A0A096MBT3_POEFO Loading...

Diacylglycerol kinase

AlphaFold DB , UniProt , Accession A0A096MBT3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 782 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	32.3	Very low	43.5	Very low	211 Å²	211	95.4 Å²	95.4	100%	1.039	52%	0.521	S	S	*	.				0	120.7	0	-60.5	-175.6	88.3	0	0	106	D5	M1-D5 HydrophobicContact CB-CB 4.4Å; M1-D5 HydrophobicContact CE-CB 4.27Å
2	S	28.6	Very low	44.3	Very low	80 Å²	80	95.4 Å²	95.4	56%	0.559	53%	0.53	S	S	*	.			trans	-70.5	158	-179.1	47.4	0	0	0	0	109.9	Q4 D5	S2-Q4 PolarHBondContact O-N 2.87Å; S2-D5 PolarHBondContact O-N 3.13Å; S2-D5 VanDerWaalsContact O-N 3.07Å
3	G	31.2	Very low	45.3	Very low	64 Å²	64	93.6 Å²	93.6	66%	0.66	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-8.4	-173.7	0	0	0	0	0	116.6
4	Q	36.6	Very low	46.6	Very low	149 Å²	149	89.6 Å²	89.6	70%	0.696	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-19.1	175.4	-81.3	174.8	-35.8	0	0	114.1	S2 K6	S2-Q4 PolarHBondContact O-N 2.87Å; Q4-K6 PolarHBondContact O-N 2.92Å
5	D	40.2	Very low	47.8	Very low	71 Å²	71	85.7 Å²	85.7	38%	0.38	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-74.6	-7.1	178.5	-76.6	-33.7	0	0	0	113.4	M1 S2	M1-D5 HydrophobicContact CB-CB 4.4Å; M1-D5 HydrophobicContact CE-CB 4.27Å; S2-D5 PolarHBondContact O-N 3.13Å; S2-D5 VanDerWaalsContact O-N 3.07Å
6	K	41.5	Very low	48.5	Very low	172 Å²	172	83.6 Å²	83.6	75%	0.748	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-77.8	-17.8	-176.6	-106.5	-172.9	175.7	-171	0	114.6	Q4	Q4-K6 PolarHBondContact O-N 2.92Å
7	W	46.1	Very low	49.8	Very low	81 Å²	81	82.1 Å²	82.1	31%	0.307	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-116.8	21.3	-165	-59.6	82.7	0	0	0	113	H75 M78	W7-H75 HydrophobicContact CE3-CB 3.75Å; W7-H75 AromaticContact CE3-CD2 3.38Å; W7-H75 AromaticContact CE3-CG 3.71Å; W7-H75 HydrophobicContact CZ3-CB 3.52Å; W7-H75 AromaticContact CZ3-CG 3.92Å; W7-M78 HydrophobicContact CB-CB 4.38Å; W7-M78 HydrophobicContact CB-CE 4.08Å; W7-M78 HydrophobicContact CB-SD 4.16Å; W7-M78 HydrophobicContact CD2-SD 3.94Å; W7-M78 HydrophobicContact CE3-SD 3.69Å; W7-M78 HydrophobicContact CG-CE 4.37Å; W7-M78 HydrophobicContact CG-SD 4.12Å; W7-M78 HydrophobicContact CZ3-SD 4.42Å
8	V	51.9	Low	51	Low	67 Å²	67	77.6 Å²	77.6	41%	0.406	44%	0.444	S	S	.	.	S	Bend	trans	-88.5	-22.1	-169.3	-176.1	0	0	0	0	112.2
9	T	54.6	Low	51.7	Low	86 Å²	86	77.7 Å²	77.7	53%	0.528	44%	0.44	S	S	.	.	S	Bend	trans	-153.2	135.8	-176.8	48.3	0	0	0	0	110.7	T11	T9-T11 PolarHBondContact O-N 3.27Å
10	L	55.9	Low	52.6	Low	8 Å²	8	78.8 Å²	78.8	4%	0.042	44%	0.442	C	S	.	.			trans	-53.7	132.3	168.8	-75.3	161.3	0	0	0	110.8	E14 F72 L76 Y135	L10-E14 HydrophobicContact CD2-CB 4.18Å; L10-F72 HydrophobicContact CD2-CE2 4.4Å; L10-L76 HydrophobicContact CD1-CD2 3.55Å; L10-L76 HydrophobicContact CD2-CB 4.5Å; L10-L76 HydrophobicContact CD2-CD2 3.38Å; L10-L76 HydrophobicContact CD2-CG 3.76Å; L10-L76 HydrophobicContact CG-CD2 4.05Å; L10-Y135 HydrophobicContact CD1-CE1 3.8Å
11	T	59.6	Low	53.6	Low	60 Å²	60	77.8 Å²	77.8	37%	0.368	43%	0.431	S	S	.	.			trans	-71	153.5	174.3	65.1	0	0	0	0	110.5	T9 A13 E14 F15	T9-T11 PolarHBondContact O-N 3.27Å; T11-A13 PolarHBondContact O-N 3.42Å; T11-A13 VanDerWaalsContact O-N 3.11Å; T11-E14 WeakPolarHBondContact CB-OE2 3.34Å; T11-E14 WeakPolarHBondContact CG2-OE2 3.17Å; T11-E14 PolarHBondContact N-OE2 2.87Å; T11-E14 WeakPolarHBondContact O-CB 3.21Å; T11-E14 PolarHBondContact O-N 2.78Å; T11-E14 VanDerWaalsContact O-N 3.15Å; T11-E14 WeakPolarHBondContact OG1-CB 3.37Å; T11-E14 VanDerWaalsContact OG1-CD 3.23Å; T11-E14 VanDerWaalsContact OG1-CG 3.25Å; T11-E14 WeakPolarHBondContact OG1-CG 3.3Å; T11-E14 PolarHBondContact OG1-N 2.86Å; T11-E14 PolarHBondContact OG1-OE2 2.9Å; T11-F15 PolarHBondContact O-N 2.68Å
12	P	53.1	Low	55.3	Low	96 Å²	96	69 Å²	69	62%	0.623	39%	0.39	S	S	*	.	H	α-helix	trans	-56.7	-26.2	173.3	-27.9	35.7	0	0	0	114.1	A16	P12-A16 WeakPolarHBondContact O-CB 3.21Å; P12-A16 PolarHBondContact O-N 3Å; P12-A16 VanDerWaalsContact O-N 3.11Å
13	A	57	Low	57.1	Low	72 Å²	72	72.4 Å²	72.4	60%	0.595	40%	0.397	S	S	*	.	H	α-helix	trans	-73.2	-44.4	176.4	0	0	0	0	0	112	T11 F15 A16 L17	T11-A13 PolarHBondContact O-N 3.42Å; T11-A13 VanDerWaalsContact O-N 3.11Å; A13-F15 VanDerWaalsContact C-N 3.33Å; A13-A16 PolarHBondContact O-N 2.85Å; A13-L17 WeakPolarHBondContact O-CB 3.42Å; A13-L17 PolarHBondContact O-N 2.85Å
14	E	64.1	Low	58.9	Low	38 Å²	38	77.4 Å²	77.4	18%	0.178	40%	0.397	C	S	.	.	H	α-helix	trans	-64.1	-37	175.1	-81.7	168	148.5	0	0	112.7	L10 T11 L17 L18 F72 H75	L10-E14 HydrophobicContact CD2-CB 4.18Å; T11-E14 WeakPolarHBondContact CB-OE2 3.34Å; T11-E14 WeakPolarHBondContact CG2-OE2 3.17Å; T11-E14 PolarHBondContact N-OE2 2.87Å; T11-E14 WeakPolarHBondContact O-CB 3.21Å; T11-E14 PolarHBondContact O-N 2.78Å; T11-E14 VanDerWaalsContact O-N 3.15Å; T11-E14 WeakPolarHBondContact OG1-CB 3.37Å; T11-E14 VanDerWaalsContact OG1-CD 3.23Å; T11-E14 VanDerWaalsContact OG1-CG 3.25Å; T11-E14 WeakPolarHBondContact OG1-CG 3.3Å; T11-E14 PolarHBondContact OG1-N 2.86Å; T11-E14 PolarHBondContact OG1-OE2 2.9Å; E14-L17 WeakPolarHBondContact O-CB 3.34Å; E14-L17 PolarHBondContact O-N 2.95Å; E14-L18 PolarHBondContact O-N 3.41Å; E14-F72 HydrophobicContact CB-CD2 4.17Å; E14-F72 HydrophobicContact CB-CE2 3.57Å; E14-F72 HydrophobicContact CB-CZ 4.44Å; E14-F72 HydrophobicContact CG-CD2 3.81Å; E14-F72 HydrophobicContact CG-CE2 3.75Å; E14-F72 VanDerWaalsContact O-CZ 3.25Å; E14-F72 WeakPolarHBondContact O-CZ 3.27Å; E14-H75 IonicContact OE1-CE1 3.48Å; E14-H75 IonicContact OE1-CG 2.88Å; E14-H75 IonicContact OE1-ND1 3.51Å; E14-H75 PolarHBondContact OE1-ND1 3.12Å; E14-H75 IonicContact OE2-CE1 3.42Å; E14-H75 PolarHBondContact OE2-CE1 3.32Å; E14-H75 IonicContact OE2-ND1 3.43Å; E14-H75 PolarHBondContact OE2-ND1 3.41Å
15	F	63.8	Low	60.7	Low	31 Å²	31	71.1 Å²	71.1	14%	0.136	37%	0.37	C	S	.	.	H	α-helix	trans	-68.2	-41.5	172.8	-175.1	-98.1	0	0	0	112.6	T11 A13 L17 L18 Q19 Y135 L139 Y181	T11-F15 PolarHBondContact O-N 2.68Å; A13-F15 VanDerWaalsContact C-N 3.33Å; F15-L17 VanDerWaalsContact C-N 3.27Å; F15-L17 PolarHBondContact O-N 3.03Å; F15-L18 WeakPolarHBondContact O-CB 3.47Å; F15-L18 PolarHBondContact O-N 3.06Å; F15-Q19 HydrophobicContact CD1-CG 4.32Å; F15-Q19 HydrophobicContact CE1-CG 4.1Å; F15-Q19 WeakPolarHBondContact O-CG 3.32Å; F15-Q19 PolarHBondContact O-N 2.92Å; F15-Y135 AromaticContact CD2-CE1 3.91Å; F15-Y135 HydrophobicContact CD2-CE1 3.91Å; F15-Y135 AromaticContact CD2-CZ 3.95Å; F15-Y135 VanDerWaalsContact CD2-OH 3.29Å; F15-Y135 WeakPolarHBondContact CD2-OH 3.43Å; F15-Y135 AromaticContact CE2-CE1 3.78Å; F15-Y135 HydrophobicContact CE2-CE1 3.78Å; F15-Y135 AromaticContact CE2-CZ 3.85Å; F15-L139 HydrophobicContact CD2-CD2 4.48Å; F15-L139 HydrophobicContact CE1-CD2 4.17Å; F15-L139 HydrophobicContact CE2-CD2 3.6Å; F15-L139 HydrophobicContact CZ-CD2 3.41Å; F15-L139 VanDerWaalsContact CZ-CD2 3.41Å; F15-Y181 WeakPolarHBondContact CB-OH 3.3Å; F15-Y181 HydrophobicContact CD1-CE1 4.41Å; F15-Y181 WeakPolarHBondContact CD1-OH 3.49Å; F15-Y181 HydrophobicContact CD2-CE1 4.27Å; F15-Y181 AromaticContact CD2-CZ 3.97Å; F15-Y181 HydrophobicContact CE1-CE1 4.45Å; F15-Y181 HydrophobicContact CE2-CE1 4.33Å; F15-Y181 HydrophobicContact CG-CE1 4.3Å; F15-Y181 AromaticContact CG-CZ 3.81Å; F15-Y181 WeakPolarHBondContact CG-OH 3.47Å; F15-Y181 HydrophobicContact CZ-CE1 4.41Å
16	A	59.1	Low	62.4	Low	51 Å²	51	73.2 Å²	73.2	42%	0.421	39%	0.385	S	S	.	.	H	α-helix	trans	-63	-37.2	173.8	0	0	0	0	0	111.5	P12 A13 Q19 E20	P12-A16 WeakPolarHBondContact O-CB 3.21Å; P12-A16 PolarHBondContact O-N 3Å; P12-A16 VanDerWaalsContact O-N 3.11Å; A13-A16 PolarHBondContact O-N 2.85Å; A16-Q19 WeakPolarHBondContact O-CB 3.41Å; A16-Q19 PolarHBondContact O-N 2.9Å; A16-E20 PolarHBondContact O-N 3.35Å
17	L	71.3	Confident	64	Low	58 Å²	58	67.5 Å²	67.5	30%	0.304	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-44.5	173.1	-176.3	64.8	0	0	0	111	A13 E14 F15 Q19 E20 Y21 F72	A13-L17 WeakPolarHBondContact O-CB 3.42Å; A13-L17 PolarHBondContact O-N 2.85Å; E14-L17 WeakPolarHBondContact O-CB 3.34Å; E14-L17 PolarHBondContact O-N 2.95Å; F15-L17 VanDerWaalsContact C-N 3.27Å; F15-L17 PolarHBondContact O-N 3.03Å; L17-Q19 VanDerWaalsContact C-N 3.31Å; L17-Q19 PolarHBondContact O-N 3.25Å; L17-E20 WeakPolarHBondContact O-CB 3.22Å; L17-E20 PolarHBondContact O-N 2.98Å; L17-E20 VanDerWaalsContact O-N 3.11Å; L17-Y21 HydrophobicContact CD1-CD2 4.29Å; L17-Y21 HydrophobicContact CD1-CE2 3.74Å; L17-Y21 HydrophobicContact CD2-CE2 4.32Å; L17-Y21 HydrophobicContact CG-CD2 4.1Å; L17-Y21 HydrophobicContact CG-CE2 3.73Å; L17-Y21 WeakPolarHBondContact O-CD2 3.41Å; L17-Y21 PolarHBondContact O-N 3.2Å; L17-F72 HydrophobicContact CB-CZ 4.49Å; L17-F72 HydrophobicContact CD2-CD1 3.99Å; L17-F72 HydrophobicContact CD2-CE1 3.91Å; L17-F72 HydrophobicContact CD2-CG 4.35Å; L17-F72 HydrophobicContact CD2-CZ 4.25Å; L17-F72 HydrophobicContact CG-CE1 4.18Å; L17-F72 HydrophobicContact CG-CZ 4.47Å
18	L	70.4	Confident	65.7	Low	1 Å²	1	68.5 Å²	68.5	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-61.7	-37.8	174.1	-170	61.3	0	0	0	112.5	E14 F15 E20 Y21 T22 M60 L64 F72 L76 L136 L139	E14-L18 PolarHBondContact O-N 3.41Å; F15-L18 WeakPolarHBondContact O-CB 3.47Å; F15-L18 PolarHBondContact O-N 3.06Å; L18-E20 VanDerWaalsContact C-N 3.32Å; L18-Y21 PolarHBondContact O-N 2.94Å; L18-T22 WeakPolarHBondContact O-CG2 3.3Å; L18-T22 PolarHBondContact O-N 3.18Å; L18-T22 PolarHBondContact O-OG1 2.91Å; L18-T22 VanDerWaalsContact O-OG1 3.11Å; L18-M60 HydrophobicContact CD1-CE 3.71Å; L18-L64 HydrophobicContact CD1-CD1 3.92Å; L18-L64 HydrophobicContact CD1-CD2 4.27Å; L18-F72 HydrophobicContact CB-CZ 4.15Å; L18-L76 HydrophobicContact CD1-CD1 4.44Å; L18-L76 HydrophobicContact CD2-CD2 3.98Å; L18-L136 HydrophobicContact CD2-CD2 3.93Å; L18-L139 HydrophobicContact CD2-CD1 3.82Å; L18-L139 HydrophobicContact CG-CD1 3.86Å
19	Q	64.6	Low	67	Low	80 Å²	80	65.3 Å²	65.3	37%	0.374	35%	0.348	S	S	.	.	H	α-helix	trans	-63.9	-35.9	172.6	-80.1	-176.3	-25	0	0	112.7	F15 A16 L17 T22 Q23 L139	F15-Q19 HydrophobicContact CD1-CG 4.32Å; F15-Q19 HydrophobicContact CE1-CG 4.1Å; F15-Q19 WeakPolarHBondContact O-CG 3.32Å; F15-Q19 PolarHBondContact O-N 2.92Å; A16-Q19 WeakPolarHBondContact O-CB 3.41Å; A16-Q19 PolarHBondContact O-N 2.9Å; L17-Q19 VanDerWaalsContact C-N 3.31Å; L17-Q19 PolarHBondContact O-N 3.25Å; Q19-T22 WeakPolarHBondContact CA-OG1 3.48Å; Q19-T22 PolarHBondContact O-OG1 3.08Å; Q19-Q23 WeakPolarHBondContact O-CG 3.27Å; Q19-Q23 PolarHBondContact O-N 3.36Å; Q19-L139 HydrophobicContact CG-CD2 3.69Å
20	E	70.8	Confident	68.2	Low	100 Å²	100	67.8 Å²	67.8	47%	0.467	35%	0.351	S	S	.	.	H	α-helix	trans	-66	-46.6	174.8	-174.9	173.6	-173.6	0	0	110.7	A16 L17 L18 T22 Q23 Y24	A16-E20 PolarHBondContact O-N 3.35Å; L17-E20 WeakPolarHBondContact O-CB 3.22Å; L17-E20 PolarHBondContact O-N 2.98Å; L17-E20 VanDerWaalsContact O-N 3.11Å; L18-E20 VanDerWaalsContact C-N 3.32Å; E20-T22 VanDerWaalsContact C-N 3.35Å; E20-T22 PolarHBondContact O-N 2.99Å; E20-Q23 WeakPolarHBondContact O-CB 3.33Å; E20-Q23 PolarHBondContact O-N 3.07Å; E20-Y24 HydrophobicContact CG-CE2 3.96Å; E20-Y24 WeakPolarHBondContact O-CD2 3.31Å; E20-Y24 WeakPolarHBondContact O-CE2 3.23Å
21	Y	72.6	Confident	69.4	Low	57 Å²	57	70.7 Å²	70.7	22%	0.224	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-40.7	176.1	-78.2	-75.2	0	0	0	112.8	L17 L18 Q23 Y24 S25 L68	L17-Y21 HydrophobicContact CD1-CD2 4.29Å; L17-Y21 HydrophobicContact CD1-CE2 3.74Å; L17-Y21 HydrophobicContact CD2-CE2 4.32Å; L17-Y21 HydrophobicContact CG-CD2 4.1Å; L17-Y21 HydrophobicContact CG-CE2 3.73Å; L17-Y21 WeakPolarHBondContact O-CD2 3.41Å; L17-Y21 PolarHBondContact O-N 3.2Å; L18-Y21 PolarHBondContact O-N 2.94Å; Y21-Q23 VanDerWaalsContact C-N 3.28Å; Y21-Q23 PolarHBondContact O-N 2.94Å; Y21-Y24 PolarHBondContact O-N 3.26Å; Y21-S25 PolarHBondContact O-N 2.92Å; Y21-L68 HydrophobicContact CD1-CD2 4.18Å; Y21-L68 HydrophobicContact CD2-CD2 3.62Å; Y21-L68 HydrophobicContact CE1-CD2 4.23Å; Y21-L68 HydrophobicContact CE2-CD2 3.69Å; Y21-L68 HydrophobicContact CG-CD2 3.9Å
22	T	68.6	Low	70.6	Confident	28 Å²	28	67.8 Å²	67.8	17%	0.172	35%	0.349	C	S	.	.	H	α-helix	trans	-68.6	-22.5	179.2	48.6	0	0	0	0	113.8	L18 Q19 E20 Y24 S25 F63 L64 L139	L18-T22 WeakPolarHBondContact O-CG2 3.3Å; L18-T22 PolarHBondContact O-N 3.18Å; L18-T22 PolarHBondContact O-OG1 2.91Å; L18-T22 VanDerWaalsContact O-OG1 3.11Å; Q19-T22 WeakPolarHBondContact CA-OG1 3.48Å; Q19-T22 PolarHBondContact O-OG1 3.08Å; E20-T22 VanDerWaalsContact C-N 3.35Å; E20-T22 PolarHBondContact O-N 2.99Å; T22-Y24 VanDerWaalsContact C-N 3.26Å; T22-Y24 PolarHBondContact O-N 2.68Å; T22-S25 PolarHBondContact O-N 3.49Å; T22-F63 HydrophobicContact CG2-CE1 3.55Å; T22-F63 HydrophobicContact CG2-CZ 3.93Å; T22-L64 HydrophobicContact CG2-CD2 3.43Å; T22-L64 VanDerWaalsContact CG2-CD2 3.43Å; T22-L139 HydrophobicContact CG2-CB 4.48Å; T22-L139 HydrophobicContact CG2-CD1 3.91Å
23	Q	65.9	Low	72	Confident	150 Å²	150	65.1 Å²	65.1	70%	0.701	33%	0.329	S	S	*	.	H	α-helix	trans	-68.2	-25.7	175.9	-76.9	172.8	32.3	0	0	113.4	Q19 E20 Y21	Q19-Q23 WeakPolarHBondContact O-CG 3.27Å; Q19-Q23 PolarHBondContact O-N 3.36Å; E20-Q23 WeakPolarHBondContact O-CB 3.33Å; E20-Q23 PolarHBondContact O-N 3.07Å; Y21-Q23 VanDerWaalsContact C-N 3.28Å; Y21-Q23 PolarHBondContact O-N 2.94Å
24	Y	68.5	Low	73.2	Confident	170 Å²	170	67.1 Å²	67.1	67%	0.667	33%	0.326	S	S	*	.	H	α-helix	trans	-95.7	-13.4	-179.5	-59.6	-72	0	0	0	113.2	E20 Y21 T22	E20-Y24 HydrophobicContact CG-CE2 3.96Å; E20-Y24 WeakPolarHBondContact O-CD2 3.31Å; E20-Y24 WeakPolarHBondContact O-CE2 3.23Å; Y21-Y24 PolarHBondContact O-N 3.26Å; T22-Y24 VanDerWaalsContact C-N 3.26Å; T22-Y24 PolarHBondContact O-N 2.68Å
25	S	74.9	Confident	74.2	Confident	17 Å²	17	67.6 Å²	67.6	12%	0.119	33%	0.328	C	S	.	.			trans	-75.1	135.8	175.9	-179.2	0	0	0	0	111.7	Y21 T22 K27 F63	Y21-S25 PolarHBondContact O-N 2.92Å; T22-S25 PolarHBondContact O-N 3.49Å; S25-K27 PolarHBondContact OG-N 3.05Å; S25-F63 WeakPolarHBondContact CB-O 3.31Å; S25-F63 PolarHBondContact OG-O 2.74Å
26	T	75.3	Confident	75.1	Confident	115 Å²	115	66.6 Å²	66.6	71%	0.706	32%	0.324	S	S	*	.			trans	-93.1	-16.1	174.5	68.3	0	0	0	0	112.9	E65	T26-E65 WeakPolarHBondContact CA-OE2 2.88Å; T26-E65 WeakPolarHBondContact CB-OE2 3.46Å; T26-E65 PolarHBondContact N-OE2 2.8Å; T26-E65 PolarHBondContact OG1-OE1 2.74Å; T26-E65 PolarHBondContact OG1-OE2 3.3Å
27	K	76.5	Confident	76.2	Confident	51 Å²	51	70.1 Å²	70.1	22%	0.222	33%	0.331	C	S	.	.			trans	-82.3	141.8	178.1	-70.5	-159.9	179.2	-170.5	0	112	S25 V32 E35 T62 E65	S25-K27 PolarHBondContact OG-N 3.05Å; K27-V32 HydrophobicContact CB-CG2 4.19Å; K27-V32 HydrophobicContact CD-CG2 4.25Å; K27-E35 IonicContact NZ-OE1 2.82Å; K27-E35 PolarHBondContact NZ-OE1 2.75Å; K27-T62 HydrophobicContact CD-CG2 4.42Å; K27-E65 HydrophobicContact CG-CG 4.25Å
28	K	80.3	Confident	76.7	Confident	102 Å²	102	70.6 Å²	70.6	44%	0.443	35%	0.35	S	S	.	.			trans	-95.3	158.3	165.6	-61.4	-60.1	179.1	-165.3	0	111	K30 D31 V32 E140	K28-K30 PolarHBondContact O-N 3.04Å; K28-K30 VanDerWaalsContact O-N 3.16Å; K28-D31 WeakPolarHBondContact CB-OD2 3.47Å; K28-D31 PolarHBondContact N-OD2 3.34Å; K28-D31 WeakPolarHBondContact O-CA 3.4Å; K28-D31 WeakPolarHBondContact O-CB 3.33Å; K28-D31 PolarHBondContact O-N 2.94Å; K28-V32 PolarHBondContact O-N 3.27Å; K28-V32 VanDerWaalsContact O-N 3.08Å; K28-E140 WeakPolarHBondContact CA-OE1 3.5Å
29	L	79.9	Confident	77	Confident	1 Å²	1	79.1 Å²	79.1	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-49.4	-42.1	173.2	-89.1	153.1	0	0	0	112.3	D31 V32 L33 F59 F63 V133 L136 S137 E140	L29-D31 PolarHBondContact O-N 2.85Å; L29-V32 PolarHBondContact O-N 2.62Å; L29-L33 WeakPolarHBondContact O-CB 3.35Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.29Å; L29-L33 PolarHBondContact O-N 3.22Å; L29-F59 HydrophobicContact CD2-CZ 4.01Å; L29-F63 HydrophobicContact CD1-CE2 4.35Å; L29-F63 HydrophobicContact CD1-CZ 4.46Å; L29-F63 HydrophobicContact CD2-CD2 4.43Å; L29-F63 HydrophobicContact CD2-CE2 4.35Å; L29-F63 HydrophobicContact CG-CD2 4.16Å; L29-F63 HydrophobicContact CG-CE2 3.69Å; L29-F63 HydrophobicContact CG-CZ 4.23Å; L29-V133 HydrophobicContact CD2-CB 4.45Å; L29-V133 HydrophobicContact CD2-CG1 4.25Å; L29-V133 HydrophobicContact CD2-CG2 4.3Å; L29-L136 VanDerWaalsContact CD1-C 3.46Å; L29-L136 HydrophobicContact CD1-CB 3.76Å; L29-L136 HydrophobicContact CD2-CB 4.1Å; L29-L136 HydrophobicContact CD2-CD1 4.31Å; L29-L136 HydrophobicContact CG-CB 4.35Å; L29-S137 VanDerWaalsContact CD1-CA 3.5Å; L29-S137 VanDerWaalsContact CD1-N 3.28Å; L29-E140 HydrophobicContact CD1-CG 4.38Å; L29-E140 PolarHBondContact N-OE1 2.82Å
30	K	79	Confident	77.7	Confident	138 Å²	138	76.1 Å²	76.1	60%	0.6	39%	0.386	S	S	*	.	H	α-helix	trans	-60.9	-31.5	176.6	-172.3	-178.9	177.4	-176.8	0	113.5	K28 Q34	K28-K30 PolarHBondContact O-N 3.04Å; K28-K30 VanDerWaalsContact O-N 3.16Å; K30-Q34 WeakPolarHBondContact O-CG 3.4Å; K30-Q34 PolarHBondContact O-NE2 2.78Å; K30-Q34 VanDerWaalsContact O-NE2 3.07Å
31	D	82.1	Confident	78.3	Confident	68 Å²	68	75.5 Å²	75.5	36%	0.364	39%	0.389	S	S	.	.	H	α-helix	trans	-76.6	-39.7	177.4	-52.5	-42.9	0	0	0	110.2	K28 L29 Q34	K28-D31 WeakPolarHBondContact CB-OD2 3.47Å; K28-D31 PolarHBondContact N-OD2 3.34Å; K28-D31 WeakPolarHBondContact O-CA 3.4Å; K28-D31 WeakPolarHBondContact O-CB 3.33Å; K28-D31 PolarHBondContact O-N 2.94Å; L29-D31 PolarHBondContact O-N 2.85Å; D31-Q34 WeakPolarHBondContact O-CB 3.28Å; D31-Q34 PolarHBondContact O-N 2.85Å
32	V	83.9	Confident	78.8	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-67.4	-38.1	176.5	-177.1	0	0	0	0	111.8	K27 K28 L29 Q34 E35 L42 F59 T62 F63	K27-V32 HydrophobicContact CB-CG2 4.19Å; K27-V32 HydrophobicContact CD-CG2 4.25Å; K28-V32 PolarHBondContact O-N 3.27Å; K28-V32 VanDerWaalsContact O-N 3.08Å; L29-V32 PolarHBondContact O-N 2.62Å; V32-Q34 PolarHBondContact O-N 3.07Å; V32-E35 VanDerWaalsContact O-CB 3.23Å; V32-E35 WeakPolarHBondContact O-CB 3.43Å; V32-E35 PolarHBondContact O-N 3.16Å; V32-L42 HydrophobicContact CG1-CD1 3.92Å; V32-F59 HydrophobicContact CG1-CD2 3.9Å; V32-F59 HydrophobicContact CG1-CE2 3.73Å; V32-F59 HydrophobicContact CG1-CZ 4.43Å; V32-T62 HydrophobicContact CG1-CG2 4.08Å; V32-T62 HydrophobicContact CG2-CG2 4.42Å; V32-F63 HydrophobicContact CG2-CB 4.01Å; V32-F63 HydrophobicContact CG2-CD2 3.98Å
33	L	83.1	Confident	79.5	Confident	40 Å²	40	73.4 Å²	73.4	21%	0.209	39%	0.386	C	S	.	.	H	α-helix	trans	-64	-26.9	177	-71.8	173.5	0	0	0	112.6	L29 E35 F36 L129 V133 F150	L29-L33 WeakPolarHBondContact O-CB 3.35Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.29Å; L29-L33 PolarHBondContact O-N 3.22Å; L33-E35 PolarHBondContact O-N 3.03Å; L33-F36 HydrophobicContact CD2-CD2 4.46Å; L33-F36 HydrophobicContact CD2-CE2 4.33Å; L33-F36 PolarHBondContact O-N 3.39Å; L33-L129 HydrophobicContact CD2-CD2 4.41Å; L33-V133 HydrophobicContact CD1-CG1 4.17Å; L33-V133 HydrophobicContact CD2-CG2 3.9Å; L33-F150 HydrophobicContact CD1-CE2 4.1Å; L33-F150 HydrophobicContact CD1-CZ 4.15Å
34	Q	82.8	Confident	80.1	Confident	114 Å²	114	73.6 Å²	73.6	53%	0.533	39%	0.385	S	S	.	.	H	α-helix	trans	-68.9	-23.7	173.3	-72	167.5	53.5	0	0	112.6	K30 D31 V32 F36 H37	K30-Q34 WeakPolarHBondContact O-CG 3.4Å; K30-Q34 PolarHBondContact O-NE2 2.78Å; K30-Q34 VanDerWaalsContact O-NE2 3.07Å; D31-Q34 WeakPolarHBondContact O-CB 3.28Å; D31-Q34 PolarHBondContact O-N 2.85Å; V32-Q34 PolarHBondContact O-N 3.07Å; Q34-F36 PolarHBondContact O-N 2.83Å; Q34-H37 PolarHBondContact O-N 3.29Å; Q34-H37 VanDerWaalsContact O-N 3.13Å
35	E	84.5	Confident	80.7	Confident	48 Å²	48	67.2 Å²	67.2	22%	0.224	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-10.2	-179.9	-56.7	-81	-177.4	0	0	112.9	K27 V32 L33 G40 V41 L42 A43 T62	K27-E35 IonicContact NZ-OE1 2.82Å; K27-E35 PolarHBondContact NZ-OE1 2.75Å; V32-E35 VanDerWaalsContact O-CB 3.23Å; V32-E35 WeakPolarHBondContact O-CB 3.43Å; V32-E35 PolarHBondContact O-N 3.16Å; L33-E35 PolarHBondContact O-N 3.03Å; E35-G40 CarbonylContact O-C 3.57Å; E35-G40 VanDerWaalsContact O-C 3.24Å; E35-G40 VanDerWaalsContact O-CA 3.29Å; E35-G40 WeakPolarHBondContact O-CA 3.06Å; E35-V41 HydrophobicContact CB-CG2 4.12Å; E35-V41 HydrophobicContact CG-CG2 4.33Å; E35-V41 PolarHBondContact OE2-N 2.84Å; E35-L42 HydrophobicContact CB-CB 4.3Å; E35-L42 HydrophobicContact CB-CD1 4.24Å; E35-L42 CarbonylContact O-C 3.56Å; E35-L42 WeakPolarHBondContact O-CA 3.37Å; E35-L42 WeakPolarHBondContact O-CB 3.36Å; E35-L42 PolarHBondContact O-N 3.02Å; E35-A43 PolarHBondContact O-N 2.82Å; E35-A43 VanDerWaalsContact O-N 3.09Å; E35-T62 HydrophobicContact CG-CG2 4.2Å
36	F	83.3	Confident	80.7	Confident	9 Å²	9	69.7 Å²	69.7	4%	0.039	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.3	171.1	-76.3	-94.5	0	0	0	113.1	L33 Q34 L42 P47 F59 L129	L33-F36 HydrophobicContact CD2-CD2 4.46Å; L33-F36 HydrophobicContact CD2-CE2 4.33Å; L33-F36 PolarHBondContact O-N 3.39Å; Q34-F36 PolarHBondContact O-N 2.83Å; F36-L42 HydrophobicContact CD1-CB 4.01Å; F36-L42 HydrophobicContact CD2-CB 3.97Å; F36-L42 HydrophobicContact CD2-CD1 3.97Å; F36-L42 HydrophobicContact CE1-CB 4.11Å; F36-L42 HydrophobicContact CE2-CB 4.09Å; F36-L42 HydrophobicContact CE2-CD1 3.5Å; F36-L42 HydrophobicContact CE2-CG 4.32Å; F36-L42 HydrophobicContact CG-CB 3.94Å; F36-L42 HydrophobicContact CZ-CB 4.15Å; F36-L42 HydrophobicContact CZ-CD1 3.89Å; F36-L42 HydrophobicContact CZ-CD2 4.38Å; F36-L42 HydrophobicContact CZ-CG 4.37Å; F36-P47 HydrophobicContact CB-CB 4.26Å; F36-P47 HydrophobicContact CB-CG 4.08Å; F36-P47 HydrophobicContact CD1-CB 3.91Å; F36-P47 HydrophobicContact CD1-CG 4.32Å; F36-P47 HydrophobicContact CE1-CB 4.41Å; F36-P47 HydrophobicContact CG-CB 4.04Å; F36-P47 HydrophobicContact CG-CG 4.36Å; F36-F59 AromaticContact CE2-CD2 3.73Å; F36-F59 HydrophobicContact CE2-CD2 3.73Å; F36-F59 AromaticContact CE2-CE2 3.96Å; F36-F59 HydrophobicContact CE2-CE2 3.96Å; F36-F59 AromaticContact CZ-CD2 3.81Å; F36-F59 HydrophobicContact CZ-CD2 3.81Å; F36-F59 HydrophobicContact CZ-CE2 4.33Å; F36-L129 HydrophobicContact CD1-CD2 4.43Å; F36-L129 HydrophobicContact CE1-CD2 3.7Å; F36-L129 HydrophobicContact CE2-CD1 4.47Å; F36-L129 HydrophobicContact CE2-CD2 3.81Å; F36-L129 HydrophobicContact CZ-CD1 3.86Å; F36-L129 HydrophobicContact CZ-CD2 3.35Å; F36-L129 HydrophobicContact CZ-CG 4.27Å
37	H	81.5	Confident	80.4	Confident	126 Å²	126	65.7 Å²	65.7	58%	0.583	35%	0.348	S	S	*	.	S	Bend	trans	-119.4	154.6	-177.2	-56.1	-63.3	0	0	0	111.6	Q34 G40	Q34-H37 PolarHBondContact O-N 3.29Å; Q34-H37 VanDerWaalsContact O-N 3.13Å; H37-G40 PolarHBondContact O-N 2.82Å
38	G	81.3	Confident	79.9	Confident	68 Å²	68	70 Å²	70	70%	0.701	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-134.2	178.6	0	0	0	0	0	112.9	G40 A43	G38-G40 VanDerWaalsContact C-N 3.29Å; G38-G40 PolarHBondContact O-N 3.15Å; G38-A43 VanDerWaalsContact O-CB 3.25Å; G38-A43 WeakPolarHBondContact O-CB 3.4Å
39	D	77	Confident	79.5	Confident	180 Å²	180	70.9 Å²	70.9	96%	0.963	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	19.5	178.8	-61.9	-38.5	0	0	0	112.9
40	G	79.9	Confident	79.5	Confident	16 Å²	16	74.9 Å²	74.9	17%	0.165	40%	0.396	C	S	.	.			trans	-67.6	158.4	-177	0	0	0	0	0	114	E35 H37 G38 L42 A43	E35-G40 CarbonylContact O-C 3.57Å; E35-G40 VanDerWaalsContact O-C 3.24Å; E35-G40 VanDerWaalsContact O-CA 3.29Å; E35-G40 WeakPolarHBondContact O-CA 3.06Å; H37-G40 PolarHBondContact O-N 2.82Å; G38-G40 VanDerWaalsContact C-N 3.29Å; G38-G40 PolarHBondContact O-N 3.15Å; G40-L42 PolarHBondContact O-N 3.02Å; G40-L42 VanDerWaalsContact O-N 3.15Å; G40-A43 WeakPolarHBondContact O-CB 3.42Å; G40-A43 PolarHBondContact O-N 2.73Å
41	V	82.8	Confident	79.8	Confident	87 Å²	87	68.5 Å²	68.5	53%	0.527	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-18.3	-175.2	-67.1	0	0	0	0	114	E35 T62	E35-V41 HydrophobicContact CB-CG2 4.12Å; E35-V41 HydrophobicContact CG-CG2 4.33Å; E35-V41 PolarHBondContact OE2-N 2.84Å; V41-T62 HydrophobicContact CG2-CG2 3.99Å
42	L	84.1	Confident	80	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	2.9	177.5	-69.8	164.4	0	0	0	112.7	V32 E35 F36 G40 K44 Y45 V58 F59	V32-L42 HydrophobicContact CG1-CD1 3.92Å; E35-L42 HydrophobicContact CB-CB 4.3Å; E35-L42 HydrophobicContact CB-CD1 4.24Å; E35-L42 CarbonylContact O-C 3.56Å; E35-L42 WeakPolarHBondContact O-CA 3.37Å; E35-L42 WeakPolarHBondContact O-CB 3.36Å; E35-L42 PolarHBondContact O-N 3.02Å; F36-L42 HydrophobicContact CD1-CB 4.01Å; F36-L42 HydrophobicContact CD2-CB 3.97Å; F36-L42 HydrophobicContact CD2-CD1 3.97Å; F36-L42 HydrophobicContact CE1-CB 4.11Å; F36-L42 HydrophobicContact CE2-CB 4.09Å; F36-L42 HydrophobicContact CE2-CD1 3.5Å; F36-L42 HydrophobicContact CE2-CG 4.32Å; F36-L42 HydrophobicContact CG-CB 3.94Å; F36-L42 HydrophobicContact CZ-CB 4.15Å; F36-L42 HydrophobicContact CZ-CD1 3.89Å; F36-L42 HydrophobicContact CZ-CD2 4.38Å; F36-L42 HydrophobicContact CZ-CG 4.37Å; G40-L42 PolarHBondContact O-N 3.02Å; G40-L42 VanDerWaalsContact O-N 3.15Å; L42-K44 PolarHBondContact O-N 2.91Å; L42-Y45 HydrophobicContact CD2-CD2 3.97Å; L42-Y45 HydrophobicContact CD2-CE2 4.34Å; L42-Y45 PolarHBondContact O-N 2.79Å; L42-V58 HydrophobicContact CD2-CB 4Å; L42-V58 HydrophobicContact CD2-CG1 3.59Å; L42-V58 HydrophobicContact CG-CG1 4.31Å; L42-F59 HydrophobicContact CD1-CB 4.4Å; L42-F59 HydrophobicContact CD1-CD2 3.93Å; L42-F59 HydrophobicContact CD2-CB 4.23Å
43	A	82.1	Confident	80.1	Confident	41 Å²	41	70.5 Å²	70.5	34%	0.339	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-13.1	-174.9	0	0	0	0	0	114.9	E35 G38 G40 Y45	E35-A43 PolarHBondContact O-N 2.82Å; E35-A43 VanDerWaalsContact O-N 3.09Å; G38-A43 VanDerWaalsContact O-CB 3.25Å; G38-A43 WeakPolarHBondContact O-CB 3.4Å; G40-A43 WeakPolarHBondContact O-CB 3.42Å; G40-A43 PolarHBondContact O-N 2.73Å; A43-Y45 VanDerWaalsContact C-N 3.32Å
44	K	80.1	Confident	80.2	Confident	154 Å²	154	73.6 Å²	73.6	67%	0.67	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.6	172.6	67.9	176.8	-177.1	166.3	0	113.9	L42	L42-K44 PolarHBondContact O-N 2.91Å
45	Y	80.9	Confident	80.3	Confident	36 Å²	36	68.2 Å²	68.2	14%	0.141	37%	0.365	C	S	.	.	S	Bend	trans	-106.9	144.3	176.9	-61.4	-74.9	0	0	0	109.9	L42 A43 G55	L42-Y45 HydrophobicContact CD2-CD2 3.97Å; L42-Y45 HydrophobicContact CD2-CE2 4.34Å; L42-Y45 PolarHBondContact O-N 2.79Å; A43-Y45 VanDerWaalsContact C-N 3.32Å; Y45-G55 VanDerWaalsContact CE2-CA 3.45Å; Y45-G55 VanDerWaalsContact OH-CA 3.28Å; Y45-G55 WeakPolarHBondContact OH-CA 3.35Å; Y45-G55 PolarHBondContact OH-N 2.84Å; Y45-G55 VanDerWaalsContact OH-N 3.17Å
46	N	75.4	Confident	80.5	Confident	69 Å²	69	65.9 Å²	65.9	37%	0.369	36%	0.355	S	S	.	.			trans	-89.1	120.6	173.6	-176.5	-4.5	0	0	0	108.9	E48 E49	N46-E48 PolarHBondContact O-N 2.86Å; N46-E48 PolarHBondContact OD1-N 2.99Å; N46-E48 VanDerWaalsContact OD1-N 3.09Å; N46-E49 HydrophobicContact CB-CB 4.06Å; N46-E49 HydrophobicContact CB-CG 4.04Å; N46-E49 PolarHBondContact ND2-OE1 2.79Å; N46-E49 PolarHBondContact O-N 2.85Å; N46-E49 VanDerWaalsContact O-N 3.15Å
47	P	67.6	Low	80.6	Confident	31 Å²	31	68.4 Å²	68.4	20%	0.201	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18	-179.8	26	-33.7	0	0	0	113.9	F36 L129	F36-P47 HydrophobicContact CB-CB 4.26Å; F36-P47 HydrophobicContact CB-CG 4.08Å; F36-P47 HydrophobicContact CD1-CB 3.91Å; F36-P47 HydrophobicContact CD1-CG 4.32Å; F36-P47 HydrophobicContact CE1-CB 4.41Å; F36-P47 HydrophobicContact CG-CB 4.04Å; F36-P47 HydrophobicContact CG-CG 4.36Å; P47-L129 HydrophobicContact CB-CD2 3.78Å
48	E	65.6	Low	80.9	Confident	141 Å²	141	63.9 Å²	63.9	66%	0.659	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-4.7	177.6	-58.6	-56.7	141.8	0	0	113.7	N46	N46-E48 PolarHBondContact O-N 2.86Å; N46-E48 PolarHBondContact OD1-N 2.99Å; N46-E48 VanDerWaalsContact OD1-N 3.09Å
49	E	72.8	Confident	81.3	Confident	121 Å²	121	60.7 Å²	60.7	57%	0.565	31%	0.313	S	S	*	.	S	Bend	trans	-112	166.3	-179.6	-69.1	174.8	-156.1	0	0	112.2	N46	N46-E49 HydrophobicContact CB-CB 4.06Å; N46-E49 HydrophobicContact CB-CG 4.04Å; N46-E49 PolarHBondContact ND2-OE1 2.79Å; N46-E49 PolarHBondContact O-N 2.85Å; N46-E49 VanDerWaalsContact O-N 3.15Å
50	D	80.2	Confident	81.8	Confident	84 Å²	84	52.2 Å²	52.2	45%	0.449	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	137.9	175.1	-58.9	-26.1	0	0	0	110.4	T126 V127 Q128	D50-T126 HydrophobicContact CB-CG2 4.48Å; D50-V127 CarbonylContact C-O 3.52Å; D50-V127 WeakPolarHBondContact CA-O 3.48Å; D50-Q128 WeakPolarHBondContact OD1-CG 3.4Å
51	I	84.5	Confident	82.1	Confident	4 Å²	4	54 Å²	54	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	141.8	179	82.1	179.3	0	0	0	110.2	F56 T126 V127 L129 I132	I51-F56 VanDerWaalsContact CD1-CA 3.47Å; I51-F56 HydrophobicContact CD1-CB 3.81Å; I51-F56 HydrophobicContact CD1-CD2 4.13Å; I51-F56 HydrophobicContact CG1-CB 4.21Å; I51-T126 CarbonylContact O-C 3.58Å; I51-T126 VanDerWaalsContact O-CA 3.29Å; I51-T126 WeakPolarHBondContact O-CA 3.43Å; I51-V127 HydrophobicContact CD1-CG2 4.17Å; I51-V127 HydrophobicContact CG1-CG2 3.5Å; I51-V127 VanDerWaalsContact CG1-CG2 3.5Å; I51-V127 PolarHBondContact N-O 3.38Å; I51-V127 PolarHBondContact O-N 3.19Å; I51-L129 HydrophobicContact CD1-CD1 4.16Å; I51-L129 HydrophobicContact CG2-CB 4.17Å; I51-L129 HydrophobicContact CG2-CD1 4.46Å; I51-I132 HydrophobicContact CD1-CD1 3.74Å; I51-I132 HydrophobicContact CG1-CD1 4.31Å
52	D	86.6	Confident	82.3	Confident	69 Å²	69	50.8 Å²	50.8	37%	0.369	25%	0.253	S	S	.	.			trans	-79.9	174.1	172.1	65.9	3.4	0	0	0	111.6	E54 G55 F56	D52-E54 VanDerWaalsContact C-N 3.26Å; D52-E54 PolarHBondContact O-N 2.89Å; D52-G55 PolarHBondContact O-N 2.89Å; D52-G55 PolarHBondContact OD1-N 3.41Å; D52-F56 PolarHBondContact O-N 2.9Å
53	F	86.3	Confident	82.3	Confident	42 Å²	42	50.9 Å²	50.9	18%	0.184	25%	0.253	C	S	.	.	H	α-helix	trans	-59.5	-35.8	-178.2	179.9	-114.5	0	0	0	113.1	F56 K57 Q74 F77	F53-F56 PolarHBondContact O-N 3.18Å; F53-K57 WeakPolarHBondContact O-CB 3.4Å; F53-K57 PolarHBondContact O-N 2.77Å; F53-Q74 HydrophobicContact CE1-CG 3.93Å; F53-Q74 HydrophobicContact CE2-CB 4.25Å; F53-Q74 HydrophobicContact CE2-CG 3.67Å; F53-Q74 HydrophobicContact CZ-CB 4.28Å; F53-Q74 HydrophobicContact CZ-CG 3.27Å; F53-F77 HydrophobicContact CB-CD1 4.26Å; F53-F77 HydrophobicContact CB-CD2 4.41Å; F53-F77 HydrophobicContact CB-CE1 4.03Å; F53-F77 HydrophobicContact CB-CE2 4.15Å; F53-F77 HydrophobicContact CB-CG 4.44Å; F53-F77 HydrophobicContact CB-CZ 3.96Å; F53-F77 HydrophobicContact CD2-CB 3.68Å; F53-F77 AromaticContact CD2-CD1 3.87Å; F53-F77 HydrophobicContact CD2-CD1 3.87Å; F53-F77 HydrophobicContact CD2-CD2 4Å; F53-F77 HydrophobicContact CD2-CE1 4.48Å; F53-F77 AromaticContact CD2-CG 3.59Å; F53-F77 HydrophobicContact CD2-CG 3.59Å; F53-F77 HydrophobicContact CE2-CB 4Å; F53-F77 HydrophobicContact CE2-CG 4.4Å; F53-F77 HydrophobicContact CG-CD1 4.48Å; F53-F77 HydrophobicContact CG-CG 4.49Å
54	E	85.1	Confident	82.5	Confident	104 Å²	104	49.1 Å²	49.1	49%	0.486	24%	0.238	S	C	.	.	H	α-helix	trans	-68.7	-40.6	177.2	-70.6	-59.4	142.3	0	0	111.6	D52 K57 V58	D52-E54 VanDerWaalsContact C-N 3.26Å; D52-E54 PolarHBondContact O-N 2.89Å; E54-K57 PolarHBondContact O-N 2.83Å; E54-V58 WeakPolarHBondContact O-CG2 3.3Å; E54-V58 PolarHBondContact O-N 2.61Å; E54-V58 VanDerWaalsContact O-N 3.09Å
55	G	85.4	Confident	82.6	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-41.3	173.1	0	0	0	0	0	112.7	Y45 D52 K57 V58 F59	Y45-G55 VanDerWaalsContact CE2-CA 3.45Å; Y45-G55 VanDerWaalsContact OH-CA 3.28Å; Y45-G55 WeakPolarHBondContact OH-CA 3.35Å; Y45-G55 PolarHBondContact OH-N 2.84Å; Y45-G55 VanDerWaalsContact OH-N 3.17Å; D52-G55 PolarHBondContact O-N 2.89Å; D52-G55 PolarHBondContact OD1-N 3.41Å; G55-K57 VanDerWaalsContact C-N 3.34Å; G55-K57 PolarHBondContact O-N 3.3Å; G55-V58 PolarHBondContact O-N 2.91Å; G55-F59 WeakPolarHBondContact O-CB 3.35Å; G55-F59 PolarHBondContact O-N 3.06Å
56	F	87.6	Confident	82.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-44	173.6	-178.8	-100.6	0	0	0	112.2	I51 D52 F53 F59 M60 C73 L76 F77 F80 V127 I132	I51-F56 VanDerWaalsContact CD1-CA 3.47Å; I51-F56 HydrophobicContact CD1-CB 3.81Å; I51-F56 HydrophobicContact CD1-CD2 4.13Å; I51-F56 HydrophobicContact CG1-CB 4.21Å; D52-F56 PolarHBondContact O-N 2.9Å; F53-F56 PolarHBondContact O-N 3.18Å; F56-F59 PolarHBondContact O-N 3.25Å; F56-M60 HydrophobicContact CD1-CG 4.06Å; F56-M60 HydrophobicContact CD2-CG 4.34Å; F56-M60 HydrophobicContact CE1-CG 3.63Å; F56-M60 HydrophobicContact CE2-CG 3.95Å; F56-M60 HydrophobicContact CE2-SD 4.08Å; F56-M60 HydrophobicContact CG-CG 4.4Å; F56-M60 HydrophobicContact CZ-CG 3.56Å; F56-M60 HydrophobicContact CZ-SD 3.88Å; F56-M60 WeakPolarHBondContact O-CB 3.4Å; F56-M60 VanDerWaalsContact O-CG 3.29Å; F56-M60 WeakPolarHBondContact O-CG 3.39Å; F56-M60 PolarHBondContact O-N 3.46Å; F56-C73 WeakPolarHBondContact CE1-O 3.5Å; F56-L76 HydrophobicContact CE1-CB 3.88Å; F56-L76 HydrophobicContact CZ-CB 3.81Å; F56-F77 HydrophobicContact CB-CD2 3.55Å; F56-F77 HydrophobicContact CB-CE2 3.96Å; F56-F77 HydrophobicContact CD1-CB 3.8Å; F56-F77 AromaticContact CD1-CD2 3.92Å; F56-F77 HydrophobicContact CD1-CD2 3.92Å; F56-F77 HydrophobicContact CD1-CG 4.34Å; F56-F77 HydrophobicContact CD2-CD2 4.16Å; F56-F77 HydrophobicContact CE1-CB 3.96Å; F56-F77 HydrophobicContact CG-CB 4.33Å; F56-F77 AromaticContact CG-CD2 3.61Å; F56-F77 HydrophobicContact CG-CD2 3.61Å; F56-F77 HydrophobicContact CG-CE2 4.45Å; F56-F77 HydrophobicContact CG-CG 4.45Å; F56-F80 HydrophobicContact CE2-CD2 4.2Å; F56-F80 HydrophobicContact CE2-CE2 4.39Å; F56-F80 HydrophobicContact CZ-CD2 4.43Å; F56-F80 HydrophobicContact CZ-CE2 4.46Å; F56-V127 HydrophobicContact CD2-CG2 4.34Å; F56-I132 HydrophobicContact CD2-CD1 3.49Å; F56-I132 VanDerWaalsContact CD2-CD1 3.49Å; F56-I132 HydrophobicContact CD2-CG1 4.24Å; F56-I132 HydrophobicContact CE2-CD1 3.72Å; F56-I132 HydrophobicContact CE2-CG1 3.95Å; F56-I132 HydrophobicContact CE2-CG2 3.99Å
57	K	86.6	Confident	82.9	Confident	61 Å²	61	50.6 Å²	50.6	27%	0.265	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-46.8	178.5	-172.8	177.7	179.5	179.4	0	111.9	F53 E54 G55 F59 M60 Q61	F53-K57 WeakPolarHBondContact O-CB 3.4Å; F53-K57 PolarHBondContact O-N 2.77Å; E54-K57 PolarHBondContact O-N 2.83Å; G55-K57 VanDerWaalsContact C-N 3.34Å; G55-K57 PolarHBondContact O-N 3.3Å; K57-F59 VanDerWaalsContact C-N 3.32Å; K57-F59 PolarHBondContact O-N 3.24Å; K57-M60 PolarHBondContact O-N 2.83Å; K57-Q61 WeakPolarHBondContact O-CB 3.4Å; K57-Q61 VanDerWaalsContact O-CG 3.28Å; K57-Q61 WeakPolarHBondContact O-CG 3.43Å; K57-Q61 PolarHBondContact O-N 2.67Å
58	V	87.1	Confident	83.7	Confident	32 Å²	32	50 Å²	50	19%	0.194	25%	0.247	C	C	.	.	H	α-helix	trans	-63.9	-39.7	177.4	179.1	0	0	0	0	110.8	L42 E54 G55 T62	L42-V58 HydrophobicContact CD2-CB 4Å; L42-V58 HydrophobicContact CD2-CG1 3.59Å; L42-V58 HydrophobicContact CG-CG1 4.31Å; E54-V58 WeakPolarHBondContact O-CG2 3.3Å; E54-V58 PolarHBondContact O-N 2.61Å; E54-V58 VanDerWaalsContact O-N 3.09Å; G55-V58 PolarHBondContact O-N 2.91Å; V58-T62 WeakPolarHBondContact O-CB 3.3Å; V58-T62 PolarHBondContact O-N 2.65Å; V58-T62 PolarHBondContact O-OG1 3.42Å
