å; W48-Y355 HydrophobicContact CZ3-CD1 3.97Å; W48-Y355 AromaticContact CZ3-CE1 3.42Å; W48-Y355 HydrophobicContact CZ3-CE1 3.42Å; W48-Y355 VanDerWaalsContact CZ3-CE1 3.42Å; W48-Y355 AromaticContact CZ3-CZ 3.93Å; L49-Y355 PolarHBondContact N-OH 3Å; N50-Y355 HydrophobicContact CB-CE2 4.14Å; N50-Y355 PolarHBondContact N-OH 3.44Å; N50-Y355 WeakPolarHBondContact O-CE2 3.3Å; N50-Y355 PolarHBondContact O-OH 3.36Å; N53-Y355 VanDerWaalsContact O-CD2 3.3Å; N53-Y355 WeakPolarHBondContact O-CD2 3.38Å; I54-Y355 HydrophobicContact CG1-CE2 4.29Å; P55-Y355 HydrophobicContact CG-CD1 4.11Å; P55-Y355 HydrophobicContact CG-CD2 4.25Å; P55-Y355 HydrophobicContact CG-CG 3.82Å; Y91-Y355 HydrophobicContact CD2-CD1 4.18Å; Y91-Y355 AromaticContact CD2-CE1 3.91Å; Y91-Y355 HydrophobicContact CD2-CE1 3.91Å; Y91-Y355 HydrophobicContact CE2-CD1 4.27Å; Y91-Y355 AromaticContact CE2-CE1 3.6Å; Y91-Y355 HydrophobicContact CE2-CE1 3.6Å; F113-Y355 HydrophobicContact CB-CD1 4.18Å; R114-Y355 WeakPolarHBondContact O-CA 3.5Å; S115-Y355 VanDerWaalsContact CB-CE1 3.47Å
356	L	97.3	Very high	89.6	Confident	11 Å²	11	45.3 Å²	45.3	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	139.2	178.5	-64	-173.2	0	0	0	110.8	F113 R114 E305 A351 R354	F113-L356 CarbonylContact C-O 3.55Å; F113-L356 VanDerWaalsContact CA-O 3.29Å; F113-L356 WeakPolarHBondContact CA-O 3.14Å; R114-L356 PolarHBondContact N-O 3Å; R114-L356 PolarHBondContact O-N 2.88Å; E305-L356 HydrophobicContact CB-CD1 3.89Å; E305-L356 HydrophobicContact CG-CD1 3.96Å; E305-L356 HydrophobicContact CG-CD2 4.46Å; A351-L356 HydrophobicContact CB-CD1 3.93Å; A351-L356 HydrophobicContact CB-CG 4.02Å; R354-L356 HydrophobicContact CG-CD2 3.99Å
357	K	96.4	Very high	87.5	Confident	96 Å²	96	49.5 Å²	49.5	42%	0.417	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	127.8	176	-75.7	-171.2	174.9	-173.9	0	110.9	V112 F113 R310	V112-K357 WeakPolarHBondContact O-CA 3.29Å; F113-K357 HydrophobicContact CD1-CG 3.95Å; F113-K357 HydrophobicContact CE1-CD 4.32Å; F113-K357 HydrophobicContact CE1-CG 3.4Å; F113-K357 HydrophobicContact CZ-CG 4.06Å; R310-K357 PolarHBondContact NH2-O 3.25Å
358	E	96.8	Very high	87	Confident	14 Å²	14	52 Å²	52	7%	0.065	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	171.6	170.7	-63.2	-67.7	-160.4	0	0	110	V112 R114 R310 T343 C344	V112-E358 HydrophobicContact CB-CB 4.12Å; V112-E358 HydrophobicContact CG1-CB 4.02Å; V112-E358 PolarHBondContact O-N 3.43Å; R114-E358 HydrophobicContact CB-CG 3.75Å; R114-E358 WeakPolarHBondContact CD-OE1 3.14Å; R114-E358 IonicContact CZ-OE1 3.68Å; R114-E358 IonicContact NE-OE1 2.73Å; R114-E358 IonicContact NH1-OE1 2.75Å; R114-E358 PolarHBondContact NH1-OE1 3.11Å; R310-E358 IonicContact NE-OE2 3.15Å; R310-E358 PolarHBondContact NE-OE2 3.48Å; T343-E358 WeakPolarHBondContact CA-OE2 3.13Å; T343-E358 HydrophobicContact CG2-CB 4.04Å; T343-E358 HydrophobicContact CG2-CG 3.87Å; C344-E358 PolarHBondContact N-OE1 2.85Å; C344-E358 PolarHBondContact N-OE2 3.17Å; C344-E358 VanDerWaalsContact N-OE2 3.12Å