59	F	88.9	Confident	84.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-49.4	175.8	176.8	-90.2	0	0	0	111.6	L29 V32 F36 L42 G55 F56 K57 Q61 T62 F63 L129 I132 V133 L136	L29-F59 HydrophobicContact CD2-CZ 4.01Å; V32-F59 HydrophobicContact CG1-CD2 3.9Å; V32-F59 HydrophobicContact CG1-CE2 3.73Å; V32-F59 HydrophobicContact CG1-CZ 4.43Å; F36-F59 AromaticContact CE2-CD2 3.73Å; F36-F59 HydrophobicContact CE2-CD2 3.73Å; F36-F59 AromaticContact CE2-CE2 3.96Å; F36-F59 HydrophobicContact CE2-CE2 3.96Å; F36-F59 AromaticContact CZ-CD2 3.81Å; F36-F59 HydrophobicContact CZ-CD2 3.81Å; F36-F59 HydrophobicContact CZ-CE2 4.33Å; L42-F59 HydrophobicContact CD1-CB 4.4Å; L42-F59 HydrophobicContact CD1-CD2 3.93Å; L42-F59 HydrophobicContact CD2-CB 4.23Å; G55-F59 WeakPolarHBondContact O-CB 3.35Å; G55-F59 PolarHBondContact O-N 3.06Å; F56-F59 PolarHBondContact O-N 3.25Å; K57-F59 VanDerWaalsContact C-N 3.32Å; K57-F59 PolarHBondContact O-N 3.24Å; F59-Q61 PolarHBondContact O-N 2.83Å; F59-T62 PolarHBondContact O-N 2.79Å; F59-F63 WeakPolarHBondContact O-CB 3.28Å; F59-F63 PolarHBondContact O-N 3.28Å; F59-L129 HydrophobicContact CD2-CD1 3.85Å; F59-L129 HydrophobicContact CE2-CD1 3.78Å; F59-L129 HydrophobicContact CG-CD1 4.32Å; F59-L129 HydrophobicContact CZ-CD1 4.19Å; F59-I132 HydrophobicContact CD1-CG2 4.12Å; F59-I132 HydrophobicContact CE1-CG2 3.6Å; F59-I132 HydrophobicContact CZ-CG2 4.39Å; F59-V133 HydrophobicContact CE2-CG2 4.44Å; F59-V133 HydrophobicContact CZ-CG2 4.04Å; F59-L136 HydrophobicContact CE1-CD1 3.57Å; F59-L136 HydrophobicContact CZ-CD1 4.24Å
60	M	87.6	Confident	85	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.015	24%	0.236	C	C	.	.	H	α-helix	trans	-65.3	-39.7	179.5	-68.6	-56.3	-64.4	0	0	112.6	L18 F56 K57 T62 F63 L64 L68 L76 L136	L18-M60 HydrophobicContact CD1-CE 3.71Å; F56-M60 HydrophobicContact CD1-CG 4.06Å; F56-M60 HydrophobicContact CD2-CG 4.34Å; F56-M60 HydrophobicContact CE1-CG 3.63Å; F56-M60 HydrophobicContact CE2-CG 3.95Å; F56-M60 HydrophobicContact CE2-SD 4.08Å; F56-M60 HydrophobicContact CG-CG 4.4Å; F56-M60 HydrophobicContact CZ-CG 3.56Å; F56-M60 HydrophobicContact CZ-SD 3.88Å; F56-M60 WeakPolarHBondContact O-CB 3.4Å; F56-M60 VanDerWaalsContact O-CG 3.29Å; F56-M60 WeakPolarHBondContact O-CG 3.39Å; F56-M60 PolarHBondContact O-N 3.46Å; K57-M60 PolarHBondContact O-N 2.83Å; M60-T62 VanDerWaalsContact C-N 3.34Å; M60-F63 PolarHBondContact O-N 2.79Å; M60-L64 HydrophobicContact CE-CD1 3.87Å; M60-L64 HydrophobicContact CE-CG 4.36Å; M60-L64 VanDerWaalsContact O-CB 3.31Å; M60-L64 WeakPolarHBondContact O-CB 3.43Å; M60-L64 WeakPolarHBondContact O-CG 3.14Å; M60-L64 PolarHBondContact O-N 3.01Å; M60-L68 HydrophobicContact CB-CD1 4.25Å; M60-L68 HydrophobicContact CE-CD1 4.01Å; M60-L76 HydrophobicContact CE-CD1 4.41Å; M60-L136 HydrophobicContact CE-CD2 4.35Å; M60-L136 HydrophobicContact SD-CD1 4Å
61	Q	87.3	Confident	85	Confident	54 Å²	54	49.9 Å²	49.9	25%	0.252	25%	0.249	S	C	.	.	H	α-helix	trans	-63.1	-41.4	174.1	-75.8	177.1	-22.9	0	0	111.8	K57 F59 E65 E67	K57-Q61 WeakPolarHBondContact O-CB 3.4Å; K57-Q61 VanDerWaalsContact O-CG 3.28Å; K57-Q61 WeakPolarHBondContact O-CG 3.43Å; K57-Q61 PolarHBondContact O-N 2.67Å; F59-Q61 PolarHBondContact O-N 2.83Å; Q61-E65 VanDerWaalsContact O-CA 3.32Å; Q61-E65 WeakPolarHBondContact O-CA 3.34Å; Q61-E65 PolarHBondContact O-N 3.26Å; Q61-E67 HydrophobicContact CG-CG 4.45Å; Q61-E67 PolarHBondContact NE2-OE1 2.8Å
62	T	85.9	Confident	84.9	Confident	19 Å²	19	50.3 Å²	50.3	12%	0.117	25%	0.251	C	S	.	.	H	α-helix	trans	-68.1	-40.2	178	-54.6	0	0	0	0	111.1	K27 V32 E35 V41 V58 F59 M60	K27-T62 HydrophobicContact CD-CG2 4.42Å; V32-T62 HydrophobicContact CG1-CG2 4.08Å; V32-T62 HydrophobicContact CG2-CG2 4.42Å; E35-T62 HydrophobicContact CG-CG2 4.2Å; V41-T62 HydrophobicContact CG2-CG2 3.99Å; V58-T62 WeakPolarHBondContact O-CB 3.3Å; V58-T62 PolarHBondContact O-N 2.65Å; V58-T62 PolarHBondContact O-OG1 3.42Å; F59-T62 PolarHBondContact O-N 2.79Å; M60-T62 VanDerWaalsContact C-N 3.34Å
63	F	84.7	Confident	84.7	Confident	3 Å²	3	47.2 Å²	47.2	1%	0.013	23%	0.234	C	C	.	.	H	α-helix	trans	-71.9	-40.8	179.4	176.1	-116.5	0	0	0	113.6	T22 S25 L29 V32 F59 M60 L136	T22-F63 HydrophobicContact CG2-CE1 3.55Å; T22-F63 HydrophobicContact CG2-CZ 3.93Å; S25-F63 WeakPolarHBondContact CB-O 3.31Å; S25-F63 PolarHBondContact OG-O 2.74Å; L29-F63 HydrophobicContact CD1-CE2 4.35Å; L29-F63 HydrophobicContact CD1-CZ 4.46Å; L29-F63 HydrophobicContact CD2-CD2 4.43Å; L29-F63 HydrophobicContact CD2-CE2 4.35Å; L29-F63 HydrophobicContact CG-CD2 4.16Å; L29-F63 HydrophobicContact CG-CE2 3.69Å; L29-F63 HydrophobicContact CG-CZ 4.23Å; V32-F63 HydrophobicContact CG2-CB 4.01Å; V32-F63 HydrophobicContact CG2-CD2 3.98Å; F59-F63 WeakPolarHBondContact O-CB 3.28Å; F59-F63 PolarHBondContact O-N 3.28Å; M60-F63 PolarHBondContact O-N 2.79Å; F63-L136 HydrophobicContact CD1-CD1 3.8Å; F63-L136 HydrophobicContact CD1-CD2 4.39Å; F63-L136 HydrophobicContact CE1-CB 4.15Å; F63-L136 HydrophobicContact CE1-CD1 3.89Å; F63-L136 HydrophobicContact CE1-CD2 3.92Å; F63-L136 HydrophobicContact CE1-CG 4.21Å; F63-L136 HydrophobicContact CG-CD1 4.41Å; F63-L136 HydrophobicContact CZ-CB 4.28Å
64	L	85.3	Confident	84.5	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-90.4	-10.3	-176.7	-61.1	177.8	0	0	0	113.5	L18 T22 M60 S66 L68	L18-L64 HydrophobicContact CD1-CD1 3.92Å; L18-L64 HydrophobicContact CD1-CD2 4.27Å; T22-L64 HydrophobicContact CG2-CD2 3.43Å; T22-L64 VanDerWaalsContact CG2-CD2 3.43Å; M60-L64 HydrophobicContact CE-CD1 3.87Å; M60-L64 HydrophobicContact CE-CG 4.36Å; M60-L64 VanDerWaalsContact O-CB 3.31Å; M60-L64 WeakPolarHBondContact O-CB 3.43Å; M60-L64 WeakPolarHBondContact O-CG 3.14Å; M60-L64 PolarHBondContact O-N 3.01Å; L64-S66 PolarHBondContact O-N 2.92Å; L64-S66 VanDerWaalsContact O-N 3.07Å; L64-L68 HydrophobicContact CD1-CD1 3.67Å; L64-L68 HydrophobicContact CD1-CD2 3.54Å; L64-L68 HydrophobicContact CD1-CG 3.68Å
65	E	82.9	Confident	84.2	Confident	97 Å²	97	44.2 Å²	44.2	45%	0.453	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	27.5	-171.1	-58.6	-173.4	111.7	0	0	112.7	T26 K27 Q61	T26-E65 WeakPolarHBondContact CA-OE2 2.88Å; T26-E65 WeakPolarHBondContact CB-OE2 3.46Å; T26-E65 PolarHBondContact N-OE2 2.8Å; T26-E65 PolarHBondContact OG1-OE1 2.74Å; T26-E65 PolarHBondContact OG1-OE2 3.3Å; K27-E65 HydrophobicContact CG-CG 4.25Å; Q61-E65 VanDerWaalsContact O-CA 3.32Å; Q61-E65 WeakPolarHBondContact O-CA 3.34Å; Q61-E65 PolarHBondContact O-N 3.26Å
66	S	82.6	Confident	83.9	Confident	46 Å²	46	44.3 Å²	44.3	32%	0.322	22%	0.221	S	C	.	.	S	Bend	trans	-151.8	148.7	-175.2	-177.8	0	0	0	0	110.4	L64	L64-S66 PolarHBondContact O-N 2.92Å; L64-S66 VanDerWaalsContact O-N 3.07Å
67	E	81.3	Confident	83.7	Confident	147 Å²	147	45 Å²	45	69%	0.687	22%	0.224	S	C	*	.	P	Polyproline II helix	trans	-80.2	128.6	171.7	-60.6	-164.1	144.3	0	0	110.7	Q61	Q61-E67 HydrophobicContact CG-CG 4.45Å; Q61-E67 PolarHBondContact NE2-OE1 2.8Å
68	L	83.3	Confident	83.2	Confident	19 Å²	19	45.7 Å²	45.7	10%	0.099	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-83.8	146.7	172.7	-68.2	-178.7	0	0	0	110.7	Y21 M60 L64 E70 F72 C73 L76	Y21-L68 HydrophobicContact CD1-CD2 4.18Å; Y21-L68 HydrophobicContact CD2-CD2 3.62Å; Y21-L68 HydrophobicContact CE1-CD2 4.23Å; Y21-L68 HydrophobicContact CE2-CD2 3.69Å; Y21-L68 HydrophobicContact CG-CD2 3.9Å; M60-L68 HydrophobicContact CB-CD1 4.25Å; M60-L68 HydrophobicContact CE-CD1 4.01Å; L64-L68 HydrophobicContact CD1-CD1 3.67Å; L64-L68 HydrophobicContact CD1-CD2 3.54Å; L64-L68 HydrophobicContact CD1-CG 3.68Å; L68-E70 PolarHBondContact O-N 2.75Å; L68-F72 HydrophobicContact CB-CD1 4.34Å; L68-F72 HydrophobicContact CD1-CD1 4.27Å; L68-F72 HydrophobicContact CD1-CE1 4.2Å; L68-F72 HydrophobicContact CD2-CD1 3.96Å; L68-F72 HydrophobicContact CD2-CE1 3.84Å; L68-F72 HydrophobicContact CG-CD1 4.43Å; L68-C73 HydrophobicContact CB-CB 4.17Å; L68-L76 HydrophobicContact CD1-CD1 3.7Å
69	P	86.3	Confident	82.5	Confident	66 Å²	66	45.4 Å²	45.4	43%	0.429	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-52.6	135.3	167.5	-24.9	33.6	0	0	0	111.3	E71 F72 C73	P69-E71 PolarHBondContact O-N 2.82Å; P69-F72 HydrophobicContact CB-CB 4.18Å; P69-F72 WeakPolarHBondContact O-CB 3.47Å; P69-F72 PolarHBondContact O-N 3.05Å; P69-C73 PolarHBondContact O-N 3.48Å
70	E	80.4	Confident	81.7	Confident	121 Å²	121	46.7 Å²	46.7	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-58.6	-44.3	-170.9	-174.9	168.3	-171.4	0	0	113	L68 F72 C73 Q74	L68-E70 PolarHBondContact O-N 2.75Å; E70-F72 VanDerWaalsContact C-N 3.29Å; E70-F72 PolarHBondContact O-N 3.15Å; E70-C73 PolarHBondContact O-N 3.48Å; E70-Q74 WeakPolarHBondContact O-CB 3.37Å; E70-Q74 WeakPolarHBondContact O-CG 3.22Å; E70-Q74 PolarHBondContact O-N 2.76Å
71	E	79.3	Confident	80.7	Confident	156 Å²	156	47.5 Å²	47.5	73%	0.729	24%	0.24	S	C	*	.	H	α-helix	trans	-61.7	-37	176.2	-67.4	-156.5	158.7	0	0	112.6	P69 H75	P69-E71 PolarHBondContact O-N 2.82Å; E71-H75 PolarHBondContact O-N 2.85Å
72	F	81.8	Confident	79.4	Confident	13 Å²	13	49.9 Å²	49.9	6%	0.057	26%	0.255	C	S	.	.	H	α-helix	trans	-71.1	-41.5	178.1	176.4	-132.9	0	0	0	111.4	L10 E14 L17 L18 L68 P69 E70 H75 L76	L10-F72 HydrophobicContact CD2-CE2 4.4Å; E14-F72 HydrophobicContact CB-CD2 4.17Å; E14-F72 HydrophobicContact CB-CE2 3.57Å; E14-F72 HydrophobicContact CB-CZ 4.44Å; E14-F72 HydrophobicContact CG-CD2 3.81Å; E14-F72 HydrophobicContact CG-CE2 3.75Å; E14-F72 VanDerWaalsContact O-CZ 3.25Å; E14-F72 WeakPolarHBondContact O-CZ 3.27Å; L17-F72 HydrophobicContact CB-CZ 4.49Å; L17-F72 HydrophobicContact CD2-CD1 3.99Å; L17-F72 HydrophobicContact CD2-CE1 3.91Å; L17-F72 HydrophobicContact CD2-CG 4.35Å; L17-F72 HydrophobicContact CD2-CZ 4.25Å; L17-F72 HydrophobicContact CG-CE1 4.18Å; L17-F72 HydrophobicContact CG-CZ 4.47Å; L18-F72 HydrophobicContact CB-CZ 4.15Å; L68-F72 HydrophobicContact CB-CD1 4.34Å; L68-F72 HydrophobicContact CD1-CD1 4.27Å; L68-F72 HydrophobicContact CD1-CE1 4.2Å; L68-F72 HydrophobicContact CD2-CD1 3.96Å; L68-F72 HydrophobicContact CD2-CE1 3.84Å; L68-F72 HydrophobicContact CG-CD1 4.43Å; P69-F72 HydrophobicContact CB-CB 4.18Å; P69-F72 WeakPolarHBondContact O-CB 3.47Å; P69-F72 PolarHBondContact O-N 3.05Å; E70-F72 VanDerWaalsContact C-N 3.29Å; E70-F72 PolarHBondContact O-N 3.15Å; F72-H75 PolarHBondContact O-N 2.97Å; F72-L76 HydrophobicContact CD1-CD1 4.14Å; F72-L76 HydrophobicContact CD2-CD1 4.14Å; F72-L76 HydrophobicContact CD2-CG 4.28Å; F72-L76 HydrophobicContact CE1-CD1 3.78Å; F72-L76 HydrophobicContact CE2-CD1 3.7Å; F72-L76 HydrophobicContact CE2-CD2 4.38Å; F72-L76 HydrophobicContact CE2-CG 3.82Å; F72-L76 HydrophobicContact CG-CD1 4.33Å; F72-L76 HydrophobicContact CZ-CD1 3.55Å; F72-L76 HydrophobicContact CZ-CD2 4.5Å; F72-L76 HydrophobicContact CZ-CG 4.12Å; F72-L76 WeakPolarHBondContact O-CB 3.39Å; F72-L76 WeakPolarHBondContact O-CG 3.49Å; F72-L76 PolarHBondContact O-N 2.87Å
73	C	83.6	Confident	77.8	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-39.3	175.7	-164	0	0	0	0	111.8	F56 L68 P69 E70 F77	F56-C73 WeakPolarHBondContact CE1-O 3.5Å; L68-C73 HydrophobicContact CB-CB 4.17Å; P69-C73 PolarHBondContact O-N 3.48Å; E70-C73 PolarHBondContact O-N 3.48Å; C73-F77 WeakPolarHBondContact O-CB 3.46Å; C73-F77 PolarHBondContact O-N 3.18Å
74	Q	81.1	Confident	75.7	Confident	73 Å²	73	56.6 Å²	56.6	34%	0.341	30%	0.3	S	S	.	.	H	α-helix	trans	-64.1	-41.8	173.6	-74.7	176.6	1.7	0	0	111.7	F53 E70 F77 M78	F53-Q74 HydrophobicContact CE1-CG 3.93Å; F53-Q74 HydrophobicContact CE2-CB 4.25Å; F53-Q74 HydrophobicContact CE2-CG 3.67Å; F53-Q74 HydrophobicContact CZ-CB 4.28Å; F53-Q74 HydrophobicContact CZ-CG 3.27Å; E70-Q74 WeakPolarHBondContact O-CB 3.37Å; E70-Q74 WeakPolarHBondContact O-CG 3.22Å; E70-Q74 PolarHBondContact O-N 2.76Å; Q74-F77 PolarHBondContact O-N 2.72Å; Q74-M78 WeakPolarHBondContact O-CG 3.3Å; Q74-M78 PolarHBondContact O-N 3.18Å
75	H	79.5	Confident	73.2	Confident	11 Å²	11	62.6 Å²	62.6	5%	0.051	34%	0.339	C	S	.	.	H	α-helix	trans	-66.8	-41.5	178.3	-167.1	-159	0	0	0	112.5	W7 E14 E71 F72 F77 M78 S79	W7-H75 HydrophobicContact CE3-CB 3.75Å; W7-H75 AromaticContact CE3-CD2 3.38Å; W7-H75 AromaticContact CE3-CG 3.71Å; W7-H75 HydrophobicContact CZ3-CB 3.52Å; W7-H75 AromaticContact CZ3-CG 3.92Å; E14-H75 IonicContact OE1-CE1 3.48Å; E14-H75 IonicContact OE1-CG 2.88Å; E14-H75 IonicContact OE1-ND1 3.51Å; E14-H75 PolarHBondContact OE1-ND1 3.12Å; E14-H75 IonicContact OE2-CE1 3.42Å; E14-H75 PolarHBondContact OE2-CE1 3.32Å; E14-H75 IonicContact OE2-ND1 3.43Å; E14-H75 PolarHBondContact OE2-ND1 3.41Å; E71-H75 PolarHBondContact O-N 2.85Å; F72-H75 PolarHBondContact O-N 2.97Å; H75-F77 PolarHBondContact O-N 3Å; H75-M78 PolarHBondContact O-N 3.45Å; H75-S79 WeakPolarHBondContact O-CB 3.34Å; H75-S79 PolarHBondContact O-N 3.34Å
76	L	78.1	Confident	70.7	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-54.7	-51.9	170.6	-81.3	162.4	0	0	0	111	L10 L18 F56 M60 L68 F72 M78 S79 F80	L10-L76 HydrophobicContact CD1-CD2 3.55Å; L10-L76 HydrophobicContact CD2-CB 4.5Å; L10-L76 HydrophobicContact CD2-CD2 3.38Å; L10-L76 HydrophobicContact CD2-CG 3.76Å; L10-L76 HydrophobicContact CG-CD2 4.05Å; L18-L76 HydrophobicContact CD1-CD1 4.44Å; L18-L76 HydrophobicContact CD2-CD2 3.98Å; F56-L76 HydrophobicContact CE1-CB 3.88Å; F56-L76 HydrophobicContact CZ-CB 3.81Å; M60-L76 HydrophobicContact CE-CD1 4.41Å; L68-L76 HydrophobicContact CD1-CD1 3.7Å; F72-L76 HydrophobicContact CD1-CD1 4.14Å; F72-L76 HydrophobicContact CD2-CD1 4.14Å; F72-L76 HydrophobicContact CD2-CG 4.28Å; F72-L76 HydrophobicContact CE1-CD1 3.78Å; F72-L76 HydrophobicContact CE2-CD1 3.7Å; F72-L76 HydrophobicContact CE2-CD2 4.38Å; F72-L76 HydrophobicContact CE2-CG 3.82Å; F72-L76 HydrophobicContact CG-CD1 4.33Å; F72-L76 HydrophobicContact CZ-CD1 3.55Å; F72-L76 HydrophobicContact CZ-CD2 4.5Å; F72-L76 HydrophobicContact CZ-CG 4.12Å; F72-L76 WeakPolarHBondContact O-CB 3.39Å; F72-L76 WeakPolarHBondContact O-CG 3.49Å; F72-L76 PolarHBondContact O-N 2.87Å; L76-M78 PolarHBondContact O-N 3Å; L76-S79 PolarHBondContact O-N 2.99Å; L76-S79 PolarHBondContact O-OG 2.94Å; L76-F80 WeakPolarHBondContact O-CD2 3.37Å
77	F	83.2	Confident	68.1	Low	16 Å²	16	70.5 Å²	70.5	7%	0.07	38%	0.379	C	S	.	.	H	α-helix	trans	-57.3	-51.5	178.5	-178.3	-102.4	0	0	0	112.3	F53 F56 C73 Q74 H75 S79 F80 S81 V127	F53-F77 HydrophobicContact CB-CD1 4.26Å; F53-F77 HydrophobicContact CB-CD2 4.41Å; F53-F77 HydrophobicContact CB-CE1 4.03Å; F53-F77 HydrophobicContact CB-CE2 4.15Å; F53-F77 HydrophobicContact CB-CG 4.44Å; F53-F77 HydrophobicContact CB-CZ 3.96Å; F53-F77 HydrophobicContact CD2-CB 3.68Å; F53-F77 AromaticContact CD2-CD1 3.87Å; F53-F77 HydrophobicContact CD2-CD1 3.87Å; F53-F77 HydrophobicContact CD2-CD2 4Å; F53-F77 HydrophobicContact CD2-CE1 4.48Å; F53-F77 AromaticContact CD2-CG 3.59Å; F53-F77 HydrophobicContact CD2-CG 3.59Å; F53-F77 HydrophobicContact CE2-CB 4Å; F53-F77 HydrophobicContact CE2-CG 4.4Å; F53-F77 HydrophobicContact CG-CD1 4.48Å; F53-F77 HydrophobicContact CG-CG 4.49Å; F56-F77 HydrophobicContact CB-CD2 3.55Å; F56-F77 HydrophobicContact CB-CE2 3.96Å; F56-F77 HydrophobicContact CD1-CB 3.8Å; F56-F77 AromaticContact CD1-CD2 3.92Å; F56-F77 HydrophobicContact CD1-CD2 3.92Å; F56-F77 HydrophobicContact CD1-CG 4.34Å; F56-F77 HydrophobicContact CD2-CD2 4.16Å; F56-F77 HydrophobicContact CE1-CB 3.96Å; F56-F77 HydrophobicContact CG-CB 4.33Å; F56-F77 AromaticContact CG-CD2 3.61Å; F56-F77 HydrophobicContact CG-CD2 3.61Å; F56-F77 HydrophobicContact CG-CE2 4.45Å; F56-F77 HydrophobicContact CG-CG 4.45Å; C73-F77 WeakPolarHBondContact O-CB 3.46Å; C73-F77 PolarHBondContact O-N 3.18Å; Q74-F77 PolarHBondContact O-N 2.72Å; H75-F77 PolarHBondContact O-N 3Å; F77-S79 PolarHBondContact O-N 2.82Å; F77-F80 PolarHBondContact O-N 2.89Å; F77-S81 PolarHBondContact O-N 3.46Å; F77-S81 PolarHBondContact O-OG 2.87Å; F77-V127 HydrophobicContact CD2-CB 4.5Å; F77-V127 HydrophobicContact CD2-CG1 3.83Å; F77-V127 HydrophobicContact CD2-CG2 3.78Å; F77-V127 HydrophobicContact CE1-CG1 4.43Å; F77-V127 HydrophobicContact CE2-CB 4.18Å; F77-V127 HydrophobicContact CE2-CG1 3.65Å; F77-V127 HydrophobicContact CE2-CG2 3.48Å; F77-V127 VanDerWaalsContact CE2-CG2 3.48Å; F77-V127 HydrophobicContact CG-CG1 4.33Å; F77-V127 HydrophobicContact CZ-CG1 3.97Å; F77-V127 HydrophobicContact CZ-CG2 4.42Å
78	M	77.4	Confident	65.5	Low	74 Å²	74	68.7 Å²	68.7	37%	0.365	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-31	-179	-71.4	-166.5	74.6	0	0	113.4	W7 Q74 H75 L76 F80 S81	W7-M78 HydrophobicContact CB-CB 4.38Å; W7-M78 HydrophobicContact CB-CE 4.08Å; W7-M78 HydrophobicContact CB-SD 4.16Å; W7-M78 HydrophobicContact CD2-SD 3.94Å; W7-M78 HydrophobicContact CE3-SD 3.69Å; W7-M78 HydrophobicContact CG-CE 4.37Å; W7-M78 HydrophobicContact CG-SD 4.12Å; W7-M78 HydrophobicContact CZ3-SD 4.42Å; Q74-M78 WeakPolarHBondContact O-CG 3.3Å; Q74-M78 PolarHBondContact O-N 3.18Å; H75-M78 PolarHBondContact O-N 3.45Å; L76-M78 PolarHBondContact O-N 3Å; M78-F80 PolarHBondContact O-N 3.27Å; M78-S81 PolarHBondContact O-N 2.78Å
79	S	72	Confident	63.1	Low	27 Å²	27	74 Å²	74	19%	0.189	42%	0.418	C	S	.	.	H	α-helix	trans	-64.9	-26.5	175.9	77.3	0	0	0	0	113	H75 L76 F77	H75-S79 WeakPolarHBondContact O-CB 3.34Å; H75-S79 PolarHBondContact O-N 3.34Å; L76-S79 PolarHBondContact O-N 2.99Å; L76-S79 PolarHBondContact O-OG 2.94Å; F77-S79 PolarHBondContact O-N 2.82Å
80	F	71.8	Confident	60.4	Low	27 Å²	27	76.2 Å²	76.2	12%	0.118	44%	0.435	C	S	.	.	H	α-helix	trans	-91	-19.9	174.8	-64.5	-71.1	0	0	0	113.3	F56 L76 F77 M78 V127 D131 I132 Y135	F56-F80 HydrophobicContact CE2-CD2 4.2Å; F56-F80 HydrophobicContact CE2-CE2 4.39Å; F56-F80 HydrophobicContact CZ-CD2 4.43Å; F56-F80 HydrophobicContact CZ-CE2 4.46Å; L76-F80 WeakPolarHBondContact O-CD2 3.37Å; F77-F80 PolarHBondContact O-N 2.89Å; M78-F80 PolarHBondContact O-N 3.27Å; F80-V127 HydrophobicContact CB-CB 4.06Å; F80-V127 HydrophobicContact CB-CG1 3.8Å; F80-D131 HydrophobicContact CD1-CB 4.4Å; F80-I132 HydrophobicContact CB-CG1 4.47Å; F80-I132 HydrophobicContact CD1-CG1 4.27Å; F80-I132 HydrophobicContact CD2-CG1 4Å; F80-I132 HydrophobicContact CE2-CG1 4.32Å; F80-I132 HydrophobicContact CG-CG1 4Å; F80-Y135 HydrophobicContact CE1-CD1 4.3Å; F80-Y135 HydrophobicContact CE1-CD2 4.29Å; F80-Y135 AromaticContact CE1-CG 3.85Å; F80-Y135 HydrophobicContact CE1-CG 3.85Å; F80-Y135 AromaticContact CZ-CD1 3.73Å; F80-Y135 HydrophobicContact CZ-CD1 3.73Å; F80-Y135 HydrophobicContact CZ-CD2 4.48Å; F80-Y135 HydrophobicContact CZ-CE1 4.42Å; F80-Y135 AromaticContact CZ-CG 3.76Å; F80-Y135 HydrophobicContact CZ-CG 3.76Å
81	S	67.6	Low	58	Low	19 Å²	19	76 Å²	76	13%	0.133	45%	0.447	C	S	.	.	H	α-helix	trans	-79.9	-19.1	-176.2	-47.5	0	0	0	0	115	F77 M78 K83 V127	F77-S81 PolarHBondContact O-N 3.46Å; F77-S81 PolarHBondContact O-OG 2.87Å; M78-S81 PolarHBondContact O-N 2.78Å; S81-K83 PolarHBondContact O-N 3.06Å; S81-V127 WeakPolarHBondContact OG-CG1 3.38Å
82	N	58.8	Low	55.6	Low	104 Å²	104	72.8 Å²	72.8	56%	0.556	45%	0.448	S	S	*	.			trans	-96.7	78.7	-164.4	-142.3	3.2	0	0	0	112.8
83	K	52.3	Low	53.1	Low	101 Å²	101	80.4 Å²	80.4	44%	0.439	49%	0.489	S	S	.	.			trans	-98.1	110.2	174.9	-69.3	-172.4	-178.1	179.9	0	112.1	S81 D131	S81-K83 PolarHBondContact O-N 3.06Å; K83-D131 WeakPolarHBondContact CE-OD2 3.48Å; K83-D131 IonicContact NZ-OD1 3.93Å; K83-D131 IonicContact NZ-OD2 2.65Å; K83-D131 PolarHBondContact NZ-OD2 3.46Å
84	G	41.5	Very low	50.5	Low	63 Å²	63	89.6 Å²	89.6	65%	0.649	53%	0.528	S	S	*	.			trans	-167.7	126.3	162.6	0	0	0	0	0	112.4	K86	G84-K86 PolarHBondContact O-N 3.35Å
85	P	32.8	Very low	47.9	Very low	129 Å²	129	92.1 Å²	92.1	84%	0.838	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-70.3	128.2	176	27.4	-30.4	0	0	0	110.3
86	K	31	Very low	45.4	Very low	184 Å²	184	103.6 Å²	103.6	80%	0.8	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-69	128.5	167	-75	179.4	178.7	170.8	0	108.7	G84 S88	G84-K86 PolarHBondContact O-N 3.35Å; K86-S88 PolarHBondContact O-N 2.84Å
87	P	27.6	Very low	42.9	Very low	125 Å²	125	109.9 Å²	109.9	81%	0.812	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-66.3	133.6	173.3	25.7	-30.6	0	0	0	110.1
88	S	27	Very low	40	Very low	109 Å²	109	114.1 Å²	114.1	76%	0.762	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-59.9	140.8	-179.3	-29	0	0	0	0	111.5	K86 S90	K86-S88 PolarHBondContact O-N 2.84Å; S88-S90 PolarHBondContact O-N 3.46Å; S88-S90 VanDerWaalsContact O-N 3.12Å
89	P	31.7	Very low	37.6	Very low	129 Å²	129	115.4 Å²	115.4	84%	0.838	69%	0.686	S	S	*	*			trans	-73.8	107.5	171.6	28.9	-29.1	0	0	0	109	S91	P89-S91 PolarHBondContact O-N 3.13Å
90	S	29.9	Very low	35.4	Very low	113 Å²	113	119.1 Å²	119.1	79%	0.79	71%	0.712	S	S	*	*			trans	-61.4	128.9	172.7	54.4	0	0	0	0	110.9	S88 A92	S88-S90 PolarHBondContact O-N 3.46Å; S88-S90 VanDerWaalsContact O-N 3.12Å; S90-A92 PolarHBondContact O-N 3.25Å
91	S	30.4	Very low	33.2	Very low	116 Å²	116	125.4 Å²	125.4	81%	0.811	75%	0.747	S	S	*	*			trans	-56.4	114.7	170.8	50.1	0	0	0	0	113	P89	P89-S91 PolarHBondContact O-N 3.13Å
92	A	29	Very low	31.2	Very low	90 Å²	90	131.5 Å²	131.5	74%	0.744	78%	0.778	S	S	*	*			trans	174.7	101.7	136.3	0	0	0	0	0	110.7	S90	S90-A92 PolarHBondContact O-N 3.25Å
93	D	29	Very low	29.6	Very low	172 Å²	172	134.6 Å²	134.6	92%	0.92	79%	0.794	S	S	*	*			trans	-141.8	96.4	147.3	-103.5	-27.7	0	0	0	108.4
94	K	28.4	Very low	28.2	Very low	198 Å²	198	132.9 Å²	132.9	86%	0.861	80%	0.804	S	S	*	*			trans	-113.8	132.7	156.9	-85.1	-173.9	178.6	176.6	0	106.7
95	P	27.5	Very low	27.4	Very low	126 Å²	126	136.9 Å²	136.9	82%	0.818	81%	0.81	S	S	*	*			trans	-76.5	130.4	177.6	31.1	-30.6	0	0	0	109.1
96	R	25.7	Very low	27.1	Very low	251 Å²	251	139.5 Å²	139.5	95%	0.947	81%	0.808	S	S	*	*			trans	-129.1	129.5	163.2	-101.1	-174.9	174.8	174.8	-1.8	111.4
97	V	25.6	Very low	26.7	Very low	135 Å²	135	138 Å²	138	82%	0.818	81%	0.809	S	S	*	*			trans	-70.2	130.5	-178.5	169	0	0	0	0	110.6
98	S	24.1	Very low	26.7	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	81%	0.812	S	S	*	*			trans	21.5	126.9	156.3	63	0	0	0	0	121.1
99	A	26.4	Very low	26.5	Very low	101 Å²	101	143.6 Å²	143.6	84%	0.835	81%	0.813	S	S	*	*				-163.8	139.2	121.2	0	0	0	0	0	110.7
100	S	24.5	Very low	26.2	Very low	105 Å²	105	142 Å²	142	73%	0.734	81%	0.805	S	S	*	*			trans	-62.3	147.9	-179	40.3	0	0	0	0	115.7
101	N	26.8	Very low	25.9	Very low	159 Å²	159	144.2 Å²	144.2	85%	0.85	81%	0.808	S	S	*	*				-174	142.6	116.1	-92.3	-7	0	0	0	113.2
102	D	24.7	Very low	25.8	Very low	147 Å²	147	144.1 Å²	144.1	79%	0.786	81%	0.807	S	S	*	*			trans	-38.7	146.4	174	-94.9	-44.4	0	0	0	117.4
103	L	25.9	Very low	25.7	Very low	169 Å²	169	146 Å²	146	89%	0.885	81%	0.81	S	S	*	*				-174.3	147.5	97.5	-107.5	119.2	0	0	0	111.2
104	G	23.6	Very low	25.8	Very low	64 Å²	64	144 Å²	144	66%	0.66	81%	0.806	S	S	*	*			trans	-70.1	-177.3	-165.3	0	0	0	0	0	117.6
105	L	24.5	Very low	25.7	Very low	147 Å²	147	142.5 Å²	142.5	77%	0.77	81%	0.806	S	S	*	*			cis	-164.9	146.7	44.9	-96.6	114.8	0	0	0	111.5
106	K	26.3	Very low	25.8	Very low	184 Å²	184	146 Å²	146	80%	0.8	81%	0.809	S	S	*	*			trans	68	103.5	140.5	-77.7	173.5	-177.2	175.8	0	122.6
107	L	22.8	Very low	25.9	Very low	154 Å²	154	140.4 Å²	140.4	81%	0.806	80%	0.802	S	S	*	*				-13.6	135.2	128	-116.7	78.7	0	0	0	117.5
108	I	27	Very low	26.2	Very low	173 Å²	173	139.5 Å²	139.5	89%	0.887	80%	0.8	S	S	*	*				-147.9	138.2	124.1	-61.8	-165.9	0	0	0	110.8
109	K	23.1	Very low	26.5	Very low	177 Å²	177	138.8 Å²	138.8	77%	0.77	80%	0.8	S	S	*	*			trans	-58.6	136.6	-178.5	-70.6	170.6	167.1	175.9	0	115.6
110	S	23.9	Very low	26.9	Very low	97 Å²	97	139.5 Å²	139.5	68%	0.678	80%	0.796	S	S	*	*				91.5	121.3	98.6	72	0	0	0	0	116.2
111	N	24.5	Very low	27.4	Very low	159 Å²	159	140.8 Å²	140.8	85%	0.85	80%	0.802	S	S	*	*				179.9	144.9	118.3	-95.4	-5.8	0	0	0	113.2
112	S	28.2	Very low	27.8	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	79%	0.792	S	S	*	*			trans	-79.1	144.5	-172.1	-25.9	0	0	0	0	113.4
113	T	28.1	Very low	28.8	Very low	131 Å²	131	133.4 Å²	133.4	80%	0.804	78%	0.782	S	S	*	*			trans	-159.8	138.8	145.3	12.4	0	0	0	0	108.9	L115	T113-L115 PolarHBondContact O-N 3.05Å
114	P	30.1	Very low	30.1	Very low	129 Å²	129	131.2 Å²	131.2	84%	0.838	77%	0.77	S	S	*	*			trans	-82.9	111	-176.4	31.2	-28.9	0	0	0	110.1
115	L	26.1	Very low	32.2	Very low	166 Å²	166	134.2 Å²	134.2	87%	0.869	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-88.2	125.5	170.6	-129.8	83.1	0	0	0	109.6	T113 T117	T113-L115 PolarHBondContact O-N 3.05Å; L115-T117 PolarHBondContact O-N 3.15Å
116	K	29.4	Very low	34.6	Very low	201 Å²	201	129.7 Å²	129.7	87%	0.874	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-47.5	127.9	174	-71.1	173	174.7	177.7	0	111
117	T	28.7	Very low	37	Very low	132 Å²	132	121.1 Å²	121.1	81%	0.81	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-64.6	128.9	169.4	-25.2	0	0	0	0	109.2	L115	L115-T117 PolarHBondContact O-N 3.15Å
118	P	32.1	Very low	39.6	Very low	117 Å²	117	116.4 Å²	116.4	76%	0.76	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-66	136.9	164.9	-8.8	24.5	0	0	0	108.5
119	A	30.3	Very low	42	Very low	89 Å²	89	108.4 Å²	108.4	74%	0.736	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-60.9	148.2	171.5	0	0	0	0	0	110.6
120	P	34.1	Very low	44.5	Very low	117 Å²	117	102.4 Å²	102.4	76%	0.76	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-65.2	149.4	174.4	27.4	-31.8	0	0	0	110.8
121	P	35.1	Very low	46.9	Very low	132 Å²	132	98 Å²	98	86%	0.857	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-66.8	137.8	178.6	19.7	-16.9	0	0	0	110.4
122	G	35.3	Very low	49.4	Very low	62 Å²	62	90.5 Å²	90.5	64%	0.639	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-68.9	164.3	174.6	0	0	0	0	0	112.7
123	P	44.9	Very low	51.7	Low	88 Å²	88	85.1 Å²	85.1	57%	0.571	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-62.4	148.2	175	27.1	-31.6	0	0	0	110.8	D125	P123-D125 PolarHBondContact O-N 3.11Å
124	L	53.5	Low	53.8	Low	123 Å²	123	79 Å²	79	64%	0.644	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-70.1	124.2	174	-70	159.6	0	0	0	108.9	T126	L124-T126 PolarHBondContact O-N 2.98Å
125	D	67.6	Low	55.9	Low	128 Å²	128	74 Å²	74	68%	0.684	44%	0.437	S	S	*	.	S	Bend	trans	-81.6	18	-173.3	-72.9	-35.8	0	0	0	114.4	P123	P123-D125 PolarHBondContact O-N 3.11Å
126	T	75.5	Confident	58.2	Low	52 Å²	52	66.2 Å²	66.2	32%	0.319	40%	0.397	S	S	.	.			trans	-144.6	158.6	-173	59.7	0	0	0	0	112.4	D50 I51 L124	D50-T126 HydrophobicContact CB-CG2 4.48Å; I51-T126 CarbonylContact O-C 3.58Å; I51-T126 VanDerWaalsContact O-CA 3.29Å; I51-T126 WeakPolarHBondContact O-CA 3.43Å; L124-T126 PolarHBondContact O-N 2.98Å
127	V	77.9	Confident	60.2	Low	3 Å²	3	57.1 Å²	57.1	2%	0.018	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.4	-177.4	-61.7	0	0	0	0	111.8	D50 I51 F56 F77 F80 S81 L129 I132	D50-V127 CarbonylContact C-O 3.52Å; D50-V127 WeakPolarHBondContact CA-O 3.48Å; I51-V127 HydrophobicContact CD1-CG2 4.17Å; I51-V127 HydrophobicContact CG1-CG2 3.5Å; I51-V127 VanDerWaalsContact CG1-CG2 3.5Å; I51-V127 PolarHBondContact N-O 3.38Å; I51-V127 PolarHBondContact O-N 3.19Å; F56-V127 HydrophobicContact CD2-CG2 4.34Å; F77-V127 HydrophobicContact CD2-CB 4.5Å; F77-V127 HydrophobicContact CD2-CG1 3.83Å; F77-V127 HydrophobicContact CD2-CG2 3.78Å; F77-V127 HydrophobicContact CE1-CG1 4.43Å; F77-V127 HydrophobicContact CE2-CB 4.18Å; F77-V127 HydrophobicContact CE2-CG1 3.65Å; F77-V127 HydrophobicContact CE2-CG2 3.48Å; F77-V127 VanDerWaalsContact CE2-CG2 3.48Å; F77-V127 HydrophobicContact CG-CG1 4.33Å; F77-V127 HydrophobicContact CZ-CG1 3.97Å; F77-V127 HydrophobicContact CZ-CG2 4.42Å; F80-V127 HydrophobicContact CB-CB 4.06Å; F80-V127 HydrophobicContact CB-CG1 3.8Å; S81-V127 WeakPolarHBondContact OG-CG1 3.38Å; V127-L129 PolarHBondContact O-N 2.94Å; V127-I132 HydrophobicContact CB-CD1 4.29Å; V127-I132 HydrophobicContact CG2-CD1 3.47Å; V127-I132 VanDerWaalsContact CG2-CD1 3.47Å; V127-I132 HydrophobicContact CG2-CG1 4.45Å
128	Q	77.3	Confident	62	Low	56 Å²	56	52.2 Å²	52.2	26%	0.262	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	123.4	178.6	-79.3	177.7	-0.4	0	0	111.1	D50 K130 D131 I132	D50-Q128 WeakPolarHBondContact OD1-CG 3.4Å; Q128-K130 VanDerWaalsContact C-N 3.26Å; Q128-K130 HydrophobicContact CB-CG 4.07Å; Q128-K130 PolarHBondContact O-N 3.2Å; Q128-D131 HydrophobicContact CB-CB 4.42Å; Q128-D131 WeakPolarHBondContact O-CB 3.4Å; Q128-D131 PolarHBondContact O-N 3.37Å; Q128-D131 VanDerWaalsContact O-N 3.08Å; Q128-I132 PolarHBondContact O-N 2.82Å
129	L	76.9	Confident	63.6	Low	5 Å²	5	48.1 Å²	48.1	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-58.2	-38.7	-179.6	-174.5	65.8	0	0	0	112.1	L33 F36 P47 I51 F59 V127 D131 I132 V133	L33-L129 HydrophobicContact CD2-CD2 4.41Å; F36-L129 HydrophobicContact CD1-CD2 4.43Å; F36-L129 HydrophobicContact CE1-CD2 3.7Å; F36-L129 HydrophobicContact CE2-CD1 4.47Å; F36-L129 HydrophobicContact CE2-CD2 3.81Å; F36-L129 HydrophobicContact CZ-CD1 3.86Å; F36-L129 HydrophobicContact CZ-CD2 3.35Å; F36-L129 HydrophobicContact CZ-CG 4.27Å; P47-L129 HydrophobicContact CB-CD2 3.78Å; I51-L129 HydrophobicContact CD1-CD1 4.16Å; I51-L129 HydrophobicContact CG2-CB 4.17Å; I51-L129 HydrophobicContact CG2-CD1 4.46Å; F59-L129 HydrophobicContact CD2-CD1 3.85Å; F59-L129 HydrophobicContact CE2-CD1 3.78Å; F59-L129 HydrophobicContact CG-CD1 4.32Å; F59-L129 HydrophobicContact CZ-CD1 4.19Å; V127-L129 PolarHBondContact O-N 2.94Å; L129-D131 VanDerWaalsContact C-N 3.25Å; L129-D131 PolarHBondContact O-N 3.33Å; L129-I132 WeakPolarHBondContact O-CB 3.46Å; L129-I132 PolarHBondContact O-N 3.3Å; L129-I132 VanDerWaalsContact O-N 3.16Å; L129-V133 HydrophobicContact CD1-CG2 4.22Å; L129-V133 HydrophobicContact CG-CG2 4Å; L129-V133 WeakPolarHBondContact O-CB 3.48Å; L129-V133 VanDerWaalsContact O-CG2 3.22Å; L129-V133 WeakPolarHBondContact O-CG2 3.38Å; L129-V133 PolarHBondContact O-N 3.45Å
130	K	74.4	Confident	65.3	Low	51 Å²	51	45.7 Å²	45.7	22%	0.222	27%	0.272	C	S	.	.	H	α-helix	trans	-56.7	-35.6	176.6	59.4	-178.6	178	-172.5	0	113.8	Q128 F134 L154 Y155	Q128-K130 VanDerWaalsContact C-N 3.26Å; Q128-K130 HydrophobicContact CB-CG 4.07Å; Q128-K130 PolarHBondContact O-N 3.2Å; K130-F134 VanDerWaalsContact O-CB 3.23Å; K130-F134 WeakPolarHBondContact O-CB 3.2Å; K130-F134 PolarHBondContact O-N 2.81Å; K130-L154 HydrophobicContact CB-CD1 4.33Å; K130-L154 HydrophobicContact CB-CG 4.45Å; K130-Y155 HydrophobicContact CD-CE1 4.32Å
131	D	74.3	Confident	66.5	Low	5 Å²	5	43.1 Å²	43.1	3%	0.027	27%	0.266	C	S	.	.	H	α-helix	trans	-72.3	-38.9	-179.8	-63.9	-12.3	0	0	0	110.9	F80 K83 Q128 L129 Y135 Q174	F80-D131 HydrophobicContact CD1-CB 4.4Å; K83-D131 WeakPolarHBondContact CE-OD2 3.48Å; K83-D131 IonicContact NZ-OD1 3.93Å; K83-D131 IonicContact NZ-OD2 2.65Å; K83-D131 PolarHBondContact NZ-OD2 3.46Å; Q128-D131 HydrophobicContact CB-CB 4.42Å; Q128-D131 WeakPolarHBondContact O-CB 3.4Å; Q128-D131 PolarHBondContact O-N 3.37Å; Q128-D131 VanDerWaalsContact O-N 3.08Å; L129-D131 VanDerWaalsContact C-N 3.25Å; L129-D131 PolarHBondContact O-N 3.33Å; D131-Y135 WeakPolarHBondContact O-CB 3.45Å; D131-Y135 PolarHBondContact O-N 2.66Å; D131-Q174 VanDerWaalsContact OD1-CD 3.25Å; D131-Q174 PolarHBondContact OD1-NE2 3.2Å; D131-Q174 PolarHBondContact OD2-NE2 3.02Å; D131-Q174 VanDerWaalsContact OD2-NE2 3.16Å
132	I	77.2	Confident	67.7	Low	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-49	175.1	-60.5	159.6	0	0	0	110	I51 F56 F59 F80 V127 Q128 L129 F134 Y135 L136	I51-I132 HydrophobicContact CD1-CD1 3.74Å; I51-I132 HydrophobicContact CG1-CD1 4.31Å; F56-I132 HydrophobicContact CD2-CD1 3.49Å; F56-I132 VanDerWaalsContact CD2-CD1 3.49Å; F56-I132 HydrophobicContact CD2-CG1 4.24Å; F56-I132 HydrophobicContact CE2-CD1 3.72Å; F56-I132 HydrophobicContact CE2-CG1 3.95Å; F56-I132 HydrophobicContact CE2-CG2 3.99Å; F59-I132 HydrophobicContact CD1-CG2 4.12Å; F59-I132 HydrophobicContact CE1-CG2 3.6Å; F59-I132 HydrophobicContact CZ-CG2 4.39Å; F80-I132 HydrophobicContact CB-CG1 4.47Å; F80-I132 HydrophobicContact CD1-CG1 4.27Å; F80-I132 HydrophobicContact CD2-CG1 4Å; F80-I132 HydrophobicContact CE2-CG1 4.32Å; F80-I132 HydrophobicContact CG-CG1 4Å; V127-I132 HydrophobicContact CB-CD1 4.29Å; V127-I132 HydrophobicContact CG2-CD1 3.47Å; V127-I132 VanDerWaalsContact CG2-CD1 3.47Å; V127-I132 HydrophobicContact CG2-CG1 4.45Å; Q128-I132 PolarHBondContact O-N 2.82Å; L129-I132 WeakPolarHBondContact O-CB 3.46Å; L129-I132 PolarHBondContact O-N 3.3Å; L129-I132 VanDerWaalsContact O-N 3.16Å; I132-F134 PolarHBondContact O-N 2.81Å; I132-Y135 PolarHBondContact O-N 2.95Å; I132-L136 HydrophobicContact CG2-CD1 3.74Å; I132-L136 HydrophobicContact CG2-CG 4.27Å; I132-L136 WeakPolarHBondContact O-CB 3.31Å; I132-L136 VanDerWaalsContact O-CG 3.27Å; I132-L136 WeakPolarHBondContact O-CG 3.48Å; I132-L136 PolarHBondContact O-N 2.83Å
133	V	76.7	Confident	68.8	Low	1 Å²	1	42.8 Å²	42.8	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-43.8	-179.5	169.7	0	0	0	0	111	L29 L33 F59 L129 S137 F150 L154	L29-V133 HydrophobicContact CD2-CB 4.45Å; L29-V133 HydrophobicContact CD2-CG1 4.25Å; L29-V133 HydrophobicContact CD2-CG2 4.3Å; L33-V133 HydrophobicContact CD1-CG1 4.17Å; L33-V133 HydrophobicContact CD2-CG2 3.9Å; F59-V133 HydrophobicContact CE2-CG2 4.44Å; F59-V133 HydrophobicContact CZ-CG2 4.04Å; L129-V133 HydrophobicContact CD1-CG2 4.22Å; L129-V133 HydrophobicContact CG-CG2 4Å; L129-V133 WeakPolarHBondContact O-CB 3.48Å; L129-V133 VanDerWaalsContact O-CG2 3.22Å; L129-V133 WeakPolarHBondContact O-CG2 3.38Å; L129-V133 PolarHBondContact O-N 3.45Å; V133-S137 WeakPolarHBondContact O-CB 3.49Å; V133-S137 PolarHBondContact O-N 2.83Å; V133-F150 HydrophobicContact CG1-CE1 3.95Å; V133-F150 HydrophobicContact CG1-CZ 3.6Å; V133-L154 HydrophobicContact CB-CD1 4.33Å; V133-L154 HydrophobicContact CB-CD2 4.38Å; V133-L154 HydrophobicContact CG1-CD1 3.81Å; V133-L154 HydrophobicContact CG1-CD2 3.86Å
134	F	73.6	Confident	69.7	Low	2 Å²	2	40.6 Å²	40.6	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-49.4	175.1	179.1	-106	0	0	0	111.4	K130 I132 L136 S137 M151 L154 Y155 Q174 M175 V178 L227	K130-F134 VanDerWaalsContact O-CB 3.23Å; K130-F134 WeakPolarHBondContact O-CB 3.2Å; K130-F134 PolarHBondContact O-N 2.81Å; I132-F134 PolarHBondContact O-N 2.81Å; F134-L136 PolarHBondContact O-N 3.02Å; F134-S137 WeakPolarHBondContact O-CB 3.29Å; F134-S137 PolarHBondContact O-N 3.35Å; F134-S137 PolarHBondContact O-OG 3.13Å; F134-M151 HydrophobicContact CE2-CG 4.39Å; F134-M151 HydrophobicContact CE2-SD 3.83Å; F134-L154 HydrophobicContact CB-CD2 4.15Å; F134-Y155 HydrophobicContact CD2-CE2 4.13Å; F134-Q174 HydrophobicContact CD1-CB 3.84Å; F134-Q174 HydrophobicContact CE1-CB 3.78Å; F134-Q174 HydrophobicContact CZ-CB 4.46Å; F134-M175 HydrophobicContact CZ-CE 4.49Å; F134-M175 HydrophobicContact CZ-CG 4.06Å; F134-V178 HydrophobicContact CD1-CG2 4.33Å; F134-V178 HydrophobicContact CE1-CG2 3.61Å; F134-V178 HydrophobicContact CZ-CG2 4.48Å; F134-L227 HydrophobicContact CE2-CD2 3.97Å
135	Y	73	Confident	70.7	Confident	24 Å²	24	38.4 Å²	38.4	9%	0.094	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-42.3	-179	-166.5	-92.8	0	0	0	112.8	L10 F15 F80 D131 I132 S137 L138	L10-Y135 HydrophobicContact CD1-CE1 3.8Å; F15-Y135 AromaticContact CD2-CE1 3.91Å; F15-Y135 HydrophobicContact CD2-CE1 3.91Å; F15-Y135 AromaticContact CD2-CZ 3.95Å; F15-Y135 VanDerWaalsContact CD2-OH 3.29Å; F15-Y135 WeakPolarHBondContact CD2-OH 3.43Å; F15-Y135 AromaticContact CE2-CE1 3.78Å; F15-Y135 HydrophobicContact CE2-CE1 3.78Å; F15-Y135 AromaticContact CE2-CZ 3.85Å; F80-Y135 HydrophobicContact CE1-CD1 4.3Å; F80-Y135 HydrophobicContact CE1-CD2 4.29Å; F80-Y135 AromaticContact CE1-CG 3.85Å; F80-Y135 HydrophobicContact CE1-CG 3.85Å; F80-Y135 AromaticContact CZ-CD1 3.73Å; F80-Y135 HydrophobicContact CZ-CD1 3.73Å; F80-Y135 HydrophobicContact CZ-CD2 4.48Å; F80-Y135 HydrophobicContact CZ-CE1 4.42Å; F80-Y135 AromaticContact CZ-CG 3.76Å; F80-Y135 HydrophobicContact CZ-CG 3.76Å; D131-Y135 WeakPolarHBondContact O-CB 3.45Å; D131-Y135 PolarHBondContact O-N 2.66Å; I132-Y135 PolarHBondContact O-N 2.95Å; Y135-S137 VanDerWaalsContact C-N 3.32Å; Y135-S137 PolarHBondContact O-N 3.13Å; Y135-L138 HydrophobicContact CD2-CD1 4.47Å; Y135-L138 VanDerWaalsContact O-CB 3.28Å; Y135-L138 WeakPolarHBondContact O-CB 3.39Å; Y135-L138 WeakPolarHBondContact O-CG 3.39Å; Y135-L138 PolarHBondContact O-N 2.82Å
136	L	74	Confident	71	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-70.3	-28.7	177.1	-65.1	176.4	0	0	0	112.4	L18 L29 F59 M60 F63 I132 F134 L138 L139	L18-L136 HydrophobicContact CD2-CD2 3.93Å; L29-L136 VanDerWaalsContact CD1-C 3.46Å; L29-L136 HydrophobicContact CD1-CB 3.76Å; L29-L136 HydrophobicContact CD2-CB 4.1Å; L29-L136 HydrophobicContact CD2-CD1 4.31Å; L29-L136 HydrophobicContact CG-CB 4.35Å; F59-L136 HydrophobicContact CE1-CD1 3.57Å; F59-L136 HydrophobicContact CZ-CD1 4.24Å; M60-L136 HydrophobicContact CE-CD2 4.35Å; M60-L136 HydrophobicContact SD-CD1 4Å; F63-L136 HydrophobicContact CD1-CD1 3.8Å; F63-L136 HydrophobicContact CD1-CD2 4.39Å; F63-L136 HydrophobicContact CE1-CB 4.15Å; F63-L136 HydrophobicContact CE1-CD1 3.89Å; F63-L136 HydrophobicContact CE1-CD2 3.92Å; F63-L136 HydrophobicContact CE1-CG 4.21Å; F63-L136 HydrophobicContact CG-CD1 4.41Å; F63-L136 HydrophobicContact CZ-CB 4.28Å; I132-L136 HydrophobicContact CG2-CD1 3.74Å; I132-L136 HydrophobicContact CG2-CG 4.27Å; I132-L136 WeakPolarHBondContact O-CB 3.31Å; I132-L136 VanDerWaalsContact O-CG 3.27Å; I132-L136 WeakPolarHBondContact O-CG 3.48Å; I132-L136 PolarHBondContact O-N 2.83Å; F134-L136 PolarHBondContact O-N 3.02Å; L136-L138 PolarHBondContact O-N 2.9Å; L136-L138 VanDerWaalsContact O-N 3.15Å; L136-L139 HydrophobicContact CD2-CD1 3.75Å; L136-L139 VanDerWaalsContact O-CB 3.3Å; L136-L139 WeakPolarHBondContact O-CB 3.44Å; L136-L139 PolarHBondContact O-N 3.35Å
137	S	72.5	Confident	71	Confident	11 Å²	11	33.8 Å²	33.8	8%	0.077	18%	0.183	C	C	.	.	H	α-helix	trans	-62.7	-20.6	175.6	82.4	0	0	0	0	112.9	L29 V133 F134 Y135 L139 E140 K147	L29-S137 VanDerWaalsContact CD1-CA 3.5Å; L29-S137 VanDerWaalsContact CD1-N 3.28Å; V133-S137 WeakPolarHBondContact O-CB 3.49Å; V133-S137 PolarHBondContact O-N 2.83Å; F134-S137 WeakPolarHBondContact O-CB 3.29Å; F134-S137 PolarHBondContact O-N 3.35Å; F134-S137 PolarHBondContact O-OG 3.13Å; Y135-S137 VanDerWaalsContact C-N 3.32Å; Y135-S137 PolarHBondContact O-N 3.13Å; S137-L139 VanDerWaalsContact C-N 3.29Å; S137-E140 PolarHBondContact O-N 2.95Å; S137-K147 PolarHBondContact O-NZ 2.97Å
138	L	65.7	Low	71.1	Confident	28 Å²	28	33.6 Å²	33.6	15%	0.147	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-27.5	173.4	-54.5	178.1	0	0	0	112.5	Y135 L136 E140 V178 L226 L227	Y135-L138 HydrophobicContact CD2-CD1 4.47Å; Y135-L138 VanDerWaalsContact O-CB 3.28Å; Y135-L138 WeakPolarHBondContact O-CB 3.39Å; Y135-L138 WeakPolarHBondContact O-CG 3.39Å; Y135-L138 PolarHBondContact O-N 2.82Å; L136-L138 PolarHBondContact O-N 2.9Å; L136-L138 VanDerWaalsContact O-N 3.15Å; L138-E140 VanDerWaalsContact C-N 3.33Å; L138-V178 HydrophobicContact CD1-CB 4.41Å; L138-V178 HydrophobicContact CD1-CG1 3.77Å; L138-V178 HydrophobicContact CD1-CG2 3.65Å; L138-L226 WeakPolarHBondContact CD2-O 3.42Å; L138-L227 VanDerWaalsContact CD2-C 3.4Å
139	L	65.6	Low	71.4	Confident	31 Å²	31	33.8 Å²	33.8	16%	0.162	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-23.9	179.5	-53.2	178.7	0	0	0	111.5	F15 L18 Q19 T22 L136 S137	F15-L139 HydrophobicContact CD2-CD2 4.48Å; F15-L139 HydrophobicContact CE1-CD2 4.17Å; F15-L139 HydrophobicContact CE2-CD2 3.6Å; F15-L139 HydrophobicContact CZ-CD2 3.41Å; F15-L139 VanDerWaalsContact CZ-CD2 3.41Å; L18-L139 HydrophobicContact CD2-CD1 3.82Å; L18-L139 HydrophobicContact CG-CD1 3.86Å; Q19-L139 HydrophobicContact CG-CD2 3.69Å; T22-L139 HydrophobicContact CG2-CB 4.48Å; T22-L139 HydrophobicContact CG2-CD1 3.91Å; L136-L139 HydrophobicContact CD2-CD1 3.75Å; L136-L139 VanDerWaalsContact O-CB 3.3Å; L136-L139 WeakPolarHBondContact O-CB 3.44Å; L136-L139 PolarHBondContact O-N 3.35Å; S137-L139 VanDerWaalsContact C-N 3.29Å
140	E	66.8	Low	71.6	Confident	39 Å²	39	36.3 Å²	36.3	18%	0.182	19%	0.194	C	C	.	.	S	Bend	trans	-85.2	137.5	179	-62	-169.2	162.9	0	0	112	K28 L29 S137 L138 K147	K28-E140 WeakPolarHBondContact CA-OE1 3.5Å; L29-E140 HydrophobicContact CD1-CG 4.38Å; L29-E140 PolarHBondContact N-OE1 2.82Å; S137-E140 PolarHBondContact O-N 2.95Å; L138-E140 VanDerWaalsContact C-N 3.33Å; E140-K147 WeakPolarHBondContact O-CE 3.26Å; E140-K147 PolarHBondContact O-NZ 2.77Å
141	G	58.5	Low	71.8	Confident	62 Å²	62	34 Å²	34	64%	0.639	18%	0.184	S	C	*	.			trans	-82.5	146.8	167.6	0	0	0	0	0	111.5
142	G	60	Low	72.3	Confident	31 Å²	31	33.9 Å²	33.9	32%	0.32	18%	0.183	S	C	.	.			trans	-165.8	176.2	176.8	0	0	0	0	0	112.3
143	R	59.9	Low	72.6	Confident	157 Å²	157	41.5 Å²	41.5	59%	0.592	21%	0.212	S	C	*	.			trans	-73.1	146.1	167	-59	-177	-67.4	171.1	4.9	109.1	E145 D146 K147	R143-E145 WeakPolarHBondContact CB-OE2 3.27Å; R143-E145 PolarHBondContact O-N 2.95Å; R143-D146 WeakPolarHBondContact CB-OD2 3.28Å; R143-D146 IonicContact CZ-OD1 2.65Å; R143-D146 IonicContact CZ-OD2 3.68Å; R143-D146 IonicContact NE-OD1 3.77Å; R143-D146 IonicContact NE-OD2 2.86Å; R143-D146 PolarHBondContact NE-OD2 3.03Å; R143-D146 IonicContact NH2-OD1 3.89Å; R143-D146 PolarHBondContact NH2-OD1 2.88Å; R143-D146 IonicContact NH2-OD2 2.72Å; R143-D146 PolarHBondContact NH2-OD2 2.79Å; R143-D146 PolarHBondContact O-N 2.91Å; R143-K147 PolarHBondContact O-N 2.79Å
144	P	63.6	Low	72.8	Confident	41 Å²	41	43.2 Å²	43.2	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-51.8	-41.3	176.8	-30.6	38.4	0	0	0	114.2	K147 L148 L218 L224 L229	P144-K147 PolarHBondContact O-N 2.95Å; P144-L148 WeakPolarHBondContact O-CB 3.08Å; P144-L148 VanDerWaalsContact O-CG 3.27Å; P144-L148 WeakPolarHBondContact O-CG 3.33Å; P144-L148 PolarHBondContact O-N 2.77Å; P144-L218 HydrophobicContact CB-CD2 3.46Å; P144-L218 VanDerWaalsContact CB-CD2 3.46Å; P144-L224 HydrophobicContact CB-CD2 4.16Å; P144-L229 HydrophobicContact CB-CD1 3.78Å; P144-L229 HydrophobicContact CB-CD2 4.5Å; P144-L229 HydrophobicContact CG-CD1 4.16Å; P144-L229 HydrophobicContact CG-CD2 4.29Å
145	E	74.3	Confident	73.2	Confident	78 Å²	78	43.2 Å²	43.2	36%	0.364	22%	0.221	S	C	.	.	H	α-helix	trans	-62.1	-46.8	179.8	-59.6	79.4	-177.7	0	0	111.4	R143 K147 L148 E149 L218	R143-E145 WeakPolarHBondContact CB-OE2 3.27Å; R143-E145 PolarHBondContact O-N 2.95Å; E145-K147 VanDerWaalsContact C-N 3.29Å; E145-K147 PolarHBondContact O-N 2.84Å; E145-L148 PolarHBondContact O-N 2.86Å; E145-E149 WeakPolarHBondContact O-CB 3.21Å; E145-E149 PolarHBondContact O-N 3.44Å; E145-L218 HydrophobicContact CG-CD1 4.08Å; E145-L218 HydrophobicContact CG-CD2 4.11Å
146	D	73.6	Confident	73.7	Confident	63 Å²	63	43.2 Å²	43.2	34%	0.337	22%	0.223	S	C	.	.	H	α-helix	trans	-64.2	-36.5	-179.3	-57.5	-32.9	0	0	0	111	R143 F150	R143-D146 WeakPolarHBondContact CB-OD2 3.28Å; R143-D146 IonicContact CZ-OD1 2.65Å; R143-D146 IonicContact CZ-OD2 3.68Å; R143-D146 IonicContact NE-OD1 3.77Å; R143-D146 IonicContact NE-OD2 2.86Å; R143-D146 PolarHBondContact NE-OD2 3.03Å; R143-D146 IonicContact NH2-OD1 3.89Å; R143-D146 PolarHBondContact NH2-OD1 2.88Å; R143-D146 IonicContact NH2-OD2 2.72Å; R143-D146 PolarHBondContact NH2-OD2 2.79Å; R143-D146 PolarHBondContact O-N 2.91Å; D146-F150 VanDerWaalsContact O-CB 3.23Å; D146-F150 WeakPolarHBondContact O-CB 3.32Å; D146-F150 PolarHBondContact O-N 3.05Å
147	K	75.2	Confident	73.7	Confident	19 Å²	19	47.1 Å²	47.1	8%	0.083	25%	0.247	C	C	.	.	H	α-helix	trans	-72.7	-40.4	177.2	-73.3	-145	-174.9	-165	0	112.8	S137 E140 R143 P144 E145 F150 M151 L227 L229	S137-K147 PolarHBondContact O-NZ 2.97Å; E140-K147 WeakPolarHBondContact O-CE 3.26Å; E140-K147 PolarHBondContact O-NZ 2.77Å; R143-K147 PolarHBondContact O-N 2.79Å; P144-K147 PolarHBondContact O-N 2.95Å; E145-K147 VanDerWaalsContact C-N 3.29Å; E145-K147 PolarHBondContact O-N 2.84Å; K147-F150 PolarHBondContact O-N 3.07Å; K147-M151 WeakPolarHBondContact O-CB 3.31Å; K147-M151 PolarHBondContact O-N 2.92Å; K147-L227 WeakPolarHBondContact CD-O 3.36Å; K147-L227 PolarHBondContact NZ-O 2.71Å; K147-L229 HydrophobicContact CB-CD2 4.3Å; K147-L229 HydrophobicContact CD-CD2 3.58Å; K147-L229 HydrophobicContact CD-CG 4.01Å; K147-L229 HydrophobicContact CG-CD2 3.88Å
148	L	80.9	Confident	73.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.6	-43.4	177.1	-73.5	165.9	0	0	0	110.8	P144 E145 M151 F152 W213 I214 L218 L223 L224 L227	P144-L148 WeakPolarHBondContact O-CB 3.08Å; P144-L148 VanDerWaalsContact O-CG 3.27Å; P144-L148 WeakPolarHBondContact O-CG 3.33Å; P144-L148 PolarHBondContact O-N 2.77Å; E145-L148 PolarHBondContact O-N 2.86Å; L148-M151 HydrophobicContact CD2-CE 3.91Å; L148-M151 PolarHBondContact O-N 3.04Å; L148-F152 WeakPolarHBondContact O-CB 3.29Å; L148-F152 PolarHBondContact O-N 3.42Å; L148-W213 VanDerWaalsContact O-CD1 3.3Å; L148-W213 PolarHBondContact O-NE1 3.11Å; L148-W213 VanDerWaalsContact O-NE1 3.09Å; L148-I214 HydrophobicContact CB-CG1 4.24Å; L148-L218 HydrophobicContact CD1-CD2 3.86Å; L148-L218 HydrophobicContact CD1-CG 3.8Å; L148-L223 HydrophobicContact CD2-CD2 3.59Å; L148-L223 HydrophobicContact CD2-CG 4.37Å; L148-L224 HydrophobicContact CD1-CD2 4.27Å; L148-L227 HydrophobicContact CD2-CD1 3.51Å; L148-L227 HydrophobicContact CG-CD1 4.19Å
149	E	83	Confident	74.6	Confident	60 Å²	60	52.8 Å²	52.8	28%	0.28	29%	0.29	S	S	.	.	H	α-helix	trans	-63.1	-43	174.3	-178.3	174.1	-160.5	0	0	111.9	E145 F152 R153 L210 I214	E145-E149 WeakPolarHBondContact O-CB 3.21Å; E145-E149 PolarHBondContact O-N 3.44Å; E149-F152 PolarHBondContact O-N 2.86Å; E149-R153 WeakPolarHBondContact O-CG 3.35Å; E149-R153 PolarHBondContact O-N 3.48Å; E149-R153 VanDerWaalsContact O-N 3.12Å; E149-R153 IonicContact OE1-CZ 3.39Å; E149-R153 IonicContact OE1-NE 3.62Å; E149-R153 IonicContact OE1-NH2 2.69Å; E149-R153 PolarHBondContact OE1-NH2 3.4Å; E149-L210 HydrophobicContact CG-CD1 4.29Å; E149-I214 HydrophobicContact CB-CD1 4.2Å
150	F	80.4	Confident	75.5	Confident	57 Å²	57	55.1 Å²	55.1	25%	0.25	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-47.4	175.9	177.6	-99.1	0	0	0	112	L33 V133 D146 K147 R153 L154	L33-F150 HydrophobicContact CD1-CE2 4.1Å; L33-F150 HydrophobicContact CD1-CZ 4.15Å; V133-F150 HydrophobicContact CG1-CE1 3.95Å; V133-F150 HydrophobicContact CG1-CZ 3.6Å; D146-F150 VanDerWaalsContact O-CB 3.23Å; D146-F150 WeakPolarHBondContact O-CB 3.32Å; D146-F150 PolarHBondContact O-N 3.05Å; K147-F150 PolarHBondContact O-N 3.07Å; F150-R153 PolarHBondContact O-N 3.25Å; F150-L154 HydrophobicContact CE1-CD2 4.32Å; F150-L154 WeakPolarHBondContact O-CB 3.18Å; F150-L154 PolarHBondContact O-N 3.41Å
151	M	80.1	Confident	76.4	Confident	3 Å²	3	55 Å²	55	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-39.7	178.1	177.8	-178.7	42.2	0	0	111.9	F134 K147 L148 R153 L154 Y155 I171 M175 W213 L227	F134-M151 HydrophobicContact CE2-CG 4.39Å; F134-M151 HydrophobicContact CE2-SD 3.83Å; K147-M151 WeakPolarHBondContact O-CB 3.31Å; K147-M151 PolarHBondContact O-N 2.92Å; L148-M151 HydrophobicContact CD2-CE 3.91Å; L148-M151 PolarHBondContact O-N 3.04Å; M151-R153 VanDerWaalsContact C-N 3.34Å; M151-R153 PolarHBondContact O-N 3.41Å; M151-L154 WeakPolarHBondContact O-CB 3.39Å; M151-L154 PolarHBondContact O-N 3.33Å; M151-Y155 HydrophobicContact CG-CD2 4.03Å; M151-Y155 HydrophobicContact CG-CE2 4.25Å; M151-Y155 WeakPolarHBondContact O-CD2 3.38Å; M151-Y155 PolarHBondContact O-N 3.47Å; M151-I171 HydrophobicContact SD-CG2 3.78Å; M151-M175 HydrophobicContact CE-CE 3.91Å; M151-M175 HydrophobicContact SD-CE 3.43Å; M151-M175 WeakPolarHBondContact SD-CE 3.41Å; M151-W213 HydrophobicContact CE-CH2 4.29Å; M151-W213 HydrophobicContact CE-CZ2 3.19Å; M151-W213 HydrophobicContact CG-CZ2 4.31Å; M151-W213 HydrophobicContact SD-CZ2 3.82Å; M151-L227 HydrophobicContact CB-CD2 4.46Å; M151-L227 HydrophobicContact CE-CD1 3.54Å; M151-L227 HydrophobicContact CE-CD2 3.44Å; M151-L227 VanDerWaalsContact CE-CD2 3.44Å; M151-L227 HydrophobicContact CE-CG 4Å; M151-L227 HydrophobicContact SD-CD2 3.49Å; M151-L227 WeakPolarHBondContact SD-CD2 3.39Å
152	F	84.8	Confident	77.8	Confident	3 Å²	3	53.2 Å²	53.2	1%	0.013	29%	0.29	C	S	.	.	H	α-helix	trans	-54.9	-53.4	175.8	-175.8	-84.1	0	0	0	110.8	L148 E149 L154 Y155 D156 G161 L163 V208 L210 W213	L148-F152 WeakPolarHBondContact O-CB 3.29Å; L148-F152 PolarHBondContact O-N 3.42Å; E149-F152 PolarHBondContact O-N 2.86Å; F152-L154 PolarHBondContact O-N 2.96Å; F152-Y155 PolarHBondContact O-N 3.02Å; F152-D156 HydrophobicContact CD1-CB 4.35Å; F152-D156 HydrophobicContact CE1-CB 4.13Å; F152-D156 WeakPolarHBondContact O-CB 3.32Å; F152-D156 PolarHBondContact O-N 3.15Å; F152-G161 WeakPolarHBondContact CZ-O 3.32Å; F152-L163 HydrophobicContact CD2-CD1 3.46Å; F152-L163 VanDerWaalsContact CD2-CD1 3.46Å; F152-L163 HydrophobicContact CD2-CG 3.75Å; F152-L163 HydrophobicContact CE2-CB 4.45Å; F152-L163 HydrophobicContact CE2-CD1 3.7Å; F152-L163 HydrophobicContact CE2-CD2 4.49Å; F152-L163 HydrophobicContact CE2-CG 3.53Å; F152-L163 HydrophobicContact CG-CD1 4.31Å; F152-L163 HydrophobicContact CZ-CG 4.09Å; F152-V208 WeakPolarHBondContact CE2-O 3.37Å; F152-L210 HydrophobicContact CB-CD1 3.68Å; F152-L210 HydrophobicContact CD1-CB 4.1Å; F152-L210 HydrophobicContact CD1-CD1 3.61Å; F152-L210 HydrophobicContact CD1-CG 4.36Å; F152-L210 HydrophobicContact CD2-CB 4.31Å; F152-L210 HydrophobicContact CD2-CD1 3.95Å; F152-L210 HydrophobicContact CE1-CB 3.83Å; F152-L210 HydrophobicContact CE1-CD1 4.24Å; F152-L210 HydrophobicContact CE2-CB 4.02Å; F152-L210 VanDerWaalsContact CE2-N 3.28Å; F152-L210 HydrophobicContact CG-CB 4.33Å; F152-L210 HydrophobicContact CG-CD1 3.45Å; F152-L210 VanDerWaalsContact CG-CD1 3.45Å; F152-L210 HydrophobicContact CG-CG 4.48Å; F152-L210 HydrophobicContact CZ-CB 3.78Å; F152-L210 VanDerWaalsContact CZ-N 3.32Å; F152-W213 HydrophobicContact CB-CG 4.39Å; F152-W213 HydrophobicContact CD2-CB 3.62Å; F152-W213 AromaticContact CD2-CD1 3.74Å; F152-W213 HydrophobicContact CD2-CD2 4.37Å; F152-W213 AromaticContact CD2-CG 3.64Å; F152-W213 HydrophobicContact CD2-CG 3.64Å; F152-W213 HydrophobicContact CE2-CB 4.06Å; F152-W213 HydrophobicContact CE2-CG 4.48Å
153	R	82.4	Confident	79.2	Confident	159 Å²	159	51.8 Å²	51.8	60%	0.6	27%	0.274	S	S	*	.	H	α-helix	trans	-66.4	-23.9	-179.5	-65.4	178.6	-174.2	-164.7	2.3	113.7	E149 F150 M151 Y155	E149-R153 WeakPolarHBondContact O-CG 3.35Å; E149-R153 PolarHBondContact O-N 3.48Å; E149-R153 VanDerWaalsContact O-N 3.12Å; E149-R153 IonicContact OE1-CZ 3.39Å; E149-R153 IonicContact OE1-NE 3.62Å; E149-R153 IonicContact OE1-NH2 2.69Å; E149-R153 PolarHBondContact OE1-NH2 3.4Å; F150-R153 PolarHBondContact O-N 3.25Å; M151-R153 VanDerWaalsContact C-N 3.34Å; M151-R153 PolarHBondContact O-N 3.41Å; R153-Y155 VanDerWaalsContact C-N 3.33Å
154	L	80.1	Confident	80.6	Confident	38 Å²	38	46.7 Å²	46.7	20%	0.199	26%	0.259	C	S	.	.	H	α-helix	trans	-73.8	-27.5	178.4	-175.9	64	0	0	0	112.1	K130 V133 F134 F150 M151 F152	K130-L154 HydrophobicContact CB-CD1 4.33Å; K130-L154 HydrophobicContact CB-CG 4.45Å; V133-L154 HydrophobicContact CB-CD1 4.33Å; V133-L154 HydrophobicContact CB-CD2 4.38Å; V133-L154 HydrophobicContact CG1-CD1 3.81Å; V133-L154 HydrophobicContact CG1-CD2 3.86Å; F134-L154 HydrophobicContact CB-CD2 4.15Å; F150-L154 HydrophobicContact CE1-CD2 4.32Å; F150-L154 WeakPolarHBondContact O-CB 3.18Å; F150-L154 PolarHBondContact O-N 3.41Å; M151-L154 WeakPolarHBondContact O-CB 3.39Å; M151-L154 PolarHBondContact O-N 3.33Å; F152-L154 PolarHBondContact O-N 2.96Å
155	Y	82	Confident	81.6	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-111.5	-16	-175.5	-75.2	-84.8	0	0	0	114.4	K130 F134 M151 F152 R153 T157 E167 H170 I171 Q174	K130-Y155 HydrophobicContact CD-CE1 4.32Å; F134-Y155 HydrophobicContact CD2-CE2 4.13Å; M151-Y155 HydrophobicContact CG-CD2 4.03Å; M151-Y155 HydrophobicContact CG-CE2 4.25Å; M151-Y155 WeakPolarHBondContact O-CD2 3.38Å; M151-Y155 PolarHBondContact O-N 3.47Å; F152-Y155 PolarHBondContact O-N 3.02Å; R153-Y155 VanDerWaalsContact C-N 3.33Å; Y155-T157 PolarHBondContact O-N 2.97Å; Y155-T157 PolarHBondContact O-OG1 2.83Å; Y155-E167 WeakPolarHBondContact O-CG 3.44Å; Y155-E167 VanDerWaalsContact O-OE1 3.06Å; Y155-H170 HydrophobicContact CD1-CB 4.09Å; Y155-H170 HydrophobicContact CE1-CB 4.18Å; Y155-I171 HydrophobicContact CD1-CG1 3.78Å; Y155-I171 HydrophobicContact CD2-CD1 4.18Å; Y155-I171 HydrophobicContact CD2-CG1 3.56Å; Y155-I171 HydrophobicContact CE1-CG1 4.31Å; Y155-I171 HydrophobicContact CE2-CG1 4.1Å; Y155-I171 HydrophobicContact CG-CD1 3.99Å; Y155-I171 HydrophobicContact CG-CG1 3.38Å; Y155-Q174 HydrophobicContact CE1-CG 4.48Å; Y155-Q174 WeakPolarHBondContact OH-CG 3.37Å
156	D	84.1	Confident	82	Confident	24 Å²	24	48.2 Å²	48.2	13%	0.128	28%	0.279	C	S	.	.			trans	-67	79.9	165	178.7	12.6	0	0	0	109.1	F152 G159 N160 G161 L163 E167	F152-D156 HydrophobicContact CD1-CB 4.35Å; F152-D156 HydrophobicContact CE1-CB 4.13Å; F152-D156 WeakPolarHBondContact O-CB 3.32Å; F152-D156 PolarHBondContact O-N 3.15Å; D156-G159 PolarHBondContact O-N 3.45Å; D156-G159 WeakPolarHBondContact OD1-CA 3.42Å; D156-G159 PolarHBondContact OD1-N 3.2Å; D156-N160 PolarHBondContact OD1-N 2.98Å; D156-G161 WeakPolarHBondContact OD2-CA 3.18Å; D156-G161 PolarHBondContact OD2-N 3.45Å; D156-G161 VanDerWaalsContact OD2-N 3.07Å; D156-L163 HydrophobicContact CB-CD2 4.16Å; D156-E167 WeakPolarHBondContact CA-OE1 3.32Å
157	T	74.9	Confident	82.7	Confident	84 Å²	84	45.7 Å²	45.7	52%	0.515	27%	0.266	S	S	.	.	S	Bend	trans	-78.2	-29	-166.6	-52.3	0	0	0	0	111	Y155 E167	Y155-T157 PolarHBondContact O-N 2.97Å; Y155-T157 PolarHBondContact O-OG1 2.83Å; T157-E167 PolarHBondContact N-OE1 3.39Å
158	D	76.4	Confident	83.1	Confident	100 Å²	100	45.6 Å²	45.6	54%	0.535	27%	0.266	S	S	.	.	S	Bend	trans	-91.6	-6	176.3	73.1	-0.9	0	0	0	113	N160	D158-N160 PolarHBondContact O-N 2.9Å; D158-N160 VanDerWaalsContact OD1-CB 3.22Å; D158-N160 WeakPolarHBondContact OD1-CB 3.41Å; D158-N160 PolarHBondContact OD1-N 3.03Å; D158-N160 VanDerWaalsContact OD1-N 3.07Å; D158-N160 PolarHBondContact OD1-ND2 2.96Å; D158-N160 PolarHBondContact OD2-ND2 2.81Å
159	G	80.1	Confident	83.2	Confident	58 Å²	58	48.9 Å²	48.9	60%	0.598	28%	0.281	S	S	*	.			trans	66.7	23	176	0	0	0	0	0	113	D156 G161	D156-G159 PolarHBondContact O-N 3.45Å; D156-G159 WeakPolarHBondContact OD1-CA 3.42Å; D156-G159 PolarHBondContact OD1-N 3.2Å; G159-G161 PolarHBondContact O-N 3.23Å
160	N	84.3	Confident	83	Confident	79 Å²	79	50.3 Å²	50.3	42%	0.422	29%	0.288	S	S	.	.	S	Bend	trans	-77.7	-9.8	-176.1	74.7	24.5	0	0	0	112.2	D156 D158 S162	D156-N160 PolarHBondContact OD1-N 2.98Å; D158-N160 PolarHBondContact O-N 2.9Å; D158-N160 VanDerWaalsContact OD1-CB 3.22Å; D158-N160 WeakPolarHBondContact OD1-CB 3.41Å; D158-N160 PolarHBondContact OD1-N 3.03Å; D158-N160 VanDerWaalsContact OD1-N 3.07Å; D158-N160 PolarHBondContact OD1-ND2 2.96Å; D158-N160 PolarHBondContact OD2-ND2 2.81Å; N160-S162 WeakPolarHBondContact OD1-CA 3.27Å; N160-S162 PolarHBondContact OD1-N 3.47Å; N160-S162 PolarHBondContact OD1-O 2.98Å; N160-S162 PolarHBondContact OD1-OG 3.35Å
161	G	84.9	Confident	83	Confident	37 Å²	37	47.6 Å²	47.6	38%	0.381	28%	0.276	S	S	.	.	S	Bend	trans	83.4	15	179	0	0	0	0	0	114.7	F152 D156 G159	F152-G161 WeakPolarHBondContact CZ-O 3.32Å; D156-G161 WeakPolarHBondContact OD2-CA 3.18Å; D156-G161 PolarHBondContact OD2-N 3.45Å; D156-G161 VanDerWaalsContact OD2-N 3.07Å; G159-G161 PolarHBondContact O-N 3.23Å
162	S	89.4	Confident	83	Confident	25 Å²	25	47.6 Å²	47.6	18%	0.175	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	145	177.6	55.4	0	0	0	0	110.5	N160 V208	N160-S162 WeakPolarHBondContact OD1-CA 3.27Å; N160-S162 PolarHBondContact OD1-N 3.47Å; N160-S162 PolarHBondContact OD1-O 2.98Å; N160-S162 PolarHBondContact OD1-OG 3.35Å; S162-V208 CarbonylContact C-O 3.54Å; S162-V208 WeakPolarHBondContact CA-O 3.43Å
163	L	89.5	Confident	82.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119.5	176.2	-65.7	169.7	0	0	0	109.8	F152 D156 E167 L168 I171 T207 V208 W213	F152-L163 HydrophobicContact CD2-CD1 3.46Å; F152-L163 VanDerWaalsContact CD2-CD1 3.46Å; F152-L163 HydrophobicContact CD2-CG 3.75Å; F152-L163 HydrophobicContact CE2-CB 4.45Å; F152-L163 HydrophobicContact CE2-CD1 3.7Å; F152-L163 HydrophobicContact CE2-CD2 4.49Å; F152-L163 HydrophobicContact CE2-CG 3.53Å; F152-L163 HydrophobicContact CG-CD1 4.31Å; F152-L163 HydrophobicContact CZ-CG 4.09Å; D156-L163 HydrophobicContact CB-CD2 4.16Å; L163-E167 WeakPolarHBondContact CA-OE2 3.43Å; L163-E167 HydrophobicContact CD2-CB 4.02Å; L163-L168 HydrophobicContact CB-CD2 3.89Å; L163-L168 HydrophobicContact CB-CG 4Å; L163-L168 HydrophobicContact CD1-CD2 4.04Å; L163-I171 HydrophobicContact CD1-CD1 3.75Å; L163-I171 HydrophobicContact CD2-CD1 4.32Å; L163-T207 WeakPolarHBondContact O-CA 3.48Å; L163-V208 HydrophobicContact CB-CB 4.39Å; L163-V208 PolarHBondContact N-O 3.41Å; L163-V208 PolarHBondContact O-N 2.89Å; L163-W213 HydrophobicContact CD1-CD2 3.97Å; L163-W213 HydrophobicContact CD1-CE3 3.92Å; L163-W213 HydrophobicContact CD1-CG 4.44Å; L163-W213 HydrophobicContact CD1-CH2 4.35Å; L163-W213 HydrophobicContact CD1-CZ2 4.36Å; L163-W213 HydrophobicContact CD1-CZ3 4.12Å
164	D	88.1	Confident	82.3	Confident	51 Å²	51	43.1 Å²	43.1	27%	0.273	27%	0.267	S	S	.	.			trans	-82.6	172.8	175.8	79.9	23.1	0	0	0	112.7	S166 E167 L168	D164-S166 PolarHBondContact O-N 2.94Å; D164-S166 VanDerWaalsContact O-N 3.14Å; D164-S166 VanDerWaalsContact OD1-CA 3.28Å; D164-S166 WeakPolarHBondContact OD1-CA 3.17Å; D164-S166 VanDerWaalsContact OD1-CB 3.25Å; D164-S166 WeakPolarHBondContact OD1-CB 3.27Å; D164-S166 PolarHBondContact OD1-N 2.87Å; D164-S166 PolarHBondContact OD1-OG 3.22Å; D164-S166 PolarHBondContact OD2-OG 3.15Å; D164-E167 PolarHBondContact N-OE2 3.35Å; D164-E167 PolarHBondContact O-N 3.21Å; D164-E167 PolarHBondContact OD1-N 3.31Å; D164-L168 WeakPolarHBondContact O-CB 3.45Å; D164-L168 VanDerWaalsContact O-CG 3.29Å; D164-L168 WeakPolarHBondContact O-CG 3.44Å; D164-L168 PolarHBondContact O-N 3.03Å
165	S	85.1	Confident	82	Confident	94 Å²	94	41.3 Å²	41.3	66%	0.657	26%	0.258	S	S	*	.	H	α-helix	trans	-57	-29.2	179.9	65.2	0	0	0	0	114.4	E169	S165-E169 WeakPolarHBondContact O-CB 3.46Å; S165-E169 PolarHBondContact O-N 2.9Å
166	S	83.4	Confident	81.7	Confident	57 Å²	57	42.3 Å²	42.3	40%	0.399	26%	0.263	S	S	.	.	H	α-helix	trans	-77.2	-44.6	178.7	80.4	0	0	0	0	110.5	D164 E169 H170	D164-S166 PolarHBondContact O-N 2.94Å; D164-S166 VanDerWaalsContact O-N 3.14Å; D164-S166 VanDerWaalsContact OD1-CA 3.28Å; D164-S166 WeakPolarHBondContact OD1-CA 3.17Å; D164-S166 VanDerWaalsContact OD1-CB 3.25Å; D164-S166 WeakPolarHBondContact OD1-CB 3.27Å; D164-S166 PolarHBondContact OD1-N 2.87Å; D164-S166 PolarHBondContact OD1-OG 3.22Å; D164-S166 PolarHBondContact OD2-OG 3.15Å; S166-E169 PolarHBondContact O-N 3.31Å; S166-H170 PolarHBondContact O-N 2.65Å; S166-H170 VanDerWaalsContact O-N 3.09Å; S166-H170 PolarHBondContact O-ND1 3.47Å
167	E	86.5	Confident	80.9	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-40.6	177.6	-65.7	172.9	137.5	0	0	111.3	Y155 D156 T157 L163 D164 E169 H170 I171	Y155-E167 WeakPolarHBondContact O-CG 3.44Å; Y155-E167 VanDerWaalsContact O-OE1 3.06Å; D156-E167 WeakPolarHBondContact CA-OE1 3.32Å; T157-E167 PolarHBondContact N-OE1 3.39Å; L163-E167 WeakPolarHBondContact CA-OE2 3.43Å; L163-E167 HydrophobicContact CD2-CB 4.02Å; D164-E167 PolarHBondContact N-OE2 3.35Å; D164-E167 PolarHBondContact O-N 3.21Å; D164-E167 PolarHBondContact OD1-N 3.31Å; E167-E169 PolarHBondContact O-N 3.48Å; E167-H170 WeakPolarHBondContact O-CB 3.41Å; E167-H170 PolarHBondContact O-N 2.97Å; E167-I171 WeakPolarHBondContact O-CG1 3.35Å; E167-I171 PolarHBondContact O-N 3.13Å
168	L	84.1	Confident	80.4	Confident	17 Å²	17	41.6 Å²	41.6	9%	0.089	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-42.2	173.7	-69	171.1	0	0	0	112.4	L163 D164 H170 I171 I172 M197 V208 W213	L163-L168 HydrophobicContact CB-CD2 3.89Å; L163-L168 HydrophobicContact CB-CG 4Å; L163-L168 HydrophobicContact CD1-CD2 4.04Å; D164-L168 WeakPolarHBondContact O-CB 3.45Å; D164-L168 VanDerWaalsContact O-CG 3.29Å; D164-L168 WeakPolarHBondContact O-CG 3.44Å; D164-L168 PolarHBondContact O-N 3.03Å; L168-H170 VanDerWaalsContact C-N 3.28Å; L168-H170 PolarHBondContact O-N 2.98Å; L168-I171 PolarHBondContact O-N 3.34Å; L168-I172 VanDerWaalsContact O-CG1 3.31Å; L168-I172 WeakPolarHBondContact O-CG1 3.37Å; L168-I172 PolarHBondContact O-N 3.42Å; L168-M197 HydrophobicContact CD2-CG 4.39Å; L168-M197 HydrophobicContact CD2-SD 3.95Å; L168-V208 HydrophobicContact CD1-CB 4.42Å; L168-V208 HydrophobicContact CD1-CG2 3.78Å; L168-V208 HydrophobicContact CD2-CG2 4.4Å; L168-W213 HydrophobicContact CD2-CE3 4.32Å; L168-W213 HydrophobicContact CD2-CH2 4.28Å; L168-W213 HydrophobicContact CD2-CZ3 3.62Å
169	E	83	Confident	79.8	Confident	68 Å²	68	36.8 Å²	36.8	32%	0.318	23%	0.227	S	C	.	.	H	α-helix	trans	-66.4	-31.4	176.9	-172.7	68.4	-159.8	0	0	111.4	S165 S166 E167 I172 S173 K190 Q194	S165-E169 WeakPolarHBondContact O-CB 3.46Å; S165-E169 PolarHBondContact O-N 2.9Å; S166-E169 PolarHBondContact O-N 3.31Å; E167-E169 PolarHBondContact O-N 3.48Å; E169-I172 PolarHBondContact O-N 3.12Å; E169-S173 WeakPolarHBondContact O-CB 3.47Å; E169-S173 PolarHBondContact O-N 3.4Å; E169-K190 VanDerWaalsContact OE1-CE 3.27Å; E169-K190 WeakPolarHBondContact OE1-CE 3.2Å; E169-K190 IonicContact OE1-NZ 2.77Å; E169-K190 PolarHBondContact OE1-NZ 3.24Å; E169-Q194 PolarHBondContact OE2-NE2 2.87Å
170	H	79.1	Confident	79	Confident	90 Å²	90	39.6 Å²	39.6	42%	0.417	23%	0.225	S	C	.	.	H	α-helix	trans	-64.6	-44.5	171.3	-72.4	90.5	0	0	0	111.8	Y155 S166 E167 L168 S173 Q174	Y155-H170 HydrophobicContact CD1-CB 4.09Å; Y155-H170 HydrophobicContact CE1-CB 4.18Å; S166-H170 PolarHBondContact O-N 2.65Å; S166-H170 VanDerWaalsContact O-N 3.09Å; S166-H170 PolarHBondContact O-ND1 3.47Å; E167-H170 WeakPolarHBondContact O-CB 3.41Å; E167-H170 PolarHBondContact O-N 2.97Å; L168-H170 VanDerWaalsContact C-N 3.28Å; L168-H170 PolarHBondContact O-N 2.98Å; H170-S173 PolarHBondContact O-N 3.09Å; H170-Q174 WeakPolarHBondContact O-CG 3.5Å; H170-Q174 PolarHBondContact O-N 3.01Å; H170-Q174 VanDerWaalsContact O-N 3.07Å
171	I	80	Confident	77.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-46.4	175.8	-63.8	167.4	0	0	0	110.7	M151 Y155 L163 E167 L168 S173 Q174 M175 W213	M151-I171 HydrophobicContact SD-CG2 3.78Å; Y155-I171 HydrophobicContact CD1-CG1 3.78Å; Y155-I171 HydrophobicContact CD2-CD1 4.18Å; Y155-I171 HydrophobicContact CD2-CG1 3.56Å; Y155-I171 HydrophobicContact CE1-CG1 4.31Å; Y155-I171 HydrophobicContact CE2-CG1 4.1Å; Y155-I171 HydrophobicContact CG-CD1 3.99Å; Y155-I171 HydrophobicContact CG-CG1 3.38Å; L163-I171 HydrophobicContact CD1-CD1 3.75Å; L163-I171 HydrophobicContact CD2-CD1 4.32Å; E167-I171 WeakPolarHBondContact O-CG1 3.35Å; E167-I171 PolarHBondContact O-N 3.13Å; L168-I171 PolarHBondContact O-N 3.34Å; I171-S173 VanDerWaalsContact C-N 3.34Å; I171-S173 PolarHBondContact O-N 2.72Å; I171-Q174 PolarHBondContact O-N 2.63Å; I171-M175 HydrophobicContact CG2-CE 3.53Å; I171-M175 HydrophobicContact CG2-CG 4.44Å; I171-M175 HydrophobicContact CG2-SD 3.88Å; I171-M175 WeakPolarHBondContact O-CG 3.5Å; I171-M175 PolarHBondContact O-N 2.82Å; I171-W213 HydrophobicContact CD1-CH2 3.72Å; I171-W213 HydrophobicContact CD1-CZ2 3.86Å; I171-W213 HydrophobicContact CG2-CH2 3.94Å; I171-W213 HydrophobicContact CG2-CZ2 4.23Å
172	I	80.8	Confident	76.1	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-47.3	177	-67.8	172.6	0	0	0	110.1	L168 E169 Q174 M175 M176 K190 L193 Q194 M197	L168-I172 VanDerWaalsContact O-CG1 3.31Å; L168-I172 WeakPolarHBondContact O-CG1 3.37Å; L168-I172 PolarHBondContact O-N 3.42Å; E169-I172 PolarHBondContact O-N 3.12Å; I172-Q174 VanDerWaalsContact C-N 3.25Å; I172-Q174 PolarHBondContact O-N 3.14Å; I172-M175 WeakPolarHBondContact O-CB 3.4Å; I172-M175 PolarHBondContact O-N 3.22Å; I172-M175 VanDerWaalsContact O-N 3.16Å; I172-M176 HydrophobicContact CG2-CG 4.18Å; I172-M176 VanDerWaalsContact O-CG 3.25Å; I172-M176 WeakPolarHBondContact O-CG 3.17Å; I172-M176 PolarHBondContact O-N 3.01Å; I172-K190 HydrophobicContact CG2-CG 4.47Å; I172-L193 HydrophobicContact CG1-CB 4.23Å; I172-L193 HydrophobicContact CG2-CB 4.08Å; I172-L193 HydrophobicContact CG2-CD1 4.27Å; I172-Q194 HydrophobicContact CD1-CB 4.43Å; I172-Q194 HydrophobicContact CD1-CG 3.7Å; I172-M197 HydrophobicContact CD1-CB 4.43Å; I172-M197 HydrophobicContact CD1-CG 3.66Å; I172-M197 HydrophobicContact CG1-CG 3.95Å
173	S	79.7	Confident	74.6	Confident	49 Å²	49	45.6 Å²	45.6	34%	0.343	24%	0.238	S	C	.	.	H	α-helix	trans	-56.9	-42.1	179.1	-164.5	0	0	0	0	111.4	E169 H170 I171 M176 H177	E169-S173 WeakPolarHBondContact O-CB 3.47Å; E169-S173 PolarHBondContact O-N 3.4Å; H170-S173 PolarHBondContact O-N 3.09Å; I171-S173 VanDerWaalsContact C-N 3.34Å; I171-S173 PolarHBondContact O-N 2.72Å; S173-M176 WeakPolarHBondContact O-CB 3.5Å; S173-M176 PolarHBondContact O-N 3.11Å; S173-H177 PolarHBondContact O-CD2 3.17Å; S173-H177 PolarHBondContact O-N 3.47Å; S173-H177 VanDerWaalsContact O-N 3.1Å
174	Q	72.4	Confident	73.1	Confident	18 Å²	18	49.9 Å²	49.9	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-69.6	-38.6	178.2	-68.1	-60.3	-22.3	0	0	112.7	D131 F134 Y155 H170 I171 I172 M176 H177 V178	D131-Q174 VanDerWaalsContact OD1-CD 3.25Å; D131-Q174 PolarHBondContact OD1-NE2 3.2Å; D131-Q174 PolarHBondContact OD2-NE2 3.02Å; D131-Q174 VanDerWaalsContact OD2-NE2 3.16Å; F134-Q174 HydrophobicContact CD1-CB 3.84Å; F134-Q174 HydrophobicContact CE1-CB 3.78Å; F134-Q174 HydrophobicContact CZ-CB 4.46Å; Y155-Q174 HydrophobicContact CE1-CG 4.48Å; Y155-Q174 WeakPolarHBondContact OH-CG 3.37Å; H170-Q174 WeakPolarHBondContact O-CG 3.5Å; H170-Q174 PolarHBondContact O-N 3.01Å; H170-Q174 VanDerWaalsContact O-N 3.07Å; I171-Q174 PolarHBondContact O-N 2.63Å; I172-Q174 VanDerWaalsContact C-N 3.25Å; I172-Q174 PolarHBondContact O-N 3.14Å; Q174-M176 VanDerWaalsContact C-N 3.29Å; Q174-M176 PolarHBondContact O-N 3.35Å; Q174-H177 WeakPolarHBondContact O-CB 3.11Å; Q174-H177 PolarHBondContact O-N 2.97Å; Q174-V178 WeakPolarHBondContact O-CG2 3.46Å; Q174-V178 PolarHBondContact O-N 3.37Å
175	M	73.9	Confident	71.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-34.9	171.4	-75.5	177	178.7	0	0	113	F134 M151 I171 I172 V178 A179 L193 L223 L226 L227	F134-M175 HydrophobicContact CZ-CE 4.49Å; F134-M175 HydrophobicContact CZ-CG 4.06Å; M151-M175 HydrophobicContact CE-CE 3.91Å; M151-M175 HydrophobicContact SD-CE 3.43Å; M151-M175 WeakPolarHBondContact SD-CE 3.41Å; I171-M175 HydrophobicContact CG2-CE 3.53Å; I171-M175 HydrophobicContact CG2-CG 4.44Å; I171-M175 HydrophobicContact CG2-SD 3.88Å; I171-M175 WeakPolarHBondContact O-CG 3.5Å; I171-M175 PolarHBondContact O-N 2.82Å; I172-M175 WeakPolarHBondContact O-CB 3.4Å; I172-M175 PolarHBondContact O-N 3.22Å; I172-M175 VanDerWaalsContact O-N 3.16Å; M175-V178 PolarHBondContact O-N 3.29Å; M175-A179 VanDerWaalsContact O-CB 3.28Å; M175-A179 WeakPolarHBondContact O-CB 3.19Å; M175-A179 PolarHBondContact O-N 3.37Å; M175-L193 HydrophobicContact CB-CD1 3.95Å; M175-L223 HydrophobicContact CE-CD1 3.21Å; M175-L223 HydrophobicContact CE-CG 4Å; M175-L223 HydrophobicContact SD-CD1 3.45Å; M175-L223 WeakPolarHBondContact SD-CD1 3.1Å; M175-L226 HydrophobicContact CB-CD1 4.02Å; M175-L226 HydrophobicContact CG-CB 4.28Å; M175-L226 HydrophobicContact CG-CD1 4.42Å; M175-L227 HydrophobicContact CE-CD2 4.29Å; M175-L227 HydrophobicContact CE-CG 4.45Å
176	M	75.3	Confident	71.1	Confident	23 Å²	23	49.9 Å²	49.9	11%	0.113	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-38.2	174.4	-68.9	-52.4	-57.3	0	0	111.8	I172 S173 Q174 A179 E180 V186 L189 K190 L193	I172-M176 HydrophobicContact CG2-CG 4.18Å; I172-M176 VanDerWaalsContact O-CG 3.25Å; I172-M176 WeakPolarHBondContact O-CG 3.17Å; I172-M176 PolarHBondContact O-N 3.01Å; S173-M176 WeakPolarHBondContact O-CB 3.5Å; S173-M176 PolarHBondContact O-N 3.11Å; Q174-M176 VanDerWaalsContact C-N 3.29Å; Q174-M176 PolarHBondContact O-N 3.35Å; M176-A179 PolarHBondContact O-N 3.42Å; M176-E180 WeakPolarHBondContact O-CB 3.47Å; M176-E180 PolarHBondContact O-N 2.94Å; M176-V186 HydrophobicContact CE-CB 3.31Å; M176-V186 HydrophobicContact CE-CG1 3.57Å; M176-V186 VanDerWaalsContact CE-O 3.24Å; M176-V186 WeakPolarHBondContact CE-O 3.47Å; M176-L189 HydrophobicContact CE-CB 4.19Å; M176-L189 HydrophobicContact CE-CD2 4.37Å; M176-L189 HydrophobicContact SD-CB 4.22Å; M176-L189 HydrophobicContact SD-CD2 4.01Å; M176-L189 HydrophobicContact SD-CG 4.03Å; M176-K190 HydrophobicContact CE-CB 3.92Å; M176-K190 HydrophobicContact CG-CB 4.38Å; M176-K190 HydrophobicContact SD-CB 3.84Å; M176-L193 HydrophobicContact CG-CD1 4.42Å; M176-L193 HydrophobicContact SD-CD1 3.7Å
177	H	68.3	Low	70.6	Confident	87 Å²	87	52.7 Å²	52.7	40%	0.403	26%	0.263	S	S	.	.	H	α-helix	trans	-64.1	-42.3	172.9	-71.8	-62.7	0	0	0	112.1	S173 Q174 A179 E180 Y181	S173-H177 PolarHBondContact O-CD2 3.17Å; S173-H177 PolarHBondContact O-N 3.47Å; S173-H177 VanDerWaalsContact O-N 3.1Å; Q174-H177 WeakPolarHBondContact O-CB 3.11Å; Q174-H177 PolarHBondContact O-N 2.97Å; H177-A179 VanDerWaalsContact C-N 3.35Å; H177-E180 PolarHBondContact O-N 2.97Å; H177-Y181 PolarHBondContact O-N 2.88Å
178	V	64.8	Low	69.6	Low	6 Å²	6	58.8 Å²	58.8	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-40.2	174.2	176	0	0	0	0	111.2	F134 L138 Q174 M175 Y181 L182 L226	F134-V178 HydrophobicContact CD1-CG2 4.33Å; F134-V178 HydrophobicContact CE1-CG2 3.61Å; F134-V178 HydrophobicContact CZ-CG2 4.48Å; L138-V178 HydrophobicContact CD1-CB 4.41Å; L138-V178 HydrophobicContact CD1-CG1 3.77Å; L138-V178 HydrophobicContact CD1-CG2 3.65Å; Q174-V178 WeakPolarHBondContact O-CG2 3.46Å; Q174-V178 PolarHBondContact O-N 3.37Å; M175-V178 PolarHBondContact O-N 3.29Å; V178-Y181 WeakPolarHBondContact O-CB 3.45Å; V178-Y181 PolarHBondContact O-N 3.29Å; V178-L182 HydrophobicContact CG1-CD1 4Å; V178-L182 HydrophobicContact CG1-CG 4.41Å; V178-L182 VanDerWaalsContact O-CG 3.27Å; V178-L182 WeakPolarHBondContact O-CG 3.3Å; V178-L182 PolarHBondContact O-N 2.8Å; V178-L226 HydrophobicContact CB-CD2 4.41Å; V178-L226 HydrophobicContact CG1-CD2 4.09Å
179	A	62.9	Low	68.8	Low	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-42.4	177.6	0	0	0	0	0	112.4	M175 M176 H177 Y181 L182 E183 W184 V186 L189 L226	M175-A179 VanDerWaalsContact O-CB 3.28Å; M175-A179 WeakPolarHBondContact O-CB 3.19Å; M175-A179 PolarHBondContact O-N 3.37Å; M176-A179 PolarHBondContact O-N 3.42Å; H177-A179 VanDerWaalsContact C-N 3.35Å; A179-Y181 VanDerWaalsContact C-N 3.31Å; A179-Y181 PolarHBondContact O-N 3.16Å; A179-L182 CarbonylContact O-C 3.51Å; A179-L182 PolarHBondContact O-N 2.76Å; A179-E183 PolarHBondContact O-N 3.37Å; A179-W184 HydrophobicContact CB-CB 4.11Å; A179-W184 HydrophobicContact CB-CE3 4.42Å; A179-W184 WeakPolarHBondContact O-CB 3.41Å; A179-W184 PolarHBondContact O-N 3.43Å; A179-V186 HydrophobicContact CB-CG1 4.37Å; A179-L189 HydrophobicContact CB-CD2 3.25Å; A179-L226 HydrophobicContact CB-CD2 3.84Å
180	E	62.8	Low	68.4	Low	117 Å²	117	59.2 Å²	59.2	55%	0.547	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-43.4	174.7	-169.4	169.7	-159	0	0	110.9	M176 H177 L182 E183 V186	M176-E180 WeakPolarHBondContact O-CB 3.47Å; M176-E180 PolarHBondContact O-N 2.94Å; H177-E180 PolarHBondContact O-N 2.97Å; E180-L182 VanDerWaalsContact C-N 3.35Å; E180-L182 PolarHBondContact O-N 3.33Å; E180-E183 PolarHBondContact O-N 3.41Å; E180-V186 HydrophobicContact CB-CG1 3.95Å