359	Y	95.2	Very high	86.5	Confident	62 Å²	62	53.9 Å²	53.9	24%	0.243	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.5	-170.6	-174.7	-106.3	0	0	0	111.1	F298 I300 P301 Y342 W361	F298-Y359 HydrophobicContact CD2-CE1 4.14Å; F298-Y359 HydrophobicContact CE2-CE1 4.09Å; I300-Y359 HydrophobicContact CD1-CD1 3.97Å; I300-Y359 HydrophobicContact CD1-CE1 3.77Å; I300-Y359 HydrophobicContact CG2-CD1 4.04Å; P301-Y359 HydrophobicContact CG-CD2 3.54Å; P301-Y359 HydrophobicContact CG-CE2 3.8Å; P301-Y359 HydrophobicContact CG-CG 4.03Å; Y342-Y359 AromaticContact CD2-CD1 3.95Å; Y342-Y359 HydrophobicContact CD2-CD1 3.95Å; Y342-Y359 HydrophobicContact CG-CD1 4.36Å; Y342-Y359 PolarHBondContact N-O 2.97Å; Y342-Y359 PolarHBondContact O-N 3.4Å; Y359-W361 HydrophobicContact CE1-CB 3.99Å
360	S	93.6	Very high	86.2	Confident	9 Å²	9	51.4 Å²	51.4	6%	0.063	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141	172.3	54.6	0	0	0	0	110.3	V110 C340	V110-S360 PolarHBondContact O-OG 3.16Å; C340-S360 WeakPolarHBondContact O-CA 3.43Å
361	W	91.3	Very high	85.9	Confident	16 Å²	16	53.6 Å²	53.6	6%	0.061	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.3	174.6	177.6	84.1	0	0	0	110.1	L291 T295 F298 V339 C340 Y342 Y359 Q363	L291-W361 HydrophobicContact CD2-CH2 4.08Å; L291-W361 HydrophobicContact CD2-CZ3 3.63Å; T295-W361 HydrophobicContact CG2-CH2 3.88Å; T295-W361 HydrophobicContact CG2-CZ2 3.81Å; T295-W361 VanDerWaalsContact OG1-CH2 3.24Å; T295-W361 WeakPolarHBondContact OG1-CH2 3.46Å; F298-W361 AromaticContact CD1-CD1 4Å; F298-W361 HydrophobicContact CD1-CD2 4.01Å; F298-W361 AromaticContact CD1-CE2 3.45Å; F298-W361 VanDerWaalsContact CD1-CE2 3.45Å; F298-W361 HydrophobicContact CD1-CG 4.31Å; F298-W361 HydrophobicContact CD1-CH2 4.46Å; F298-W361 AromaticContact CD1-CZ2 3.72Å; F298-W361 HydrophobicContact CD1-CZ2 3.72Å; F298-W361 AromaticContact CD1-NE1 3.47Å; F298-W361 HydrophobicContact CD2-CB 4.22Å; F298-W361 AromaticContact CD2-CD1 3.46Å; F298-W361 VanDerWaalsContact CD2-CD1 3.46Å; F298-W361 HydrophobicContact CD2-CD2 4.24Å; F298-W361 AromaticContact CD2-CG 3.73Å; F298-W361 HydrophobicContact CD2-CG 3.73Å; F298-W361 AromaticContact CD2-NE1 3.82Å; F298-W361 AromaticContact CE1-CD2 3.39Å; F298-W361 HydrophobicContact CE1-CD2 3.39Å; F298-W361 AromaticContact CE1-CE2 3.22Å; F298-W361 AromaticContact CE1-CE3 3.74Å; F298-W361 HydrophobicContact CE1-CE3 3.74Å; F298-W361 AromaticContact CE1-CG 3.94Å; F298-W361 HydrophobicContact CE1-CG 