181	Y	57.3	Low	68.2	Low	53 Å²	53	58.2 Å²	58.2	21%	0.208	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-41	173.4	176.9	-95	0	0	0	112.8	F15 H177 V178 A179 E183	F15-Y181 WeakPolarHBondContact CB-OH 3.3Å; F15-Y181 HydrophobicContact CD1-CE1 4.41Å; F15-Y181 WeakPolarHBondContact CD1-OH 3.49Å; F15-Y181 HydrophobicContact CD2-CE1 4.27Å; F15-Y181 AromaticContact CD2-CZ 3.97Å; F15-Y181 HydrophobicContact CE1-CE1 4.45Å; F15-Y181 HydrophobicContact CE2-CE1 4.33Å; F15-Y181 HydrophobicContact CG-CE1 4.3Å; F15-Y181 AromaticContact CG-CZ 3.81Å; F15-Y181 WeakPolarHBondContact CG-OH 3.47Å; F15-Y181 HydrophobicContact CZ-CE1 4.41Å; H177-Y181 PolarHBondContact O-N 2.88Å; V178-Y181 WeakPolarHBondContact O-CB 3.45Å; V178-Y181 PolarHBondContact O-N 3.29Å; A179-Y181 VanDerWaalsContact C-N 3.31Å; A179-Y181 PolarHBondContact O-N 3.16Å; Y181-E183 PolarHBondContact O-N 3Å; Y181-E183 VanDerWaalsContact O-N 3.15Å
182	L	52.8	Low	67.7	Low	76 Å²	76	61.7 Å²	61.7	40%	0.398	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	6.3	176.3	-66.5	174.9	0	0	0	113.5	V178 A179 E180 W184 L226	V178-L182 HydrophobicContact CG1-CD1 4Å; V178-L182 HydrophobicContact CG1-CG 4.41Å; V178-L182 VanDerWaalsContact O-CG 3.27Å; V178-L182 WeakPolarHBondContact O-CG 3.3Å; V178-L182 PolarHBondContact O-N 2.8Å; A179-L182 CarbonylContact O-C 3.51Å; A179-L182 PolarHBondContact O-N 2.76Å; E180-L182 VanDerWaalsContact C-N 3.35Å; E180-L182 PolarHBondContact O-N 3.33Å; L182-W184 VanDerWaalsContact C-N 3.27Å; L182-W184 HydrophobicContact CB-CG 4.36Å; L182-W184 VanDerWaalsContact O-CD1 3.27Å; L182-W184 PolarHBondContact O-N 3.02Å; L182-L226 HydrophobicContact CD1-CD2 4.29Å
183	E	56.6	Low	67.3	Low	138 Å²	138	61.5 Å²	61.5	65%	0.645	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	34.5	-175.6	-56.1	178.2	-175.2	0	0	113.1	A179 E180 Y181 K427	A179-E183 PolarHBondContact O-N 3.37Å; E180-E183 PolarHBondContact O-N 3.41Å; Y181-E183 PolarHBondContact O-N 3Å; Y181-E183 VanDerWaalsContact O-N 3.15Å; E183-K427 IonicContact OE2-NZ 3.81Å; E183-K427 PolarHBondContact OE2-NZ 3.11Å
184	W	58.8	Low	67.3	Low	90 Å²	90	62.6 Å²	62.6	34%	0.341	31%	0.31	S	S	.	.			trans	-80.7	151.3	173.4	-68.8	19.5	0	0	0	110.2	A179 L182 V186 L189 V225 L226	A179-W184 HydrophobicContact CB-CB 4.11Å; A179-W184 HydrophobicContact CB-CE3 4.42Å; A179-W184 WeakPolarHBondContact O-CB 3.41Å; A179-W184 PolarHBondContact O-N 3.43Å; L182-W184 VanDerWaalsContact C-N 3.27Å; L182-W184 HydrophobicContact CB-CG 4.36Å; L182-W184 VanDerWaalsContact O-CD1 3.27Å; L182-W184 PolarHBondContact O-N 3.02Å; W184-V186 PolarHBondContact O-N 2.81Å; W184-L189 HydrophobicContact CE3-CD1 4.28Å; W184-L189 HydrophobicContact CE3-CD2 3.81Å; W184-L189 HydrophobicContact CZ3-CD1 4.46Å; W184-L189 HydrophobicContact CZ3-CD2 4.49Å; W184-V225 HydrophobicContact CH2-CB 3.9Å; W184-V225 HydrophobicContact CH2-CG1 3.45Å; W184-V225 VanDerWaalsContact CH2-CG1 3.45Å; W184-V225 HydrophobicContact CZ2-CB 4.38Å; W184-V225 HydrophobicContact CZ2-CG1 3.44Å; W184-V225 VanDerWaalsContact CZ2-CG1 3.44Å; W184-L226 HydrophobicContact CE3-CD2 4.26Å; W184-L226 HydrophobicContact CH2-CD2 4.36Å; W184-L226 HydrophobicContact CH2-CG 4.38Å; W184-L226 HydrophobicContact CZ3-CD1 4.32Å; W184-L226 HydrophobicContact CZ3-CD2 4.03Å; W184-L226 HydrophobicContact CZ3-CG 4.08Å
185	D	62.6	Low	67.4	Low	100 Å²	100	67.3 Å²	67.3	54%	0.535	33%	0.332	S	S	.	.			trans	-72.3	101.8	172.8	-168.8	-18	0	0	0	109.6	T187 L189	D185-T187 PolarHBondContact O-N 3.18Å; D185-T187 VanDerWaalsContact OD1-CB 3.23Å; D185-T187 WeakPolarHBondContact OD1-CB 3.41Å; D185-T187 PolarHBondContact OD1-N 3.03Å; D185-T187 PolarHBondContact OD1-OG1 3.44Å; D185-L189 WeakPolarHBondContact O-CB 3.39Å; D185-L189 PolarHBondContact O-N 3.4Å
186	V	68.1	Low	67.3	Low	45 Å²	45	67.9 Å²	67.9	27%	0.273	34%	0.335	S	S	.	.	H	α-helix	trans	-71.2	-17.7	-177.8	-68.2	0	0	0	0	113.4	M176 A179 E180 W184 K190	M176-V186 HydrophobicContact CE-CB 3.31Å; M176-V186 HydrophobicContact CE-CG1 3.57Å; M176-V186 VanDerWaalsContact CE-O 3.24Å; M176-V186 WeakPolarHBondContact CE-O 3.47Å; A179-V186 HydrophobicContact CB-CG1 4.37Å; E180-V186 HydrophobicContact CB-CG1 3.95Å; W184-V186 PolarHBondContact O-N 2.81Å; V186-K190 PolarHBondContact O-N 2.82Å
187	T	72.5	Confident	67.4	Low	115 Å²	115	67.2 Å²	67.2	71%	0.706	33%	0.332	S	S	*	.	H	α-helix	trans	-67.6	-39.5	-176.3	-36.9	0	0	0	0	111.6	D185	D185-T187 PolarHBondContact O-N 3.18Å; D185-T187 VanDerWaalsContact OD1-CB 3.23Å; D185-T187 WeakPolarHBondContact OD1-CB 3.41Å; D185-T187 PolarHBondContact OD1-N 3.03Å; D185-T187 PolarHBondContact OD1-OG1 3.44Å
188	E	66.7	Low	68	Low	139 Å²	139	70.1 Å²	70.1	65%	0.65	35%	0.345	S	S	*	.	H	α-helix	trans	-93.8	-20.2	179.3	-62.4	-171.4	168.6	0	0	112.4	P191 I192	E188-P191 WeakPolarHBondContact O-CD 3.31Å; E188-P191 WeakPolarHBondContact O-CG 3.35Å; E188-I192 WeakPolarHBondContact O-CD1 3.34Å; E188-I192 VanDerWaalsContact O-CG1 3.23Å; E188-I192 WeakPolarHBondContact O-CG1 3.44Å
189	L	66.2	Low	68.6	Low	14 Å²	14	75.8 Å²	75.8	7%	0.073	37%	0.371	C	S	.	.	H	α-helix	trans	-77.9	-39.2	-174.1	-174.6	67.6	0	0	0	113.8	M176 A179 W184 D185 I192 L193 L226	M176-L189 HydrophobicContact CE-CB 4.19Å; M176-L189 HydrophobicContact CE-CD2 4.37Å; M176-L189 HydrophobicContact SD-CB 4.22Å; M176-L189 HydrophobicContact SD-CD2 4.01Å; M176-L189 HydrophobicContact SD-CG 4.03Å; A179-L189 HydrophobicContact CB-CD2 3.25Å; W184-L189 HydrophobicContact CE3-CD1 4.28Å; W184-L189 HydrophobicContact CE3-CD2 3.81Å; W184-L189 HydrophobicContact CZ3-CD1 4.46Å; W184-L189 HydrophobicContact CZ3-CD2 4.49Å; D185-L189 WeakPolarHBondContact O-CB 3.39Å; D185-L189 PolarHBondContact O-N 3.4Å; L189-I192 WeakPolarHBondContact O-CB 3.38Å; L189-I192 PolarHBondContact O-N 3.14Å; L189-I192 VanDerWaalsContact O-N 3.14Å; L189-L193 HydrophobicContact CD1-CG 4.38Å; L189-L193 HydrophobicContact CD2-CD1 4.49Å; L189-L193 HydrophobicContact CG-CD1 4.15Å; L189-L193 HydrophobicContact CG-CG 4.24Å; L189-L193 PolarHBondContact O-N 3.32Å; L189-L226 HydrophobicContact CD2-CD1 4.43Å
190	K	74.6	Confident	69.5	Low	80 Å²	80	75.9 Å²	75.9	35%	0.348	37%	0.372	S	S	.	.	H	α-helix	trans	-55.9	-50.5	179.7	-175.3	168.2	-178.8	164.5	0	113.2	E169 I172 M176 V186 I192 L193 Q194	E169-K190 VanDerWaalsContact OE1-CE 3.27Å; E169-K190 WeakPolarHBondContact OE1-CE 3.2Å; E169-K190 IonicContact OE1-NZ 2.77Å; E169-K190 PolarHBondContact OE1-NZ 3.24Å; I172-K190 HydrophobicContact CG2-CG 4.47Å; M176-K190 HydrophobicContact CE-CB 3.92Å; M176-K190 HydrophobicContact CG-CB 4.38Å; M176-K190 HydrophobicContact SD-CB 3.84Å; V186-K190 PolarHBondContact O-N 2.82Å; K190-I192 VanDerWaalsContact C-N 3.27Å; K190-I192 PolarHBondContact O-N 3.07Å; K190-L193 PolarHBondContact O-N 2.79Å; K190-Q194 WeakPolarHBondContact O-CG 3.44Å; K190-Q194 PolarHBondContact O-N 2.82Å
191	P	74.8	Confident	70.5	Confident	68 Å²	68	71.4 Å²	71.4	44%	0.442	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-31.4	177.7	23.5	-32.4	0	0	0	112.6	E188 Q194 E195	E188-P191 WeakPolarHBondContact O-CD 3.31Å; E188-P191 WeakPolarHBondContact O-CG 3.35Å; P191-Q194 PolarHBondContact O-N 3.22Å; P191-E195 WeakPolarHBondContact O-CB 3.46Å; P191-E195 PolarHBondContact O-N 3.02Å
192	I	69.7	Low	71.7	Confident	74 Å²	74	74.3 Å²	74.3	38%	0.379	36%	0.363	S	S	.	.	H	α-helix	trans	-63.7	-47.5	173.9	-66.4	167.8	0	0	0	110.4	E188 L189 K190 Q194 E195 M196	E188-I192 WeakPolarHBondContact O-CD1 3.34Å; E188-I192 VanDerWaalsContact O-CG1 3.23Å; E188-I192 WeakPolarHBondContact O-CG1 3.44Å; L189-I192 WeakPolarHBondContact O-CB 3.38Å; L189-I192 PolarHBondContact O-N 3.14Å; L189-I192 VanDerWaalsContact O-N 3.14Å; K190-I192 VanDerWaalsContact C-N 3.27Å; K190-I192 PolarHBondContact O-N 3.07Å; I192-Q194 VanDerWaalsContact C-N 3.31Å; I192-Q194 PolarHBondContact O-N 3.21Å; I192-E195 PolarHBondContact O-N 2.96Å; I192-M196 HydrophobicContact CG2-CG 4.29Å; I192-M196 HydrophobicContact CG2-SD 3.86Å; I192-M196 WeakPolarHBondContact O-CB 3.45Å; I192-M196 WeakPolarHBondContact O-CG 3.42Å; I192-M196 PolarHBondContact O-N 3.09Å
193	L	71.6	Confident	73.1	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-64	-37	179	-68.6	177	0	0	0	112	I172 M175 M176 L189 K190 M196 M197 P222 L226	I172-L193 HydrophobicContact CG1-CB 4.23Å; I172-L193 HydrophobicContact CG2-CB 4.08Å; I172-L193 HydrophobicContact CG2-CD1 4.27Å; M175-L193 HydrophobicContact CB-CD1 3.95Å; M176-L193 HydrophobicContact CG-CD1 4.42Å; M176-L193 HydrophobicContact SD-CD1 3.7Å; L189-L193 HydrophobicContact CD1-CG 4.38Å; L189-L193 HydrophobicContact CD2-CD1 4.49Å; L189-L193 HydrophobicContact CG-CD1 4.15Å; L189-L193 HydrophobicContact CG-CG 4.24Å; L189-L193 PolarHBondContact O-N 3.32Å; K190-L193 PolarHBondContact O-N 2.79Å; L193-M196 HydrophobicContact CD2-SD 4.15Å; L193-M196 WeakPolarHBondContact O-CB 3.45Å; L193-M196 PolarHBondContact O-N 3.21Å; L193-M197 VanDerWaalsContact O-CG 3.32Å; L193-M197 WeakPolarHBondContact O-CG 3.3Å; L193-M197 PolarHBondContact O-N 3.32Å; L193-P222 HydrophobicContact CD2-CB 4.23Å; L193-L226 HydrophobicContact CD1-CD1 4.23Å; L193-L226 HydrophobicContact CD2-CD1 4.21Å
194	Q	79.8	Confident	74.4	Confident	71 Å²	71	77 Å²	77	33%	0.332	38%	0.377	S	S	.	.	H	α-helix	trans	-66.7	-43.2	175.9	-72.2	178.6	-33.4	0	0	112.4	E169 I172 K190 P191 I192 M196 M197 Q198	E169-Q194 PolarHBondContact OE2-NE2 2.87Å; I172-Q194 HydrophobicContact CD1-CB 4.43Å; I172-Q194 HydrophobicContact CD1-CG 3.7Å; K190-Q194 WeakPolarHBondContact O-CG 3.44Å; K190-Q194 PolarHBondContact O-N 2.82Å; P191-Q194 PolarHBondContact O-N 3.22Å; I192-Q194 VanDerWaalsContact C-N 3.31Å; I192-Q194 PolarHBondContact O-N 3.21Å; Q194-M196 VanDerWaalsContact C-N 3.33Å; Q194-M197 PolarHBondContact O-N 3.2Å; Q194-Q198 WeakPolarHBondContact O-CG 3.35Å; Q194-Q198 PolarHBondContact O-N 3.16Å
195	E	75.4	Confident	75.7	Confident	118 Å²	118	77.3 Å²	77.3	55%	0.551	39%	0.386	S	S	*	.	H	α-helix	trans	-62.6	-41.8	173.5	-172.6	173.7	-164	0	0	110.8	P191 I192 M197 Q198 E199	P191-E195 WeakPolarHBondContact O-CB 3.46Å; P191-E195 PolarHBondContact O-N 3.02Å; I192-E195 PolarHBondContact O-N 2.96Å; E195-M197 PolarHBondContact O-N 3.47Å; E195-Q198 WeakPolarHBondContact O-CB 3.45Å; E195-Q198 PolarHBondContact O-N 2.83Å; E195-E199 PolarHBondContact O-N 3.41Å
196	M	71.4	Confident	76.7	Confident	11 Å²	11	74.9 Å²	74.9	5%	0.054	38%	0.384	C	S	.	.	H	α-helix	trans	-60.5	-42.7	175.4	-72.1	176.2	123.9	0	0	112.7	I192 L193 Q194 Q198 E199 I200 T220 P222	I192-M196 HydrophobicContact CG2-CG 4.29Å; I192-M196 HydrophobicContact CG2-SD 3.86Å; I192-M196 WeakPolarHBondContact O-CB 3.45Å; I192-M196 WeakPolarHBondContact O-CG 3.42Å; I192-M196 PolarHBondContact O-N 3.09Å; L193-M196 HydrophobicContact CD2-SD 4.15Å; L193-M196 WeakPolarHBondContact O-CB 3.45Å; L193-M196 PolarHBondContact O-N 3.21Å; Q194-M196 VanDerWaalsContact C-N 3.33Å; M196-Q198 VanDerWaalsContact C-N 3.26Å; M196-Q198 PolarHBondContact O-N 3.24Å; M196-E199 PolarHBondContact O-N 3.24Å; M196-E199 VanDerWaalsContact O-N 3.13Å; M196-I200 VanDerWaalsContact O-CG1 3.24Å; M196-I200 WeakPolarHBondContact O-CG1 3.49Å; M196-I200 PolarHBondContact O-N 2.9Å; M196-I200 VanDerWaalsContact O-N 3.09Å; M196-T220 HydrophobicContact CB-CG2 4.1Å; M196-T220 HydrophobicContact CE-CG2 3.11Å; M196-T220 HydrophobicContact CG-CG2 4.1Å; M196-T220 HydrophobicContact SD-CG2 3.47Å; M196-T220 WeakPolarHBondContact SD-CG2 3.25Å; M196-P222 HydrophobicContact CE-CB 4.08Å; M196-P222 HydrophobicContact CE-CG 3.57Å; M196-P222 HydrophobicContact SD-CB 3.99Å; M196-P222 HydrophobicContact SD-CG 3.95Å
197	M	77.6	Confident	77.6	Confident	9 Å²	9	74.6 Å²	74.6	4%	0.044	38%	0.383	C	S	.	.	H	α-helix	trans	-64	-33.4	178	-68.2	-48.5	130.7	0	0	112.3	L168 I172 L193 Q194 E195 I200 W213 L223	L168-M197 HydrophobicContact CD2-CG 4.39Å; L168-M197 HydrophobicContact CD2-SD 3.95Å; I172-M197 HydrophobicContact CD1-CB 4.43Å; I172-M197 HydrophobicContact CD1-CG 3.66Å; I172-M197 HydrophobicContact CG1-CG 3.95Å; L193-M197 VanDerWaalsContact O-CG 3.32Å; L193-M197 WeakPolarHBondContact O-CG 3.3Å; L193-M197 PolarHBondContact O-N 3.32Å; Q194-M197 PolarHBondContact O-N 3.2Å; E195-M197 PolarHBondContact O-N 3.47Å; M197-I200 HydrophobicContact CE-CD1 4.15Å; M197-I200 PolarHBondContact O-N 2.96Å; M197-I200 HydrophobicContact SD-CD1 4.05Å; M197-W213 HydrophobicContact CE-CH2 4.25Å; M197-W213 HydrophobicContact CE-CZ3 4.21Å; M197-W213 HydrophobicContact SD-CH2 3.91Å; M197-W213 HydrophobicContact SD-CZ3 3.42Å; M197-W213 WeakPolarHBondContact SD-CZ3 3.3Å; M197-L223 HydrophobicContact CE-CD1 3.66Å
198	Q	80	Confident	78.5	Confident	148 Å²	148	69.2 Å²	69.2	69%	0.692	35%	0.349	S	S	*	.	H	α-helix	trans	-70.6	-30.9	173.3	-67.2	174.3	3.6	0	0	112.8	Q194 E195 M196	Q194-Q198 WeakPolarHBondContact O-CG 3.35Å; Q194-Q198 PolarHBondContact O-N 3.16Å; E195-Q198 WeakPolarHBondContact O-CB 3.45Å; E195-Q198 PolarHBondContact O-N 2.83Å; M196-Q198 VanDerWaalsContact C-N 3.26Å; M196-Q198 PolarHBondContact O-N 3.24Å
199	E	78.2	Confident	79.6	Confident	125 Å²	125	64.6 Å²	64.6	58%	0.584	33%	0.333	S	S	*	.	H	α-helix	trans	-78.1	-19.5	176.7	-70.6	-169.1	162.6	0	0	113.7	E195 M196	E195-E199 PolarHBondContact O-N 3.41Å; M196-E199 PolarHBondContact O-N 3.24Å; M196-E199 VanDerWaalsContact O-N 3.13Å
200	I	81.8	Confident	80.6	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-78.4	-29.5	177.8	-68.6	170.8	0	0	0	111	M196 M197 Y202 V208 E212 W213 T220	M196-I200 VanDerWaalsContact O-CG1 3.24Å; M196-I200 WeakPolarHBondContact O-CG1 3.49Å; M196-I200 PolarHBondContact O-N 2.9Å; M196-I200 VanDerWaalsContact O-N 3.09Å; M197-I200 HydrophobicContact CE-CD1 4.15Å; M197-I200 PolarHBondContact O-N 2.96Å; M197-I200 HydrophobicContact SD-CD1 4.05Å; I200-Y202 WeakPolarHBondContact O-CD2 3.43Å; I200-Y202 PolarHBondContact O-N 3.37Å; I200-Y202 VanDerWaalsContact O-N 3.08Å; I200-V208 HydrophobicContact CG2-CG1 3.62Å; I200-V208 HydrophobicContact CG2-CG2 4.44Å; I200-E212 WeakPolarHBondContact CG2-O 3.31Å; I200-E212 WeakPolarHBondContact O-CB 3.48Å; I200-W213 HydrophobicContact CG2-CE3 4.41Å; I200-T220 HydrophobicContact CD1-CG2 4.49Å
201	D	84.6	Confident	80.8	Confident	23 Å²	23	64.9 Å²	64.9	12%	0.123	35%	0.35	C	S	.	.			trans	-69.5	93.6	168.4	178.1	0.8	0	0	0	109.4	Q204 D205 G206 V208	D201-Q204 WeakPolarHBondContact OD1-CA 3.15Å; D201-Q204 PolarHBondContact OD1-N 3.02Å; D201-Q204 WeakPolarHBondContact OD2-CA 3.36Å; D201-D205 PolarHBondContact OD1-N 3.48Å; D201-G206 WeakPolarHBondContact OD2-CA 3.27Å; D201-G206 PolarHBondContact OD2-N 2.85Å; D201-V208 HydrophobicContact CB-CG2 4.04Å
202	Y	80.8	Confident	81.3	Confident	115 Å²	115	62.5 Å²	62.5	45%	0.451	33%	0.332	S	S	.	.	S	Bend	trans	-81.2	-31.2	-171	-78.6	-63.7	0	0	0	112.3	I200 E212 Q215	I200-Y202 WeakPolarHBondContact O-CD2 3.43Å; I200-Y202 PolarHBondContact O-N 3.37Å; I200-Y202 VanDerWaalsContact O-N 3.08Å; Y202-E212 HydrophobicContact CD2-CB 4.26Å; Y202-E212 HydrophobicContact CD2-CG 4.05Å; Y202-E212 PolarHBondContact N-OE1 2.89Å; Y202-Q215 HydrophobicContact CE2-CB 4.26Å; Y202-Q215 HydrophobicContact CE2-CG 4.01Å
203	D	83.2	Confident	82.1	Confident	103 Å²	103	59 Å²	59	55%	0.551	31%	0.314	S	S	*	.	S	Bend	trans	-94.2	-4.8	179.6	68.3	13.8	0	0	0	114	D205 E212	D203-D205 VanDerWaalsContact C-N 3.27Å; D203-D205 PolarHBondContact O-N 3.25Å; D203-D205 WeakPolarHBondContact OD1-CB 3.3Å; D203-D205 VanDerWaalsContact OD1-CG 3.28Å; D203-D205 PolarHBondContact OD1-N 3.46Å; D203-E212 PolarHBondContact N-OE1 3.04Å
204	Q	83.9	Confident	82.3	Confident	167 Å²	167	60.8 Å²	60.8	78%	0.78	32%	0.324	S	S	*	.			trans	61.2	34	175.9	-57.7	-172.1	-11.7	0	0	112.8	D201 G206	D201-Q204 WeakPolarHBondContact OD1-CA 3.15Å; D201-Q204 PolarHBondContact OD1-N 3.02Å; D201-Q204 WeakPolarHBondContact OD2-CA 3.36Å; Q204-G206 PolarHBondContact O-N 2.57Å
205	D	86.1	Confident	81.9	Confident	97 Å²	97	62.9 Å²	62.9	52%	0.519	33%	0.333	S	S	.	.	S	Bend	trans	-80.4	-6.8	178.8	82.3	4.4	0	0	0	113.2	D201 D203 T207	D201-D205 PolarHBondContact OD1-N 3.48Å; D203-D205 VanDerWaalsContact C-N 3.27Å; D203-D205 PolarHBondContact O-N 3.25Å; D203-D205 WeakPolarHBondContact OD1-CB 3.3Å; D203-D205 VanDerWaalsContact OD1-CG 3.28Å; D203-D205 PolarHBondContact OD1-N 3.46Å; D205-T207 WeakPolarHBondContact OD1-CA 3.32Å; D205-T207 PolarHBondContact OD1-N 3.18Å; D205-T207 VanDerWaalsContact OD1-O 3.08Å; D205-T207 PolarHBondContact OD1-OG1 3.32Å; D205-T207 PolarHBondContact OD2-OG1 2.96Å
206	G	83	Confident	81.8	Confident	49 Å²	49	57.3 Å²	57.3	51%	0.505	31%	0.308	S	S	.	.	S	Bend	trans	88.3	3.9	178.8	0	0	0	0	0	113.8	D201 Q204	D201-G206 WeakPolarHBondContact OD2-CA 3.27Å; D201-G206 PolarHBondContact OD2-N 2.85Å; Q204-G206 PolarHBondContact O-N 2.57Å
207	T	88.2	Confident	81.8	Confident	39 Å²	39	56.8 Å²	56.8	24%	0.239	31%	0.305	C	S	.	.	S	Bend	trans	-128.5	164.9	172.8	64.8	0	0	0	0	110	L163 D205	L163-T207 WeakPolarHBondContact O-CA 3.48Å; D205-T207 WeakPolarHBondContact OD1-CA 3.32Å; D205-T207 PolarHBondContact OD1-N 3.18Å; D205-T207 VanDerWaalsContact OD1-O 3.08Å; D205-T207 PolarHBondContact OD1-OG1 3.32Å; D205-T207 PolarHBondContact OD2-OG1 2.96Å
208	V	90	Very high	81.1	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	111.3	177.6	175.5	0	0	0	0	109.5	F152 S162 L163 L168 I200 D201 E212 W213	F152-V208 WeakPolarHBondContact CE2-O 3.37Å; S162-V208 CarbonylContact C-O 3.54Å; S162-V208 WeakPolarHBondContact CA-O 3.43Å; L163-V208 HydrophobicContact CB-CB 4.39Å; L163-V208 PolarHBondContact N-O 3.41Å; L163-V208 PolarHBondContact O-N 2.89Å; L168-V208 HydrophobicContact CD1-CB 4.42Å; L168-V208 HydrophobicContact CD1-CG2 3.78Å; L168-V208 HydrophobicContact CD2-CG2 4.4Å; I200-V208 HydrophobicContact CG2-CG1 3.62Å; I200-V208 HydrophobicContact CG2-CG2 4.44Å; D201-V208 HydrophobicContact CB-CG2 4.04Å; V208-E212 HydrophobicContact CG1-CB 4.12Å; V208-W213 HydrophobicContact CG1-CB 3.98Å; V208-W213 HydrophobicContact CG1-CE3 4.01Å
209	S	91.3	Very high	80.1	Confident	43 Å²	43	53.7 Å²	53.7	30%	0.301	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	161.8	176.5	68.7	0	0	0	0	112.4	G211 E212 W213	S209-G211 PolarHBondContact O-N 3.07Å; S209-E212 WeakPolarHBondContact CB-OE2 3.41Å; S209-E212 PolarHBondContact N-OE2 2.85Å; S209-E212 PolarHBondContact O-N 3.23Å; S209-E212 VanDerWaalsContact O-N 3.15Å; S209-E212 VanDerWaalsContact OG-CG 3.25Å; S209-E212 WeakPolarHBondContact OG-CG 3.37Å; S209-E212 PolarHBondContact OG-N 2.97Å; S209-E212 PolarHBondContact OG-OE2 2.91Å; S209-W213 WeakPolarHBondContact O-CB 3.5Å; S209-W213 PolarHBondContact O-N 3.04Å
210	L	87.1	Confident	79.5	Confident	50 Å²	50	48.3 Å²	48.3	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-55.1	-38.6	176.1	177.1	63.1	0	0	0	112.8	E149 F152 I214	E149-L210 HydrophobicContact CG-CD1 4.29Å; F152-L210 HydrophobicContact CB-CD1 3.68Å; F152-L210 HydrophobicContact CD1-CB 4.1Å; F152-L210 HydrophobicContact CD1-CD1 3.61Å; F152-L210 HydrophobicContact CD1-CG 4.36Å; F152-L210 HydrophobicContact CD2-CB 4.31Å; F152-L210 HydrophobicContact CD2-CD1 3.95Å; F152-L210 HydrophobicContact CE1-CB 3.83Å; F152-L210 HydrophobicContact CE1-CD1 4.24Å; F152-L210 HydrophobicContact CE2-CB 4.02Å; F152-L210 VanDerWaalsContact CE2-N 3.28Å; F152-L210 HydrophobicContact CG-CB 4.33Å; F152-L210 HydrophobicContact CG-CD1 3.45Å; F152-L210 VanDerWaalsContact CG-CD1 3.45Å; F152-L210 HydrophobicContact CG-CG 4.48Å; F152-L210 HydrophobicContact CZ-CB 3.78Å; F152-L210 VanDerWaalsContact CZ-N 3.32Å; L210-I214 HydrophobicContact CD1-CD1 3.8Å; L210-I214 HydrophobicContact CD1-CG1 4.13Å; L210-I214 HydrophobicContact CG-CD1 4.06Å; L210-I214 WeakPolarHBondContact O-CG1 3.18Å; L210-I214 PolarHBondContact O-N 2.9Å
211	G	78.4	Confident	78.3	Confident	50 Å²	50	50 Å²	50	52%	0.515	28%	0.279	S	S	.	.	H	α-helix	trans	-64.8	-44.2	179.4	0	0	0	0	0	112	S209 Q215	S209-G211 PolarHBondContact O-N 3.07Å; G211-Q215 VanDerWaalsContact O-CB 3.23Å; G211-Q215 WeakPolarHBondContact O-CB 3.31Å; G211-Q215 PolarHBondContact O-N 3.15Å
212	E	84.8	Confident	77.2	Confident	17 Å²	17	50.2 Å²	50.2	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-68.7	-42.6	177.4	-67.2	173.3	120.4	0	0	111.6	I200 Y202 D203 V208 S209 I214 Q215 G216	I200-E212 WeakPolarHBondContact CG2-O 3.31Å; I200-E212 WeakPolarHBondContact O-CB 3.48Å; Y202-E212 HydrophobicContact CD2-CB 4.26Å; Y202-E212 HydrophobicContact CD2-CG 4.05Å; Y202-E212 PolarHBondContact N-OE1 2.89Å; D203-E212 PolarHBondContact N-OE1 3.04Å; V208-E212 HydrophobicContact CG1-CB 4.12Å; S209-E212 WeakPolarHBondContact CB-OE2 3.41Å; S209-E212 PolarHBondContact N-OE2 2.85Å; S209-E212 PolarHBondContact O-N 3.23Å; S209-E212 VanDerWaalsContact O-N 3.15Å; S209-E212 VanDerWaalsContact OG-CG 3.25Å; S209-E212 WeakPolarHBondContact OG-CG 3.37Å; S209-E212 PolarHBondContact OG-N 2.97Å; S209-E212 PolarHBondContact OG-OE2 2.91Å; E212-I214 PolarHBondContact O-N 3.31Å; E212-Q215 PolarHBondContact O-N 3.29Å; E212-G216 PolarHBondContact O-N 3.47Å
213	W	86.4	Confident	76.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.4	-47.8	175.4	-176.7	-110.9	0	0	0	112.9	L148 M151 F152 L163 L168 I171 M197 I200 V208 S209 G217	L148-W213 VanDerWaalsContact O-CD1 3.3Å; L148-W213 PolarHBondContact O-NE1 3.11Å; L148-W213 VanDerWaalsContact O-NE1 3.09Å; M151-W213 HydrophobicContact CE-CH2 4.29Å; M151-W213 HydrophobicContact CE-CZ2 3.19Å; M151-W213 HydrophobicContact CG-CZ2 4.31Å; M151-W213 HydrophobicContact SD-CZ2 3.82Å; F152-W213 HydrophobicContact CB-CG 4.39Å; F152-W213 HydrophobicContact CD2-CB 3.62Å; F152-W213 AromaticContact CD2-CD1 3.74Å; F152-W213 HydrophobicContact CD2-CD2 4.37Å; F152-W213 AromaticContact CD2-CG 3.64Å; F152-W213 HydrophobicContact CD2-CG 3.64Å; F152-W213 HydrophobicContact CE2-CB 4.06Å; F152-W213 HydrophobicContact CE2-CG 4.48Å; L163-W213 HydrophobicContact CD1-CD2 3.97Å; L163-W213 HydrophobicContact CD1-CE3 3.92Å; L163-W213 HydrophobicContact CD1-CG 4.44Å; L163-W213 HydrophobicContact CD1-CH2 4.35Å; L163-W213 HydrophobicContact CD1-CZ2 4.36Å; L163-W213 HydrophobicContact CD1-CZ3 4.12Å; L168-W213 HydrophobicContact CD2-CE3 4.32Å; L168-W213 HydrophobicContact CD2-CH2 4.28Å; L168-W213 HydrophobicContact CD2-CZ3 3.62Å; I171-W213 HydrophobicContact CD1-CH2 3.72Å; I171-W213 HydrophobicContact CD1-CZ2 3.86Å; I171-W213 HydrophobicContact CG2-CH2 3.94Å; I171-W213 HydrophobicContact CG2-CZ2 4.23Å; M197-W213 HydrophobicContact CE-CH2 4.25Å; M197-W213 HydrophobicContact CE-CZ3 4.21Å; M197-W213 HydrophobicContact SD-CH2 3.91Å; M197-W213 HydrophobicContact SD-CZ3 3.42Å; M197-W213 WeakPolarHBondContact SD-CZ3 3.3Å; I200-W213 HydrophobicContact CG2-CE3 4.41Å; V208-W213 HydrophobicContact CG1-CB 3.98Å; V208-W213 HydrophobicContact CG1-CE3 4.01Å; S209-W213 WeakPolarHBondContact O-CB 3.5Å; S209-W213 PolarHBondContact O-N 3.04Å; W213-G217 VanDerWaalsContact O-CA 3.26Å; W213-G217 WeakPolarHBondContact O-CA 3.43Å; W213-G217 PolarHBondContact O-N 2.5Å
214	I	75.6	Confident	75.8	Confident	38 Å²	38	41.3 Å²	41.3	20%	0.195	24%	0.241	C	C	.	.	H	α-helix	trans	-67.6	-48.4	177.4	-67.5	172.4	0	0	0	109.6	L148 E149 L210 E212 G217 L218	L148-I214 HydrophobicContact CB-CG1 4.24Å; E149-I214 HydrophobicContact CB-CD1 4.2Å; L210-I214 HydrophobicContact CD1-CD1 3.8Å; L210-I214 HydrophobicContact CD1-CG1 4.13Å; L210-I214 HydrophobicContact CG-CD1 4.06Å; L210-I214 WeakPolarHBondContact O-CG1 3.18Å; L210-I214 PolarHBondContact O-N 2.9Å; E212-I214 PolarHBondContact O-N 3.31Å; I214-G217 PolarHBondContact O-N 3.14Å; I214-L218 HydrophobicContact CG2-CD1 3.86Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.46Å; I214-L218 WeakPolarHBondContact O-CD1 3.42Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.96Å
215	Q	72.4	Confident	74.6	Confident	115 Å²	115	36.3 Å²	36.3	54%	0.537	22%	0.222	S	C	.	.	H	α-helix	trans	-62.2	-49.9	-176.5	-177.6	177.8	-60.6	0	0	112.1	Y202 G211 E212 T219	Y202-Q215 HydrophobicContact CE2-CB 4.26Å; Y202-Q215 HydrophobicContact CE2-CG 4.01Å; G211-Q215 VanDerWaalsContact O-CB 3.23Å; G211-Q215 WeakPolarHBondContact O-CB 3.31Å; G211-Q215 PolarHBondContact O-N 3.15Å; E212-Q215 PolarHBondContact O-N 3.29Å; Q215-T219 WeakPolarHBondContact O-CG2 3.24Å
216	G	72.1	Confident	73.5	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-67.5	-47.1	177.1	0	0	0	0	0	111.2	E212 L218 T219 T220	E212-G216 PolarHBondContact O-N 3.47Å; G216-L218 VanDerWaalsContact C-N 3.33Å; G216-L218 PolarHBondContact O-N 2.65Å; G216-T219 CarbonylContact O-C 3.57Å; G216-T219 WeakPolarHBondContact O-CA 3.3Å; G216-T219 WeakPolarHBondContact O-CB 3.48Å; G216-T219 PolarHBondContact O-N 2.73Å; G216-T219 PolarHBondContact O-OG1 3.28Å; G216-T220 PolarHBondContact O-N 3.05Å; G216-T220 PolarHBondContact O-OG1 2.98Å
217	G	71.4	Confident	72.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-34.1	-178.5	0	0	0	0	0	115.1	W213 I214 T219 T220 L224	W213-G217 VanDerWaalsContact O-CA 3.26Å; W213-G217 WeakPolarHBondContact O-CA 3.43Å; W213-G217 PolarHBondContact O-N 2.5Å; I214-G217 PolarHBondContact O-N 3.14Å; G217-T219 PolarHBondContact O-N 3.36Å; G217-T220 PolarHBondContact O-N 3.13Å; G217-L224 WeakPolarHBondContact O-CD2 3.44Å; G217-L224 WeakPolarHBondContact O-CG 3.38Å
218	L	63.5	Low	71.2	Confident	61 Å²	61	28.9 Å²	28.9	32%	0.319	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.4	171.8	-73.9	172.1	0	0	0	113.6	P144 E145 L148 I214 G216	P144-L218 HydrophobicContact CB-CD2 3.46Å; P144-L218 VanDerWaalsContact CB-CD2 3.46Å; E145-L218 HydrophobicContact CG-CD1 4.08Å; E145-L218 HydrophobicContact CG-CD2 4.11Å; L148-L218 HydrophobicContact CD1-CD2 3.86Å; L148-L218 HydrophobicContact CD1-CG 3.8Å; I214-L218 HydrophobicContact CG2-CD1 3.86Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.46Å; I214-L218 WeakPolarHBondContact O-CD1 3.42Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.96Å; G216-L218 VanDerWaalsContact C-N 3.33Å; G216-L218 PolarHBondContact O-N 2.65Å
219	T	59.7	Low	69.7	Low	32 Å²	32	29.9 Å²	29.9	20%	0.196	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-15.3	-177	70.7	0	0	0	0	113	Q215 G216 G217 I221 V281 A282	Q215-T219 WeakPolarHBondContact O-CG2 3.24Å; G216-T219 CarbonylContact O-C 3.57Å; G216-T219 WeakPolarHBondContact O-CA 3.3Å; G216-T219 WeakPolarHBondContact O-CB 3.48Å; G216-T219 PolarHBondContact O-N 2.73Å; G216-T219 PolarHBondContact O-OG1 3.28Å; G217-T219 PolarHBondContact O-N 3.36Å; T219-I221 PolarHBondContact O-N 2.8Å; T219-V281 HydrophobicContact CG2-CG1 4.47Å; T219-A282 HydrophobicContact CG2-CB 3.29Å
220	T	65.1	Low	67.7	Low	11 Å²	11	32.4 Å²	32.4	7%	0.067	19%	0.188	C	C	.	.			trans	-90.5	88.7	-177.1	-61	0	0	0	0	109.5	M196 I200 G216 G217 L223 L224	M196-T220 HydrophobicContact CB-CG2 4.1Å; M196-T220 HydrophobicContact CE-CG2 3.11Å; M196-T220 HydrophobicContact CG-CG2 4.1Å; M196-T220 HydrophobicContact SD-CG2 3.47Å; M196-T220 WeakPolarHBondContact SD-CG2 3.25Å; I200-T220 HydrophobicContact CD1-CG2 4.49Å; G216-T220 PolarHBondContact O-N 3.05Å; G216-T220 PolarHBondContact O-OG1 2.98Å; G217-T220 PolarHBondContact O-N 3.13Å; T220-L223 HydrophobicContact CG2-CB 3.55Å; T220-L223 HydrophobicContact CG2-CD2 4.43Å; T220-L223 HydrophobicContact CG2-CG 4.45Å; T220-L223 WeakPolarHBondContact O-CA 3.34Å; T220-L223 WeakPolarHBondContact O-CB 3.34Å; T220-L223 PolarHBondContact O-N 2.97Å; T220-L224 PolarHBondContact O-N 3.41Å; T220-L224 VanDerWaalsContact O-N 3.13Å
221	I	57	Low	65.6	Low	39 Å²	39	34.7 Å²	34.7	20%	0.2	20%	0.204	C	C	.	.	H	α-helix	trans	-58.6	-46.3	-172	-70.3	169.8	0	0	0	113.9	T219 L223 L224 V225 W241 L267	T219-I221 PolarHBondContact O-N 2.8Å; I221-L223 PolarHBondContact O-N 3.31Å; I221-L224 PolarHBondContact O-N 3.12Å; I221-L224 VanDerWaalsContact O-N 3.16Å; I221-V225 HydrophobicContact CG2-CG2 4.16Å; I221-V225 WeakPolarHBondContact O-CG2 3.28Å; I221-V225 PolarHBondContact O-N 3.12Å; I221-W241 HydrophobicContact CD1-CB 3.92Å; I221-L267 HydrophobicContact CD1-CD1 3.57Å; I221-L267 HydrophobicContact CD1-CD2 3.43Å; I221-L267 VanDerWaalsContact CD1-CD2 3.43Å; I221-L267 HydrophobicContact CD1-CG 4.14Å
222	P	61.4	Low	63.7	Low	27 Å²	27	35.8 Å²	35.8	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-45.4	-45.2	168	-33.2	33	0	0	0	113.4	L193 M196 V225 L226	L193-P222 HydrophobicContact CD2-CB 4.23Å; M196-P222 HydrophobicContact CE-CB 4.08Å; M196-P222 HydrophobicContact CE-CG 3.57Å; M196-P222 HydrophobicContact SD-CB 3.99Å; M196-P222 HydrophobicContact SD-CG 3.95Å; P222-V225 PolarHBondContact O-N 3.21Å; P222-L226 VanDerWaalsContact O-CB 3.29Å; P222-L226 WeakPolarHBondContact O-CB 3.5Å; P222-L226 WeakPolarHBondContact O-CD1 3.13Å; P222-L226 WeakPolarHBondContact O-CG 3.02Å; P222-L226 PolarHBondContact O-N 3.07Å
223	L	68.1	Low	61.9	Low	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.6	-51.2	176.9	-156.8	76.6	0	0	0	111.7	L148 M175 M197 T220 I221 V225 L226 L227	L148-L223 HydrophobicContact CD2-CD2 3.59Å; L148-L223 HydrophobicContact CD2-CG 4.37Å; M175-L223 HydrophobicContact CE-CD1 3.21Å; M175-L223 HydrophobicContact CE-CG 4Å; M175-L223 HydrophobicContact SD-CD1 3.45Å; M175-L223 WeakPolarHBondContact SD-CD1 3.1Å; M197-L223 HydrophobicContact CE-CD1 3.66Å; T220-L223 HydrophobicContact CG2-CB 3.55Å; T220-L223 HydrophobicContact CG2-CD2 4.43Å; T220-L223 HydrophobicContact CG2-CG 4.45Å; T220-L223 WeakPolarHBondContact O-CA 3.34Å; T220-L223 WeakPolarHBondContact O-CB 3.34Å; T220-L223 PolarHBondContact O-N 2.97Å; I221-L223 PolarHBondContact O-N 3.31Å; L223-V225 VanDerWaalsContact C-N 3.31Å; L223-V225 PolarHBondContact O-N 3.46Å; L223-L226 PolarHBondContact O-N 2.88Å; L223-L227 HydrophobicContact CG-CD1 4.09Å; L223-L227 WeakPolarHBondContact O-CB 3.29Å; L223-L227 WeakPolarHBondContact O-CD1 3.43Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.49Å
224	L	65.4	Low	60.1	Low	31 Å²	31	43.3 Å²	43.3	16%	0.162	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-40.4	-178.5	-62.7	177.6	0	0	0	112.3	P144 L148 G217 T220 I221 L227 L229	P144-L224 HydrophobicContact CB-CD2 4.16Å; L148-L224 HydrophobicContact CD1-CD2 4.27Å; G217-L224 WeakPolarHBondContact O-CD2 3.44Å; G217-L224 WeakPolarHBondContact O-CG 3.38Å; T220-L224 PolarHBondContact O-N 3.41Å; T220-L224 VanDerWaalsContact O-N 3.13Å; I221-L224 PolarHBondContact O-N 3.12Å; I221-L224 VanDerWaalsContact O-N 3.16Å; L224-L227 PolarHBondContact O-N 3.01Å; L224-L229 HydrophobicContact CB-CB 4.5Å; L224-L229 HydrophobicContact CB-CD1 4.21Å; L224-L229 HydrophobicContact CD2-CD1 3.47Å; L224-L229 VanDerWaalsContact CD2-CD1 3.47Å; L224-L229 HydrophobicContact CG-CD1 4.45Å; L224-L229 VanDerWaalsContact O-CB 3.24Å; L224-L229 WeakPolarHBondContact O-CB 3.49Å; L224-L229 PolarHBondContact O-N 3.16Å; L224-L229 VanDerWaalsContact O-N 3.07Å
225	V	59.6	Low	59.3	Low	61 Å²	61	46.5 Å²	46.5	37%	0.37	25%	0.253	S	S	.	.	H	α-helix	trans	-70	-41	178.7	177.7	0	0	0	0	111.2	W184 I221 P222 L223 L227 G228	W184-V225 HydrophobicContact CH2-CB 3.9Å; W184-V225 HydrophobicContact CH2-CG1 3.45Å; W184-V225 VanDerWaalsContact CH2-CG1 3.45Å; W184-V225 HydrophobicContact CZ2-CB 4.38Å; W184-V225 HydrophobicContact CZ2-CG1 3.44Å; W184-V225 VanDerWaalsContact CZ2-CG1 3.44Å; I221-V225 HydrophobicContact CG2-CG2 4.16Å; I221-V225 WeakPolarHBondContact O-CG2 3.28Å; I221-V225 PolarHBondContact O-N 3.12Å; P222-V225 PolarHBondContact O-N 3.21Å; L223-V225 VanDerWaalsContact C-N 3.31Å; L223-V225 PolarHBondContact O-N 3.46Å; V225-L227 PolarHBondContact O-N 3.02Å; V225-G228 PolarHBondContact O-N 3Å; V225-G228 VanDerWaalsContact O-N 3.09Å
226	L	63.8	Low	59.1	Low	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-70.1	-16.8	176.9	-67.3	168.1	0	0	0	112.8	L138 M175 V178 A179 L182 W184 L189 L193 P222 L223 G228	L138-L226 WeakPolarHBondContact CD2-O 3.42Å; M175-L226 HydrophobicContact CB-CD1 4.02Å; M175-L226 HydrophobicContact CG-CB 4.28Å; M175-L226 HydrophobicContact CG-CD1 4.42Å; V178-L226 HydrophobicContact CB-CD2 4.41Å; V178-L226 HydrophobicContact CG1-CD2 4.09Å; A179-L226 HydrophobicContact CB-CD2 3.84Å; L182-L226 HydrophobicContact CD1-CD2 4.29Å; W184-L226 HydrophobicContact CE3-CD2 4.26Å; W184-L226 HydrophobicContact CH2-CD2 4.36Å; W184-L226 HydrophobicContact CH2-CG 4.38Å; W184-L226 HydrophobicContact CZ3-CD1 4.32Å; W184-L226 HydrophobicContact CZ3-CD2 4.03Å; W184-L226 HydrophobicContact CZ3-CG 4.08Å; L189-L226 HydrophobicContact CD2-CD1 4.43Å; L193-L226 HydrophobicContact CD1-CD1 4.23Å; L193-L226 HydrophobicContact CD2-CD1 4.21Å; P222-L226 VanDerWaalsContact O-CB 3.29Å; P222-L226 WeakPolarHBondContact O-CB 3.5Å; P222-L226 WeakPolarHBondContact O-CD1 3.13Å; P222-L226 WeakPolarHBondContact O-CG 3.02Å; P222-L226 PolarHBondContact O-N 3.07Å; L223-L226 PolarHBondContact O-N 2.88Å; L226-G228 VanDerWaalsContact C-N 3.3Å
227	L	65.3	Low	59.1	Low	2 Å²	2	43.1 Å²	43.1	1%	0.01	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	8.4	170.3	-67.5	166.8	0	0	0	114.2	F134 L138 K147 L148 M151 M175 L223 L224 V225 L229	F134-L227 HydrophobicContact CE2-CD2 3.97Å; L138-L227 VanDerWaalsContact CD2-C 3.4Å; K147-L227 WeakPolarHBondContact CD-O 3.36Å; K147-L227 PolarHBondContact NZ-O 2.71Å; L148-L227 HydrophobicContact CD2-CD1 3.51Å; L148-L227 HydrophobicContact CG-CD1 4.19Å; M151-L227 HydrophobicContact CB-CD2 4.46Å; M151-L227 HydrophobicContact CE-CD1 3.54Å; M151-L227 HydrophobicContact CE-CD2 3.44Å; M151-L227 VanDerWaalsContact CE-CD2 3.44Å; M151-L227 HydrophobicContact CE-CG 4Å; M151-L227 HydrophobicContact SD-CD2 3.49Å; M151-L227 WeakPolarHBondContact SD-CD2 3.39Å; M175-L227 HydrophobicContact CE-CD2 4.29Å; M175-L227 HydrophobicContact CE-CG 4.45Å; L223-L227 HydrophobicContact CG-CD1 4.09Å; L223-L227 WeakPolarHBondContact O-CB 3.29Å; L223-L227 WeakPolarHBondContact O-CD1 3.43Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.49Å; L224-L227 PolarHBondContact O-N 3.01Å; V225-L227 PolarHBondContact O-N 3.02Å; L227-L229 HydrophobicContact CB-CD1 4.14Å; L227-L229 HydrophobicContact CB-CG 4.21Å; L227-L229 HydrophobicContact CD1-CD1 4.46Å; L227-L229 PolarHBondContact O-N 2.86Å
228	G	56	Low	59.6	Low	28 Å²	28	47.3 Å²	47.3	29%	0.289	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	20.3	-178.8	0	0	0	0	0	113.1	V225 L226 E230	V225-G228 PolarHBondContact O-N 3Å; V225-G228 VanDerWaalsContact O-N 3.09Å; L226-G228 VanDerWaalsContact C-N 3.3Å; G228-E230 VanDerWaalsContact C-N 3.26Å; G228-E230 PolarHBondContact O-N 3.1Å
229	L	60.1	Low	60.4	Low	22 Å²	22	45 Å²	45	12%	0.115	25%	0.247	C	C	.	.			trans	-77.7	83.5	174.9	-63	163.6	0	0	0	108.6	P144 K147 L224 L227 T231	P144-L229 HydrophobicContact CB-CD1 3.78Å; P144-L229 HydrophobicContact CB-CD2 4.5Å; P144-L229 HydrophobicContact CG-CD1 4.16Å; P144-L229 HydrophobicContact CG-CD2 4.29Å; K147-L229 HydrophobicContact CB-CD2 4.3Å; K147-L229 HydrophobicContact CD-CD2 3.58Å; K147-L229 HydrophobicContact CD-CG 4.01Å; K147-L229 HydrophobicContact CG-CD2 3.88Å; L224-L229 HydrophobicContact CB-CB 4.5Å; L224-L229 HydrophobicContact CB-CD1 4.21Å; L224-L229 HydrophobicContact CD2-CD1 3.47Å; L224-L229 VanDerWaalsContact CD2-CD1 3.47Å; L224-L229 HydrophobicContact CG-CD1 4.45Å; L224-L229 VanDerWaalsContact O-CB 3.24Å; L224-L229 WeakPolarHBondContact O-CB 3.49Å; L224-L229 PolarHBondContact O-N 3.16Å; L224-L229 VanDerWaalsContact O-N 3.07Å; L227-L229 HydrophobicContact CB-CD1 4.14Å; L227-L229 HydrophobicContact CB-CG 4.21Å; L227-L229 HydrophobicContact CD1-CD1 4.46Å; L227-L229 PolarHBondContact O-N 2.86Å; L229-T231 PolarHBondContact O-N 3.43Å
230	E	48.7	Very low	61.5	Low	96 Å²	96	44.3 Å²	44.3	45%	0.449	24%	0.243	S	C	.	.			trans	-62.1	123.2	164.2	-63.1	-156.4	142.1	0	0	108.9	G228 N232 K451	G228-E230 VanDerWaalsContact C-N 3.26Å; G228-E230 PolarHBondContact O-N 3.1Å; E230-N232 PolarHBondContact O-N 2.91Å; E230-K451 WeakPolarHBondContact OE1-CE 3.46Å; E230-K451 IonicContact OE1-NZ 3.35Å; E230-K451 PolarHBondContact OE1-NZ 3.4Å; E230-K451 IonicContact OE2-NZ 3.88Å; E230-K451 PolarHBondContact OE2-NZ 3.42Å
231	T	42	Very low	62.1	Low	97 Å²	97	45.9 Å²	45.9	60%	0.595	25%	0.247	S	C	*	.			trans	-66.8	65.9	165.3	43.4	0	0	0	0	109.4	L229	L229-T231 PolarHBondContact O-N 3.43Å
232	N	39.7	Very low	62.8	Low	74 Å²	74	49.4 Å²	49.4	40%	0.396	26%	0.258	S	S	.	.			trans	-57.6	145.8	166.5	-77.2	-43.1	0	0	0	107.7	E230 K234	E230-N232 PolarHBondContact O-N 2.91Å; N232-K234 HydrophobicContact CB-CD 3.79Å; N232-K234 HydrophobicContact CB-CG 3.61Å; N232-K234 PolarHBondContact O-N 3.37Å
233	V	46.8	Very low	63.4	Low	54 Å²	54	52.8 Å²	52.8	33%	0.327	27%	0.274	S	S	.	.	S	Bend	trans	-69.6	60.9	174.2	-171.9	0	0	0	0	108.5	F271	V233-F271 HydrophobicContact CG2-CZ 4.07Å
234	K	48.9	Very low	63.8	Low	120 Å²	120	56.9 Å²	56.9	52%	0.522	29%	0.292	S	S	.	.			trans	-85.5	-37.9	-175.8	-74.1	174.3	174.2	-179.9	0	110	N232	N232-K234 HydrophobicContact CB-CD 3.79Å; N232-K234 HydrophobicContact CB-CG 3.61Å; N232-K234 PolarHBondContact O-N 3.37Å
235	D	57.7	Low	64.4	Low	106 Å²	106	60.4 Å²	60.4	57%	0.567	31%	0.308	S	S	*	.	S	Bend	trans	-121.6	103.8	-176.5	-64.5	-47.3	0	0	0	112.9	G237 Q238	D235-G237 PolarHBondContact O-N 2.82Å; D235-Q238 HydrophobicContact CB-CB 4.27Å; D235-Q238 VanDerWaalsContact O-CB 3.29Å; D235-Q238 WeakPolarHBondContact O-CB 3.15Å; D235-Q238 PolarHBondContact O-N 2.94Å
236	D	68.3	Low	65.3	Low	36 Å²	36	58.5 Å²	58.5	19%	0.193	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	126	174.6	-120.3	37.1	0	0	0	110.7	K290 T291 Y292	D236-K290 WeakPolarHBondContact OD2-CA 3.37Å; D236-T291 WeakPolarHBondContact OD1-CB 3.22Å; D236-T291 PolarHBondContact OD1-N 2.94Å; D236-T291 PolarHBondContact OD1-OG1 3.33Å; D236-T291 PolarHBondContact OD2-N 3.16Å; D236-Y292 HydrophobicContact CB-CD1 4.48Å; D236-Y292 HydrophobicContact CB-CE1 3.84Å; D236-Y292 WeakPolarHBondContact OD2-CD1 3.32Å; D236-Y292 WeakPolarHBondContact OD2-CE1 3.47Å; D236-Y292 PolarHBondContact OD2-N 3.39Å
237	G	73.7	Confident	65.8	Low	8 Å²	8	66.2 Å²	66.2	8%	0.082	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.1	-6.2	-174.5	0	0	0	0	0	115	D235 L286 S287 C288 I289	D235-G237 PolarHBondContact O-N 2.82Å; G237-L286 CarbonylContact O-C 3.56Å; G237-S287 PolarHBondContact O-N 3.32Å; G237-C288 VanDerWaalsContact C-CB 3.5Å; G237-C288 WeakPolarHBondContact O-CB 3.12Å; G237-C288 PolarHBondContact O-N 3.01Å; G237-I289 PolarHBondContact N-O 3.37Å
238	Q	81	Confident	66.4	Low	89 Å²	89	71.9 Å²	71.9	42%	0.416	36%	0.36	S	S	.	.			trans	-80.8	143.4	171.8	-164	176.3	27.4	0	0	112	D235 L286 C288	D235-Q238 HydrophobicContact CB-CB 4.27Å; D235-Q238 VanDerWaalsContact O-CB 3.29Å; D235-Q238 WeakPolarHBondContact O-CB 3.15Å; D235-Q238 PolarHBondContact O-N 2.94Å; Q238-L286 HydrophobicContact CG-CD2 4.12Å; Q238-C288 VanDerWaalsContact O-CB 3.27Å; Q238-C288 WeakPolarHBondContact O-CB 3.37Å; Q238-C288 PolarHBondContact O-SG 3.08Å
239	H	80.8	Confident	67.6	Low	11 Å²	11	72.6 Å²	72.6	5%	0.051	36%	0.36	C	S	.	.			trans	-82.8	134.3	175.3	-69.3	-76.3	0	0	0	111.4	W241 C269 C272 Y274 P285	H239-W241 HydrophobicContact CB-CD2 3.94Å; H239-W241 HydrophobicContact CB-CE3 4.43Å; H239-W241 HydrophobicContact CB-CH2 3.8Å; H239-W241 HydrophobicContact CB-CZ2 3.25Å; H239-W241 HydrophobicContact CB-CZ3 4.38Å; H239-W241 AromaticContact CD2-CH2 3.9Å; H239-W241 AromaticContact CD2-CZ2 3.54Å; H239-W241 AromaticContact CG-CH2 3.63Å; H239-W241 AromaticContact CG-CZ2 3.39Å; H239-W241 AromaticContact ND1-CH2 3.95Å; H239-C269 HydrophobicContact CB-CB 4.25Å; H239-C269 PolarHBondContact ND1-SG 2.8Å; H239-C269 VanDerWaalsContact ND1-SG 3.39Å; H239-C272 PolarHBondContact CE1-SG 3.2Å; H239-C272 PolarHBondContact ND1-SG 3.46Å; H239-C272 VanDerWaalsContact ND1-SG 3.35Å; H239-Y274 AromaticContact CE1-CG 3.97Å; H239-P285 PolarHBondContact CD2-O 3.21Å; H239-P285 VanDerWaalsContact CD2-O 3.25Å; H239-P285 PolarHBondContact NE2-O 3.18Å; H239-P285 VanDerWaalsContact NE2-O 3.13Å
240	V	81.3	Confident	68.9	Low	19 Å²	19	71.8 Å²	71.8	12%	0.115	36%	0.356	C	S	.	.			trans	-96.9	95.2	169.3	178.2	0	0	0	0	109.6	C269 S270 F271	V240-C269 CarbonylContact O-C 3.54Å; V240-C269 WeakPolarHBondContact O-CA 3.5Å; V240-S270 PolarHBondContact O-N 2.81Å; V240-S270 PolarHBondContact O-OG 3.4Å; V240-F271 HydrophobicContact CB-CD2 4.45Å; V240-F271 HydrophobicContact CB-CE2 4.04Å; V240-F271 HydrophobicContact CB-CZ 4.17Å; V240-F271 HydrophobicContact CG2-CD2 4.07Å; V240-F271 HydrophobicContact CG2-CE2 3.31Å; V240-F271 HydrophobicContact CG2-CZ 3.6Å
241	W	78.1	Confident	70.9	Confident	43 Å²	43	68.3 Å²	68.3	16%	0.163	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	146.4	-174.5	-58.7	113.4	0	0	0	113.2	I221 H239 L267 C269 Y274 V276 V281 A284	I221-W241 HydrophobicContact CD1-CB 3.92Å; H239-W241 HydrophobicContact CB-CD2 3.94Å; H239-W241 HydrophobicContact CB-CE3 4.43Å; H239-W241 HydrophobicContact CB-CH2 3.8Å; H239-W241 HydrophobicContact CB-CZ2 3.25Å; H239-W241 HydrophobicContact CB-CZ3 4.38Å; H239-W241 AromaticContact CD2-CH2 3.9Å; H239-W241 AromaticContact CD2-CZ2 3.54Å; H239-W241 AromaticContact CG-CH2 3.63Å; H239-W241 AromaticContact CG-CZ2 3.39Å; H239-W241 AromaticContact ND1-CH2 3.95Å; W241-L267 HydrophobicContact CB-CB 4.49Å; W241-L267 HydrophobicContact CE3-CB 4.12Å; W241-C269 HydrophobicContact CE3-CB 4.14Å; W241-C269 HydrophobicContact CZ3-CB 3.92Å; W241-Y274 AromaticContact CH2-CD1 3.67Å; W241-Y274 HydrophobicContact CH2-CD1 3.67Å; W241-Y274 HydrophobicContact CH2-CE1 4.39Å; W241-Y274 HydrophobicContact CH2-CG 4.47Å; W241-Y274 HydrophobicContact CZ3-CD1 4.19Å; W241-Y274 WeakPolarHBondContact CZ3-O 3.23Å; W241-V276 HydrophobicContact CD2-CG2 4.44Å; W241-V276 HydrophobicContact CE3-CG2 3.97Å; W241-V276 HydrophobicContact CH2-CG1 4.06Å; W241-V276 HydrophobicContact CH2-CG2 3.92Å; W241-V276 HydrophobicContact CZ2-CG2 4.35Å; W241-V276 HydrophobicContact CZ3-CG1 4.35Å; W241-V276 HydrophobicContact CZ3-CG2 3.69Å; W241-V281 HydrophobicContact CB-CG2 4.48Å; W241-V281 HydrophobicContact CD2-CG2 3.86Å; W241-V281 HydrophobicContact CG-CG2 3.65Å; W241-V281 HydrophobicContact CZ2-CG2 4.47Å; W241-V281 VanDerWaalsContact NE1-CG2 3.3Å; W241-A284 HydrophobicContact CH2-CB 4.06Å; W241-A284 HydrophobicContact CZ2-CB 3.52Å
242	R	71.8	Confident	73.2	Confident	113 Å²	113	63.7 Å²	63.7	43%	0.426	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	141.7	172.1	-63.4	-63.4	-66.1	-141.3	13.5	110	K244 L267 C268 S270 R435	R242-K244 PolarHBondContact O-N 3.16Å; R242-L267 CarbonylContact O-C 3.52Å; R242-L267 VanDerWaalsContact O-CA 3.32Å; R242-L267 WeakPolarHBondContact O-CA 3.38Å; R242-C268 PolarHBondContact N-O 2.85Å; R242-C268 VanDerWaalsContact N-O 3.09Å; R242-C268 PolarHBondContact O-N 2.8Å; R242-S270 WeakPolarHBondContact CG-OG 3.33Å; R242-R435 VanDerWaalsContact NH1-NH2 3.16Å; R242-R435 VanDerWaalsContact NH2-CZ 3.33Å
243	L	74.6	Confident	75.8	Confident	98 Å²	98	61 Å²	61	51%	0.513	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	133.5	168	-167.8	65.7	0	0	0	110.3	Q265 L267	L243-Q265 HydrophobicContact CD1-CB 4.36Å; L243-L267 HydrophobicContact CB-CD2 4.45Å; L243-L267 HydrophobicContact CD1-CD2 4.37Å
244	K	75.5	Confident	77.9	Confident	87 Å²	87	60.6 Å²	60.6	38%	0.378	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	132	-180	-178.8	171.3	175.6	-176.9	0	110.2	R242 F246 G266 C268	R242-K244 PolarHBondContact O-N 3.16Å; K244-F246 HydrophobicContact CB-CE2 3.93Å; K244-F246 HydrophobicContact CB-CZ 4.09Å; K244-F246 HydrophobicContact CD-CD1 4.28Å; K244-F246 HydrophobicContact CD-CE1 3.68Å; K244-F246 HydrophobicContact CD-CE2 4.25Å; K244-F246 HydrophobicContact CD-CZ 3.67Å; K244-F246 HydrophobicContact CG-CD1 4.48Å; K244-F246 HydrophobicContact CG-CD2 4.31Å; K244-F246 HydrophobicContact CG-CE1 4.18Å; K244-F246 HydrophobicContact CG-CE2 3.98Å; K244-F246 HydrophobicContact CG-CZ 3.93Å; K244-F246 WeakPolarHBondContact O-CD2 3.5Å; K244-F246 WeakPolarHBondContact O-CE2 3.21Å; K244-G266 PolarHBondContact N-O 2.81Å; K244-G266 PolarHBondContact O-N 2.83Å; K244-G266 VanDerWaalsContact O-N 3.07Å; K244-G266 VanDerWaalsContact O-O 3.12Å; K244-C268 HydrophobicContact CB-CB 3.99Å; K244-C268 HydrophobicContact CD-CB 3.73Å
245	H	79.3	Confident	79.9	Confident	104 Å²	104	56.7 Å²	56.7	48%	0.481	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	127.8	169	-57.5	-96.1	0	0	0	109.1	Q265	H245-Q265 PolarHBondContact CE1-NE2 3.49Å
246	F	78.2	Confident	81.4	Confident	21 Å²	21	56.9 Å²	56.9	9%	0.092	28%	0.28	C	S	.	.			trans	-102.9	110	-178.1	-64.7	-94.2	0	0	0	110.8	K244 K248 A250 L259 K264 C268 T275	K244-F246 HydrophobicContact CB-CE2 3.93Å; K244-F246 HydrophobicContact CB-CZ 4.09Å; K244-F246 HydrophobicContact CD-CD1 4.28Å; K244-F246 HydrophobicContact CD-CE1 3.68Å; K244-F246 HydrophobicContact CD-CE2 4.25Å; K244-F246 HydrophobicContact CD-CZ 3.67Å; K244-F246 HydrophobicContact CG-CD1 4.48Å; K244-F246 HydrophobicContact CG-CD2 4.31Å; K244-F246 HydrophobicContact CG-CE1 4.18Å; K244-F246 HydrophobicContact CG-CE2 3.98Å; K244-F246 HydrophobicContact CG-CZ 3.93Å; K244-F246 WeakPolarHBondContact O-CD2 3.5Å; K244-F246 WeakPolarHBondContact O-CE2 3.21Å; F246-K248 WeakPolarHBondContact CB-O 3.45Å; F246-K248 PolarHBondContact O-N 2.79Å; F246-K248 VanDerWaalsContact O-N 3.12Å; F246-A250 HydrophobicContact CB-CB 3.86Å; F246-A250 HydrophobicContact CD1-CB 3.41Å; F246-A250 VanDerWaalsContact CD1-CB 3.41Å; F246-A250 HydrophobicContact CD2-CB 4.23Å; F246-A250 HydrophobicContact CE1-CB 3.92Å; F246-A250 HydrophobicContact CG-CB 3.58Å; F246-L259 HydrophobicContact CD2-CD1 3.84Å; F246-L259 HydrophobicContact CE2-CD1 3.48Å; F246-L259 VanDerWaalsContact CE2-CD1 3.48Å; F246-L259 HydrophobicContact CZ-CD1 3.88Å; F246-K264 WeakPolarHBondContact CD2-O 3.34Å; F246-K264 PolarHBondContact N-O 2.81Å; F246-K264 VanDerWaalsContact N-O 3.13Å; F246-C268 HydrophobicContact CZ-CB 4.32Å; F246-T275 HydrophobicContact CE1-CG2 3.88Å; F246-T275 HydrophobicContact CZ-CG2 3.62Å
247	N	74.7	Confident	82.4	Confident	163 Å²	163	59.8 Å²	59.8	87%	0.872	30%	0.296	S	S	*	.	S	Bend	trans	-67.6	-10.2	177.1	-62.2	-7.9	0	0	0	113.5
248	K	78.3	Confident	83.1	Confident	120 Å²	120	62.8 Å²	62.8	52%	0.522	31%	0.308	S	S	.	.	S	Bend	trans	-128.5	156	177.6	-66.3	-177	-178.5	-179.9	0	108.8	F246 A250 P312	F246-K248 WeakPolarHBondContact CB-O 3.45Å; F246-K248 PolarHBondContact O-N 2.79Å; F246-K248 VanDerWaalsContact O-N 3.12Å; K248-A250 PolarHBondContact O-N 2.6Å; K248-P312 HydrophobicContact CD-CB 4.16Å; K248-P312 HydrophobicContact CD-CG 4.14Å
249	P	81.1	Confident	83.2	Confident	44 Å²	44	58.6 Å²	58.6	29%	0.286	29%	0.289	S	S	.	.			trans	-49.7	126.9	170.6	-24.1	33.8	0	0	0	110.5	M258	P249-M258 HydrophobicContact CB-SD 4.37Å
250	A	87.2	Confident	82.5	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.033	32%	0.316	C	S	.	.			trans	-132.3	151.2	179.1	0	0	0	0	0	108.7	F246 K248 L259 N310	F246-A250 HydrophobicContact CB-CB 3.86Å; F246-A250 HydrophobicContact CD1-CB 3.41Å; F246-A250 VanDerWaalsContact CD1-CB 3.41Å; F246-A250 HydrophobicContact CD2-CB 4.23Å; F246-A250 HydrophobicContact CE1-CB 3.92Å; F246-A250 HydrophobicContact CG-CB 3.58Å; K248-A250 PolarHBondContact O-N 2.6Å; A250-L259 HydrophobicContact CB-CD1 3.89Å; A250-L259 PolarHBondContact O-N 3.22Å; A250-N310 VanDerWaalsContact CA-OD1 3.27Å; A250-N310 WeakPolarHBondContact CA-OD1 3.42Å
251	Y	90.6	Very high	81.3	Confident	23 Å²	23	64.9 Å²	64.9	9%	0.09	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-122.2	145.7	-172.5	-65.1	-97.6	0	0	0	110.4	L256 N257 M258 T275 N310 C324 Y325 Q326 G327	Y251-L256 WeakPolarHBondContact CD1-O 3.48Å; Y251-N257 WeakPolarHBondContact CA-O 3.49Å; Y251-M258 HydrophobicContact CD1-CB 4.1Å; Y251-M258 HydrophobicContact CE1-CB 3.92Å; Y251-M258 HydrophobicContact CE1-CG 4.43Å; Y251-T275 PolarHBondContact O-OG1 3.31Å; Y251-N310 PolarHBondContact N-OD1 2.84Å; Y251-N310 PolarHBondContact O-ND2 2.69Å; Y251-C324 WeakPolarHBondContact CE2-O 3.5Å; Y251-Y325 PolarHBondContact OH-O 3.34Å; Y251-Q326 PolarHBondContact OH-N 3.22Å; Y251-G327 VanDerWaalsContact CZ-N 3.3Å; Y251-G327 PolarHBondContact OH-N 3.01Å
252	C	90.5	Very high	79.7	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.366	C	S	.	.			trans	-72.8	124.5	174.5	175.1	0	0	0	0	110.1	L254 C255 L256 N257 L259 V276 H277 L328	C252-L254 PolarHBondContact O-N 3Å; C252-L254 PolarHBondContact SG-N 3.19Å; C252-L254 VanDerWaalsContact SG-N 3.44Å; C252-C255 VanDerWaalsContact CB-SG 3.58Å; C252-C255 PolarHBondContact SG-N 2.82Å; C252-L256 WeakPolarHBondContact O-CA 3.35Å; C252-L256 PolarHBondContact O-N 2.88Å; C252-N257 PolarHBondContact N-O 3.01Å; C252-L259 HydrophobicContact CB-CD2 3.9Å; C252-V276 VanDerWaalsContact SG-CA 3.6Å; C252-H277 WeakPolarHBondContact CB-CE1 3.45Å; C252-H277 WeakPolarHBondContact CB-ND1 3.47Å; C252-H277 PolarHBondContact SG-ND1 2.89Å; C252-L328 WeakPolarHBondContact O-CD1 3.37Å
253	N	92.7	Very high	78.9	Confident	17 Å²	17	68.3 Å²	68.3	9%	0.091	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.6	177.1	-72.6	98	0	0	0	114.1	Y274 T275 E308 L328	N253-Y274 HydrophobicContact CB-CD1 3.7Å; N253-Y274 HydrophobicContact CB-CD2 3.88Å; N253-Y274 HydrophobicContact CB-CE1 3.32Å; N253-Y274 HydrophobicContact CB-CE2 3.47Å; N253-Y274 VanDerWaalsContact CB-CE2 3.47Å; N253-Y274 HydrophobicContact CB-CG 4Å; N253-Y274 PolarHBondContact O-OH 3.33Å; N253-T275 VanDerWaalsContact CB-O 3.31Å; N253-T275 WeakPolarHBondContact CB-O 3.24Å; N253-T275 PolarHBondContact N-O 3.44Å; N253-T275 PolarHBondContact OD1-N 3.31Å; N253-T275 PolarHBondContact OD1-O 2.84Å; N253-T275 VanDerWaalsContact OD1-O 3.13Å; N253-T275 PolarHBondContact OD1-OG1 2.53Å; N253-E308 PolarHBondContact ND2-O 2.81Å; N253-L328 HydrophobicContact CB-CD1 4.47Å
254	L	91.3	Very high	78.2	Confident	46 Å²	46	67.4 Å²	67.4	24%	0.241	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-59	177	-177	68.4	0	0	0	112.6	C252 V276 C280 R283	C252-L254 PolarHBondContact O-N 3Å; C252-L254 PolarHBondContact SG-N 3.19Å; C252-L254 VanDerWaalsContact SG-N 3.44Å; L254-V276 HydrophobicContact CB-CG1 4.35Å; L254-C280 HydrophobicContact CB-CB 4.35Å; L254-C280 HydrophobicContact CD2-CB 3.82Å; L254-C280 WeakPolarHBondContact CD2-O 3.18Å; L254-R283 HydrophobicContact CD2-CB 3.54Å
255	C	90.6	Very high	77.9	Confident	39 Å²	39	67.1 Å²	67.1	26%	0.264	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-1.3	-173.9	72.7	0	0	0	0	113.6	C252 N257 H277	C252-C255 VanDerWaalsContact CB-SG 3.58Å; C252-C255 PolarHBondContact SG-N 2.82Å; C255-N257 PolarHBondContact O-N 3.27Å; C255-H277 PolarHBondContact SG-CE1 3.02Å; C255-H277 PolarHBondContact SG-ND1 3.1Å
256	L	91.1	Very high	77.9	Confident	109 Å²	109	62.4 Å²	62.4	57%	0.571	34%	0.343	S	S	*	.			trans	63	-3.1	179.2	-43.6	179.9	0	0	0	115	Y251 C252 L328	Y251-L256 WeakPolarHBondContact CD1-O 3.48Å; C252-L256 WeakPolarHBondContact O-CA 3.35Å; C252-L256 PolarHBondContact O-N 2.88Å; L256-L328 HydrophobicContact CD2-CD1 3.57Å
257	N	89.1	Confident	78	Confident	97 Å²	97	61.6 Å²	61.6	52%	0.519	34%	0.339	S	S	.	.			trans	-80.6	155.2	178.2	-67.2	-40.7	0	0	0	111.8	Y251 C252 C255	Y251-N257 WeakPolarHBondContact CA-O 3.49Å; C252-N257 PolarHBondContact N-O 3.01Å; C255-N257 PolarHBondContact O-N 3.27Å
258	M	87	Confident	78.6	Confident	71 Å²	71	54.2 Å²	54.2	35%	0.35	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-60.3	142.5	176.7	-168.6	172.9	64.1	0	0	110.8	P249 Y251 I260 H277	P249-M258 HydrophobicContact CB-SD 4.37Å; Y251-M258 HydrophobicContact CD1-CB 4.1Å; Y251-M258 HydrophobicContact CE1-CB 3.92Å; Y251-M258 HydrophobicContact CE1-CG 4.43Å; M258-I260 HydrophobicContact CB-CG1 4.45Å; M258-I260 HydrophobicContact CE-CG1 4.06Å; M258-I260 WeakPolarHBondContact O-CG1 3.33Å; M258-I260 PolarHBondContact O-N 3.38Å; M258-H277 PolarHBondContact O-CE1 3.13Å; M258-H277 PolarHBondContact O-NE2 3.24Å
259	L	84	Confident	79	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	28%	0.276	C	S	.	.			trans	-71	112	168.6	-60.5	174.7	0	0	0	108	F246 A250 C252 H277	F246-L259 HydrophobicContact CD2-CD1 3.84Å; F246-L259 HydrophobicContact CE2-CD1 3.48Å; F246-L259 VanDerWaalsContact CE2-CD1 3.48Å; F246-L259 HydrophobicContact CZ-CD1 3.88Å; A250-L259 HydrophobicContact CB-CD1 3.89Å; A250-L259 PolarHBondContact O-N 3.22Å; C252-L259 HydrophobicContact CB-CD2 3.9Å; L259-H277 HydrophobicContact CD2-CB 4.43Å
260	I	65.6	Low	79.2	Confident	123 Å²	123	46.8 Å²	46.8	63%	0.631	27%	0.265	S	S	*	.			trans	-111.6	140.5	-173.5	-60.8	161.8	0	0	0	108.5	M258	M258-I260 HydrophobicContact CB-CG1 4.45Å; M258-I260 HydrophobicContact CE-CG1 4.06Å; M258-I260 WeakPolarHBondContact O-CG1 3.33Å; M258-I260 PolarHBondContact O-N 3.38Å
261	G	56.9	Low	79.3	Confident	40 Å²	40	47.1 Å²	47.1	41%	0.412	27%	0.266	S	S	.	.	S	Bend	trans	156.2	160.8	177.5	0	0	0	0	0	111.9	G263 K264	G261-G263 PolarHBondContact O-N 3.17Å; G261-K264 PolarHBondContact O-N 2.92Å
262	L	44	Very low	79.3	Confident	175 Å²	175	46.1 Å²	46.1	92%	0.916	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	112.1	170.6	-106.7	130.8	0	0	0	108.8	Q265	L262-Q265 PolarHBondContact O-NE2 2.91Å
263	G	53.9	Low	79.4	Confident	52 Å²	52	49.2 Å²	49.2	54%	0.536	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	10.4	-173.1	0	0	0	0	0	116.2	G261	G261-G263 PolarHBondContact O-N 3.17Å
264	K	60.8	Low	79.3	Confident	80 Å²	80	50.1 Å²	50.1	35%	0.348	28%	0.278	S	S	.	.			trans	48.7	61.5	178.1	-61.3	178.5	-177.1	176.3	0	112.1	F246 G261	F246-K264 WeakPolarHBondContact CD2-O 3.34Å; F246-K264 PolarHBondContact N-O 2.81Å; F246-K264 VanDerWaalsContact N-O 3.13Å; G261-K264 PolarHBondContact O-N 2.92Å
265	Q	68.9	Low	79.3	Confident	81 Å²	81	48.1 Å²	48.1	38%	0.379	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	147.5	-175.7	-51	-168.7	10.4	0	0	111.3	L243 H245 L262	L243-Q265 HydrophobicContact CD1-CB 4.36Å; H245-Q265 PolarHBondContact CE1-NE2 3.49Å; L262-Q265 PolarHBondContact O-NE2 2.91Å
266	G	78.5	Confident	79.2	Confident	4 Å²	4	46.2 Å²	46.2	4%	0.041	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	174.7	172.3	0	0	0	0	0	111.2	K244	K244-G266 PolarHBondContact N-O 2.81Å; K244-G266 PolarHBondContact O-N 2.83Å; K244-G266 VanDerWaalsContact O-N 3.07Å; K244-G266 VanDerWaalsContact O-O 3.12Å
267	L	81.8	Confident	78.7	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143.4	179.8	-61.3	173.3	0	0	0	110.7	I221 W241 R242 L243 T275 V276 V281	I221-L267 HydrophobicContact CD1-CD1 3.57Å; I221-L267 HydrophobicContact CD1-CD2 3.43Å; I221-L267 VanDerWaalsContact CD1-CD2 3.43Å; I221-L267 HydrophobicContact CD1-CG 4.14Å; W241-L267 HydrophobicContact CB-CB 4.49Å; W241-L267 HydrophobicContact CE3-CB 4.12Å; R242-L267 CarbonylContact O-C 3.52Å; R242-L267 VanDerWaalsContact O-CA 3.32Å; R242-L267 WeakPolarHBondContact O-CA 3.38Å; L243-L267 HydrophobicContact CB-CD2 4.45Å; L243-L267 HydrophobicContact CD1-CD2 4.37Å; L267-T275 CarbonylContact O-C 3.59Å; L267-T275 WeakPolarHBondContact O-CA 3.46Å; L267-V276 HydrophobicContact CB-CG2 3.86Å; L267-V276 HydrophobicContact CD1-CG2 4.41Å; L267-V276 PolarHBondContact N-O 3.1Å; L267-V276 PolarHBondContact O-N 3.33Å; L267-V281 HydrophobicContact CD1-CB 3.69Å; L267-V281 HydrophobicContact CD1-CG1 4.29Å; L267-V281 HydrophobicContact CD1-CG2 3.62Å
268	C	85.8	Confident	78.2	Confident	8 Å²	8	41.8 Å²	41.8	5%	0.054	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	126.4	178.5	-177.8	0	0	0	0	109.5	R242 K244 F246 S270 Y274 T275	R242-C268 PolarHBondContact N-O 2.85Å; R242-C268 VanDerWaalsContact N-O 3.09Å; R242-C268 PolarHBondContact O-N 2.8Å; K244-C268 HydrophobicContact CB-CB 3.99Å; K244-C268 HydrophobicContact CD-CB 3.73Å; F246-C268 HydrophobicContact CZ-CB 4.32Å; C268-S270 PolarHBondContact O-N 2.85Å; C268-Y274 CarbonylContact C-O 3.59Å; C268-Y274 WeakPolarHBondContact CA-O 3.48Å; C268-T275 HydrophobicContact CB-CG2 4.11Å
269	C	87.4	Confident	77.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.4	176.9	-178.6	0	0	0	0	110.5	H239 V240 W241 F271 K273 Y274	H239-C269 HydrophobicContact CB-CB 4.25Å; H239-C269 PolarHBondContact ND1-SG 2.8Å; H239-C269 VanDerWaalsContact ND1-SG 3.39Å; V240-C269 CarbonylContact O-C 3.54Å; V240-C269 WeakPolarHBondContact O-CA 3.5Å; W241-C269 HydrophobicContact CE3-CB 4.14Å; W241-C269 HydrophobicContact CZ3-CB 3.92Å; C269-F271 VanDerWaalsContact C-N 3.28Å; C269-F271 PolarHBondContact O-N 3.19Å; C269-K273 VanDerWaalsContact O-CA 3.25Å; C269-K273 WeakPolarHBondContact O-CA 3.31Å; C269-K273 PolarHBondContact O-N 2.76Å; C269-Y274 PolarHBondContact N-O 3.42Å
270	S	85.3	Confident	77.5	Confident	8 Å²	8	47.6 Å²	47.6	6%	0.056	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.9	-179.2	-62.8	0	0	0	0	112.6	V240 R242 C268 K273	V240-S270 PolarHBondContact O-N 2.81Å; V240-S270 PolarHBondContact O-OG 3.4Å; R242-S270 WeakPolarHBondContact CG-OG 3.33Å; C268-S270 PolarHBondContact O-N 2.85Å; S270-K273 PolarHBondContact O-NZ 2.86Å
271	F	89.3	Confident	78.2	Confident	12 Å²	12	42.4 Å²	42.4	5%	0.053	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-43.2	-172.8	-55.2	-31.6	0	0	0	114.7	V233 V240 C269 I289 V334 Q438 Y439 P443	V233-F271 HydrophobicContact CG2-CZ 4.07Å; V240-F271 HydrophobicContact CB-CD2 4.45Å; V240-F271 HydrophobicContact CB-CE2 4.04Å; V240-F271 HydrophobicContact CB-CZ 4.17Å; V240-F271 HydrophobicContact CG2-CD2 4.07Å; V240-F271 HydrophobicContact CG2-CE2 3.31Å; V240-F271 HydrophobicContact CG2-CZ 3.6Å; C269-F271 VanDerWaalsContact C-N 3.28Å; C269-F271 PolarHBondContact O-N 3.19Å; F271-I289 HydrophobicContact CB-CD1 3.75Å; F271-I289 HydrophobicContact CB-CG1 3.85Å; F271-I289 HydrophobicContact CG-CD1 4.44Å; F271-V334 WeakPolarHBondContact O-CG1 3.18Å; F271-Q438 HydrophobicContact CD1-CB 4.2Å; F271-Q438 HydrophobicContact CE1-CB 4.05Å; F271-Q438 HydrophobicContact CE1-CG 4.48Å; F271-Y439 WeakPolarHBondContact O-CD2 3.4Å; F271-Y439 WeakPolarHBondContact O-CE2 3.42Å; F271-P443 HydrophobicContact CD1-CG 3.92Å; F271-P443 HydrophobicContact CE1-CB 4.2Å; F271-P443 HydrophobicContact CE1-CG 4.09Å; F271-P443 HydrophobicContact CG-CG 4.2Å; F271-P443 HydrophobicContact CZ-CB 4.41Å; F271-P443 HydrophobicContact CZ-CG 4.47Å
272	C	91.7	Very high	78.9	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.007	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-8.6	-177.4	65.7	0	0	0	0	113.8	H239 Y274 I289 F305 V307 V334	H239-C272 PolarHBondContact CE1-SG 3.2Å; H239-C272 PolarHBondContact ND1-SG 3.46Å; H239-C272 VanDerWaalsContact ND1-SG 3.35Å; C272-Y274 PolarHBondContact O-N 3.09Å; C272-Y274 WeakPolarHBondContact SG-CB 3.42Å; C272-I289 HydrophobicContact CB-CG2 4.15Å; C272-F305 HydrophobicContact CB-CE1 3.79Å; C272-F305 HydrophobicContact CB-CZ 4.44Å; C272-V307 HydrophobicContact CB-CG2 4.06Å; C272-V307 WeakPolarHBondContact O-CG2 3.49Å; C272-V334 HydrophobicContact CB-CG2 4.03Å
273	K	90.9	Very high	80.7	Confident	65 Å²	65	44.2 Å²	44.2	28%	0.283	22%	0.218	S	C	.	.			trans	62.5	14.6	-174.1	-50.7	-57.6	-179.4	-145.7	0	115.2	C269 S270 T275 Y439	C269-K273 VanDerWaalsContact O-CA 3.25Å; C269-K273 WeakPolarHBondContact O-CA 3.31Å; C269-K273 PolarHBondContact O-N 2.76Å; S270-K273 PolarHBondContact O-NZ 2.86Å; K273-T275 WeakPolarHBondContact O-CG2 3.26Å; K273-T275 PolarHBondContact O-N 3.48Å; K273-Y439 HydrophobicContact CB-CE2 4.45Å; K273-Y439 HydrophobicContact CD-CD2 4.09Å; K273-Y439 HydrophobicContact CD-CE2 4.13Å; K273-Y439 HydrophobicContact CG-CD2 3.81Å; K273-Y439 HydrophobicContact CG-CE2 3.35Å
274	Y	92	Very high	81.9	Confident	37 Å²	37	42.4 Å²	42.4	15%	0.145	20%	0.197	C	C	.	.			trans	-52.3	136.8	164.9	-160.7	-87	0	0	0	109.5	H239 W241 N253 C268 C269 C272 V276	H239-Y274 AromaticContact CE1-CG 3.97Å; W241-Y274 AromaticContact CH2-CD1 3.67Å; W241-Y274 HydrophobicContact CH2-CD1 3.67Å; W241-Y274 HydrophobicContact CH2-CE1 4.39Å; W241-Y274 HydrophobicContact CH2-CG 4.47Å; W241-Y274 HydrophobicContact CZ3-CD1 4.19Å; W241-Y274 WeakPolarHBondContact CZ3-O 3.23Å; N253-Y274 HydrophobicContact CB-CD1 3.7Å; N253-Y274 HydrophobicContact CB-CD2 3.88Å; N253-Y274 HydrophobicContact CB-CE1 3.32Å; N253-Y274 HydrophobicContact CB-CE2 3.47Å; N253-Y274 VanDerWaalsContact CB-CE2 3.47Å; N253-Y274 HydrophobicContact CB-CG 4Å; N253-Y274 PolarHBondContact O-OH 3.33Å; C268-Y274 CarbonylContact C-O 3.59Å; C268-Y274 WeakPolarHBondContact CA-O 3.48Å; C269-Y274 PolarHBondContact N-O 3.42Å; C272-Y274 PolarHBondContact O-N 3.09Å; C272-Y274 WeakPolarHBondContact SG-CB 3.42Å; Y274-V276 HydrophobicContact CD1-CG1 3.84Å; Y274-V276 HydrophobicContact CE1-CG1 3.61Å
275	T	90.8	Very high	83	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.4	-173.7	55.4	0	0	0	0	111.4	F246 Y251 N253 L267 C268 K273 N310	F246-T275 HydrophobicContact CE1-CG2 3.88Å; F246-T275 HydrophobicContact CZ-CG2 3.62Å; Y251-T275 PolarHBondContact O-OG1 3.31Å; N253-T275 VanDerWaalsContact CB-O 3.31Å; N253-T275 WeakPolarHBondContact CB-O 3.24Å; N253-T275 PolarHBondContact N-O 3.44Å; N253-T275 PolarHBondContact OD1-N 3.31Å; N253-T275 PolarHBondContact OD1-O 2.84Å; N253-T275 VanDerWaalsContact OD1-O 3.13Å; N253-T275 PolarHBondContact OD1-OG1 2.53Å; L267-T275 CarbonylContact O-C 3.59Å; L267-T275 WeakPolarHBondContact O-CA 3.46Å; C268-T275 HydrophobicContact CB-CG2 4.11Å; K273-T275 WeakPolarHBondContact O-CG2 3.26Å; K273-T275 PolarHBondContact O-N 3.48Å; T275-N310 PolarHBondContact OG1-ND2 3.19Å
276	V	87.9	Confident	83.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.5	179.7	-66.1	0	0	0	0	111.1	W241 C252 L254 L267 Y274 C280 V281 A284	W241-V276 HydrophobicContact CD2-CG2 4.44Å; W241-V276 HydrophobicContact CE3-CG2 3.97Å; W241-V276 HydrophobicContact CH2-CG1 4.06Å; W241-V276 HydrophobicContact CH2-CG2 3.92Å; W241-V276 HydrophobicContact CZ2-CG2 4.35Å; W241-V276 HydrophobicContact CZ3-CG1 4.35Å; W241-V276 HydrophobicContact CZ3-CG2 3.69Å; C252-V276 VanDerWaalsContact SG-CA 3.6Å; L254-V276 HydrophobicContact CB-CG1 4.35Å; L267-V276 HydrophobicContact CB-CG2 3.86Å; L267-V276 HydrophobicContact CD1-CG2 4.41Å; L267-V276 PolarHBondContact N-O 3.1Å; L267-V276 PolarHBondContact O-N 3.33Å; Y274-V276 HydrophobicContact CD1-CG1 3.84Å; Y274-V276 HydrophobicContact CE1-CG1 3.61Å; V276-C280 HydrophobicContact CB-CB 4.04Å; V276-V281 HydrophobicContact CG2-CB 4.26Å; V276-V281 HydrophobicContact CG2-CG2 4.34Å; V276-A284 HydrophobicContact CG1-CB 4.33Å
277	H	81.1	Confident	83.8	Confident	15 Å²	15	46.4 Å²	46.4	7%	0.069	23%	0.231	C	C	.	.			trans	-65.1	157.8	159.8	-60.1	100	0	0	0	109.6	C252 C255 M258 L259 R279 C280 V281	C252-H277 WeakPolarHBondContact CB-CE1 3.45Å; C252-H277 WeakPolarHBondContact CB-ND1 3.47Å; C252-H277 PolarHBondContact SG-ND1 2.89Å; C255-H277 PolarHBondContact SG-CE1 3.02Å; C255-H277 PolarHBondContact SG-ND1 3.1Å; M258-H277 PolarHBondContact O-CE1 3.13Å; M258-H277 PolarHBondContact O-NE2 3.24Å; L259-H277 HydrophobicContact CD2-CB 4.43Å; H277-R279 HydrophobicContact CB-CG 3.89Å; H277-C280 HydrophobicContact CB-CB 4.02Å; H277-C280 WeakPolarHBondContact O-CA 3.49Å; H277-C280 WeakPolarHBondContact O-CB 3.47Å; H277-C280 PolarHBondContact O-N 3.09Å; H277-V281 PolarHBondContact O-N 3.13Å
278	E	77.6	Confident	84.2	Confident	97 Å²	97	46.4 Å²	46.4	45%	0.453	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-52.5	-56.7	169.8	-175.5	158.9	-154.7	0	0	111.5	C280 V281	E278-C280 PolarHBondContact O-N 3.23Å; E278-V281 WeakPolarHBondContact O-CB 3.24Å; E278-V281 WeakPolarHBondContact O-CG1 3.27Å; E278-V281 PolarHBondContact O-N 3Å
279	R	76.1	Confident	84.5	Confident	188 Å²	188	46.2 Å²	46.2	71%	0.709	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-56.4	-15.1	172.4	69.1	-178.4	176.9	-149.2	-0.6	116.4	H277	H277-R279 HydrophobicContact CB-CG 3.89Å
280	C	81.4	Confident	84.5	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.041	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-97.3	-7.7	-179.8	-72.5	0	0	0	0	112.8	L254 V276 H277 E278 A282 R283 A284	L254-C280 HydrophobicContact CB-CB 4.35Å; L254-C280 HydrophobicContact CD2-CB 3.82Å; L254-C280 WeakPolarHBondContact CD2-O 3.18Å; V276-C280 HydrophobicContact CB-CB 4.04Å; H277-C280 HydrophobicContact CB-CB 4.02Å; H277-C280 WeakPolarHBondContact O-CA 3.49Å; H277-C280 WeakPolarHBondContact O-CB 3.47Å; H277-C280 PolarHBondContact O-N 3.09Å; E278-C280 PolarHBondContact O-N 3.23Å; C280-A282 PolarHBondContact O-N 3.31Å; C280-R283 PolarHBondContact O-N 3.24Å; C280-A284 PolarHBondContact O-N 3.22Å
281	V	79.7	Confident	84.6	Confident	14 Å²	14	52.1 Å²	52.1	9%	0.085	26%	0.255	C	S	.	.	S	Bend	trans	-63.8	-43.7	-172.4	75.1	0	0	0	0	112.9	T219 W241 L267 V276 H277 E278 R283 A284	T219-V281 HydrophobicContact CG2-CG1 4.47Å; W241-V281 HydrophobicContact CB-CG2 4.48Å; W241-V281 HydrophobicContact CD2-CG2 3.86Å; W241-V281 HydrophobicContact CG-CG2 3.65Å; W241-V281 HydrophobicContact CZ2-CG2 4.47Å; W241-V281 VanDerWaalsContact NE1-CG2 3.3Å; L267-V281 HydrophobicContact CD1-CB 3.69Å; L267-V281 HydrophobicContact CD1-CG1 4.29Å; L267-V281 HydrophobicContact CD1-CG2 3.62Å; V276-V281 HydrophobicContact CG2-CB 4.26Å; V276-V281 HydrophobicContact CG2-CG2 4.34Å; H277-V281 PolarHBondContact O-N 3.13Å; E278-V281 WeakPolarHBondContact O-CB 3.24Å; E278-V281 WeakPolarHBondContact O-CG1 3.27Å; E278-V281 PolarHBondContact O-N 3Å; V281-R283 PolarHBondContact O-N 3.27Å; V281-A284 VanDerWaalsContact O-CB 3.24Å; V281-A284 WeakPolarHBondContact O-CB 3.12Å; V281-A284 PolarHBondContact O-N 2.84Å; V281-A284 VanDerWaalsContact O-N 3.09Å
282	A	72.6	Confident	84.4	Confident	70 Å²	70	53.2 Å²	53.2	58%	0.579	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.3	-178.7	0	0	0	0	0	112.7	T219 C280	T219-A282 HydrophobicContact CG2-CB 3.29Å; C280-A282 PolarHBondContact O-N 3.31Å
283	R	82	Confident	83.8	Confident	184 Å²	184	54.1 Å²	54.1	69%	0.694	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	0.4	-176.3	-67.6	174.5	55.2	-157.1	-3.7	112.6	L254 C280 V281	L254-R283 HydrophobicContact CD2-CB 3.54Å; C280-R283 PolarHBondContact O-N 3.24Å; V281-R283 PolarHBondContact O-N 3.27Å
284	A	79.3	Confident	82.9	Confident	13 Å²	13	58.3 Å²	58.3	11%	0.107	28%	0.283	C	S	.	.	S	Bend	trans	-68.5	130.9	178.9	0	0	0	0	0	109.7	W241 V276 C280 V281	W241-A284 HydrophobicContact CH2-CB 4.06Å; W241-A284 HydrophobicContact CZ2-CB 3.52Å; V276-A284 HydrophobicContact CG1-CB 4.33Å; C280-A284 PolarHBondContact O-N 3.22Å; V281-A284 VanDerWaalsContact O-CB 3.24Å; V281-A284 WeakPolarHBondContact O-CB 3.12Å; V281-A284 PolarHBondContact O-N 2.84Å; V281-A284 VanDerWaalsContact O-N 3.09Å
285	P	82.5	Confident	81.7	Confident	57 Å²	57	58.9 Å²	58.9	37%	0.37	29%	0.292	S	S	.	.			trans	-64.4	144.2	-179.1	25.4	-33.5	0	0	0	111.4	H239 S287	H239-P285 PolarHBondContact CD2-O 3.21Å; H239-P285 VanDerWaalsContact CD2-O 3.25Å; H239-P285 PolarHBondContact NE2-O 3.18Å; H239-P285 VanDerWaalsContact NE2-O 3.13Å; P285-S287 WeakPolarHBondContact CG-OG 3.37Å; P285-S287 PolarHBondContact O-N 2.82Å; P285-S287 PolarHBondContact O-OG 2.86Å
286	L	79.6	Confident	80.5	Confident	135 Å²	135	64.5 Å²	64.5	71%	0.707	32%	0.316	S	S	*	.	S	Bend	trans	-73.6	59.3	173.3	-59.7	178.6	0	0	0	111.5	G237 Q238	G237-L286 CarbonylContact O-C 3.56Å; Q238-L286 HydrophobicContact CG-CD2 4.12Å
287	S	86.1	Confident	79.4	Confident	58 Å²	58	73 Å²	73	41%	0.406	35%	0.353	S	S	.	.			trans	-121.3	23	-170.3	62.4	0	0	0	0	112.2	G237 P285 F305	G237-S287 PolarHBondContact O-N 3.32Å; P285-S287 WeakPolarHBondContact CG-OG 3.37Å; P285-S287 PolarHBondContact O-N 2.82Å; P285-S287 PolarHBondContact O-OG 2.86Å; S287-F305 WeakPolarHBondContact O-CE2 3.32Å; S287-F305 WeakPolarHBondContact O-CZ 3.1Å
288	C	90.2	Very high	78.5	Confident	4 Å²	4	77.1 Å²	77.1	3%	0.027	38%	0.376	C	S	.	.			trans	-63.1	175.4	173.8	-161.6	0	0	0	0	111.3	G237 Q238	G237-C288 VanDerWaalsContact C-CB 3.5Å; G237-C288 WeakPolarHBondContact O-CB 3.12Å; G237-C288 PolarHBondContact O-N 3.01Å; Q238-C288 VanDerWaalsContact O-CB 3.27Å; Q238-C288 WeakPolarHBondContact O-CB 3.37Å; Q238-C288 PolarHBondContact O-SG 3.08Å
289	I	90.6	Very high	77.9	Confident	4 Å²	4	74.9 Å²	74.9	2%	0.021	37%	0.369	C	S	.	.			trans	-57.4	146.2	176.5	62.7	168.3	0	0	0	111	G237 F271 C272 F305 V334 W335 P443	G237-I289 PolarHBondContact N-O 3.37Å; F271-I289 HydrophobicContact CB-CD1 3.75Å; F271-I289 HydrophobicContact CB-CG1 3.85Å; F271-I289 HydrophobicContact CG-CD1 4.44Å; C272-I289 HydrophobicContact CB-CG2 4.15Å; I289-F305 HydrophobicContact CG2-CD1 3.69Å; I289-F305 HydrophobicContact CG2-CD2 4.09Å; I289-F305 HydrophobicContact CG2-CE1 3.76Å; I289-F305 HydrophobicContact CG2-CE2 4.13Å; I289-F305 HydrophobicContact CG2-CG 3.87Å; I289-F305 HydrophobicContact CG2-CZ 3.97Å; I289-V334 HydrophobicContact CG2-CB 4.22Å; I289-V334 HydrophobicContact CG2-CG1 3.98Å; I289-V334 HydrophobicContact CG2-CG2 4.32Å; I289-W335 HydrophobicContact CB-CZ2 4.09Å; I289-W335 HydrophobicContact CD1-CH2 3.96Å; I289-W335 HydrophobicContact CD1-CZ2 4.01Å; I289-W335 HydrophobicContact CG2-CZ2 4.37Å; I289-P443 HydrophobicContact CD1-CG 3.99Å
290	K	87.9	Confident	77.6	Confident	128 Å²	128	74.1 Å²	74.1	56%	0.557	37%	0.373	S	S	*	.			trans	-92	142.6	164.9	-61.1	178.3	-177.9	170.3	0	108.3	D236 W335 P364	D236-K290 WeakPolarHBondContact OD2-CA 3.37Å; K290-W335 WeakPolarHBondContact O-CZ2 3.4Å; K290-P364 WeakPolarHBondContact O-CB 3.44Å; K290-P364 WeakPolarHBondContact O-CG 3.18Å
291	T	87.9	Confident	77.6	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.018	39%	0.39	C	S	.	.	S	Bend	trans	-101.6	-11.5	179	67.1	0	0	0	0	112.4	D236 I367 N442 P443 R444	D236-T291 WeakPolarHBondContact OD1-CB 3.22Å; D236-T291 PolarHBondContact OD1-N 2.94Å; D236-T291 PolarHBondContact OD1-OG1 3.33Å; D236-T291 PolarHBondContact OD2-N 3.16Å; T291-I367 WeakPolarHBondContact O-CD1 3.22Å; T291-N442 WeakPolarHBondContact CB-OD1 3.43Å; T291-N442 PolarHBondContact O-ND2 3.01Å; T291-P443 HydrophobicContact CG2-CB 4.27Å; T291-P443 HydrophobicContact CG2-CG 3.99Å; T291-R444 PolarHBondContact OG1-NE 3.1Å
292	Y	84.4	Confident	78	Confident	35 Å²	35	77.4 Å²	77.4	14%	0.137	39%	0.391	C	S	.	.	S	Bend	trans	-150.6	171.2	173.2	68.4	-85.5	0	0	0	111.3	D236 K294 P364 I367 P369	D236-Y292 HydrophobicContact CB-CD1 4.48Å; D236-Y292 HydrophobicContact CB-CE1 3.84Å; D236-Y292 WeakPolarHBondContact OD2-CD1 3.32Å; D236-Y292 WeakPolarHBondContact OD2-CE1 3.47Å; D236-Y292 PolarHBondContact OD2-N 3.39Å; Y292-K294 HydrophobicContact CE2-CG 4.4Å; Y292-P364 CarbonylContact C-O 3.54Å; Y292-P364 VanDerWaalsContact CA-O 3.31Å; Y292-P364 WeakPolarHBondContact CA-O 3.35Å; Y292-I367 WeakPolarHBondContact CB-O 3.27Å; Y292-P369 HydrophobicContact CD2-CG 3.85Å; Y292-P369 HydrophobicContact CE2-CG 3.58Å
293	V	79.6	Confident	78.9	Confident	21 Å²	21	79.4 Å²	79.4	13%	0.127	39%	0.389	C	S	.	.			trans	-101.1	137.1	171.4	-67.6	0	0	0	0	111.8	S295 N298 T299 P364 N365 I367 C368 P369	V293-S295 PolarHBondContact O-N 3.41Å; V293-N298 HydrophobicContact CB-CB 4.28Å; V293-N298 HydrophobicContact CG1-CB 4.35Å; V293-T299 HydrophobicContact CG2-CG2 3.66Å; V293-P364 PolarHBondContact N-O 3.23Å; V293-P364 VanDerWaalsContact N-O 3.17Å; V293-N365 HydrophobicContact CG1-CB 4.23Å; V293-I367 WeakPolarHBondContact CG2-O 3.11Å; V293-I367 PolarHBondContact N-O 3.47Å; V293-C368 HydrophobicContact CG2-CB 4.05Å; V293-P369 WeakPolarHBondContact O-CD 3.44Å