3.94Å; F298-W361 AromaticContact CE1-CH2 3.76Å; F298-W361 HydrophobicContact CE1-CH2 3.76Å; F298-W361 AromaticContact CE1-CZ2 3.43Å; F298-W361 HydrophobicContact CE1-CZ2 3.43Å; F298-W361 VanDerWaalsContact CE1-CZ2 3.43Å; F298-W361 AromaticContact CE1-CZ3 3.91Å; F298-W361 HydrophobicContact CE1-CZ3 3.91Å; F298-W361 AromaticContact CE1-NE1 3.69Å; F298-W361 HydrophobicContact CE2-CB 3.5Å; F298-W361 VanDerWaalsContact CE2-CB 3.5Å; F298-W361 AromaticContact CE2-CD1 3.49Å; F298-W361 VanDerWaalsContact CE2-CD1 3.49Å; F298-W361 AromaticContact CE2-CD2 3.59Å; F298-W361 HydrophobicContact CE2-CD2 3.59Å; F298-W361 HydrophobicContact CE2-CE3 4.24Å; F298-W361 AromaticContact CE2-CG 3.22Å; F298-W361 HydrophobicContact CE2-CG 3.22Å; F298-W361 AromaticContact CE2-NE1 3.96Å; F298-W361 AromaticContact CG-CD1 3.72Å; F298-W361 HydrophobicContact CG-CD2 4.42Å; F298-W361 HydrophobicContact CG-CG 4.24Å; F298-W361 AromaticContact CG-NE1 3.57Å; F298-W361 HydrophobicContact CZ-CB 3.92Å; F298-W361 AromaticContact CZ-CD1 3.84Å; F298-W361 AromaticContact CZ-CD2 3.15Å; F298-W361 HydrophobicContact CZ-CD2 3.15Å; F298-W361 AromaticContact CZ-CE2 3.55Å; F298-W361 AromaticContact CZ-CE3 3.45Å; F298-W361 HydrophobicContact CZ-CE3 3.45Å; F298-W361 VanDerWaalsContact CZ-CE3 3.45Å; F298-W361 AromaticContact CZ-CG 3.38Å; F298-W361 HydrophobicContact CZ-CG 3.38Å; F298-W361 HydrophobicContact CZ-CH2 4.33Å; F298-W361 HydrophobicContact CZ-CZ2 4.13Å; F298-W361 HydrophobicContact CZ-CZ3 4.03Å; F298-W361 AromaticContact CZ-NE1 3.93Å; V339-W361 CarbonylContact C-O 3.49Å; V339-W361 VanDerWaalsContact CA-O 3.3Å; V339-W361 WeakPolarHBondContact CA-O 3.46Å; C340-W361 HydrophobicContact CB-CE3 4.13Å; C340-W361 PolarHBondContact N-O 3Å; C340-W361 PolarHBondContact O-N 3.45Å; Y342-W361 HydrophobicContact CE2-CB 4.22Å; Y359-W361 HydrophobicContact CE1-CB 3.99Å; W361-Q363 HydrophobicContact CH2-CB 3.7Å; W361-Q363 HydrophobicContact CH2-CG 4.1Å; W361-Q363 HydrophobicContact CZ2-CB 4.44Å; W361-Q363 HydrophobicContact CZ3-CB 3.84Å
362	K	87.5	Confident	85.7	Confident	15 Å²	15	56.9 Å²	56.9	7%	0.065	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.9	-173.3	178.2	178.8	101.1	104.7	0	107.5	W101 V107 D335 W336 T338 V339 D364	W101-K362 HydrophobicContact CE3-CD 3.64Å; W101-K362 HydrophobicContact CZ3-CD 3.56Å; W101-K362 PolarHBondContact O-NZ 3.33Å; V107-K362 HydrophobicContact CB-CB 4.48Å; V107-K362 HydrophobicContact CG1-CB 4.22Å; V107-K362 HydrophobicContact CG2-CB 3.4Å; V107-K362 VanDerWaalsContact CG2-CB 3.4Å; V107-K362 VanDerWaalsContact CG2-N 3.3Å; D335-K362 PolarHBondContact O-NZ 2.69Å; W336-K362 HydrophobicContact CB-CD 4.02Å; W336-K362 HydrophobicContact CB-CG 3.92Å; T338-K362 WeakPolarHBondContact O-CA 3.34Å; V339-K362 HydrophobicContact CG2-CB 4.38Å; V339-K362 HydrophobicContact CG2-CG 4.24Å; K362-D364 WeakPolarHBondContact CE-OD2 3.48Å; K362-D364 IonicContact NZ-OD1 2.72Å; K362-D364 PolarHBondContact NZ-OD1 2.98Å; K362-D364 IonicContact NZ-OD2 3.53Å; K362-D364 PolarHBondContact NZ-OD2 3.45Å; K362-D364 VanDerWaalsContact NZ-OD2 3.15Å