294	K	71.9	Confident	79.4	Confident	153 Å²	153	71.8 Å²	71.8	67%	0.665	36%	0.361	S	S	*	.	S	Bend	trans	-69.1	-15.9	-178.4	-62.1	-172.6	177.9	-172.7	0	114.4	Y292	Y292-K294 HydrophobicContact CE2-CG 4.4Å
295	S	67.3	Low	80.1	Confident	49 Å²	49	73.6 Å²	73.6	34%	0.343	37%	0.366	S	S	.	.	S	Bend	trans	-152.7	146.2	-175.8	168.5	0	0	0	0	111	V293 K297 N298	V293-S295 PolarHBondContact O-N 3.41Å; S295-K297 PolarHBondContact O-N 3.35Å; S295-K297 PolarHBondContact OG-N 3.21Å; S295-N298 PolarHBondContact O-N 2.97Å
296	K	66	Low	80.7	Confident	121 Å²	121	74.7 Å²	74.7	53%	0.526	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25.9	173.7	-72.6	-173.7	176.9	-179.9	0	113.7	N298 T299	K296-N298 PolarHBondContact O-N 3.43Å; K296-N298 VanDerWaalsContact O-N 3.14Å; K296-T299 WeakPolarHBondContact O-CG2 3.37Å; K296-T299 PolarHBondContact O-N 2.85Å; K296-T299 PolarHBondContact O-OG1 2.82Å
297	K	62.9	Low	81.4	Confident	179 Å²	179	68.8 Å²	68.8	78%	0.778	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-65.1	-17.2	175.9	-65.6	-173.5	179	-177.2	0	113.2	S295	S295-K297 PolarHBondContact O-N 3.35Å; S295-K297 PolarHBondContact OG-N 3.21Å
298	N	63.7	Low	81.6	Confident	101 Å²	101	69.9 Å²	69.9	54%	0.54	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-100.5	11.1	-178.9	-62.7	-20.7	0	0	0	112.8	V293 S295 K296	V293-N298 HydrophobicContact CB-CB 4.28Å; V293-N298 HydrophobicContact CG1-CB 4.35Å; S295-N298 PolarHBondContact O-N 2.97Å; K296-N298 PolarHBondContact O-N 3.43Å; K296-N298 VanDerWaalsContact O-N 3.14Å
299	T	65.4	Low	81.4	Confident	50 Å²	50	70 Å²	70	31%	0.307	33%	0.333	S	S	.	.			trans	-84.9	-16.3	-177.1	58.6	0	0	0	0	113.5	V293 K296 V301 N365	V293-T299 HydrophobicContact CG2-CG2 3.66Å; K296-T299 WeakPolarHBondContact O-CG2 3.37Å; K296-T299 PolarHBondContact O-N 2.85Å; K296-T299 PolarHBondContact O-OG1 2.82Å; T299-V301 PolarHBondContact O-N 3.27Å; T299-N365 WeakPolarHBondContact CG2-O 3.46Å; T299-N365 PolarHBondContact O-ND2 3.36Å; T299-N365 VanDerWaalsContact O-ND2 3.16Å
300	E	68.8	Low	81.1	Confident	171 Å²	171	71.5 Å²	71.5	80%	0.799	34%	0.341	S	S	*	.	S	Bend	trans	-68.5	-33.9	-165.3	-64.5	-173.9	169.5	0	0	114.2
301	V	80.9	Confident	80.8	Confident	65 Å²	65	66.1 Å²	66.1	39%	0.394	32%	0.319	S	S	.	.			trans	-141.2	120.3	-176.7	-175.1	0	0	0	0	112.4	T299 H303 E351	T299-V301 PolarHBondContact O-N 3.27Å; V301-H303 PolarHBondContact O-ND1 3.46Å; V301-E351 HydrophobicContact CG1-CB 4.2Å; V301-E351 HydrophobicContact CG1-CG 3.42Å; V301-E351 VanDerWaalsContact CG1-CG 3.42Å
302	M	88.4	Confident	80.3	Confident	24 Å²	24	68.8 Å²	68.8	12%	0.118	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-85.2	123.3	172.9	-166.1	-89.2	-173.2	0	0	109.6	W335 E351 C352	M302-W335 HydrophobicContact CE-CB 3.41Å; M302-W335 VanDerWaalsContact CE-CB 3.41Å; M302-W335 HydrophobicContact CE-CD2 3.94Å; M302-W335 HydrophobicContact CE-CG 3.21Å; M302-E351 CarbonylContact O-C 3.47Å; M302-E351 WeakPolarHBondContact O-CA 3.12Å; M302-C352 HydrophobicContact CE-CB 4.24Å; M302-C352 PolarHBondContact O-N 2.96Å; M302-C352 HydrophobicContact SD-CB 3.37Å; M302-C352 WeakPolarHBondContact SD-CB 3.46Å
303	H	91.3	Very high	80.4	Confident	113 Å²	113	70.3 Å²	70.3	52%	0.523	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-103.2	153.4	-178.3	-69.1	80	0	0	0	111.3	V301 F305	V301-H303 PolarHBondContact O-ND1 3.46Å; H303-F305 PolarHBondContact O-N 3.36Å
304	H	93.7	Very high	81	Confident	24 Å²	24	76 Å²	76	11%	0.111	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-57.5	132.8	171.4	-72.2	-78.4	0	0	0	111.5	W306 C333 C336 K349 P350 E351 C352	H304-W306 HydrophobicContact CB-CD2 4.11Å; H304-W306 VanDerWaalsContact CB-CE2 3.41Å; H304-W306 HydrophobicContact CB-CG 4.38Å; H304-W306 HydrophobicContact CB-CZ2 3.67Å; H304-W306 VanDerWaalsContact CB-NE1 3.27Å; H304-W306 AromaticContact CD2-CZ2 3.9Å; H304-W306 AromaticContact CG-CE2 3.8Å; H304-W306 AromaticContact CG-CZ2 3.49Å; H304-W306 VanDerWaalsContact CG-CZ2 3.49Å; H304-W306 AromaticContact ND1-CH2 4Å; H304-W306 AromaticContact ND1-CZ2 3.72Å; H304-C333 PolarHBondContact ND1-SG 2.98Å; H304-C336 PolarHBondContact CE1-SG 2.69Å; H304-C336 PolarHBondContact ND1-SG 2.62Å; H304-C336 VanDerWaalsContact ND1-SG 3.36Å; H304-K349 PolarHBondContact CD2-O 2.77Å; H304-K349 PolarHBondContact NE2-O 3.07Å; H304-P350 PolarHBondContact CD2-O 2.94Å; H304-P350 PolarHBondContact N-O 3.13Å; H304-E351 PolarHBondContact NE2-O 2.83Å; H304-C352 HydrophobicContact CB-CB 4.23Å; H304-C352 WeakPolarHBondContact ND1-CB 3.46Å
305	F	94.2	Very high	82.1	Confident	50 Å²	50	68.7 Å²	68.7	22%	0.219	34%	0.341	C	S	.	.			trans	-98.3	95	169.1	-171.9	-81	0	0	0	108.8	C272 S287 I289 H303 V307 C333 V334	C272-F305 HydrophobicContact CB-CE1 3.79Å; C272-F305 HydrophobicContact CB-CZ 4.44Å; S287-F305 WeakPolarHBondContact O-CE2 3.32Å; S287-F305 WeakPolarHBondContact O-CZ 3.1Å; I289-F305 HydrophobicContact CG2-CD1 3.69Å; I289-F305 HydrophobicContact CG2-CD2 4.09Å; I289-F305 HydrophobicContact CG2-CE1 3.76Å; I289-F305 HydrophobicContact CG2-CE2 4.13Å; I289-F305 HydrophobicContact CG2-CG 3.87Å; I289-F305 HydrophobicContact CG2-CZ 3.97Å; H303-F305 PolarHBondContact O-N 3.36Å; F305-V307 HydrophobicContact CD1-CG2 3.96Å; F305-V307 HydrophobicContact CE1-CG2 3.62Å; F305-C333 VanDerWaalsContact O-CA 3.28Å; F305-C333 WeakPolarHBondContact O-CA 3.38Å; F305-V334 HydrophobicContact CD1-CB 4.16Å; F305-V334 HydrophobicContact CD1-CG2 3.63Å; F305-V334 HydrophobicContact CE1-CG2 4.17Å; F305-V334 PolarHBondContact O-N 3.07Å
306	W	94.4	Very high	83.4	Confident	80 Å²	80	70.1 Å²	70.1	30%	0.303	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	132.4	-177.3	-62.9	112.9	0	0	0	112	H304 L331 H332 C333 I338 L340	H304-W306 HydrophobicContact CB-CD2 4.11Å; H304-W306 VanDerWaalsContact CB-CE2 3.41Å; H304-W306 HydrophobicContact CB-CG 4.38Å; H304-W306 HydrophobicContact CB-CZ2 3.67Å; H304-W306 VanDerWaalsContact CB-NE1 3.27Å; H304-W306 AromaticContact CD2-CZ2 3.9Å; H304-W306 AromaticContact CG-CE2 3.8Å; H304-W306 AromaticContact CG-CZ2 3.49Å; H304-W306 VanDerWaalsContact CG-CZ2 3.49Å; H304-W306 AromaticContact ND1-CH2 4Å; H304-W306 AromaticContact ND1-CZ2 3.72Å; W306-L331 HydrophobicContact CB-CD2 4.24Å; W306-L331 HydrophobicContact CD2-CB 4.14Å; W306-L331 HydrophobicContact CE3-CB 3.62Å; W306-L331 HydrophobicContact CZ3-CB 4.18Å; W306-H332 WeakPolarHBondContact CA-O 3.47Å; W306-C333 HydrophobicContact CD2-CB 4.37Å; W306-C333 HydrophobicContact CE3-CB 3.74Å; W306-C333 HydrophobicContact CH2-CB 3.97Å; W306-C333 HydrophobicContact CZ3-CB 3.53Å; W306-I338 HydrophobicContact CH2-CG2 3.5Å; W306-I338 VanDerWaalsContact CH2-CG2 3.5Å; W306-I338 HydrophobicContact CZ3-CG2 3.75Å; W306-L340 HydrophobicContact CH2-CD1 3.58Å; W306-L340 HydrophobicContact CH2-CG 4.34Å; W306-L340 HydrophobicContact CZ2-CD1 4.32Å; W306-L340 HydrophobicContact CZ3-CD1 4.19Å
307	V	93.7	Very high	84.7	Confident	12 Å²	12	69.9 Å²	69.9	7%	0.073	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.4	168	-179.4	0	0	0	0	108.2	C272 F305 H332 V334	C272-V307 HydrophobicContact CB-CG2 4.06Å; C272-V307 WeakPolarHBondContact O-CG2 3.49Å; F305-V307 HydrophobicContact CD1-CG2 3.96Å; F305-V307 HydrophobicContact CE1-CG2 3.62Å; V307-H332 PolarHBondContact N-O 2.97Å; V307-H332 PolarHBondContact O-N 3.3Å; V307-V334 HydrophobicContact CG2-CG2 3.89Å
308	E	90.9	Very high	86.2	Confident	81 Å²	81	63.5 Å²	63.5	38%	0.379	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	142.5	-175.8	-168.8	168.3	-154.6	0	0	112.4	N253 L328 G330 L331 N342	N253-E308 PolarHBondContact ND2-O 2.81Å; E308-L328 HydrophobicContact CG-CB 4.34Å; E308-G330 CarbonylContact C-O 3.57Å; E308-G330 WeakPolarHBondContact CA-O 3.5Å; E308-L331 HydrophobicContact CB-CD2 3.96Å; E308-L331 HydrophobicContact CG-CD2 4.09Å; E308-N342 PolarHBondContact OE1-ND2 3.06Å
309	G	86.1	Confident	87.7	Confident	5 Å²	5	65.1 Å²	65.1	5%	0.052	33%	0.326	C	S	.	.	S	Bend	trans	78.6	179.7	166.3	0	0	0	0	0	115.8	C311 T329 G330	G309-C311 PolarHBondContact O-N 3.47Å; G309-C311 VanDerWaalsContact O-N 3.1Å; G309-C311 PolarHBondContact O-SG 3.22Å; G309-T329 WeakPolarHBondContact CA-O 3.37Å; G309-G330 PolarHBondContact N-O 3.39Å
310	N	84.1	Confident	89	Confident	36 Å²	36	70 Å²	70	19%	0.193	34%	0.342	C	S	.	.			trans	52.9	32.3	179.8	-58.4	-40.5	0	0	0	114.6	A250 Y251 T275 P312	A250-N310 VanDerWaalsContact CA-OD1 3.27Å; A250-N310 WeakPolarHBondContact CA-OD1 3.42Å; Y251-N310 PolarHBondContact N-OD1 2.84Å; Y251-N310 PolarHBondContact O-ND2 2.69Å; T275-N310 PolarHBondContact OG1-ND2 3.19Å; N310-P312 VanDerWaalsContact C-CD 3.41Å; N310-P312 WeakPolarHBondContact O-CD 3.44Å
311	C	81.9	Confident	90.1	Very high	15 Å²	15	66 Å²	66	10%	0.101	33%	0.329	C	S	.	.			trans	-109.5	75.2	-177.9	-70.3	0	0	0	0	112	G309 T313 T339	G309-C311 PolarHBondContact O-N 3.47Å; G309-C311 VanDerWaalsContact O-N 3.1Å; G309-C311 PolarHBondContact O-SG 3.22Å; C311-T313 PolarHBondContact O-N 3.2Å; C311-T339 HydrophobicContact CB-CG2 3.68Å
312	P	75.9	Confident	90.5	Very high	59 Å²	59	63 Å²	63	38%	0.383	31%	0.311	S	S	.	.			trans	-79.3	53.1	-177.8	35.5	-38.6	0	0	0	111.8	K248 N310	K248-P312 HydrophobicContact CD-CB 4.16Å; K248-P312 HydrophobicContact CD-CG 4.14Å; N310-P312 VanDerWaalsContact C-CD 3.41Å; N310-P312 WeakPolarHBondContact O-CD 3.44Å
313	T	87.8	Confident	90.3	Very high	67 Å²	67	69.7 Å²	69.7	41%	0.411	34%	0.34	S	S	.	.	S	Bend	trans	-124.3	176.2	-178.6	62.1	0	0	0	0	110.9	C311 I322 T339	C311-T313 PolarHBondContact O-N 3.2Å; T313-I322 PolarHBondContact O-N 3.39Å; T313-T339 WeakPolarHBondContact OG1-CG2 3.44Å
314	K	92.8	Very high	89.5	Confident	140 Å²	140	64.8 Å²	64.8	61%	0.609	32%	0.318	S	S	*	.	B	Isolated β-bridge	trans	-80.1	142.1	171.6	-68	-179.2	178.1	-177.8	0	108.9	D316	K314-D316 PolarHBondContact O-N 2.95Å
315	C	94.3	Very high	88.3	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	34%	0.344	C	S	.	.			trans	-66.2	129.1	172.1	169.9	0	0	0	0	110	K317 H319 K320 I322 T339 H341	C315-K317 PolarHBondContact O-N 2.95Å; C315-K317 PolarHBondContact SG-N 3.11Å; C315-K317 VanDerWaalsContact SG-N 3.4Å; C315-H319 WeakPolarHBondContact O-CA 3.3Å; C315-H319 PolarHBondContact O-N 3.13Å; C315-K320 PolarHBondContact N-O 3.41Å; C315-I322 HydrophobicContact CB-CD1 4.34Å; C315-I322 HydrophobicContact CB-CG1 4.14Å; C315-T339 CarbonylContact C-O 3.57Å; C315-T339 WeakPolarHBondContact CA-O 3.42Å; C315-H341 VanDerWaalsContact CB-CE1 3.42Å; C315-H341 WeakPolarHBondContact CB-CE1 3.39Å; C315-H341 VanDerWaalsContact CB-ND1 3.29Å; C315-H341 WeakPolarHBondContact CB-ND1 3.32Å
316	D	94.2	Very high	87.3	Confident	79 Å²	79	78.3 Å²	78.3	42%	0.422	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.6	-178.6	-68.2	-53.3	0	0	0	113.4	K314 H319 I338 T339 L340	K314-D316 PolarHBondContact O-N 2.95Å; D316-H319 PolarHBondContact O-CE1 2.99Å; D316-H319 VanDerWaalsContact O-CE1 3.25Å; D316-I338 HydrophobicContact CB-CD1 4Å; D316-I338 HydrophobicContact CB-CG1 3.5Å; D316-I338 VanDerWaalsContact CB-CG1 3.5Å; D316-I338 WeakPolarHBondContact OD2-CA 3.36Å; D316-I338 WeakPolarHBondContact OD2-CG1 3.4Å; D316-T339 PolarHBondContact N-O 2.97Å; D316-T339 PolarHBondContact OD2-N 3.3Å; D316-L340 HydrophobicContact CB-CD2 4.41Å
317	K	93.4	Very high	86.6	Confident	116 Å²	116	75.1 Å²	75.1	50%	0.504	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-47.7	178	-174.9	67.8	177.1	-166.8	0	113.7	C315 L340 C344	C315-K317 PolarHBondContact O-N 2.95Å; C315-K317 PolarHBondContact SG-N 3.11Å; C315-K317 VanDerWaalsContact SG-N 3.4Å; K317-L340 HydrophobicContact CB-CD2 3.69Å; K317-C344 HydrophobicContact CB-CB 4.14Å; K317-C344 HydrophobicContact CG-CB 4.4Å
318	C	94.3	Very high	86.1	Confident	46 Å²	46	75.5 Å²	75.5	31%	0.311	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-3.6	-174	76.2	0	0	0	0	114	K320 H341	C318-K320 PolarHBondContact O-N 3.47Å; C318-H341 PolarHBondContact SG-CE1 2.85Å; C318-H341 PolarHBondContact SG-ND1 3.49Å
319	H	94.6	Very high	85.9	Confident	135 Å²	135	73.8 Å²	73.8	63%	0.625	37%	0.365	S	S	*	.			trans	59.1	6.1	-179.7	-51.2	-56.6	0	0	0	116.1	C315 D316	C315-H319 WeakPolarHBondContact O-CA 3.3Å; C315-H319 PolarHBondContact O-N 3.13Å; D316-H319 PolarHBondContact O-CE1 2.99Å; D316-H319 VanDerWaalsContact O-CE1 3.25Å
320	K	93.8	Very high	86.1	Confident	152 Å²	152	73.6 Å²	73.6	66%	0.661	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-82.9	149.4	172.8	-62.1	179.5	-178.7	-179.6	0	110.7	C315 C318 H341	C315-K320 PolarHBondContact N-O 3.41Å; C318-K320 PolarHBondContact O-N 3.47Å; K320-H341 PolarHBondContact O-CE1 3.26Å; K320-H341 VanDerWaalsContact O-CE1 3.28Å
321	T	91.5	Very high	86.6	Confident	86 Å²	86	73.3 Å²	73.3	53%	0.528	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-62.1	137.6	178.1	-51.9	0	0	0	0	111.6	H341	T321-H341 PolarHBondContact O-NE2 2.88Å
322	I	89.6	Confident	87.2	Confident	3 Å²	3	73.8 Å²	73.8	2%	0.015	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-83	118	169.8	-57.4	170.6	0	0	0	107.9	T313 C315 C324 T339 H341	T313-I322 PolarHBondContact O-N 3.39Å; C315-I322 HydrophobicContact CB-CD1 4.34Å; C315-I322 HydrophobicContact CB-CG1 4.14Å; I322-C324 PolarHBondContact O-N 3.29Å; I322-T339 HydrophobicContact CD1-CG2 3.57Å; I322-H341 WeakPolarHBondContact CA-NE2 3.47Å
323	K	83.8	Confident	88.1	Confident	165 Å²	165	71 Å²	71	72%	0.717	34%	0.344	S	S	*	.			trans	-87	101.7	-175.7	-69.5	-174.4	178.3	-175.9	0	110.6	Y325 T329	K323-Y325 HydrophobicContact CB-CD2 4.4Å; K323-T329 PolarHBondContact O-OG1 3.03Å
324	C	74.3	Confident	88.4	Confident	10 Å²	10	67.9 Å²	67.9	7%	0.068	33%	0.325	C	S	.	.			trans	-101.5	27.8	-176.7	64	0	0	0	0	114.6	Y251 I322	Y251-C324 WeakPolarHBondContact CE2-O 3.5Å; I322-C324 PolarHBondContact O-N 3.29Å
325	Y	69.4	Low	88.5	Confident	164 Å²	164	61.8 Å²	61.8	64%	0.643	30%	0.298	S	S	*	.	S	Bend	trans	-91.3	-11	-172.7	-56.9	-80.5	0	0	0	114.9	Y251 K323	Y251-Y325 PolarHBondContact OH-O 3.34Å; K323-Y325 HydrophobicContact CB-CD2 4.4Å
326	Q	72.1	Confident	88.5	Confident	194 Å²	194	62.1 Å²	62.1	91%	0.907	30%	0.3	S	S	*	.	S	Bend	trans	-128	13.3	-173.8	-70.4	-179.8	-26.2	0	0	112.6	Y251	Y251-Q326 PolarHBondContact OH-N 3.22Å
327	G	79.7	Confident	88.5	Confident	12 Å²	12	60.1 Å²	60.1	12%	0.124	29%	0.288	C	S	.	.	S	Bend	trans	147.4	-176.3	-179.6	0	0	0	0	0	113.8	Y251 T329	Y251-G327 VanDerWaalsContact CZ-N 3.3Å; Y251-G327 PolarHBondContact OH-N 3.01Å; G327-T329 PolarHBondContact O-N 3.4Å
328	L	83.9	Confident	88.5	Confident	20 Å²	20	56.6 Å²	56.6	11%	0.105	27%	0.274	C	S	.	.			trans	-69.8	112.2	173.4	-66.9	166.3	0	0	0	109.5	C252 N253 L256 E308	C252-L328 WeakPolarHBondContact O-CD1 3.37Å; N253-L328 HydrophobicContact CB-CD1 4.47Å; L256-L328 HydrophobicContact CD2-CD1 3.57Å; E308-L328 HydrophobicContact CG-CB 4.34Å
329	T	85.7	Confident	88.6	Confident	46 Å²	46	54.9 Å²	54.9	28%	0.282	26%	0.263	S	S	.	.			trans	-141.2	145	177.6	53	0	0	0	0	110.1	G309 K323 G327	G309-T329 WeakPolarHBondContact CA-O 3.37Å; K323-T329 PolarHBondContact O-OG1 3.03Å; G327-T329 PolarHBondContact O-N 3.4Å
330	G	90.9	Very high	88.6	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.01	23%	0.233	C	C	.	.			trans	89.8	152.2	-176.2	0	0	0	0	0	111.9	E308 G309 L340 N342	E308-G330 CarbonylContact C-O 3.57Å; E308-G330 WeakPolarHBondContact CA-O 3.5Å; G309-G330 PolarHBondContact N-O 3.39Å; G330-L340 CarbonylContact C-O 3.56Å; G330-L340 WeakPolarHBondContact CA-O 3.37Å; G330-N342 VanDerWaalsContact CA-OD1 3.25Å; G330-N342 WeakPolarHBondContact CA-OD1 3.34Å; G330-N342 PolarHBondContact N-OD1 3.47Å
331	L	94.1	Very high	88.6	Confident	29 Å²	29	42.7 Å²	42.7	15%	0.152	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134	180	-64.1	168.2	0	0	0	108.4	W306 E308 T339 L340 N342 A345	W306-L331 HydrophobicContact CB-CD2 4.24Å; W306-L331 HydrophobicContact CD2-CB 4.14Å; W306-L331 HydrophobicContact CE3-CB 3.62Å; W306-L331 HydrophobicContact CZ3-CB 4.18Å; E308-L331 HydrophobicContact CB-CD2 3.96Å; E308-L331 HydrophobicContact CG-CD2 4.09Å; L331-T339 CarbonylContact O-C 3.55Å; L331-T339 WeakPolarHBondContact O-CA 3.48Å; L331-L340 PolarHBondContact N-O 3.28Å; L331-L340 PolarHBondContact O-N 3.36Å; L331-N342 WeakPolarHBondContact CG-OD1 3.4Å; L331-A345 HydrophobicContact CD1-CB 3.54Å
332	H	95.1	Very high	88.5	Confident	26 Å²	26	41.8 Å²	41.8	12%	0.12	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.2	173.3	-175.5	75.9	0	0	0	110.1	W306 V307 Q337 I338 T339 Y439	W306-H332 WeakPolarHBondContact CA-O 3.47Å; V307-H332 PolarHBondContact N-O 2.97Å; V307-H332 PolarHBondContact O-N 3.3Å; H332-Q337 PolarHBondContact CE1-O 2.95Å; H332-I338 WeakPolarHBondContact CA-O 3.28Å; H332-I338 PolarHBondContact ND1-O 2.71Å; H332-T339 HydrophobicContact CB-CG2 4.41Å; H332-T339 PolarHBondContact ND1-OG1 3.48Å; H332-Y439 PolarHBondContact CD2-OH 3.33Å; H332-Y439 AromaticContact NE2-CZ 3.99Å; H332-Y439 PolarHBondContact NE2-OH 3.07Å
333	C	95.4	Very high	88.6	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123	175.3	179.1	0	0	0	0	110	H304 F305 W306 W335 C336 Q337 I338	H304-C333 PolarHBondContact ND1-SG 2.98Å; F305-C333 VanDerWaalsContact O-CA 3.28Å; F305-C333 WeakPolarHBondContact O-CA 3.38Å; W306-C333 HydrophobicContact CD2-CB 4.37Å; W306-C333 HydrophobicContact CE3-CB 3.74Å; W306-C333 HydrophobicContact CH2-CB 3.97Å; W306-C333 HydrophobicContact CZ3-CB 3.53Å; C333-W335 VanDerWaalsContact C-N 3.29Å; C333-W335 PolarHBondContact O-N 2.89Å; C333-C336 WeakPolarHBondContact CB-SG 3.31Å; C333-C336 PolarHBondContact SG-SG 2.63Å; C333-Q337 WeakPolarHBondContact O-CA 3.32Å; C333-Q337 PolarHBondContact O-N 2.82Å; C333-I338 HydrophobicContact CB-CG2 4.04Å; C333-I338 PolarHBondContact N-O 2.94Å
334	V	94.3	Very high	89.1	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.012	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.6	-179.3	178.1	0	0	0	0	112.3	F271 C272 I289 F305 V307 Q337 Y439	F271-V334 WeakPolarHBondContact O-CG1 3.18Å; C272-V334 HydrophobicContact CB-CG2 4.03Å; I289-V334 HydrophobicContact CG2-CB 4.22Å; I289-V334 HydrophobicContact CG2-CG1 3.98Å; I289-V334 HydrophobicContact CG2-CG2 4.32Å; F305-V334 HydrophobicContact CD1-CB 4.16Å; F305-V334 HydrophobicContact CD1-CG2 3.63Å; F305-V334 HydrophobicContact CE1-CG2 4.17Å; F305-V334 PolarHBondContact O-N 3.07Å; V307-V334 HydrophobicContact CG2-CG2 3.89Å; V334-Q337 PolarHBondContact O-NE2 3.41Å; V334-Y439 HydrophobicContact CG1-CE2 4.17Å
335	W	94.8	Very high	89.9	Confident	11 Å²	11	42 Å²	42	4%	0.042	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-59.1	-175.7	-60.7	117.1	0	0	0	113.8	I289 K290 M302 C333 Q337 I361 P364 N442	I289-W335 HydrophobicContact CB-CZ2 4.09Å; I289-W335 HydrophobicContact CD1-CH2 3.96Å; I289-W335 HydrophobicContact CD1-CZ2 4.01Å; I289-W335 HydrophobicContact CG2-CZ2 4.37Å; K290-W335 WeakPolarHBondContact O-CZ2 3.4Å; M302-W335 HydrophobicContact CE-CB 3.41Å; M302-W335 VanDerWaalsContact CE-CB 3.41Å; M302-W335 HydrophobicContact CE-CD2 3.94Å; M302-W335 HydrophobicContact CE-CG 3.21Å; C333-W335 VanDerWaalsContact C-N 3.29Å; C333-W335 PolarHBondContact O-N 2.89Å; W335-Q337 VanDerWaalsContact C-N 3.31Å; W335-Q337 PolarHBondContact O-N 3.26Å; W335-I361 HydrophobicContact CE3-CG2 4.28Å; W335-I361 HydrophobicContact CZ3-CG2 4.39Å; W335-P364 HydrophobicContact CH2-CG 3.71Å; W335-P364 HydrophobicContact CZ2-CG 3.31Å; W335-N442 HydrophobicContact CH2-CB 4.28Å; W335-N442 HydrophobicContact CZ3-CB 4.15Å
336	C	94.2	Very high	90.9	Very high	8 Å²	8	38.9 Å²	38.9	5%	0.054	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-3	179.3	63.8	0	0	0	0	115	H304 C333 I338 C352	H304-C336 PolarHBondContact CE1-SG 2.69Å; H304-C336 PolarHBondContact ND1-SG 2.62Å; H304-C336 VanDerWaalsContact ND1-SG 3.36Å; C333-C336 WeakPolarHBondContact CB-SG 3.31Å; C333-C336 PolarHBondContact SG-SG 2.63Å; C336-I338 PolarHBondContact O-N 3.32Å; C336-I338 WeakPolarHBondContact SG-CG2 3.42Å; C336-C352 VanDerWaalsContact CB-SG 3.58Å
337	Q	93.4	Very high	91.7	Very high	36 Å²	36	35.5 Å²	35.5	17%	0.168	19%	0.19	C	C	.	.			trans	61.2	9.4	177.7	-58.3	-74.5	-51.7	0	0	115.3	H332 C333 V334 W335 L357	H332-Q337 PolarHBondContact CE1-O 2.95Å; C333-Q337 WeakPolarHBondContact O-CA 3.32Å; C333-Q337 PolarHBondContact O-N 2.82Å; V334-Q337 PolarHBondContact O-NE2 3.41Å; W335-Q337 VanDerWaalsContact C-N 3.31Å; W335-Q337 PolarHBondContact O-N 3.26Å; Q337-L357 HydrophobicContact CG-CD1 4.37Å
338	I	94	Very high	92.3	Very high	42 Å²	42	37 Å²	37	22%	0.215	20%	0.197	C	C	.	.			trans	-70.1	141.4	175.9	-158.4	175.9	0	0	0	110.6	W306 D316 H332 C333 C336 L340	W306-I338 HydrophobicContact CH2-CG2 3.5Å; W306-I338 VanDerWaalsContact CH2-CG2 3.5Å; W306-I338 HydrophobicContact CZ3-CG2 3.75Å; D316-I338 HydrophobicContact CB-CD1 4Å; D316-I338 HydrophobicContact CB-CG1 3.5Å; D316-I338 VanDerWaalsContact CB-CG1 3.5Å; D316-I338 WeakPolarHBondContact OD2-CA 3.36Å; D316-I338 WeakPolarHBondContact OD2-CG1 3.4Å; H332-I338 WeakPolarHBondContact CA-O 3.28Å; H332-I338 PolarHBondContact ND1-O 2.71Å; C333-I338 HydrophobicContact CB-CG2 4.04Å; C333-I338 PolarHBondContact N-O 2.94Å; C336-I338 PolarHBondContact O-N 3.32Å; C336-I338 WeakPolarHBondContact SG-CG2 3.42Å; I338-L340 HydrophobicContact CD1-CD1 4.35Å; I338-L340 HydrophobicContact CD1-CD2 3.85Å; I338-L340 HydrophobicContact CD1-CG 4.25Å; I338-L340 HydrophobicContact CG1-CD2 4.03Å; I338-L340 HydrophobicContact CG1-CG 4.22Å; I338-L340 HydrophobicContact CG2-CD1 4.41Å; I338-L340 HydrophobicContact CG2-CG 4.44Å
339	T	95.2	Very high	92.7	Very high	11 Å²	11	43.5 Å²	43.5	7%	0.067	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.9	176.6	-43	0	0	0	0	110.4	C311 T313 C315 D316 I322 L331 H332	C311-T339 HydrophobicContact CB-CG2 3.68Å; T313-T339 WeakPolarHBondContact OG1-CG2 3.44Å; C315-T339 CarbonylContact C-O 3.57Å; C315-T339 WeakPolarHBondContact CA-O 3.42Å; D316-T339 PolarHBondContact N-O 2.97Å; D316-T339 PolarHBondContact OD2-N 3.3Å; I322-T339 HydrophobicContact CD1-CG2 3.57Å; L331-T339 CarbonylContact O-C 3.55Å; L331-T339 WeakPolarHBondContact O-CA 3.48Å; H332-T339 HydrophobicContact CB-CG2 4.41Å; H332-T339 PolarHBondContact ND1-OG1 3.48Å
340	L	95.3	Very high	92.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.9	-171.8	-60.7	176.7	0	0	0	111.6	W306 D316 K317 G330 L331 I338 C344 A345 V348	W306-L340 HydrophobicContact CH2-CD1 3.58Å; W306-L340 HydrophobicContact CH2-CG 4.34Å; W306-L340 HydrophobicContact CZ2-CD1 4.32Å; W306-L340 HydrophobicContact CZ3-CD1 4.19Å; D316-L340 HydrophobicContact CB-CD2 4.41Å; K317-L340 HydrophobicContact CB-CD2 3.69Å; G330-L340 CarbonylContact C-O 3.56Å; G330-L340 WeakPolarHBondContact CA-O 3.37Å; L331-L340 PolarHBondContact N-O 3.28Å; L331-L340 PolarHBondContact O-N 3.36Å; I338-L340 HydrophobicContact CD1-CD1 4.35Å; I338-L340 HydrophobicContact CD1-CD2 3.85Å; I338-L340 HydrophobicContact CD1-CG 4.25Å; I338-L340 HydrophobicContact CG1-CD2 4.03Å; I338-L340 HydrophobicContact CG1-CG 4.22Å; I338-L340 HydrophobicContact CG2-CD1 4.41Å; I338-L340 HydrophobicContact CG2-CG 4.44Å; L340-C344 HydrophobicContact CB-CB 4.29Å; L340-A345 HydrophobicContact CD1-CB 4.28Å; L340-V348 HydrophobicContact CD1-CB 4.25Å; L340-V348 HydrophobicContact CD1-CG2 3.57Å
341	H	93.9	Very high	93	Very high	30 Å²	30	49.4 Å²	49.4	14%	0.139	26%	0.255	C	S	.	.			trans	-65.2	151.3	157.5	-63.3	109.8	0	0	0	109.5	C315 C318 K320 T321 I322 K343 C344 A345	C315-H341 VanDerWaalsContact CB-CE1 3.42Å; C315-H341 WeakPolarHBondContact CB-CE1 3.39Å; C315-H341 VanDerWaalsContact CB-ND1 3.29Å; C315-H341 WeakPolarHBondContact CB-ND1 3.32Å; C318-H341 PolarHBondContact SG-CE1 2.85Å; C318-H341 PolarHBondContact SG-ND1 3.49Å; K320-H341 PolarHBondContact O-CE1 3.26Å; K320-H341 VanDerWaalsContact O-CE1 3.28Å; T321-H341 PolarHBondContact O-NE2 2.88Å; I322-H341 WeakPolarHBondContact CA-NE2 3.47Å; H341-K343 HydrophobicContact CB-CG 4.06Å; H341-K343 PolarHBondContact O-N 3.37Å; H341-C344 HydrophobicContact CB-CB 4.15Å; H341-C344 WeakPolarHBondContact O-CA 3.34Å; H341-C344 WeakPolarHBondContact O-CB 3.39Å; H341-C344 PolarHBondContact O-N 2.95Å; H341-A345 PolarHBondContact O-N 3.39Å
342	N	90.6	Very high	93	Very high	67 Å²	67	48.5 Å²	48.5	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-52.1	-43.8	176.8	-63.8	-0.5	0	0	0	111.5	E308 G330 L331 C344 A345	E308-N342 PolarHBondContact OE1-ND2 3.06Å; G330-N342 VanDerWaalsContact CA-OD1 3.25Å; G330-N342 WeakPolarHBondContact CA-OD1 3.34Å; G330-N342 PolarHBondContact N-OD1 3.47Å; L331-N342 WeakPolarHBondContact CG-OD1 3.4Å; N342-C344 VanDerWaalsContact C-N 3.29Å; N342-C344 PolarHBondContact O-N 3.33Å; N342-A345 PolarHBondContact O-N 2.87Å
343	K	91.1	Very high	92.8	Very high	156 Å²	156	52.6 Å²	52.6	68%	0.678	27%	0.274	S	S	*	.	H	α-helix	trans	-68.9	-19.4	175.1	68.2	178	-178.6	179.4	0	115.4	H341 S346 H347	H341-K343 HydrophobicContact CB-CG 4.06Å; H341-K343 PolarHBondContact O-N 3.37Å; K343-S346 PolarHBondContact O-OG 3.25Å; K343-H347 PolarHBondContact O-CE1 2.89Å; K343-H347 PolarHBondContact O-ND1 3.38Å
344	C	94	Very high	92.7	Very high	10 Å²	10	52.9 Å²	52.9	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-86.9	-22.3	179.1	-71.4	0	0	0	0	111.8	K317 L340 H341 N342 S346 H347	K317-C344 HydrophobicContact CB-CB 4.14Å; K317-C344 HydrophobicContact CG-CB 4.4Å; L340-C344 HydrophobicContact CB-CB 4.29Å; H341-C344 HydrophobicContact CB-CB 4.15Å; H341-C344 WeakPolarHBondContact O-CA 3.34Å; H341-C344 WeakPolarHBondContact O-CB 3.39Å; H341-C344 PolarHBondContact O-N 2.95Å; N342-C344 VanDerWaalsContact C-N 3.29Å; N342-C344 PolarHBondContact O-N 3.33Å; C344-S346 VanDerWaalsContact C-N 3.31Å; C344-S346 PolarHBondContact O-N 3.35Å; C344-H347 WeakPolarHBondContact O-CB 3.37Å; C344-H347 PolarHBondContact O-N 2.98Å; C344-H347 VanDerWaalsContact O-N 3.11Å
345	A	91	Very high	92.7	Very high	18 Å²	18	53.5 Å²	53.5	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-63.7	-33.4	-178.8	0	0	0	0	0	113.4	L331 L340 H341 N342 H347 V348	L331-A345 HydrophobicContact CD1-CB 3.54Å; L340-A345 HydrophobicContact CD1-CB 4.28Å; H341-A345 PolarHBondContact O-N 3.39Å; N342-A345 PolarHBondContact O-N 2.87Å; A345-H347 PolarHBondContact O-N 3.14Å; A345-H347 VanDerWaalsContact O-N 3.13Å; A345-V348 PolarHBondContact O-N 3.22Å; A345-V348 VanDerWaalsContact O-N 3.11Å
346	S	89.6	Confident	92.6	Very high	97 Å²	97	57.4 Å²	57.4	68%	0.678	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.7	174.8	57.5	0	0	0	0	114.5	K343 C344	K343-S346 PolarHBondContact O-OG 3.25Å; C344-S346 VanDerWaalsContact C-N 3.31Å; C344-S346 PolarHBondContact O-N 3.35Å
347	H	90.5	Very high	92.6	Very high	124 Å²	124	57.2 Å²	57.2	57%	0.574	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	10.2	177.6	-56.1	98.9	0	0	0	113	K343 C344 A345	K343-H347 PolarHBondContact O-CE1 2.89Å; K343-H347 PolarHBondContact O-ND1 3.38Å; C344-H347 WeakPolarHBondContact O-CB 3.37Å; C344-H347 PolarHBondContact O-N 2.98Å; C344-H347 VanDerWaalsContact O-N 3.11Å; A345-H347 PolarHBondContact O-N 3.14Å; A345-H347 VanDerWaalsContact O-N 3.13Å
348	V	91.2	Very high	92.6	Very high	42 Å²	42	61.5 Å²	61.5	26%	0.255	33%	0.326	S	S	.	.	S	Bend	trans	-115.9	146.6	175.5	-178.6	0	0	0	0	107.9	L340 A345	L340-V348 HydrophobicContact CD1-CB 4.25Å; L340-V348 HydrophobicContact CD1-CG2 3.57Å; A345-V348 PolarHBondContact O-N 3.22Å; A345-V348 VanDerWaalsContact O-N 3.11Å
349	K	91.8	Very high	92.7	Very high	157 Å²	157	60.1 Å²	60.1	68%	0.683	32%	0.319	S	S	*	.			trans	-59.8	148.6	177.1	-72.6	-172.4	-179.8	-176.5	0	110.7	H304 E351	H304-K349 PolarHBondContact CD2-O 2.77Å; H304-K349 PolarHBondContact NE2-O 3.07Å; K349-E351 VanDerWaalsContact C-N 3.25Å; K349-E351 WeakPolarHBondContact CB-OE2 3.5Å; K349-E351 PolarHBondContact O-N 3.31Å
350	P	90.6	Very high	92.8	Very high	77 Å²	77	59.6 Å²	59.6	50%	0.5	32%	0.316	S	S	.	.	S	Bend	trans	-69	-26.7	175.6	27.4	-32.8	0	0	0	112.4	H304	H304-P350 PolarHBondContact CD2-O 2.94Å; H304-P350 PolarHBondContact N-O 3.13Å
351	E	93.1	Very high	92.8	Very high	94 Å²	94	59.7 Å²	59.7	44%	0.439	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-76.7	131.4	177.7	-51.2	85	-177.5	0	0	111.4	V301 M302 H304 K349	V301-E351 HydrophobicContact CG1-CB 4.2Å; V301-E351 HydrophobicContact CG1-CG 3.42Å; V301-E351 VanDerWaalsContact CG1-CG 3.42Å; M302-E351 CarbonylContact O-C 3.47Å; M302-E351 WeakPolarHBondContact O-CA 3.12Å; H304-E351 PolarHBondContact NE2-O 2.83Å; K349-E351 VanDerWaalsContact C-N 3.25Å; K349-E351 WeakPolarHBondContact CB-OE2 3.5Å; K349-E351 PolarHBondContact O-N 3.31Å
352	C	93.5	Very high	92.8	Very high	10 Å²	10	58.3 Å²	58.3	7%	0.068	31%	0.31	C	S	.	.			trans	-100.7	134.1	176	176.8	0	0	0	0	110.3	M302 H304 C336	M302-C352 HydrophobicContact CE-CB 4.24Å; M302-C352 PolarHBondContact O-N 2.96Å; M302-C352 HydrophobicContact SD-CB 3.37Å; M302-C352 WeakPolarHBondContact SD-CB 3.46Å; H304-C352 HydrophobicContact CB-CB 4.23Å; H304-C352 WeakPolarHBondContact ND1-CB 3.46Å; C336-C352 VanDerWaalsContact CB-SG 3.58Å
353	D	92.2	Very high	92.9	Very high	112 Å²	112	55.5 Å²	55.5	60%	0.599	30%	0.295	S	S	*	.			trans	-102.1	13.6	-177.4	65.5	-11.7	0	0	0	112.7	G355 K358	D353-G355 PolarHBondContact O-N 3.13Å; D353-G355 WeakPolarHBondContact OD1-CA 3.42Å; D353-G355 PolarHBondContact OD1-N 3.12Å; D353-K358 VanDerWaalsContact O-CB 3.28Å; D353-K358 WeakPolarHBondContact O-CB 3.43Å
354	C	93.4	Very high	92.9	Very high	6 Å²	6	48.6 Å²	48.6	4%	0.041	27%	0.266	C	S	.	.			trans	58.7	7	-170.9	-62.8	0	0	0	0	115	L357 K358 I361	C354-L357 PolarHBondContact O-N 3.16Å; C354-K358 HydrophobicContact CB-CB 3.97Å; C354-K358 PolarHBondContact O-N 2.54Å; C354-I361 HydrophobicContact CB-CB 4.47Å; C354-I361 HydrophobicContact CB-CD1 4.07Å
355	G	93.6	Very high	92.6	Very high	15 Å²	15	49.5 Å²	49.5	16%	0.155	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	54.8	-141.1	171.2	0	0	0	0	0	114.1	D353 L357 K358	D353-G355 PolarHBondContact O-N 3.13Å; D353-G355 WeakPolarHBondContact OD1-CA 3.42Å; D353-G355 PolarHBondContact OD1-N 3.12Å; G355-L357 PolarHBondContact O-N 3.02Å; G355-L357 VanDerWaalsContact O-N 3.07Å; G355-K358 WeakPolarHBondContact O-CB 3.06Å; G355-K358 PolarHBondContact O-N 2.78Å
356	P	92.2	Very high	92.5	Very high	93 Å²	93	49 Å²	49	60%	0.604	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-62.9	-14.1	-178.2	-23.3	34.1	0	0	0	115.2
357	L	94.3	Very high	92.4	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-103.9	7.7	-177.3	-61	-174.5	0	0	0	112.9	Q337 C354 G355 D359 H360 I361 L440 L523 L526	Q337-L357 HydrophobicContact CG-CD1 4.37Å; C354-L357 PolarHBondContact O-N 3.16Å; G355-L357 PolarHBondContact O-N 3.02Å; G355-L357 VanDerWaalsContact O-N 3.07Å; L357-D359 PolarHBondContact O-N 2.79Å; L357-D359 VanDerWaalsContact O-N 3.12Å; L357-H360 PolarHBondContact O-N 2.94Å; L357-I361 HydrophobicContact CB-CD1 3.51Å; L357-I361 HydrophobicContact CB-CG1 3.96Å; L357-I361 HydrophobicContact CD1-CD1 4.44Å; L357-I361 WeakPolarHBondContact O-CG1 3.09Å; L357-I361 PolarHBondContact O-N 2.77Å; L357-L440 HydrophobicContact CD1-CB 4.11Å; L357-L440 HydrophobicContact CD1-CD2 4.24Å; L357-L440 WeakPolarHBondContact CD1-O 3.35Å; L357-L523 HydrophobicContact CD1-CD2 3.76Å; L357-L523 HydrophobicContact CD2-CD2 3.86Å; L357-L523 HydrophobicContact CG-CD2 4.16Å; L357-L526 HydrophobicContact CD1-CD1 4.25Å; L357-L526 HydrophobicContact CD2-CB 4.13Å; L357-L526 HydrophobicContact CD2-CD1 3.69Å
358	K	94.6	Very high	91.8	Very high	126 Å²	126	38.7 Å²	38.7	55%	0.548	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-32.4	-176.9	72.1	178.6	-174.5	172.3	0	114.7	D353 C354 G355 H360	D353-K358 VanDerWaalsContact O-CB 3.28Å; D353-K358 WeakPolarHBondContact O-CB 3.43Å; C354-K358 HydrophobicContact CB-CB 3.97Å; C354-K358 PolarHBondContact O-N 2.54Å; G355-K358 WeakPolarHBondContact O-CB 3.06Å; G355-K358 PolarHBondContact O-N 2.78Å; K358-H360 VanDerWaalsContact C-N 3.32Å
359	D	95.4	Very high	90.7	Very high	14 Å²	14	38 Å²	38	8%	0.075	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-35.9	179.4	-173.1	53.5	0	0	0	111.2	L357 T413 H414 R468	L357-D359 PolarHBondContact O-N 2.79Å; L357-D359 VanDerWaalsContact O-N 3.12Å; D359-T413 WeakPolarHBondContact OD1-CA 3.29Å; D359-H414 CarbonylContact O-C 3.57Å; D359-H414 PolarHBondContact O-N 2.69Å; D359-H414 IonicContact OD1-CE1 3.67Å; D359-H414 IonicContact OD1-CG 2.65Å; D359-H414 PolarHBondContact OD1-N 3.31Å; D359-H414 IonicContact OD1-ND1 3.52Å; D359-H414 PolarHBondContact OD1-ND1 3.3Å; D359-H414 IonicContact OD2-ND1 2.67Å; D359-R468 IonicContact OD2-CZ 2.72Å; D359-R468 IonicContact OD2-NH1 3.5Å; D359-R468 PolarHBondContact OD2-NH1 3.21Å; D359-R468 IonicContact OD2-NH2 3.35Å
360	H	96.6	Very high	89.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-28.4	-172.8	-58.6	-65.5	0	0	0	113.5	L357 K358 L416 L441 Q445 L526	L357-H360 PolarHBondContact O-N 2.94Å; K358-H360 VanDerWaalsContact C-N 3.32Å; H360-L416 HydrophobicContact CB-CB 3.93Å; H360-L416 PolarHBondContact O-N 3.06Å; H360-L441 HydrophobicContact CB-CD2 3.77Å; H360-Q445 PolarHBondContact O-NE2 2.98Å; H360-L526 PolarHBondContact CE1-O 3Å; H360-L526 PolarHBondContact NE2-O 3.39Å
361	I	95.8	Very high	87.3	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	20%	0.201	C	C	.	.			trans	-77.3	130.9	-175.3	-69.2	170.8	0	0	0	109.7	W335 C354 L357 P363 L441	W335-I361 HydrophobicContact CE3-CG2 4.28Å; W335-I361 HydrophobicContact CZ3-CG2 4.39Å; C354-I361 HydrophobicContact CB-CB 4.47Å; C354-I361 HydrophobicContact CB-CD1 4.07Å; L357-I361 HydrophobicContact CB-CD1 3.51Å; L357-I361 HydrophobicContact CB-CG1 3.96Å; L357-I361 HydrophobicContact CD1-CD1 4.44Å; L357-I361 WeakPolarHBondContact O-CG1 3.09Å; L357-I361 PolarHBondContact O-N 2.77Å; I361-P363 HydrophobicContact CG2-CG 4.37Å; I361-P363 VanDerWaalsContact O-CD 3.23Å; I361-P363 WeakPolarHBondContact O-CD 3.45Å; I361-L441 HydrophobicContact CG1-CD2 3.91Å
362	L	93.5	Very high	84.7	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	22%	0.22	C	C	.	.			trans	-88.9	103	161.3	-172.2	61.4	0	0	0	108.8	I367 I407 T409 P415 N442 Q445 F460	L362-I367 HydrophobicContact CD2-CD1 3.71Å; L362-I367 HydrophobicContact CD2-CG1 3.84Å; L362-I367 HydrophobicContact CG-CD1 3.84Å; L362-I367 HydrophobicContact CG-CG1 3.95Å; L362-I407 HydrophobicContact CD1-CG2 3.69Å; L362-I407 HydrophobicContact CD2-CD1 4.17Å; L362-I407 HydrophobicContact CD2-CG2 3.88Å; L362-I407 HydrophobicContact CG-CG2 4.32Å; L362-T409 HydrophobicContact CD1-CG2 4.45Å; L362-P415 HydrophobicContact CB-CB 4.39Å; L362-P415 HydrophobicContact CD1-CG 4.26Å; L362-N442 VanDerWaalsContact O-CB 3.26Å; L362-N442 WeakPolarHBondContact O-CB 3.45Å; L362-N442 PolarHBondContact O-ND2 3.3Å; L362-Q445 HydrophobicContact CB-CG 4.09Å; L362-F460 HydrophobicContact CD2-CE1 4.17Å; L362-F460 HydrophobicContact CD2-CZ 4.27Å
363	P	92.6	Very high	81.8	Confident	7 Å²	7	46.1 Å²	46.1	5%	0.045	25%	0.253	C	S	.	.			trans	-67.1	150.8	-170.3	-23.6	38	0	0	0	112.2	I361 N365 S366 I410	I361-P363 HydrophobicContact CG2-CG 4.37Å; I361-P363 VanDerWaalsContact O-CD 3.23Å; I361-P363 WeakPolarHBondContact O-CD 3.45Å; P363-N365 WeakPolarHBondContact CB-OD1 2.95Å; P363-N365 PolarHBondContact O-N 3.31Å; P363-S366 VanDerWaalsContact O-CB 3.3Å; P363-S366 WeakPolarHBondContact O-CB 3.26Å; P363-S366 PolarHBondContact O-N 2.95Å; P363-I410 HydrophobicContact CG-CD1 3.88Å
364	P	90.6	Very high	79.1	Confident	11 Å²	11	51.9 Å²	51.9	7%	0.071	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58	-34.4	177.7	-26.6	35.2	0	0	0	114	K290 Y292 V293 W335 S366 I367	K290-P364 WeakPolarHBondContact O-CB 3.44Å; K290-P364 WeakPolarHBondContact O-CG 3.18Å; Y292-P364 CarbonylContact C-O 3.54Å; Y292-P364 VanDerWaalsContact CA-O 3.31Å; Y292-P364 WeakPolarHBondContact CA-O 3.35Å; V293-P364 PolarHBondContact N-O 3.23Å; V293-P364 VanDerWaalsContact N-O 3.17Å; W335-P364 HydrophobicContact CH2-CG 3.71Å; W335-P364 HydrophobicContact CZ2-CG 3.31Å; P364-S366 PolarHBondContact O-N 3.19Å; P364-I367 PolarHBondContact O-N 2.93Å; P364-I367 VanDerWaalsContact O-O 3.12Å
365	N	89	Confident	76.1	Confident	29 Å²	29	60.8 Å²	60.8	16%	0.155	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-73.9	-8.5	177.6	69.2	-51	0	0	0	113.7	V293 T299 P363	V293-N365 HydrophobicContact CG1-CB 4.23Å; T299-N365 WeakPolarHBondContact CG2-O 3.46Å; T299-N365 PolarHBondContact O-ND2 3.36Å; T299-N365 VanDerWaalsContact O-ND2 3.16Å; P363-N365 WeakPolarHBondContact CB-OD1 2.95Å; P363-N365 PolarHBondContact O-N 3.31Å
366	S	89.3	Confident	73.1	Confident	8 Å²	8	64.4 Å²	64.4	6%	0.056	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-88	-6	171.4	-71.2	0	0	0	0	113.1	P363 P364 I407 T408	P363-S366 VanDerWaalsContact O-CB 3.3Å; P363-S366 WeakPolarHBondContact O-CB 3.26Å; P363-S366 PolarHBondContact O-N 2.95Å; P364-S366 PolarHBondContact O-N 3.19Å; S366-I407 CarbonylContact O-C 3.55Å; S366-I407 VanDerWaalsContact O-CA 3.3Å; S366-I407 WeakPolarHBondContact O-CA 3.39Å; S366-T408 WeakPolarHBondContact CB-O 3.48Å; S366-T408 PolarHBondContact O-N 2.95Å; S366-T408 PolarHBondContact OG-O 3.38Å
367	I	86.5	Confident	70.4	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	125.2	-175.5	-55	162.4	0	0	0	108.7	T291 Y292 V293 L362 P364 L405 N442 F460	T291-I367 WeakPolarHBondContact O-CD1 3.22Å; Y292-I367 WeakPolarHBondContact CB-O 3.27Å; V293-I367 WeakPolarHBondContact CG2-O 3.11Å; V293-I367 PolarHBondContact N-O 3.47Å; L362-I367 HydrophobicContact CD2-CD1 3.71Å; L362-I367 HydrophobicContact CD2-CG1 3.84Å; L362-I367 HydrophobicContact CG-CD1 3.84Å; L362-I367 HydrophobicContact CG-CG1 3.95Å; P364-I367 PolarHBondContact O-N 2.93Å; P364-I367 VanDerWaalsContact O-O 3.12Å; I367-L405 HydrophobicContact CG2-CB 4.21Å; I367-L405 HydrophobicContact CG2-CD1 3.72Å; I367-L405 HydrophobicContact CG2-CG 4.4Å; I367-N442 WeakPolarHBondContact CD1-ND2 3.48Å; I367-F460 HydrophobicContact CD1-CZ 4.2Å
368	C	77.3	Confident	67.6	Low	5 Å²	5	72.3 Å²	72.3	3%	0.034	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	144.3	177	64.9	0	0	0	0	112.3	V293 L405 Q406	V293-C368 HydrophobicContact CG2-CB 4.05Å; C368-L405 CarbonylContact O-C 3.35Å; C368-L405 WeakPolarHBondContact O-CA 3.48Å; C368-Q406 PolarHBondContact N-O 3.45Å; C368-Q406 PolarHBondContact O-N 2.9Å
369	P	69.1	Low	65	Low	27 Å²	27	77.5 Å²	77.5	18%	0.175	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	145.2	174.4	-20.7	32.8	0	0	0	112.7	Y292 V293 V371 L405	Y292-P369 HydrophobicContact CD2-CG 3.85Å; Y292-P369 HydrophobicContact CE2-CG 3.58Å; V293-P369 WeakPolarHBondContact O-CD 3.44Å; P369-V371 VanDerWaalsContact C-N 3.26Å; P369-V371 PolarHBondContact O-N 3.21Å; P369-L405 HydrophobicContact CB-CD2 4.02Å; P369-L405 HydrophobicContact CG-CD2 3.94Å
370	V	63.1	Low	62.3	Low	64 Å²	64	85.6 Å²	85.6	39%	0.388	42%	0.422	S	S	.	.	S	Bend	trans	-81	-7.6	-176.6	176.9	0	0	0	0	112.1	L372 A395 G404 Q406	V370-L372 PolarHBondContact O-N 3.43Å; V370-A395 HydrophobicContact CB-CB 4.38Å; V370-A395 HydrophobicContact CG1-CB 4.3Å; V370-A395 HydrophobicContact CG2-CB 3.34Å; V370-G404 WeakPolarHBondContact CB-O 3.3Å; V370-G404 VanDerWaalsContact CG2-O 3.27Å; V370-G404 WeakPolarHBondContact CG2-O 3.47Å; V370-G404 PolarHBondContact N-O 2.94Å; V370-Q406 HydrophobicContact CG2-CB 3.97Å
371	V	48.1	Very low	59.1	Low	122 Å²	122	92.2 Å²	92.2	74%	0.739	46%	0.457	S	S	*	.			trans	-96.1	99.9	-176.5	-174.2	0	0	0	0	111	P369	P369-V371 VanDerWaalsContact C-N 3.26Å; P369-V371 PolarHBondContact O-N 3.21Å
372	L	38.3	Very low	56.4	Low	160 Å²	160	97.7 Å²	97.7	84%	0.838	50%	0.496	S	S	*	.			trans	-177.4	50.5	143.6	-97.9	170.6	0	0	0	112.1	V370	V370-L372 PolarHBondContact O-N 3.43Å
373	E	32.9	Very low	53.7	Low	163 Å²	163	108.9 Å²	108.9	76%	0.762	54%	0.538	S	S	*	.			trans	-129.7	36.8	169.9	-146.1	175.5	-141.4	0	0	112.6
374	R	34.4	Very low	50.7	Low	233 Å²	233	114.5 Å²	114.5	88%	0.879	58%	0.577	S	S	*	*	S	Bend	trans	-111.2	4.3	176.1	-88.9	-173	178	-179.9	-0.1	115.8
375	Q	31.1	Very low	48	Very low	192 Å²	192	118.9 Å²	118.9	90%	0.897	61%	0.608	S	S	*	*	S	Bend	trans	-133.9	3.3	-177.2	-78.4	-169.1	2	0	0	117.7
376	S	31.5	Very low	45.3	Very low	91 Å²	91	126.3 Å²	126.3	64%	0.636	64%	0.642	S	S	*	*	S	Bend	trans	-102	-10.7	176.4	54.8	0	0	0	0	115.2
377	T	35.5	Very low	42.5	Very low	107 Å²	107	131.3 Å²	131.3	66%	0.656	68%	0.677	S	S	*	*	S	Bend	trans	-101.1	6.5	-175.2	48.2	0	0	0	0	115.3
378	L	35.7	Very low	39.6	Very low	156 Å²	156	137 Å²	137	82%	0.817	72%	0.717	S	S	*	*	S	Bend	trans	-99.9	7.7	174.1	-73.9	174.3	0	0	0	114.4
379	R	38.3	Very low	37.4	Very low	235 Å²	235	149.1 Å²	149.1	89%	0.887	76%	0.762	S	S	*	*	S	Bend	trans	-141.4	50.9	176.9	-67.7	-168.2	178.3	-171.1	1	113.7
380	K	38.4	Very low	35.4	Very low	184 Å²	184	151.2 Å²	151.2	80%	0.8	79%	0.788	S	S	*	*	S	Bend	trans	-173.8	137.3	143.5	-114.4	171.4	177	-179.5	0	110.7
381	D	30.7	Very low	33.8	Very low	140 Å²	140	157.8 Å²	157.8	75%	0.749	81%	0.812	S	S	*	*			trans	108.2	65	158.9	-52.8	-18.8	0	0	0	116.3	R383	D381-R383 PolarHBondContact O-N 2.98Å
382	S	38.6	Very low	33	Very low	117 Å²	117	160.7 Å²	160.7	82%	0.818	82%	0.819	S	S	*	*			trans	-61.7	110.9	134.4	33	0	0	0	0	109.3
383	R	37.9	Very low	33.1	Very low	236 Å²	236	160.8 Å²	160.8	89%	0.891	82%	0.815	S	S	*	*			trans	111.4	92	166.5	-63.1	171.6	173.8	-167.1	-1.4	114.9	D381	D381-R383 PolarHBondContact O-N 2.98Å
384	S	29.5	Very low	33.6	Very low	125 Å²	125	163.4 Å²	163.4	87%	0.874	82%	0.818	S	S	*	*				168.1	148.9	113.9	54.7	0	0	0	0	110.7
385	S	33.4	Very low	34.4	Very low	103 Å²	103	153.7 Å²	153.7	72%	0.72	79%	0.788	S	S	*	*			trans	-87.2	151	-173.3	47.7	0	0	0	0	113.2
386	Q	31	Very low	35.7	Very low	184 Å²	184	148.6 Å²	148.6	86%	0.86	77%	0.767	S	S	*	*			trans	94.3	132.5	154.9	-69.6	177.9	-14.4	0	0	120.7
387	S	31.8	Very low	37.4	Very low	114 Å²	114	144.3 Å²	144.3	80%	0.797	74%	0.737	S	S	*	*			trans	69.7	89.5	155.8	71.4	0	0	0	0	120.8
388	S	25.4	Very low	38.7	Very low	119 Å²	119	141.7 Å²	141.7	83%	0.832	72%	0.721	S	S	*	*				173.8	112.9	113.5	61.5	0	0	0	0	109.3	G390	S388-G390 VanDerWaalsContact C-N 3.33Å; S388-G390 PolarHBondContact O-N 3.43Å
389	R	30.6	Very low	39.8	Very low	260 Å²	260	134.7 Å²	134.7	98%	0.981	69%	0.685	S	S	*	*			trans	-72.4	87.1	172.4	-81.3	-179.4	172.2	167.2	-2.7	109.4	K391	R389-K391 PolarHBondContact O-N 3.2Å
390	G	28.3	Very low	40.6	Very low	71 Å²	71	128.2 Å²	128.2	73%	0.732	67%	0.671	S	S	*	*			trans	-68.2	117.9	163.7	0	0	0	0	0	109.6	S388 M392	S388-G390 VanDerWaalsContact C-N 3.33Å; S388-G390 PolarHBondContact O-N 3.43Å; G390-M392 PolarHBondContact O-N 3.29Å
391	K	28.2	Very low	41.1	Very low	202 Å²	202	125.1 Å²	125.1	88%	0.878	66%	0.663	S	S	*	*			trans	-63	118.6	170.3	-85.8	179.2	175.1	177.8	0	108.6	R389 Q393	R389-K391 PolarHBondContact O-N 3.2Å; K391-Q393 PolarHBondContact O-N 2.72Å; K391-Q393 VanDerWaalsContact O-N 3.16Å
392	M	31.4	Very low	42.1	Very low	182 Å²	182	121 Å²	121	90%	0.897	65%	0.654	S	S	*	*			trans	-61.8	109	169.9	-153.2	164.3	66.5	0	0	108.4	G390 R394	G390-M392 PolarHBondContact O-N 3.29Å; M392-R394 PolarHBondContact O-N 2.97Å; M392-R394 VanDerWaalsContact O-N 3.15Å
393	Q	40.8	Very low	43.1	Very low	163 Å²	163	118.3 Å²	118.3	76%	0.762	63%	0.628	S	S	*	*			trans	-70.6	104.1	175.3	-84.1	177.9	-27	0	0	108.9	K391	K391-Q393 PolarHBondContact O-N 2.72Å; K391-Q393 VanDerWaalsContact O-N 3.16Å
394	R	43.3	Very low	44.3	Very low	217 Å²	217	108.1 Å²	108.1	82%	0.819	60%	0.597	S	S	*	*			trans	-66	127.1	160.9	-93.4	178.9	171.6	164.5	-3.7	107.4	M392	M392-R394 PolarHBondContact O-N 2.97Å; M392-R394 VanDerWaalsContact O-N 3.15Å
395	A	50.8	Low	46.3	Very low	30 Å²	30	102.2 Å²	102.2	25%	0.248	56%	0.555	C	S	.	*			trans	-76	127.3	168.1	0	0	0	0	0	109	V370	V370-A395 HydrophobicContact CB-CB 4.38Å; V370-A395 HydrophobicContact CG1-CB 4.3Å; V370-A395 HydrophobicContact CG2-CB 3.34Å
396	N	58.1	Low	48.5	Very low	85 Å²	85	99.6 Å²	99.6	46%	0.455	53%	0.532	S	S	.	.			trans	-99.7	-13.3	174.8	-53.3	-48.4	0	0	0	111.7	V398 D463	N396-V398 PolarHBondContact O-N 3.21Å; N396-D463 WeakPolarHBondContact CA-OD2 3.24Å; N396-D463 PolarHBondContact N-OD2 3.06Å; N396-D463 PolarHBondContact ND2-OD1 3.35Å
397	S	67.7	Low	51.1	Low	0 Å²	0	91.7 Å²	91.7	0%	0	50%	0.495	C	S	.	.			trans	-67.1	108	168.5	-78.9	0	0	0	0	111.2	L405 N459 F460 D463	S397-L405 WeakPolarHBondContact CB-O 3.46Å; S397-L405 PolarHBondContact O-N 3.46Å; S397-N459 WeakPolarHBondContact CA-O 3.28Å; S397-F460 VanDerWaalsContact CB-O 3.32Å; S397-F460 WeakPolarHBondContact CB-O 3.38Å; S397-F460 PolarHBondContact OG-O 3.49Å; S397-D463 PolarHBondContact N-OD2 3.45Å; S397-D463 PolarHBondContact OG-N 3.25Å
398	V	63.1	Low	53.7	Low	52 Å²	52	90.4 Å²	90.4	32%	0.315	48%	0.482	S	S	.	.	B	Isolated β-bridge	trans	-120.5	133.9	-177.6	-177.7	0	0	0	0	109.3	N396 G402	N396-V398 PolarHBondContact O-N 3.21Å; V398-G402 VanDerWaalsContact CG1-CA 3.43Å
399	T	58.3	Low	56.6	Low	10 Å²	10	86.6 Å²	86.6	6%	0.061	45%	0.454	C	S	.	.			trans	-76	171	173.9	57	0	0	0	0	111.5	D401 G402 Q403 L405 F460	T399-D401 WeakPolarHBondContact CB-OD1 3.45Å; T399-D401 PolarHBondContact O-N 3.28Å; T399-D401 VanDerWaalsContact O-N 3.13Å; T399-D401 VanDerWaalsContact OG1-CG 3.24Å; T399-D401 PolarHBondContact OG1-OD1 3.2Å; T399-G402 PolarHBondContact O-N 2.95Å; T399-Q403 HydrophobicContact CG2-CB 4.44Å; T399-Q403 PolarHBondContact N-O 3.33Å; T399-Q403 WeakPolarHBondContact OG1-CA 3.26Å; T399-Q403 VanDerWaalsContact OG1-CB 3.25Å; T399-Q403 WeakPolarHBondContact OG1-CB 3.44Å; T399-Q403 PolarHBondContact OG1-N 3.42Å; T399-Q403 PolarHBondContact OG1-O 3.39Å; T399-L405 HydrophobicContact CG2-CD1 3.23Å; T399-L405 HydrophobicContact CG2-CG 3.79Å; T399-F460 HydrophobicContact CG2-CD2 4.28Å; T399-F460 HydrophobicContact CG2-CE2 4.44Å
400	V	54.5	Low	59.2	Low	99 Å²	99	78.2 Å²	78.2	60%	0.6	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.5	177.3	-176.1	0	0	0	0	112.2	G402 Y447 P456	V400-G402 VanDerWaalsContact C-N 3.35Å; V400-Y447 HydrophobicContact CG2-CE1 4.21Å; V400-P456 HydrophobicContact CG2-CB 3.87Å
401	D	49.3	Very low	62	Low	119 Å²	119	83.9 Å²	83.9	64%	0.636	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	6.5	179.4	57.9	-54.1	0	0	0	114.4	T399 Q403	T399-D401 WeakPolarHBondContact CB-OD1 3.45Å; T399-D401 PolarHBondContact O-N 3.28Å; T399-D401 VanDerWaalsContact O-N 3.13Å; T399-D401 VanDerWaalsContact OG1-CG 3.24Å; T399-D401 PolarHBondContact OG1-OD1 3.2Å; D401-Q403 VanDerWaalsContact C-N 3.32Å; D401-Q403 PolarHBondContact O-N 2.97Å
402	G	53.2	Low	64.8	Low	54 Å²	54	77.6 Å²	77.6	56%	0.557	43%	0.428	S	S	*	.			trans	82.1	5.7	177.6	0	0	0	0	0	114.6	V398 T399 V400 G404	V398-G402 VanDerWaalsContact CG1-CA 3.43Å; T399-G402 PolarHBondContact O-N 2.95Å; V400-G402 VanDerWaalsContact C-N 3.35Å; G402-G404 PolarHBondContact O-N 3.07Å
403	Q	58.6	Low	67.8	Low	60 Å²	60	70 Å²	70	28%	0.28	39%	0.392	S	S	.	.			trans	-72.9	120	176.7	-167.4	179.5	42.6	0	0	110.3	T399 D401 L405	T399-Q403 HydrophobicContact CG2-CB 4.44Å; T399-Q403 PolarHBondContact N-O 3.33Å; T399-Q403 WeakPolarHBondContact OG1-CA 3.26Å; T399-Q403 VanDerWaalsContact OG1-CB 3.25Å; T399-Q403 WeakPolarHBondContact OG1-CB 3.44Å; T399-Q403 PolarHBondContact OG1-N 3.42Å; T399-Q403 PolarHBondContact OG1-O 3.39Å; D401-Q403 VanDerWaalsContact C-N 3.32Å; D401-Q403 PolarHBondContact O-N 2.97Å; Q403-L405 HydrophobicContact CG-CD2 4.07Å; Q403-L405 PolarHBondContact O-N 3.21Å
404	G	62.6	Low	70.4	Confident	22 Å²	22	65 Å²	65	23%	0.227	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-70.1	118.4	170.2	0	0	0	0	0	110.6	V370 G402	V370-G404 WeakPolarHBondContact CB-O 3.3Å; V370-G404 VanDerWaalsContact CG2-O 3.27Å; V370-G404 WeakPolarHBondContact CG2-O 3.47Å; V370-G404 PolarHBondContact N-O 2.94Å; G402-G404 PolarHBondContact O-N 3.07Å
405	L	72.4	Confident	72.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.6	176.6	-63.8	-177.4	0	0	0	109.5	I367 C368 P369 S397 T399 Q403 F460	I367-L405 HydrophobicContact CG2-CB 4.21Å; I367-L405 HydrophobicContact CG2-CD1 3.72Å; I367-L405 HydrophobicContact CG2-CG 4.4Å; C368-L405 CarbonylContact O-C 3.35Å; C368-L405 WeakPolarHBondContact O-CA 3.48Å; P369-L405 HydrophobicContact CB-CD2 4.02Å; P369-L405 HydrophobicContact CG-CD2 3.94Å; S397-L405 WeakPolarHBondContact CB-O 3.46Å; S397-L405 PolarHBondContact O-N 3.46Å; T399-L405 HydrophobicContact CG2-CD1 3.23Å; T399-L405 HydrophobicContact CG2-CG 3.79Å; Q403-L405 HydrophobicContact CG-CD2 4.07Å; Q403-L405 PolarHBondContact O-N 3.21Å; L405-F460 HydrophobicContact CB-CE2 4.48Å; L405-F460 HydrophobicContact CD1-CE2 3.74Å
406	Q	78.3	Confident	75.2	Confident	49 Å²	49	53.2 Å²	53.2	23%	0.229	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	125.2	168.5	178.9	170.2	20.7	0	0	108.4	C368 V370	C368-Q406 PolarHBondContact N-O 3.45Å; C368-Q406 PolarHBondContact O-N 2.9Å; V370-Q406 HydrophobicContact CG2-CB 3.97Å
407	I	87.2	Confident	77	Confident	18 Å²	18	49.2 Å²	49.2	9%	0.092	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.1	178	-55	174.3	0	0	0	108.7	L362 S366 T409 F460 V464	L362-I407 HydrophobicContact CD1-CG2 3.69Å; L362-I407 HydrophobicContact CD2-CD1 4.17Å; L362-I407 HydrophobicContact CD2-CG2 3.88Å; L362-I407 HydrophobicContact CG-CG2 4.32Å; S366-I407 CarbonylContact O-C 3.55Å; S366-I407 VanDerWaalsContact O-CA 3.3Å; S366-I407 WeakPolarHBondContact O-CA 3.39Å; I407-T409 HydrophobicContact CG2-CG2 4.36Å; I407-F460 HydrophobicContact CD1-CD2 4.28Å; I407-F460 HydrophobicContact CD1-CE1 4.33Å; I407-F460 HydrophobicContact CD1-CE2 3.79Å; I407-F460 HydrophobicContact CD1-CZ 3.82Å; I407-F460 VanDerWaalsContact CD1-O 3.29Å; I407-F460 WeakPolarHBondContact CD1-O 3.48Å; I407-V464 HydrophobicContact CB-CG2 4.28Å; I407-V464 HydrophobicContact CD1-CG2 3.64Å; I407-V464 HydrophobicContact CG2-CG2 3.94Å
408	T	86.6	Confident	78.5	Confident	86 Å²	86	49.2 Å²	49.2	53%	0.528	30%	0.296	S	S	.	.			trans	-118.7	100.2	174	-53.6	0	0	0	0	108.6	S366	S366-T408 WeakPolarHBondContact CB-O 3.48Å; S366-T408 PolarHBondContact O-N 2.95Å; S366-T408 PolarHBondContact OG-O 3.38Å
409	T	84.6	Confident	80.1	Confident	39 Å²	39	46.7 Å²	46.7	24%	0.239	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-71.6	153	-179	48.7	0	0	0	0	112.1	L362 I407 P415 V464 P465	L362-T409 HydrophobicContact CD1-CG2 4.45Å; I407-T409 HydrophobicContact CG2-CG2 4.36Å; T409-P415 HydrophobicContact CG2-CG 4.23Å; T409-V464 HydrophobicContact CG2-CB 4.42Å; T409-V464 HydrophobicContact CG2-CG1 3.57Å; T409-P465 HydrophobicContact CG2-CG 4.3Å; T409-P465 WeakPolarHBondContact OG1-CD 3.45Å; T409-P465 VanDerWaalsContact OG1-CG 3.31Å; T409-P465 WeakPolarHBondContact OG1-CG 3.3Å
410	I	86.4	Confident	81.7	Confident	85 Å²	85	46.3 Å²	46.3	44%	0.436	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-84.4	132.6	174	-60.2	174.3	0	0	0	108.1	P363 G412 T413	P363-I410 HydrophobicContact CG-CD1 3.88Å; I410-G412 PolarHBondContact O-N 3.04Å; I410-T413 HydrophobicContact CB-CG2 3.83Å; I410-T413 HydrophobicContact CG2-CG2 3.93Å; I410-T413 PolarHBondContact O-N 2.79Å; I410-T413 PolarHBondContact O-OG1 3.38Å
411	E	86.4	Confident	83.3	Confident	190 Å²	190	42.8 Å²	42.8	89%	0.888	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	137.8	178	-69.4	-173.5	171.4	0	0	111.9	T413	E411-T413 PolarHBondContact O-N 3.02Å
412	G	87.3	Confident	84.6	Confident	70 Å²	70	37.7 Å²	37.7	72%	0.722	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.3	6.4	-179.9	0	0	0	0	0	115.1	I410	I410-G412 PolarHBondContact O-N 3.04Å
413	T	93.2	Very high	85.6	Confident	22 Å²	22	43.6 Å²	43.6	14%	0.135	24%	0.24	C	C	.	.			trans	-97.5	153.9	170.1	65.9	0	0	0	0	111.2	D359 I410 E411	D359-T413 WeakPolarHBondContact OD1-CA 3.29Å; I410-T413 HydrophobicContact CB-CG2 3.83Å; I410-T413 HydrophobicContact CG2-CG2 3.93Å; I410-T413 PolarHBondContact O-N 2.79Å; I410-T413 PolarHBondContact O-OG1 3.38Å; E411-T413 PolarHBondContact O-N 3.02Å
414	H	95.9	Very high	86.2	Confident	57 Å²	57	41.5 Å²	41.5	26%	0.264	23%	0.232	S	C	.	.			trans	-127.8	76.4	179	-52.2	83	0	0	0	109.9	D359 L416 D466 R468	D359-H414 CarbonylContact O-C 3.57Å; D359-H414 PolarHBondContact O-N 2.69Å; D359-H414 IonicContact OD1-CE1 3.67Å; D359-H414 IonicContact OD1-CG 2.65Å; D359-H414 PolarHBondContact OD1-N 3.31Å; D359-H414 IonicContact OD1-ND1 3.52Å; D359-H414 PolarHBondContact OD1-ND1 3.3Å; D359-H414 IonicContact OD2-ND1 2.67Å; H414-L416 PolarHBondContact O-N 3.05Å; H414-D466 PolarHBondContact CD2-O 2.9Å; H414-R468 HydrophobicContact CB-CG 4.22Å; H414-R468 VanDerWaalsContact CB-CZ 3.48Å; H414-R468 VanDerWaalsContact CG-NH2 3.28Å; H414-R468 PolarHBondContact ND1-NH2 3.03Å
415	P	96.5	Very high	86.1	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.006	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-50.6	136.3	-175.1	-28.8	36.3	0	0	0	112.2	L362 T409 F461 V464 F467 R468	L362-P415 HydrophobicContact CB-CB 4.39Å; L362-P415 HydrophobicContact CD1-CG 4.26Å; T409-P415 HydrophobicContact CG2-CG 4.23Å; P415-F461 HydrophobicContact CB-CE1 3.95Å; P415-V464 HydrophobicContact CB-CG1 4.18Å; P415-V464 HydrophobicContact CG-CG1 4Å; P415-F467 VanDerWaalsContact O-CA 3.32Å; P415-F467 WeakPolarHBondContact O-CA 3.37Å; P415-F467 VanDerWaalsContact O-CB 3.27Å; P415-F467 WeakPolarHBondContact O-CB 3.36Å; P415-R468 PolarHBondContact O-N 3.4Å
416	L	97.9	Very high	85.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.2	-174.8	-171.3	67.2	0	0	0	110.8	H360 H414 V418 L441 Q445 R468 L470 L526 I529	H360-L416 HydrophobicContact CB-CB 3.93Å; H360-L416 PolarHBondContact O-N 3.06Å; H414-L416 PolarHBondContact O-N 3.05Å; L416-V418 HydrophobicContact CD2-CG2 3.98Å; L416-V418 HydrophobicContact CG-CG2 3.99Å; L416-L441 HydrophobicContact CB-CD1 4.48Å; L416-L441 HydrophobicContact CD2-CD1 4.25Å; L416-Q445 WeakPolarHBondContact O-CB 3.49Å; L416-Q445 PolarHBondContact O-NE2 3.36Å; L416-R468 HydrophobicContact CD1-CB 3.75Å; L416-L470 HydrophobicContact CD1-CB 3.98Å; L416-L470 HydrophobicContact CD2-CB 4.15Å; L416-L470 HydrophobicContact CD2-CD2 4.2Å; L416-L470 HydrophobicContact CG-CB 4.18Å; L416-L526 HydrophobicContact CD2-CD2 3.42Å; L416-L526 VanDerWaalsContact CD2-CD2 3.42Å; L416-I529 HydrophobicContact CD1-CG2 4.47Å; L416-I529 HydrophobicContact CD2-CD1 4.21Å
417	L	97.9	Very high	84.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120.7	169.1	174.5	58.2	0	0	0	109.4	F419 Y447 L458 F461 F467 R468 V469 L470	L417-F419 HydrophobicContact CD1-CZ 4.2Å; L417-F419 HydrophobicContact CD2-CE2 3.63Å; L417-F419 HydrophobicContact CD2-CZ 3.62Å; L417-F419 HydrophobicContact CG-CD2 4.42Å; L417-F419 HydrophobicContact CG-CE2 3.78Å; L417-F419 HydrophobicContact CG-CZ 3.91Å; L417-Y447 HydrophobicContact CD1-CD2 3.52Å; L417-Y447 HydrophobicContact CD1-CE2 3.56Å; L417-L458 HydrophobicContact CD2-CD2 4.13Å; L417-F461 HydrophobicContact CB-CD1 4.08Å; L417-F461 HydrophobicContact CB-CD2 4.21Å; L417-F461 HydrophobicContact CB-CE1 3.94Å; L417-F461 HydrophobicContact CB-CE2 4.11Å; L417-F461 HydrophobicContact CB-CG 4.19Å; L417-F461 HydrophobicContact CB-CZ 3.94Å; L417-F461 HydrophobicContact CD1-CD2 3.83Å; L417-F461 HydrophobicContact CD1-CE2 3.77Å; L417-F461 HydrophobicContact CD1-CZ 4.4Å; L417-F461 HydrophobicContact CD2-CB 4.24Å; L417-F461 HydrophobicContact CD2-CD2 4.18Å; L417-F461 HydrophobicContact CD2-CG 4.15Å; L417-F461 HydrophobicContact CG-CD2 4.3Å; L417-F461 HydrophobicContact CG-CE2 4.42Å; L417-F467 HydrophobicContact CB-CD2 4.16Å; L417-F467 HydrophobicContact CB-CE2 4.35Å; L417-F467 HydrophobicContact CD2-CE2 3.99Å; L417-R468 PolarHBondContact N-O 3.5Å; L417-V469 HydrophobicContact CB-CG2 4.4Å; L417-V469 HydrophobicContact CD2-CG2 4.36Å; L417-V469 CarbonylContact O-C 3.47Å; L417-V469 WeakPolarHBondContact O-CA 3.47Å; L417-L470 PolarHBondContact O-N 3.32Å
418	V	97.6	Very high	83.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	120.5	-174.5	-175	0	0	0	0	110.7	L416 V420 F437 L441 Q445 V446 Y447 L470	L416-V418 HydrophobicContact CD2-CG2 3.98Å; L416-V418 HydrophobicContact CG-CG2 3.99Å; V418-V420 HydrophobicContact CG1-CG2 3.99Å; V418-F437 HydrophobicContact CG1-CB 4.45Å; V418-F437 HydrophobicContact CG1-CD2 3.83Å; V418-F437 HydrophobicContact CG1-CE2 4.19Å; V418-F437 HydrophobicContact CG1-CG 4.11Å; V418-F437 HydrophobicContact CG2-CD1 4.48Å; V418-L441 HydrophobicContact CG2-CD1 3.52Å; V418-Q445 PolarHBondContact N-O 3.32Å; V418-V446 HydrophobicContact CB-CG1 4.3Å; V418-V446 HydrophobicContact CB-CG2 4.36Å; V418-V446 HydrophobicContact CG1-CG1 4.33Å; V418-V446 WeakPolarHBondContact O-CA 3.29Å; V418-Y447 PolarHBondContact O-N 3.47Å; V418-L470 WeakPolarHBondContact CA-O 3.41Å; V418-L470 HydrophobicContact CG1-CB 4.46Å; V418-L470 HydrophobicContact CG1-CD2 4.11Å; V418-L470 HydrophobicContact CG1-CG 4.33Å; V418-L470 HydrophobicContact CG2-CB 4.23Å; V418-L470 HydrophobicContact CG2-CD2 4.22Å
419	F	96.8	Very high	81.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	130.5	170.3	-67.9	-66.5	0	0	0	110.4	L417 Y447 L449 P454 L458 V469 L470 C472 I481	L417-F419 HydrophobicContact CD1-CZ 4.2Å; L417-F419 HydrophobicContact CD2-CE2 3.63Å; L417-F419 HydrophobicContact CD2-CZ 3.62Å; L417-F419 HydrophobicContact CG-CD2 4.42Å; L417-F419 HydrophobicContact CG-CE2 3.78Å; L417-F419 HydrophobicContact CG-CZ 3.91Å; F419-Y447 HydrophobicContact CD1-CG 4.46Å; F419-Y447 HydrophobicContact CE1-CD2 4.42Å; F419-Y447 HydrophobicContact CE1-CG 4.17Å; F419-L449 HydrophobicContact CB-CD1 4.04Å; F419-L449 HydrophobicContact CB-CD2 3.96Å; F419-L449 HydrophobicContact CB-CG 3.99Å; F419-L449 HydrophobicContact CD1-CD2 3.56Å; F419-L449 HydrophobicContact CD1-CG 4.33Å; F419-L449 HydrophobicContact CE1-CD2 4.35Å; F419-L449 HydrophobicContact CG-CD2 3.98Å; F419-P454 HydrophobicContact CE1-CB 4.17Å; F419-P454 WeakPolarHBondContact CE1-O 3.39Å; F419-P454 HydrophobicContact CZ-CB 4.18Å; F419-P454 VanDerWaalsContact CZ-O 3.31Å; F419-P454 WeakPolarHBondContact CZ-O 3.38Å; F419-L458 HydrophobicContact CE2-CD2 4.38Å; F419-L458 HydrophobicContact CZ-CD2 4.41Å; F419-L458 HydrophobicContact CZ-CG 4.19Å; F419-V469 HydrophobicContact CD2-CG1 3.73Å; F419-V469 HydrophobicContact CE2-CG1 3.94Å; F419-L470 PolarHBondContact N-O 3.27Å; F419-C472 WeakPolarHBondContact O-CB 3.45Å; F419-C472 PolarHBondContact O-N 3.35Å; F419-I481 HydrophobicContact CB-CD1 3.62Å; F419-I481 HydrophobicContact CD2-CD1 3.79Å; F419-I481 HydrophobicContact CD2-CG1 4.21Å; F419-I481 HydrophobicContact CD2-CG2 4.3Å; F419-I481 HydrophobicContact CE2-CG2 4.43Å; F419-I481 HydrophobicContact CG-CD1 3.92Å; F419-I481 HydrophobicContact CG-CG1 4.46Å
420	V	92.6	Very high	80.8	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.4	178.1	-171.8	0	0	0	0	110.2	V418 P422 I433 Y434 V446 Y447 L449 C472	V418-V420 HydrophobicContact CG1-CG2 3.99Å; V420-P422 VanDerWaalsContact O-CD 3.28Å; V420-P422 WeakPolarHBondContact O-CD 3.48Å; V420-I433 HydrophobicContact CG1-CG2 4.39Å; V420-I433 HydrophobicContact CG2-CG2 4.35Å; V420-Y434 HydrophobicContact CB-CD2 4.17Å; V420-Y434 HydrophobicContact CG2-CD2 4.1Å; V420-V446 HydrophobicContact CG2-CG1 4.41Å; V420-Y447 PolarHBondContact N-O 2.87Å; V420-L449 PolarHBondContact O-N 3.09Å; V420-C472 HydrophobicContact CB-CB 4.38Å; V420-C472 HydrophobicContact CG1-CB 4.22Å; V420-C472 HydrophobicContact CG2-CB 4.17Å
421	N	88.6	Confident	79.5	Confident	25 Å²	25	46.7 Å²	46.7	13%	0.134	26%	0.259	C	S	.	.			trans	-89.1	105.2	167.8	-174.2	-14.4	0	0	0	109.4	K423 S424 L449 C472 T477	N421-K423 PolarHBondContact O-N 3.23Å; N421-K423 WeakPolarHBondContact OD1-CB 3.41Å; N421-K423 PolarHBondContact OD1-N 2.88Å; N421-K423 VanDerWaalsContact OD1-N 3.07Å; N421-S424 PolarHBondContact ND2-OG 3.29Å; N421-S424 PolarHBondContact O-N 3.45Å; N421-L449 HydrophobicContact CB-CD1 4.09Å; N421-C472 PolarHBondContact N-O 3.41Å; N421-T477 HydrophobicContact CB-CG2 3.85Å; N421-T477 PolarHBondContact ND2-OG1 3.41Å
422	P	76.6	Confident	78.8	Confident	13 Å²	13	46 Å²	46	8%	0.084	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-24.7	-177.1	29.1	-36.6	0	0	0	113.2	V420 S424 E430 N448 A450	V420-P422 VanDerWaalsContact O-CD 3.28Å; V420-P422 WeakPolarHBondContact O-CD 3.48Å; P422-S424 PolarHBondContact O-N 3.39Å; P422-E430 HydrophobicContact CB-CB 3.72Å; P422-E430 HydrophobicContact CB-CG 4.32Å; P422-N448 VanDerWaalsContact CD-OD1 3.22Å; P422-N448 WeakPolarHBondContact CD-OD1 3.47Å; P422-N448 VanDerWaalsContact CG-OD1 3.3Å; P422-N448 WeakPolarHBondContact CG-OD1 3.34Å; P422-A450 HydrophobicContact CG-CB 3.47Å; P422-A450 VanDerWaalsContact CG-CB 3.47Å
423	K	73.7	Confident	78.7	Confident	177 Å²	177	42.7 Å²	42.7	77%	0.77	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-18.2	178.6	-60.8	-175.5	177.9	-178.9	0	112.4	N421	N421-K423 PolarHBondContact O-N 3.23Å; N421-K423 WeakPolarHBondContact OD1-CB 3.41Å; N421-K423 PolarHBondContact OD1-N 2.88Å; N421-K423 VanDerWaalsContact OD1-N 3.07Å
424	S	70.4	Confident	78.4	Confident	16 Å²	16	43.7 Å²	43.7	11%	0.112	22%	0.216	C	C	.	.	S	Bend	trans	-80.2	149.8	179.6	-66.3	0	0	0	0	112.7	N421 P422	N421-S424 PolarHBondContact ND2-OG 3.29Å; N421-S424 PolarHBondContact O-N 3.45Å; P422-S424 PolarHBondContact O-N 3.39Å
425	G	61.2	Low	77.8	Confident	15 Å²	15	43.7 Å²	43.7	16%	0.155	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	29.7	168.5	0	0	0	0	0	116.4	Q428 L501	G425-Q428 WeakPolarHBondContact O-CB 3.48Å; G425-Q428 VanDerWaalsContact O-CG 3.24Å; G425-Q428 WeakPolarHBondContact O-CG 3.34Å; G425-Q428 PolarHBondContact O-N 3.15Å; G425-L501 WeakPolarHBondContact CA-O 3.29Å; G425-L501 PolarHBondContact N-O 3.22Å
426	G	60.7	Low	77.4	Confident	44 Å²	44	47.4 Å²	47.4	45%	0.454	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	44.8	178.8	0	0	0	0	0	112.8	Q428	G426-Q428 PolarHBondContact O-N 3.24Å
427	K	60.1	Low	77.2	Confident	134 Å²	134	47.4 Å²	47.4	58%	0.583	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.9	14.1	-177.6	-52.9	-175.5	179.2	-174.8	0	115	E183 G429	E183-K427 IonicContact OE2-NZ 3.81Å; E183-K427 PolarHBondContact OE2-NZ 3.11Å; K427-G429 VanDerWaalsContact C-N 3.29Å; K427-G429 PolarHBondContact O-N 2.86Å
428	Q	57.4	Low	76.8	Confident	68 Å²	68	48.1 Å²	48.1	32%	0.318	23%	0.233	S	C	.	.	H	α-helix	trans	-70	-23.8	173.9	-68.5	-175.9	18.3	0	0	113.5	G425 G426 R432	G425-Q428 WeakPolarHBondContact O-CB 3.48Å; G425-Q428 VanDerWaalsContact O-CG 3.24Å; G425-Q428 WeakPolarHBondContact O-CG 3.34Å; G425-Q428 PolarHBondContact O-N 3.15Å; G426-Q428 PolarHBondContact O-N 3.24Å; Q428-R432 PolarHBondContact O-N 3.11Å
429	G	58.2	Low	76.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.236	C	C	.	.	I	π-helix	trans	-61.1	-46.1	-176.8	0	0	0	0	0	113.5	K427 Y434	K427-G429 VanDerWaalsContact C-N 3.29Å; K427-G429 PolarHBondContact O-N 2.86Å; G429-Y434 WeakPolarHBondContact O-CB 3.41Å; G429-Y434 PolarHBondContact O-N 2.89Å
430	E	61.8	Low	76.5	Confident	93 Å²	93	48.9 Å²	48.9	44%	0.435	24%	0.236	S	C	.	.	I	π-helix	trans	-76.3	-48.9	-173	-168.5	173.6	-169.4	0	0	113.8	P422	P422-E430 HydrophobicContact CB-CB 3.72Å; P422-E430 HydrophobicContact CB-CG 4.32Å
431	S	59.3	Low	76.6	Confident	55 Å²	55	48.9 Å²	48.9	39%	0.385	24%	0.236	S	C	.	.	I	π-helix	trans	-83.2	-28.1	-169.2	65.2	0	0	0	0	114	R435	S431-R435 WeakPolarHBondContact O-CD 3.4Å
432	R	70.4	Confident	76.8	Confident	175 Å²	175	47.7 Å²	47.7	66%	0.66	23%	0.23	S	C	*	.	I	π-helix	trans	-111.2	-49.8	-174.4	-66.4	-172.4	178.1	-174.2	0.7	113.5	Q428 K436	Q428-R432 PolarHBondContact O-N 3.11Å; R432-K436 WeakPolarHBondContact O-CB 3.33Å; R432-K436 PolarHBondContact O-N 2.92Å
433	I	86	Confident	77.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-79.8	-55.4	-169.2	-65	171.2	0	0	0	110.8	V420 R435 K436 F437 C472 L499 L501 Y517	V420-I433 HydrophobicContact CG1-CG2 4.39Å; V420-I433 HydrophobicContact CG2-CG2 4.35Å; I433-R435 PolarHBondContact O-N 3.11Å; I433-K436 PolarHBondContact O-N 3.08Å; I433-K436 VanDerWaalsContact O-N 3.14Å; I433-F437 HydrophobicContact CG2-CD2 3.6Å; I433-F437 HydrophobicContact CG2-CE2 3.53Å; I433-F437 WeakPolarHBondContact O-CD2 3.45Å; I433-F437 PolarHBondContact O-N 2.85Å; I433-C472 HydrophobicContact CG2-CB 4.35Å; I433-L499 HydrophobicContact CD1-CD2 3.96Å; I433-L499 HydrophobicContact CG2-CD2 3.95Å; I433-L501 HydrophobicContact CD1-CD1 3.64Å; I433-L501 HydrophobicContact CD1-CD2 3.37Å; I433-L501 HydrophobicContact CD1-CG 4.13Å; I433-Y517 HydrophobicContact CD1-CD1 3.88Å; I433-Y517 HydrophobicContact CD1-CE1 3.86Å; I433-Y517 HydrophobicContact CG1-CE1 4.04Å
434	Y	86.9	Confident	78.3	Confident	44 Å²	44	40.5 Å²	40.5	17%	0.173	20%	0.197	C	C	.	.	I	π-helix	trans	-52.2	-53.5	179.7	-179	-106	0	0	0	112	V420 G429 K436 F437 Q438 V446 N448	V420-Y434 HydrophobicContact CB-CD2 4.17Å; V420-Y434 HydrophobicContact CG2-CD2 4.1Å; G429-Y434 WeakPolarHBondContact O-CB 3.41Å; G429-Y434 PolarHBondContact O-N 2.89Å; Y434-K436 VanDerWaalsContact C-N 3.32Å; Y434-K436 PolarHBondContact O-N 3.16Å; Y434-F437 PolarHBondContact O-N 3.28Å; Y434-Q438 HydrophobicContact CE1-CG 4.29Å; Y434-Q438 VanDerWaalsContact CE1-OE1 3.27Å; Y434-Q438 WeakPolarHBondContact O-CG 3.25Å; Y434-Q438 PolarHBondContact O-N 3.3Å; Y434-Q438 PolarHBondContact OH-NE2 3.02Å; Y434-V446 HydrophobicContact CD2-CG1 3.65Å; Y434-V446 HydrophobicContact CE2-CB 4.46Å; Y434-V446 HydrophobicContact CE2-CG1 3.77Å; Y434-N448 HydrophobicContact CD2-CB 4.34Å; Y434-N448 HydrophobicContact CE2-CB 3.87Å
435	R	82.9	Confident	79.5	Confident	57 Å²	57	39.8 Å²	39.8	22%	0.215	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-34.1	-179.3	-58.7	-177.3	-163.9	158.9	6.9	113.4	R242 S431 I433 Y439	R242-R435 VanDerWaalsContact NH1-NH2 3.16Å; R242-R435 VanDerWaalsContact NH2-CZ 3.33Å; S431-R435 WeakPolarHBondContact O-CD 3.4Å; I433-R435 PolarHBondContact O-N 3.11Å; R435-Y439 PolarHBondContact O-N 3.36Å
436	K	88.4	Confident	81	Confident	78 Å²	78	39.3 Å²	39.3	34%	0.339	19%	0.185	S	C	.	.	H	α-helix	trans	-73	-38.5	179	-174.5	64.2	176.9	174.6	0	110.5	R432 I433 Y434 Y439 L440 L522	R432-K436 WeakPolarHBondContact O-CB 3.33Å; R432-K436 PolarHBondContact O-N 2.92Å; I433-K436 PolarHBondContact O-N 3.08Å; I433-K436 VanDerWaalsContact O-N 3.14Å; Y434-K436 VanDerWaalsContact C-N 3.32Å; Y434-K436 PolarHBondContact O-N 3.16Å; K436-Y439 WeakPolarHBondContact O-CB 3.45Å; K436-Y439 PolarHBondContact O-N 3Å; K436-L440 HydrophobicContact CD-CD1 4.43Å; K436-L440 HydrophobicContact CD-CG 4.37Å; K436-L440 HydrophobicContact CG-CD1 4.05Å; K436-L440 HydrophobicContact CG-CG 4.37Å; K436-L440 VanDerWaalsContact O-CG 3.3Å; K436-L440 WeakPolarHBondContact O-CG 3.44Å; K436-L440 PolarHBondContact O-N 3.31Å; K436-L522 HydrophobicContact CB-CD1 3.71Å; K436-L522 HydrophobicContact CG-CD1 3.55Å; K436-L522 HydrophobicContact CG-CG 4.3Å
437	F	93.3	Very high	82.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.7	-39.2	172.3	-77.7	-59	0	0	0	112.5	V418 I433 Y434 Y439 L440 L441 V446 L470 L499 L522 L526	V418-F437 HydrophobicContact CG1-CB 4.45Å; V418-F437 HydrophobicContact CG1-CD2 3.83Å; V418-F437 HydrophobicContact CG1-CE2 4.19Å; V418-F437 HydrophobicContact CG1-CG 4.11Å; V418-F437 HydrophobicContact CG2-CD1 4.48Å; I433-F437 HydrophobicContact CG2-CD2 3.6Å; I433-F437 HydrophobicContact CG2-CE2 3.53Å; I433-F437 WeakPolarHBondContact O-CD2 3.45Å; I433-F437 PolarHBondContact O-N 2.85Å; Y434-F437 PolarHBondContact O-N 3.28Å; F437-Y439 PolarHBondContact O-N 2.92Å; F437-Y439 VanDerWaalsContact O-N 3.12Å; F437-L440 PolarHBondContact O-N 2.95Å; F437-L440 VanDerWaalsContact O-N 3.13Å; F437-L441 HydrophobicContact CD1-CD1 4.13Å; F437-L441 WeakPolarHBondContact O-CB 3.4Å; F437-L441 PolarHBondContact O-N 3.29Å; F437-V446 HydrophobicContact CB-CG1 3.91Å; F437-V446 HydrophobicContact CB-CG2 3.88Å; F437-L470 HydrophobicContact CE1-CD2 3.97Å; F437-L470 HydrophobicContact CE2-CD2 3.89Å; F437-L470 HydrophobicContact CZ-CD2 3.43Å; F437-L470 VanDerWaalsContact CZ-CD2 3.43Å; F437-L499 HydrophobicContact CE2-CD2 4.33Å; F437-L522 HydrophobicContact CD1-CD1 4.43Å; F437-L522 HydrophobicContact CD2-CD1 4.09Å; F437-L522 HydrophobicContact CE1-CB 4.35Å; F437-L522 HydrophobicContact CE1-CD1 4.18Å; F437-L522 HydrophobicContact CE2-CD1 3.86Å; F437-L522 HydrophobicContact CE2-CD2 4.41Å; F437-L522 HydrophobicContact CG-CD1 4.37Å; F437-L522 HydrophobicContact CZ-CB 4.38Å; F437-L522 HydrophobicContact CZ-CD1 3.89Å; F437-L522 HydrophobicContact CZ-CD2 4.15Å; F437-L522 HydrophobicContact CZ-CG 4.37Å; F437-L526 HydrophobicContact CE1-CD1 4.43Å; F437-L526 HydrophobicContact CE1-CD2 4.05Å; F437-L526 HydrophobicContact CE1-CG 4.27Å
438	Q	91	Very high	83.8	Confident	15 Å²	15	32.2 Å²	32.2	7%	0.07	14%	0.142	C	C	.	.	H	α-helix	trans	-61.6	-19.5	172.6	-72.1	-173.8	-50	0	0	113.8	F271 Y434 V446	F271-Q438 HydrophobicContact CD1-CB 4.2Å; F271-Q438 HydrophobicContact CE1-CB 4.05Å; F271-Q438 HydrophobicContact CE1-CG 4.48Å; Y434-Q438 HydrophobicContact CE1-CG 4.29Å; Y434-Q438 VanDerWaalsContact CE1-OE1 3.27Å; Y434-Q438 WeakPolarHBondContact O-CG 3.25Å; Y434-Q438 PolarHBondContact O-N 3.3Å; Y434-Q438 PolarHBondContact OH-NE2 3.02Å; Q438-V446 HydrophobicContact CG-CB 3.91Å; Q438-V446 HydrophobicContact CG-CG1 4.09Å; Q438-V446 HydrophobicContact CG-CG2 4.31Å
439	Y	91.6	Very high	85.3	Confident	15 Å²	15	29.1 Å²	29.1	6%	0.059	13%	0.128	C	C	.	.	H	α-helix	trans	-89.2	-36.8	173.7	176.1	-104	0	0	0	113	F271 K273 H332 V334 R435 K436 F437	F271-Y439 WeakPolarHBondContact O-CD2 3.4Å; F271-Y439 WeakPolarHBondContact O-CE2 3.42Å; K273-Y439 HydrophobicContact CB-CE2 4.45Å; K273-Y439 HydrophobicContact CD-CD2 4.09Å; K273-Y439 HydrophobicContact CD-CE2 4.13Å; K273-Y439 HydrophobicContact CG-CD2 3.81Å; K273-Y439 HydrophobicContact CG-CE2 3.35Å; H332-Y439 PolarHBondContact CD2-OH 3.33Å; H332-Y439 AromaticContact NE2-CZ 3.99Å; H332-Y439 PolarHBondContact NE2-OH 3.07Å; V334-Y439 HydrophobicContact CG1-CE2 4.17Å; R435-Y439 PolarHBondContact O-N 3.36Å; K436-Y439 WeakPolarHBondContact O-CB 3.45Å; K436-Y439 PolarHBondContact O-N 3Å; F437-Y439 PolarHBondContact O-N 2.92Å; F437-Y439 VanDerWaalsContact O-N 3.12Å
440	L	94.5	Very high	86.4	Confident	1 Å²	1	32 Å²	32	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-83.9	-28.8	-176	-69.1	-179.9	0	0	0	112.9	L357 K436 F437 L522 L523 L526	L357-L440 HydrophobicContact CD1-CB 4.11Å; L357-L440 HydrophobicContact CD1-CD2 4.24Å; L357-L440 WeakPolarHBondContact CD1-O 3.35Å; K436-L440 HydrophobicContact CD-CD1 4.43Å; K436-L440 HydrophobicContact CD-CG 4.37Å; K436-L440 HydrophobicContact CG-CD1 4.05Å; K436-L440 HydrophobicContact CG-CG 4.37Å; K436-L440 VanDerWaalsContact O-CG 3.3Å; K436-L440 WeakPolarHBondContact O-CG 3.44Å; K436-L440 PolarHBondContact O-N 3.31Å; F437-L440 PolarHBondContact O-N 2.95Å; F437-L440 VanDerWaalsContact O-N 3.13Å; L440-L522 HydrophobicContact CD1-CB 3.94Å; L440-L523 HydrophobicContact CD1-CD2 4.1Å; L440-L523 HydrophobicContact CD1-CG 4.33Å; L440-L523 HydrophobicContact CD2-CD2 3.72Å; L440-L523 HydrophobicContact CD2-CG 4.26Å; L440-L523 HydrophobicContact CG-CD2 4.5Å; L440-L526 HydrophobicContact CB-CD1 4.45Å; L440-L526 HydrophobicContact CD1-CD1 4.15Å
441	L	95.5	Very high	87.1	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	15%	0.153	C	C	.	.	S	Bend	trans	-117.8	172.5	-179.7	-57.2	176.3	0	0	0	109.7	H360 I361 L416 V418 F437 P443 V446	H360-L441 HydrophobicContact CB-CD2 3.77Å; I361-L441 HydrophobicContact CG1-CD2 3.91Å; L416-L441 HydrophobicContact CB-CD1 4.48Å; L416-L441 HydrophobicContact CD2-CD1 4.25Å; V418-L441 HydrophobicContact CG2-CD1 3.52Å; F437-L441 HydrophobicContact CD1-CD1 4.13Å; F437-L441 WeakPolarHBondContact O-CB 3.4Å; F437-L441 PolarHBondContact O-N 3.29Å; L441-P443 WeakPolarHBondContact O-CD 3.32Å; L441-V446 HydrophobicContact CB-CG2 4.45Å