363	Q	84.9	Confident	85.5	Confident	3 Å²	3	58.6 Å²	58.6	1%	0.014	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.9	166.6	-171.2	172.7	41.6	0	0	109.4	S293 T295 A337 T338 W361	S293-Q363 PolarHBondContact O-NE2 3.44Å; S293-Q363 PolarHBondContact OG-NE2 3.05Å; T295-Q363 HydrophobicContact CG2-CG 4.01Å; T295-Q363 VanDerWaalsContact CG2-NE2 3.31Å; T295-Q363 PolarHBondContact OG1-NE2 2.63Å; A337-Q363 WeakPolarHBondContact CA-O 3.48Å; A337-Q363 WeakPolarHBondContact CB-O 3.35Å; A337-Q363 PolarHBondContact N-O 2.84Å; T338-Q363 HydrophobicContact CG2-CB 3.88Å; T338-Q363 PolarHBondContact N-O 2.99Å; T338-Q363 PolarHBondContact O-N 3.38Å; W361-Q363 HydrophobicContact CH2-CB 3.7Å; W361-Q363 HydrophobicContact CH2-CG 4.1Å; W361-Q363 HydrophobicContact CZ2-CB 4.44Å; W361-Q363 HydrophobicContact CZ3-CB 3.84Å
364	D	79.5	Confident	85.3	Confident	18 Å²	18	52.7 Å²	52.7	10%	0.096	25%	0.254	C	S	.	.			trans	-95.6	152.3	169.4	-74.9	-57.5	0	0	0	110.8	P103 K362 N366	P103-D364 WeakPolarHBondContact CA-OD2 2.98Å; K362-D364 WeakPolarHBondContact CE-OD2 3.48Å; K362-D364 IonicContact NZ-OD1 2.72Å; K362-D364 PolarHBondContact NZ-OD1 2.98Å; K362-D364 IonicContact NZ-OD2 3.53Å; K362-D364 PolarHBondContact NZ-OD2 3.45Å; K362-D364 VanDerWaalsContact NZ-OD2 3.15Å; D364-N366 VanDerWaalsContact C-N 3.29Å; D364-N366 PolarHBondContact O-N 3.01Å
365	Y	68.5	Low	84.8	Confident	88 Å²	88	48 Å²	48	35%	0.345	24%	0.24	S	C	.	.	S	Bend	trans	-63.5	-38.7	178	-77.3	-74.6	0	0	0	112	F266 F269 P318 A337	F266-Y365 HydrophobicContact CE2-CD1 4.3Å; F269-Y365 HydrophobicContact CE1-CE1 4.09Å; P318-Y365 WeakPolarHBondContact CB-OH 3.46Å; P318-Y365 HydrophobicContact CG-CE2 4.4Å; P318-Y365 WeakPolarHBondContact CG-OH 3.43Å; A337-Y365 HydrophobicContact CB-CD1 3.74Å; A337-Y365 HydrophobicContact CB-CD2 3.86Å; A337-Y365 HydrophobicContact CB-CE1 3.91Å; A337-Y365 HydrophobicContact CB-CE2 4.03Å; A337-Y365 HydrophobicContact CB-CG 3.73Å
366	N	62.3	Low	83.8	Confident	140 Å²	140	50.7 Å²	50.7	75%	0.749	26%	0.255	S	S	*	.			trans	-121.2	95.4	175.1	-67.7	-26.9	0	0	0	107.3	D364	D364-N366 VanDerWaalsContact C-N 3.29Å; D364-N366 PolarHBondContact O-N 3.01Å
367	P	51.8	Low	82.5	Confident	136 Å²	136	54.3 Å²	54.3	88%	0.883	27%	0.273	S	S	*	.			trans	-63.4	0	-179.1	23.5	-31.7	0	0	0	114.2

Retrieved 367 of 367 residues in 239.7 ms (Link to these results)

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