442	N	93.9	Very high	87.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.15	C	C	.	.			trans	-63.8	128.4	169.2	-176.5	-28	0	0	0	108.8	T291 W335 L362 I367 R444 Q445	T291-N442 WeakPolarHBondContact CB-OD1 3.43Å; T291-N442 PolarHBondContact O-ND2 3.01Å; W335-N442 HydrophobicContact CH2-CB 4.28Å; W335-N442 HydrophobicContact CZ3-CB 4.15Å; L362-N442 VanDerWaalsContact O-CB 3.26Å; L362-N442 WeakPolarHBondContact O-CB 3.45Å; L362-N442 PolarHBondContact O-ND2 3.3Å; I367-N442 WeakPolarHBondContact CD1-ND2 3.48Å; N442-R444 PolarHBondContact O-N 3.19Å; N442-R444 PolarHBondContact OD1-N 2.87Å; N442-R444 VanDerWaalsContact OD1-N 3.13Å; N442-Q445 HydrophobicContact CB-CG 4.06Å; N442-Q445 VanDerWaalsContact CB-OE1 3.29Å; N442-Q445 VanDerWaalsContact N-OE1 3.08Å; N442-Q445 VanDerWaalsContact O-CB 3.27Å; N442-Q445 WeakPolarHBondContact O-CB 3.23Å; N442-Q445 WeakPolarHBondContact O-CG 3.34Å; N442-Q445 PolarHBondContact O-N 3.5Å
443	P	91.5	Very high	88.4	Confident	5 Å²	5	24.6 Å²	24.6	3%	0.032	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-51.7	-27.6	-179.9	-28.8	33.1	0	0	0	114.8	F271 I289 T291 L441 Q445 V446	F271-P443 HydrophobicContact CD1-CG 3.92Å; F271-P443 HydrophobicContact CE1-CB 4.2Å; F271-P443 HydrophobicContact CE1-CG 4.09Å; F271-P443 HydrophobicContact CG-CG 4.2Å; F271-P443 HydrophobicContact CZ-CB 4.41Å; F271-P443 HydrophobicContact CZ-CG 4.47Å; I289-P443 HydrophobicContact CD1-CG 3.99Å; T291-P443 HydrophobicContact CG2-CB 4.27Å; T291-P443 HydrophobicContact CG2-CG 3.99Å; L441-P443 WeakPolarHBondContact O-CD 3.32Å; P443-Q445 PolarHBondContact O-N 2.92Å; P443-V446 PolarHBondContact O-N 2.88Å
444	R	89.6	Confident	88.7	Confident	35 Å²	35	24.6 Å²	24.6	13%	0.132	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-67.6	-9.4	174.9	-67.8	-174.5	177	-84.3	-9	114.3	T291 N442 Y447 F460	T291-R444 PolarHBondContact OG1-NE 3.1Å; N442-R444 PolarHBondContact O-N 3.19Å; N442-R444 PolarHBondContact OD1-N 2.87Å; N442-R444 VanDerWaalsContact OD1-N 3.13Å; R444-Y447 WeakPolarHBondContact O-CE2 3.49Å; R444-Y447 PolarHBondContact O-OH 3.4Å; R444-F460 HydrophobicContact CB-CE1 3.86Å; R444-F460 HydrophobicContact CB-CZ 4.04Å; R444-F460 WeakPolarHBondContact O-CD1 3.45Å
445	Q	94.3	Very high	88.8	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-93.7	-5.9	177.5	-56.9	-179	-105.7	0	0	113.2	H360 L362 L416 V418 N442 P443 F461	H360-Q445 PolarHBondContact O-NE2 2.98Å; L362-Q445 HydrophobicContact CB-CG 4.09Å; L416-Q445 WeakPolarHBondContact O-CB 3.49Å; L416-Q445 PolarHBondContact O-NE2 3.36Å; V418-Q445 PolarHBondContact N-O 3.32Å; N442-Q445 HydrophobicContact CB-CG 4.06Å; N442-Q445 VanDerWaalsContact CB-OE1 3.29Å; N442-Q445 VanDerWaalsContact N-OE1 3.08Å; N442-Q445 VanDerWaalsContact O-CB 3.27Å; N442-Q445 WeakPolarHBondContact O-CB 3.23Å; N442-Q445 WeakPolarHBondContact O-CG 3.34Å; N442-Q445 PolarHBondContact O-N 3.5Å; P443-Q445 PolarHBondContact O-N 2.92Å; Q445-F461 HydrophobicContact CB-CE2 4.44Å; Q445-F461 HydrophobicContact CB-CZ 4.2Å; Q445-F461 HydrophobicContact CG-CE2 4.27Å; Q445-F461 HydrophobicContact CG-CZ 3.86Å
446	V	93.8	Very high	89	Confident	5 Å²	5	23.6 Å²	23.6	3%	0.03	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	114.6	-167.5	-168.6	0	0	0	0	110.3	V418 V420 Y434 F437 Q438 L441 P443	V418-V446 HydrophobicContact CB-CG1 4.3Å; V418-V446 HydrophobicContact CB-CG2 4.36Å; V418-V446 HydrophobicContact CG1-CG1 4.33Å; V418-V446 WeakPolarHBondContact O-CA 3.29Å; V420-V446 HydrophobicContact CG2-CG1 4.41Å; Y434-V446 HydrophobicContact CD2-CG1 3.65Å; Y434-V446 HydrophobicContact CE2-CB 4.46Å; Y434-V446 HydrophobicContact CE2-CG1 3.77Å; F437-V446 HydrophobicContact CB-CG1 3.91Å; F437-V446 HydrophobicContact CB-CG2 3.88Å; Q438-V446 HydrophobicContact CG-CB 3.91Å; Q438-V446 HydrophobicContact CG-CG1 4.09Å; Q438-V446 HydrophobicContact CG-CG2 4.31Å; L441-V446 HydrophobicContact CB-CG2 4.45Å; P443-V446 PolarHBondContact O-N 2.88Å
447	Y	91.9	Very high	89.1	Confident	21 Å²	21	19.9 Å²	19.9	8%	0.082	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135.7	-172.1	-70.9	-97.3	0	0	0	111.7	V400 L417 V418 F419 V420 R444 P456 G457 F460	V400-Y447 HydrophobicContact CG2-CE1 4.21Å; L417-Y447 HydrophobicContact CD1-CD2 3.52Å; L417-Y447 HydrophobicContact CD1-CE2 3.56Å; V418-Y447 PolarHBondContact O-N 3.47Å; F419-Y447 HydrophobicContact CD1-CG 4.46Å; F419-Y447 HydrophobicContact CE1-CD2 4.42Å; F419-Y447 HydrophobicContact CE1-CG 4.17Å; V420-Y447 PolarHBondContact N-O 2.87Å; R444-Y447 WeakPolarHBondContact O-CE2 3.49Å; R444-Y447 PolarHBondContact O-OH 3.4Å; Y447-P456 HydrophobicContact CE1-CB 4.16Å; Y447-G457 VanDerWaalsContact CE2-CA 3.49Å; Y447-F460 VanDerWaalsContact OH-CB 3.3Å; Y447-F460 WeakPolarHBondContact OH-CB 3.44Å
448	N	88.3	Confident	89.1	Confident	8 Å²	8	19.9 Å²	19.9	4%	0.043	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	113.3	170.8	-176.5	-22.5	0	0	0	109	P422 Y434 A450 K451 S452	P422-N448 VanDerWaalsContact CD-OD1 3.22Å; P422-N448 WeakPolarHBondContact CD-OD1 3.47Å; P422-N448 VanDerWaalsContact CG-OD1 3.3Å; P422-N448 WeakPolarHBondContact CG-OD1 3.34Å; Y434-N448 HydrophobicContact CD2-CB 4.34Å; Y434-N448 HydrophobicContact CE2-CB 3.87Å; N448-A450 VanDerWaalsContact C-N 3.28Å; N448-A450 PolarHBondContact O-N 2.89Å; N448-A450 WeakPolarHBondContact OD1-CB 3.29Å; N448-A450 PolarHBondContact OD1-N 3.41Å; N448-K451 HydrophobicContact CB-CB 4.45Å; N448-K451 HydrophobicContact CB-CD 4.27Å; N448-K451 HydrophobicContact CB-CG 4.23Å; N448-K451 PolarHBondContact O-N 3.13Å; N448-S452 PolarHBondContact O-N 3.25Å
449	L	87.8	Confident	89	Confident	4 Å²	4	21.7 Å²	21.7	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-66	-28.7	-176.7	-70.8	176.3	0	0	0	113.4	F419 V420 N421 K451 G453 P454 T477 W480 I481	F419-L449 HydrophobicContact CB-CD1 4.04Å; F419-L449 HydrophobicContact CB-CD2 3.96Å; F419-L449 HydrophobicContact CB-CG 3.99Å; F419-L449 HydrophobicContact CD1-CD2 3.56Å; F419-L449 HydrophobicContact CD1-CG 4.33Å; F419-L449 HydrophobicContact CE1-CD2 4.35Å; F419-L449 HydrophobicContact CG-CD2 3.98Å; V420-L449 PolarHBondContact O-N 3.09Å; N421-L449 HydrophobicContact CB-CD1 4.09Å; L449-K451 PolarHBondContact O-N 3.02Å; L449-G453 WeakPolarHBondContact O-CA 3.39Å; L449-G453 PolarHBondContact O-N 2.71Å; L449-P454 HydrophobicContact CD2-CB 4.16Å; L449-P454 HydrophobicContact CD2-CG 3.78Å; L449-T477 HydrophobicContact CD1-CG2 3.46Å; L449-T477 VanDerWaalsContact CD1-CG2 3.46Å; L449-W480 HydrophobicContact CB-CH2 4.29Å; L449-W480 HydrophobicContact CB-CZ3 3.83Å; L449-W480 HydrophobicContact CD1-CE3 4.38Å; L449-W480 HydrophobicContact CD1-CZ3 4.28Å; L449-W480 HydrophobicContact CD2-CZ3 4.45Å; L449-W480 HydrophobicContact CG-CZ3 4.44Å; L449-I481 HydrophobicContact CD1-CD1 4.16Å
450	A	82	Confident	88.9	Confident	60 Å²	60	21 Å²	21	50%	0.496	12%	0.12	S	C	.	.	H	α-helix	trans	-71.9	-19.7	179	0	0	0	0	0	112.9	P422 N448	P422-A450 HydrophobicContact CG-CB 3.47Å; P422-A450 VanDerWaalsContact CG-CB 3.47Å; N448-A450 VanDerWaalsContact C-N 3.28Å; N448-A450 PolarHBondContact O-N 2.89Å; N448-A450 WeakPolarHBondContact OD1-CB 3.29Å; N448-A450 PolarHBondContact OD1-N 3.41Å
451	K	75.6	Confident	88.8	Confident	106 Å²	106	21 Å²	21	46%	0.461	12%	0.119	S	C	.	.	H	α-helix	trans	-92.9	-44.8	-177.9	-66.8	-171.3	172.7	-160.3	0	113.6	E230 N448 L449	E230-K451 WeakPolarHBondContact OE1-CE 3.46Å; E230-K451 IonicContact OE1-NZ 3.35Å; E230-K451 PolarHBondContact OE1-NZ 3.4Å; E230-K451 IonicContact OE2-NZ 3.88Å; E230-K451 PolarHBondContact OE2-NZ 3.42Å; N448-K451 HydrophobicContact CB-CB 4.45Å; N448-K451 HydrophobicContact CB-CD 4.27Å; N448-K451 HydrophobicContact CB-CG 4.23Å; N448-K451 PolarHBondContact O-N 3.13Å; L449-K451 PolarHBondContact O-N 3.02Å
452	S	70	Confident	88.5	Confident	48 Å²	48	25 Å²	25	34%	0.336	14%	0.135	S	C	.	.	H	α-helix	trans	-137	2.8	-165.1	62.5	0	0	0	0	113.9	N448 P456	N448-S452 PolarHBondContact O-N 3.25Å; S452-P456 WeakPolarHBondContact O-CD 3.44Å; S452-P456 VanDerWaalsContact O-CG 3.29Å; S452-P456 WeakPolarHBondContact O-CG 3.37Å
453	G	86.9	Confident	88.1	Confident	14 Å²	14	28 Å²	28	14%	0.144	15%	0.151	C	C	.	.			trans	62	-170.7	-175.1	0	0	0	0	0	114	L449	L449-G453 WeakPolarHBondContact O-CA 3.39Å; L449-G453 PolarHBondContact O-N 2.71Å
454	P	92.6	Very high	88.1	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-80	-31.1	-177.6	-14.7	28.9	0	0	0	114.4	F419 L449 G457 L458 W480 I481 F484	F419-P454 HydrophobicContact CE1-CB 4.17Å; F419-P454 WeakPolarHBondContact CE1-O 3.39Å; F419-P454 HydrophobicContact CZ-CB 4.18Å; F419-P454 VanDerWaalsContact CZ-O 3.31Å; F419-P454 WeakPolarHBondContact CZ-O 3.38Å; L449-P454 HydrophobicContact CD2-CB 4.16Å; L449-P454 HydrophobicContact CD2-CG 3.78Å; P454-G457 PolarHBondContact O-N 3.39Å; P454-G457 VanDerWaalsContact O-N 3.15Å; P454-L458 HydrophobicContact CB-CD1 4.44Å; P454-L458 PolarHBondContact O-N 3.37Å; P454-W480 HydrophobicContact CG-CD2 4.18Å; P454-W480 HydrophobicContact CG-CZ2 4.24Å; P454-I481 HydrophobicContact CB-CG1 4.38Å; P454-I481 HydrophobicContact CG-CG1 4.25Å; P454-F484 HydrophobicContact CB-CB 3.9Å; P454-F484 HydrophobicContact CB-CD1 4.13Å; P454-F484 HydrophobicContact CB-CG 4.05Å; P454-F484 HydrophobicContact CG-CB 4.1Å; P454-F484 HydrophobicContact CG-CD1 4.1Å; P454-F484 HydrophobicContact CG-CD2 4.23Å; P454-F484 HydrophobicContact CG-CG 3.86Å
455	M	89.1	Confident	88.1	Confident	51 Å²	51	29.6 Å²	29.6	25%	0.251	17%	0.165	S	C	.	.	H	α-helix	trans	-58.2	-41	-167.6	-164.8	60.8	81.6	0	0	114.3	G457 L458 N459 F484 K487 A488	M455-G457 VanDerWaalsContact C-N 3.29Å; M455-G457 PolarHBondContact O-N 2.92Å; M455-L458 PolarHBondContact O-N 3.09Å; M455-N459 WeakPolarHBondContact O-CB 3.43Å; M455-N459 PolarHBondContact O-N 3.06Å; M455-F484 HydrophobicContact CB-CD1 3.94Å; M455-F484 HydrophobicContact CB-CE1 4.05Å; M455-F484 HydrophobicContact CE-CD1 3.71Å; M455-F484 HydrophobicContact CE-CE1 4.12Å; M455-F484 HydrophobicContact SD-CD1 4.49Å; M455-K487 HydrophobicContact CE-CB 4.15Å; M455-A488 HydrophobicContact SD-CB 4.3Å
456	P	87.8	Confident	88	Confident	28 Å²	28	33.2 Å²	33.2	18%	0.182	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-34.4	179.5	-24.6	36.1	0	0	0	113.6	V400 Y447 S452 F460	V400-P456 HydrophobicContact CG2-CB 3.87Å; Y447-P456 HydrophobicContact CE1-CB 4.16Å; S452-P456 WeakPolarHBondContact O-CD 3.44Å; S452-P456 VanDerWaalsContact O-CG 3.29Å; S452-P456 WeakPolarHBondContact O-CG 3.37Å; P456-F460 WeakPolarHBondContact O-CB 3.48Å; P456-F460 PolarHBondContact O-N 3.15Å
457	G	91.1	Very high	88.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-70	-42.5	174.9	0	0	0	0	0	112.6	Y447 P454 M455 N459 F460 F461	Y447-G457 VanDerWaalsContact CE2-CA 3.49Å; P454-G457 PolarHBondContact O-N 3.39Å; P454-G457 VanDerWaalsContact O-N 3.15Å; M455-G457 VanDerWaalsContact C-N 3.29Å; M455-G457 PolarHBondContact O-N 2.92Å; G457-N459 VanDerWaalsContact C-N 3.35Å; G457-F460 PolarHBondContact O-N 3.33Å; G457-F461 PolarHBondContact O-N 3.03Å
458	L	92.8	Very high	88.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-39.9	176.5	-65.3	173.3	0	0	0	111.8	L417 F419 P454 M455 F461 R462 F484 I485 A488	L417-L458 HydrophobicContact CD2-CD2 4.13Å; F419-L458 HydrophobicContact CE2-CD2 4.38Å; F419-L458 HydrophobicContact CZ-CD2 4.41Å; F419-L458 HydrophobicContact CZ-CG 4.19Å; P454-L458 HydrophobicContact CB-CD1 4.44Å; P454-L458 PolarHBondContact O-N 3.37Å; M455-L458 PolarHBondContact O-N 3.09Å; L458-F461 CarbonylContact O-C 3.56Å; L458-F461 PolarHBondContact O-N 3.06Å; L458-R462 PolarHBondContact O-N 3.37Å; L458-R462 VanDerWaalsContact O-N 3.07Å; L458-F484 HydrophobicContact CD1-CB 3.86Å; L458-F484 WeakPolarHBondContact CD1-O 3.18Å; L458-I485 HydrophobicContact CD1-CG1 4.21Å; L458-I485 HydrophobicContact CD2-CG1 3.87Å; L458-A488 HydrophobicContact CB-CB 4.21Å; L458-A488 HydrophobicContact CD1-CB 4.09Å
459	N	88.8	Confident	88.9	Confident	54 Å²	54	33.5 Å²	33.5	29%	0.289	19%	0.185	S	C	.	.	H	α-helix	trans	-66.5	-41.1	175.3	-75.6	-20	0	0	0	111.9	S397 M455 G457 F461 R462	S397-N459 WeakPolarHBondContact CA-O 3.28Å; M455-N459 WeakPolarHBondContact O-CB 3.43Å; M455-N459 PolarHBondContact O-N 3.06Å; G457-N459 VanDerWaalsContact C-N 3.35Å; N459-F461 VanDerWaalsContact C-N 3.3Å; N459-F461 PolarHBondContact O-N 3.31Å; N459-R462 VanDerWaalsContact O-CB 3.27Å; N459-R462 WeakPolarHBondContact O-CB 3.18Å; N459-R462 PolarHBondContact O-N 3.35Å
460	F	88.4	Confident	89.4	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-39.4	176.3	179.6	-117	0	0	0	111.8	L362 I367 S397 T399 L405 I407 R444 Y447 P456 G457 R462	L362-F460 HydrophobicContact CD2-CE1 4.17Å; L362-F460 HydrophobicContact CD2-CZ 4.27Å; I367-F460 HydrophobicContact CD1-CZ 4.2Å; S397-F460 VanDerWaalsContact CB-O 3.32Å; S397-F460 WeakPolarHBondContact CB-O 3.38Å; S397-F460 PolarHBondContact OG-O 3.49Å; T399-F460 HydrophobicContact CG2-CD2 4.28Å; T399-F460 HydrophobicContact CG2-CE2 4.44Å; L405-F460 HydrophobicContact CB-CE2 4.48Å; L405-F460 HydrophobicContact CD1-CE2 3.74Å; I407-F460 HydrophobicContact CD1-CD2 4.28Å; I407-F460 HydrophobicContact CD1-CE1 4.33Å; I407-F460 HydrophobicContact CD1-CE2 3.79Å; I407-F460 HydrophobicContact CD1-CZ 3.82Å; I407-F460 VanDerWaalsContact CD1-O 3.29Å; I407-F460 WeakPolarHBondContact CD1-O 3.48Å; R444-F460 HydrophobicContact CB-CE1 3.86Å; R444-F460 HydrophobicContact CB-CZ 4.04Å; R444-F460 WeakPolarHBondContact O-CD1 3.45Å; Y447-F460 VanDerWaalsContact OH-CB 3.3Å; Y447-F460 WeakPolarHBondContact OH-CB 3.44Å; P456-F460 WeakPolarHBondContact O-CB 3.48Å; P456-F460 PolarHBondContact O-N 3.15Å; G457-F460 PolarHBondContact O-N 3.33Å; F460-R462 VanDerWaalsContact C-N 3.33Å; F460-R462 PolarHBondContact O-N 3.08Å
461	F	92.9	Very high	90.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	3.7	178.8	-87	-112.1	0	0	0	114.8	P415 L417 Q445 G457 L458 N459 D463 V464 F467	P415-F461 HydrophobicContact CB-CE1 3.95Å; L417-F461 HydrophobicContact CB-CD1 4.08Å; L417-F461 HydrophobicContact CB-CD2 4.21Å; L417-F461 HydrophobicContact CB-CE1 3.94Å; L417-F461 HydrophobicContact CB-CE2 4.11Å; L417-F461 HydrophobicContact CB-CG 4.19Å; L417-F461 HydrophobicContact CB-CZ 3.94Å; L417-F461 HydrophobicContact CD1-CD2 3.83Å; L417-F461 HydrophobicContact CD1-CE2 3.77Å; L417-F461 HydrophobicContact CD1-CZ 4.4Å; L417-F461 HydrophobicContact CD2-CB 4.24Å; L417-F461 HydrophobicContact CD2-CD2 4.18Å; L417-F461 HydrophobicContact CD2-CG 4.15Å; L417-F461 HydrophobicContact CG-CD2 4.3Å; L417-F461 HydrophobicContact CG-CE2 4.42Å; Q445-F461 HydrophobicContact CB-CE2 4.44Å; Q445-F461 HydrophobicContact CB-CZ 4.2Å; Q445-F461 HydrophobicContact CG-CE2 4.27Å; Q445-F461 HydrophobicContact CG-CZ 3.86Å; G457-F461 PolarHBondContact O-N 3.03Å; L458-F461 CarbonylContact O-C 3.56Å; L458-F461 PolarHBondContact O-N 3.06Å; N459-F461 VanDerWaalsContact C-N 3.3Å; N459-F461 PolarHBondContact O-N 3.31Å; F461-D463 VanDerWaalsContact C-N 3.28Å; F461-D463 PolarHBondContact O-N 3.19Å; F461-V464 HydrophobicContact CB-CB 4.43Å; F461-V464 HydrophobicContact CB-CG2 4.33Å; F461-V464 HydrophobicContact CD1-CB 3.99Å; F461-V464 HydrophobicContact CD1-CG1 3.99Å; F461-V464 HydrophobicContact CD1-CG2 4.05Å; F461-V464 HydrophobicContact CE1-CG1 4.35Å; F461-V464 HydrophobicContact CG-CB 4.47Å; F461-V464 HydrophobicContact CG-CG2 4.22Å; F461-V464 WeakPolarHBondContact O-CB 3.28Å; F461-V464 PolarHBondContact O-N 2.7Å; F461-F467 HydrophobicContact CB-CD1 4.48Å; F461-F467 HydrophobicContact CB-CD2 4.16Å; F461-F467 HydrophobicContact CB-CE1 4.28Å; F461-F467 HydrophobicContact CB-CE2 3.96Å; F461-F467 HydrophobicContact CB-CG 4.4Å; F461-F467 HydrophobicContact CB-CZ 4Å; F461-F467 HydrophobicContact CD1-CB 3.68Å; F461-F467 HydrophobicContact CD1-CD1 4.36Å; F461-F467 AromaticContact CD1-CD2 3.53Å; F461-F467 HydrophobicContact CD1-CD2 3.53Å; F461-F467 HydrophobicContact CD1-CE2 4.17Å; F461-F467 AromaticContact CD1-CG 3.62Å; F461-F467 HydrophobicContact CD1-CG 3.62Å; F461-F467 HydrophobicContact CE1-CB 4.07Å; F461-F467 HydrophobicContact CE1-CD2 4.26Å; F461-F467 HydrophobicContact CE1-CG 4.41Å; F461-F467 HydrophobicContact CG-CD2 4.18Å; F461-F467 HydrophobicContact CG-CE2 4.38Å; F461-F467 HydrophobicContact CG-CG 4.47Å
462	R	89.6	Confident	91	Very high	85 Å²	85	25.4 Å²	25.4	32%	0.321	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-40.7	-171.8	-171.2	174.8	-164.6	97.8	15.5	113.9	L458 N459 F460 A488 N489 L490	L458-R462 PolarHBondContact O-N 3.37Å; L458-R462 VanDerWaalsContact O-N 3.07Å; N459-R462 VanDerWaalsContact O-CB 3.27Å; N459-R462 WeakPolarHBondContact O-CB 3.18Å; N459-R462 PolarHBondContact O-N 3.35Å; F460-R462 VanDerWaalsContact C-N 3.33Å; F460-R462 PolarHBondContact O-N 3.08Å; R462-A488 VanDerWaalsContact CZ-O 3.32Å; R462-A488 PolarHBondContact NH1-O 3.13Å; R462-A488 PolarHBondContact NH2-O 3.13Å; R462-N489 PolarHBondContact NH2-O 3.33Å; R462-L490 HydrophobicContact CB-CD2 4.36Å; R462-L490 HydrophobicContact CG-CD2 3.98Å
463	D	86.4	Confident	92	Very high	64 Å²	64	23.1 Å²	23.1	34%	0.342	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	7.9	-178.9	-58.3	-34	0	0	0	112.7	N396 S397 F461 P465	N396-D463 WeakPolarHBondContact CA-OD2 3.24Å; N396-D463 PolarHBondContact N-OD2 3.06Å; N396-D463 PolarHBondContact ND2-OD1 3.35Å; S397-D463 PolarHBondContact N-OD2 3.45Å; S397-D463 PolarHBondContact OG-N 3.25Å; F461-D463 VanDerWaalsContact C-N 3.28Å; F461-D463 PolarHBondContact O-N 3.19Å; D463-P465 WeakPolarHBondContact O-CD 3.36Å
464	V	90.8	Very high	92.1	Very high	5 Å²	5	23 Å²	23	3%	0.03	12%	0.12	C	C	.	.			trans	-89.9	112.7	179.7	-176.7	0	0	0	0	108.6	I407 T409 P415 F461 F467	I407-V464 HydrophobicContact CB-CG2 4.28Å; I407-V464 HydrophobicContact CD1-CG2 3.64Å; I407-V464 HydrophobicContact CG2-CG2 3.94Å; T409-V464 HydrophobicContact CG2-CB 4.42Å; T409-V464 HydrophobicContact CG2-CG1 3.57Å; P415-V464 HydrophobicContact CB-CG1 4.18Å; P415-V464 HydrophobicContact CG-CG1 4Å; F461-V464 HydrophobicContact CB-CB 4.43Å; F461-V464 HydrophobicContact CB-CG2 4.33Å; F461-V464 HydrophobicContact CD1-CB 3.99Å; F461-V464 HydrophobicContact CD1-CG1 3.99Å; F461-V464 HydrophobicContact CD1-CG2 4.05Å; F461-V464 HydrophobicContact CE1-CG1 4.35Å; F461-V464 HydrophobicContact CG-CB 4.47Å; F461-V464 HydrophobicContact CG-CG2 4.22Å; F461-V464 WeakPolarHBondContact O-CB 3.28Å; F461-V464 PolarHBondContact O-N 2.7Å; V464-F467 HydrophobicContact CB-CB 4.45Å; V464-F467 HydrophobicContact CB-CD1 4.46Å; V464-F467 HydrophobicContact CG1-CB 3.86Å; V464-F467 WeakPolarHBondContact O-CD1 3.16Å
465	P	90.3	Very high	91.9	Very high	67 Å²	67	24 Å²	24	44%	0.435	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	150.3	176.7	29.3	-36.1	0	0	0	111.7	T409 D463 F467	T409-P465 HydrophobicContact CG2-CG 4.3Å; T409-P465 WeakPolarHBondContact OG1-CD 3.45Å; T409-P465 VanDerWaalsContact OG1-CG 3.31Å; T409-P465 WeakPolarHBondContact OG1-CG 3.3Å; D463-P465 WeakPolarHBondContact O-CD 3.36Å; P465-F467 PolarHBondContact O-N 2.96Å
466	D	91.5	Very high	91.9	Very high	77 Å²	77	23.3 Å²	23.3	41%	0.412	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	26.5	169.5	-59.3	-36.6	0	0	0	116.2	H414 R492	H414-D466 PolarHBondContact CD2-O 2.9Å; D466-R492 IonicContact OD1-CZ 2.86Å; D466-R492 IonicContact OD1-NH1 2.71Å; D466-R492 PolarHBondContact OD1-NH1 3.49Å
467	F	96.3	Very high	92.1	Very high	9 Å²	9	22.5 Å²	22.5	4%	0.039	13%	0.126	C	C	.	.			trans	-70.6	155.9	176	79.5	-84.1	0	0	0	111.9	P415 L417 F461 V464 P465 V469 L490 P494	P415-F467 VanDerWaalsContact O-CA 3.32Å; P415-F467 WeakPolarHBondContact O-CA 3.37Å; P415-F467 VanDerWaalsContact O-CB 3.27Å; P415-F467 WeakPolarHBondContact O-CB 3.36Å; L417-F467 HydrophobicContact CB-CD2 4.16Å; L417-F467 HydrophobicContact CB-CE2 4.35Å; L417-F467 HydrophobicContact CD2-CE2 3.99Å; F461-F467 HydrophobicContact CB-CD1 4.48Å; F461-F467 HydrophobicContact CB-CD2 4.16Å; F461-F467 HydrophobicContact CB-CE1 4.28Å; F461-F467 HydrophobicContact CB-CE2 3.96Å; F461-F467 HydrophobicContact CB-CG 4.4Å; F461-F467 HydrophobicContact CB-CZ 4Å; F461-F467 HydrophobicContact CD1-CB 3.68Å; F461-F467 HydrophobicContact CD1-CD1 4.36Å; F461-F467 AromaticContact CD1-CD2 3.53Å; F461-F467 HydrophobicContact CD1-CD2 3.53Å; F461-F467 HydrophobicContact CD1-CE2 4.17Å; F461-F467 AromaticContact CD1-CG 3.62Å; F461-F467 HydrophobicContact CD1-CG 3.62Å; F461-F467 HydrophobicContact CE1-CB 4.07Å; F461-F467 HydrophobicContact CE1-CD2 4.26Å; F461-F467 HydrophobicContact CE1-CG 4.41Å; F461-F467 HydrophobicContact CG-CD2 4.18Å; F461-F467 HydrophobicContact CG-CE2 4.38Å; F461-F467 HydrophobicContact CG-CG 4.47Å; V464-F467 HydrophobicContact CB-CB 4.45Å; V464-F467 HydrophobicContact CB-CD1 4.46Å; V464-F467 HydrophobicContact CG1-CB 3.86Å; V464-F467 WeakPolarHBondContact O-CD1 3.16Å; P465-F467 PolarHBondContact O-N 2.96Å; F467-V469 HydrophobicContact CD2-CG2 4.18Å; F467-V469 HydrophobicContact CE2-CG2 3.69Å; F467-L490 HydrophobicContact CE1-CD1 4.23Å; F467-L490 HydrophobicContact CZ-CD1 3.85Å; F467-P494 HydrophobicContact CD1-CB 4.29Å; F467-P494 HydrophobicContact CD2-CB 3.96Å; F467-P494 HydrophobicContact CD2-CG 4.45Å; F467-P494 HydrophobicContact CE1-CB 4.03Å; F467-P494 HydrophobicContact CE1-CG 4.18Å; F467-P494 HydrophobicContact CE2-CB 3.65Å; F467-P494 HydrophobicContact CE2-CG 3.64Å; F467-P494 HydrophobicContact CG-CB 4.29Å; F467-P494 HydrophobicContact CZ-CB 3.71Å; F467-P494 HydrophobicContact CZ-CG 3.51Å; F467-P494 VanDerWaalsContact O-CB 3.28Å; F467-P494 WeakPolarHBondContact O-CB 3.43Å
468	R	97.9	Very high	92.3	Very high	30 Å²	30	22.5 Å²	22.5	11%	0.113	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	154.9	177	-61.6	175.9	-176.1	139.5	2	110.1	D359 H414 P415 L416 L417 P495 L759	D359-R468 IonicContact OD2-CZ 2.72Å; D359-R468 IonicContact OD2-NH1 3.5Å; D359-R468 PolarHBondContact OD2-NH1 3.21Å; D359-R468 IonicContact OD2-NH2 3.35Å; H414-R468 HydrophobicContact CB-CG 4.22Å; H414-R468 VanDerWaalsContact CB-CZ 3.48Å; H414-R468 VanDerWaalsContact CG-NH2 3.28Å; H414-R468 PolarHBondContact ND1-NH2 3.03Å; P415-R468 PolarHBondContact O-N 3.4Å; L416-R468 HydrophobicContact CD1-CB 3.75Å; L417-R468 PolarHBondContact N-O 3.5Å; R468-P495 HydrophobicContact CG-CG 4.1Å; R468-L759 HydrophobicContact CB-CD1 4.39Å; R468-L759 HydrophobicContact CG-CD1 4.29Å
469	V	98.5	Very high	92.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.8	175.5	177.3	0	0	0	0	110.3	L417 F419 F467 I481 P494 P495 V496 C497	L417-V469 HydrophobicContact CB-CG2 4.4Å; L417-V469 HydrophobicContact CD2-CG2 4.36Å; L417-V469 CarbonylContact O-C 3.47Å; L417-V469 WeakPolarHBondContact O-CA 3.47Å; F419-V469 HydrophobicContact CD2-CG1 3.73Å; F419-V469 HydrophobicContact CE2-CG1 3.94Å; F467-V469 HydrophobicContact CD2-CG2 4.18Å; F467-V469 HydrophobicContact CE2-CG2 3.69Å; V469-I481 HydrophobicContact CG1-CG2 4.16Å; V469-P494 HydrophobicContact CG2-CB 3.98Å; V469-P494 HydrophobicContact CG2-CG 3.69Å; V469-P495 PolarHBondContact N-O 3.45Å; V469-V496 HydrophobicContact CB-CG2 4.2Å; V469-V496 HydrophobicContact CG1-CG1 4.35Å; V469-V496 CarbonylContact O-C 3.54Å; V469-V496 WeakPolarHBondContact O-CA 3.45Å; V469-C497 PolarHBondContact O-N 3.45Å; V469-C497 PolarHBondContact O-SG 3.18Å
470	L	98.2	Very high	92.5	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.1	169.5	173.9	62.1	0	0	0	110.4	L416 L417 V418 F419 F437 C497 L499 I529	L416-L470 HydrophobicContact CD1-CB 3.98Å; L416-L470 HydrophobicContact CD2-CB 4.15Å; L416-L470 HydrophobicContact CD2-CD2 4.2Å; L416-L470 HydrophobicContact CG-CB 4.18Å; L417-L470 PolarHBondContact O-N 3.32Å; V418-L470 WeakPolarHBondContact CA-O 3.41Å; V418-L470 HydrophobicContact CG1-CB 4.46Å; V418-L470 HydrophobicContact CG1-CD2 4.11Å; V418-L470 HydrophobicContact CG1-CG 4.33Å; V418-L470 HydrophobicContact CG2-CB 4.23Å; V418-L470 HydrophobicContact CG2-CD2 4.22Å; F419-L470 PolarHBondContact N-O 3.27Å; F437-L470 HydrophobicContact CE1-CD2 3.97Å; F437-L470 HydrophobicContact CE2-CD2 3.89Å; F437-L470 HydrophobicContact CZ-CD2 3.43Å; F437-L470 VanDerWaalsContact CZ-CD2 3.43Å; L470-C497 WeakPolarHBondContact CA-SG 3.39Å; L470-C497 HydrophobicContact CD1-CB 4.45Å; L470-C497 WeakPolarHBondContact CD1-SG 3.14Å; L470-L499 HydrophobicContact CD1-CB 4.07Å; L470-I529 HydrophobicContact CD1-CD1 4.15Å; L470-I529 HydrophobicContact CD2-CD1 4.2Å
471	T	97.1	Very high	92.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	113	176	-60.1	0	0	0	0	110.8	T477 V478 I481 C497 I498 L499	T471-T477 HydrophobicContact CG2-CG2 3.78Å; T471-V478 HydrophobicContact CG2-CB 4.46Å; T471-V478 HydrophobicContact CG2-CG2 3.71Å; T471-I481 HydrophobicContact CG2-CD1 3.44Å; T471-I481 VanDerWaalsContact CG2-CD1 3.44Å; T471-I481 WeakPolarHBondContact OG1-CD1 3.11Å; T471-C497 PolarHBondContact N-O 3.48Å; T471-I498 WeakPolarHBondContact O-CA 3.28Å; T471-L499 PolarHBondContact O-N 3.1Å
472	C	94.5	Very high	93	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	96.8	173.1	-50.2	0	0	0	0	110	F419 V420 N421 I433 L499 L501	F419-C472 WeakPolarHBondContact O-CB 3.45Å; F419-C472 PolarHBondContact O-N 3.35Å; V420-C472 HydrophobicContact CB-CB 4.38Å; V420-C472 HydrophobicContact CG1-CB 4.22Å; V420-C472 HydrophobicContact CG2-CB 4.17Å; N421-C472 PolarHBondContact N-O 3.41Å; I433-C472 HydrophobicContact CG2-CB 4.35Å; C472-L499 HydrophobicContact CB-CB 4.2Å; C472-L499 HydrophobicContact CB-CD2 4.12Å; C472-L501 HydrophobicContact CB-CD1 3.84Å; C472-L501 HydrophobicContact CB-CG 4.43Å
473	G	91.3	Very high	93.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-168.7	-172.4	0	0	0	0	0	114	L499 L501 G502	G473-L499 PolarHBondContact N-O 3.29Å; G473-L499 VanDerWaalsContact N-O 3.16Å; G473-L501 PolarHBondContact O-N 3.11Å; G473-G502 PolarHBondContact O-N 2.86Å
474	G	89.1	Confident	93.5	Very high	10 Å²	10	22.3 Å²	22.3	10%	0.103	13%	0.126	C	C	.	.			trans	-94.3	-174.2	165.8	0	0	0	0	0	112.2	G476 T477 V478	G474-G476 PolarHBondContact O-N 3.37Å; G474-T477 WeakPolarHBondContact O-CB 3.47Å; G474-T477 PolarHBondContact O-N 3.33Å; G474-T477 VanDerWaalsContact O-N 3.08Å; G474-V478 PolarHBondContact O-N 3.02Å
475	D	88.7	Confident	93.7	Very high	23 Å²	23	22.5 Å²	22.5	12%	0.123	13%	0.126	C	C	.	.	H	α-helix	trans	-57.9	-43.5	-176.6	-57.5	-68.1	0	0	0	112.8	T477 V478 G479 N505 D506 L507 N563	D475-T477 VanDerWaalsContact C-N 3.31Å; D475-T477 PolarHBondContact O-N 3.23Å; D475-V478 WeakPolarHBondContact O-CA 3.42Å; D475-V478 WeakPolarHBondContact O-CB 3.08Å; D475-V478 PolarHBondContact O-N 3.19Å; D475-G479 PolarHBondContact O-N 2.96Å; D475-N505 WeakPolarHBondContact OD2-CA 3.21Å; D475-N505 PolarHBondContact OD2-N 2.86Å; D475-D506 PolarHBondContact OD1-N 3.18Å; D475-D506 PolarHBondContact OD2-N 2.96Å; D475-L507 WeakPolarHBondContact OD1-CB 3.08Å; D475-L507 PolarHBondContact OD1-N 2.72Å; D475-N563 PolarHBondContact OD1-ND2 2.89Å
476	G	88.8	Confident	93.8	Very high	36 Å²	36	21.6 Å²	21.6	37%	0.371	12%	0.118	S	C	.	.	H	α-helix	trans	-60.2	-35.4	175.4	0	0	0	0	0	114.1	G474 V478 G479 W480	G474-G476 PolarHBondContact O-N 3.37Å; G476-V478 VanDerWaalsContact C-N 3.31Å; G476-V478 PolarHBondContact O-N 3.44Å; G476-G479 PolarHBondContact O-N 3.14Å; G476-W480 WeakPolarHBondContact O-CB 3.36Å; G476-W480 PolarHBondContact O-N 2.68Å
477	T	91.4	Very high	93.8	Very high	10 Å²	10	23.8 Å²	23.8	6%	0.061	12%	0.124	C	C	.	.	H	α-helix	trans	-64.6	-38.1	173.8	-53.2	0	0	0	0	111.2	N421 L449 T471 G474 D475 W480 I481	N421-T477 HydrophobicContact CB-CG2 3.85Å; N421-T477 PolarHBondContact ND2-OG1 3.41Å; L449-T477 HydrophobicContact CD1-CG2 3.46Å; L449-T477 VanDerWaalsContact CD1-CG2 3.46Å; T471-T477 HydrophobicContact CG2-CG2 3.78Å; G474-T477 WeakPolarHBondContact O-CB 3.47Å; G474-T477 PolarHBondContact O-N 3.33Å; G474-T477 VanDerWaalsContact O-N 3.08Å; D475-T477 VanDerWaalsContact C-N 3.31Å; D475-T477 PolarHBondContact O-N 3.23Å; T477-W480 PolarHBondContact O-N 3.36Å; T477-I481 HydrophobicContact CG2-CD1 4.33Å; T477-I481 PolarHBondContact O-N 3.15Å; T477-I481 VanDerWaalsContact O-N 3.16Å
478	V	94.5	Very high	93.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67.4	-46.4	177.9	-177.5	0	0	0	0	110	T471 G474 D475 G476 W480 I481 L482 I498 L507 M758	T471-V478 HydrophobicContact CG2-CB 4.46Å; T471-V478 HydrophobicContact CG2-CG2 3.71Å; G474-V478 PolarHBondContact O-N 3.02Å; D475-V478 WeakPolarHBondContact O-CA 3.42Å; D475-V478 WeakPolarHBondContact O-CB 3.08Å; D475-V478 PolarHBondContact O-N 3.19Å; G476-V478 VanDerWaalsContact C-N 3.31Å; G476-V478 PolarHBondContact O-N 3.44Å; V478-W480 VanDerWaalsContact C-N 3.3Å; V478-W480 PolarHBondContact O-N 2.95Å; V478-I481 PolarHBondContact O-N 2.94Å; V478-L482 HydrophobicContact CG1-CD1 4.09Å; V478-L482 HydrophobicContact CG1-CG 4.34Å; V478-L482 WeakPolarHBondContact O-CG 3.43Å; V478-L482 PolarHBondContact O-N 2.97Å; V478-I498 HydrophobicContact CG1-CD1 4.16Å; V478-I498 HydrophobicContact CG1-CG1 4.35Å; V478-I498 HydrophobicContact CG2-CD1 3.88Å; V478-I498 HydrophobicContact CG2-CG1 3.83Å; V478-I498 HydrophobicContact CG2-CG2 3.98Å; V478-L507 HydrophobicContact CB-CD2 4.42Å; V478-L507 HydrophobicContact CG1-CD2 3.79Å; V478-M758 HydrophobicContact CG1-CE 4.16Å
479	G	93.2	Very high	93	Very high	14 Å²	14	28.1 Å²	28.1	14%	0.144	15%	0.15	C	C	.	.	H	α-helix	trans	-56.1	-43.3	174.7	0	0	0	0	0	112.7	D475 G476 I481 L482 D483	D475-G479 PolarHBondContact O-N 2.96Å; G476-G479 PolarHBondContact O-N 3.14Å; G479-I481 PolarHBondContact O-N 3.32Å; G479-L482 PolarHBondContact O-N 3.19Å; G479-D483 PolarHBondContact O-N 3.04Å
480	W	92.5	Very high	92.6	Very high	98 Å²	98	29.1 Å²	29.1	37%	0.371	16%	0.156	S	C	.	.	H	α-helix	trans	-60.2	-44.6	176.7	-176.9	25.4	0	0	0	112.7	L449 P454 G476 T477 V478 D483 F484	L449-W480 HydrophobicContact CB-CH2 4.29Å; L449-W480 HydrophobicContact CB-CZ3 3.83Å; L449-W480 HydrophobicContact CD1-CE3 4.38Å; L449-W480 HydrophobicContact CD1-CZ3 4.28Å; L449-W480 HydrophobicContact CD2-CZ3 4.45Å; L449-W480 HydrophobicContact CG-CZ3 4.44Å; P454-W480 HydrophobicContact CG-CD2 4.18Å; P454-W480 HydrophobicContact CG-CZ2 4.24Å; G476-W480 WeakPolarHBondContact O-CB 3.36Å; G476-W480 PolarHBondContact O-N 2.68Å; T477-W480 PolarHBondContact O-N 3.36Å; V478-W480 VanDerWaalsContact C-N 3.3Å; V478-W480 PolarHBondContact O-N 2.95Å; W480-D483 PolarHBondContact O-N 2.94Å; W480-F484 AromaticContact CD1-CD2 3.49Å; W480-F484 VanDerWaalsContact CD1-CD2 3.49Å; W480-F484 AromaticContact CD1-CE2 3.45Å; W480-F484 VanDerWaalsContact CD1-CE2 3.45Å; W480-F484 AromaticContact NE1-CD2 3.48Å; W480-F484 AromaticContact NE1-CE2 3.05Å; W480-F484 AromaticContact NE1-CZ 3.74Å; W480-F484 WeakPolarHBondContact O-CD2 3.13Å; W480-F484 PolarHBondContact O-N 3.14Å; W480-F484 VanDerWaalsContact O-N 3.15Å
481	I	95.9	Very high	91.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.6	-41.8	178	-72.3	165.2	0	0	0	111.4	F419 L449 P454 V469 T471 T477 V478 G479 D483 F484 I485	F419-I481 HydrophobicContact CB-CD1 3.62Å; F419-I481 HydrophobicContact CD2-CD1 3.79Å; F419-I481 HydrophobicContact CD2-CG1 4.21Å; F419-I481 HydrophobicContact CD2-CG2 4.3Å; F419-I481 HydrophobicContact CE2-CG2 4.43Å; F419-I481 HydrophobicContact CG-CD1 3.92Å; F419-I481 HydrophobicContact CG-CG1 4.46Å; L449-I481 HydrophobicContact CD1-CD1 4.16Å; P454-I481 HydrophobicContact CB-CG1 4.38Å; P454-I481 HydrophobicContact CG-CG1 4.25Å; V469-I481 HydrophobicContact CG1-CG2 4.16Å; T471-I481 HydrophobicContact CG2-CD1 3.44Å; T471-I481 VanDerWaalsContact CG2-CD1 3.44Å; T471-I481 WeakPolarHBondContact OG1-CD1 3.11Å; T477-I481 HydrophobicContact CG2-CD1 4.33Å; T477-I481 PolarHBondContact O-N 3.15Å; T477-I481 VanDerWaalsContact O-N 3.16Å; V478-I481 PolarHBondContact O-N 2.94Å; G479-I481 PolarHBondContact O-N 3.32Å; I481-D483 VanDerWaalsContact C-N 3.3Å; I481-D483 PolarHBondContact O-N 2.86Å; I481-F484 PolarHBondContact O-N 2.95Å; I481-F484 VanDerWaalsContact O-N 3.15Å; I481-I485 HydrophobicContact CG2-CD1 3.82Å; I481-I485 HydrophobicContact CG2-CG1 4.32Å; I481-I485 WeakPolarHBondContact O-CG1 3.49Å; I481-I485 PolarHBondContact O-N 2.8Å
482	L	96.1	Very high	91.5	Very high	4 Å²	4	44 Å²	44	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-39.3	177.8	-70.4	176.2	0	0	0	112.1	V478 G479 I485 D486 V496 L537 A756 M758	V478-L482 HydrophobicContact CG1-CD1 4.09Å; V478-L482 HydrophobicContact CG1-CG 4.34Å; V478-L482 WeakPolarHBondContact O-CG 3.43Å; V478-L482 PolarHBondContact O-N 2.97Å; G479-L482 PolarHBondContact O-N 3.19Å; L482-I485 PolarHBondContact O-N 3.24Å; L482-D486 PolarHBondContact O-N 3.36Å; L482-D486 VanDerWaalsContact O-N 3.12Å; L482-V496 HydrophobicContact CD2-CG2 3.85Å; L482-L537 HydrophobicContact CD1-CD2 4.38Å; L482-A756 HydrophobicContact CD1-CB 4.41Å; L482-A756 HydrophobicContact CD2-CB 3.77Å; L482-M758 HydrophobicContact CD1-SD 4.4Å; L482-M758 HydrophobicContact CD2-SD 4.1Å
483	D	92.9	Very high	91.4	Very high	39 Å²	39	46.2 Å²	46.2	21%	0.209	24%	0.241	C	C	.	.	H	α-helix	trans	-64.8	-39.6	174.1	-175.2	60	0	0	0	112.4	G479 W480 I481 D486 K487	G479-D483 PolarHBondContact O-N 3.04Å; W480-D483 PolarHBondContact O-N 2.94Å; I481-D483 VanDerWaalsContact C-N 3.3Å; I481-D483 PolarHBondContact O-N 2.86Å; D483-D486 WeakPolarHBondContact O-CB 3.44Å; D483-D486 PolarHBondContact O-N 2.98Å; D483-K487 WeakPolarHBondContact O-CG 3.44Å; D483-K487 PolarHBondContact O-N 3.13Å; D483-K487 WeakPolarHBondContact OD2-CE 3.27Å; D483-K487 IonicContact OD2-NZ 3.51Å; D483-K487 PolarHBondContact OD2-NZ 3.26Å
484	F	94.4	Very high	91.6	Very high	46 Å²	46	46.5 Å²	46.5	20%	0.202	24%	0.242	C	C	.	.	H	α-helix	trans	-71.8	-30.2	176.3	-89	-109.4	0	0	0	113.2	P454 M455 L458 W480 I481 K487 A488	P454-F484 HydrophobicContact CB-CB 3.9Å; P454-F484 HydrophobicContact CB-CD1 4.13Å; P454-F484 HydrophobicContact CB-CG 4.05Å; P454-F484 HydrophobicContact CG-CB 4.1Å; P454-F484 HydrophobicContact CG-CD1 4.1Å; P454-F484 HydrophobicContact CG-CD2 4.23Å; P454-F484 HydrophobicContact CG-CG 3.86Å; M455-F484 HydrophobicContact CB-CD1 3.94Å; M455-F484 HydrophobicContact CB-CE1 4.05Å; M455-F484 HydrophobicContact CE-CD1 3.71Å; M455-F484 HydrophobicContact CE-CE1 4.12Å; M455-F484 HydrophobicContact SD-CD1 4.49Å; L458-F484 HydrophobicContact CD1-CB 3.86Å; L458-F484 WeakPolarHBondContact CD1-O 3.18Å; W480-F484 AromaticContact CD1-CD2 3.49Å; W480-F484 VanDerWaalsContact CD1-CD2 3.49Å; W480-F484 AromaticContact CD1-CE2 3.45Å; W480-F484 VanDerWaalsContact CD1-CE2 3.45Å; W480-F484 AromaticContact NE1-CD2 3.48Å; W480-F484 AromaticContact NE1-CE2 3.05Å; W480-F484 AromaticContact NE1-CZ 3.74Å; W480-F484 WeakPolarHBondContact O-CD2 3.13Å; W480-F484 PolarHBondContact O-N 3.14Å; W480-F484 VanDerWaalsContact O-N 3.15Å; I481-F484 PolarHBondContact O-N 2.95Å; I481-F484 VanDerWaalsContact O-N 3.15Å; F484-K487 PolarHBondContact O-N 3.45Å; F484-A488 WeakPolarHBondContact O-CB 3.24Å; F484-A488 PolarHBondContact O-N 3.08Å
485	I	95.5	Very high	92	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-44.5	170.7	-71.6	167.4	0	0	0	110.2	L458 I481 L482 K487 A488 P494 V496	L458-I485 HydrophobicContact CD1-CG1 4.21Å; L458-I485 HydrophobicContact CD2-CG1 3.87Å; I481-I485 HydrophobicContact CG2-CD1 3.82Å; I481-I485 HydrophobicContact CG2-CG1 4.32Å; I481-I485 WeakPolarHBondContact O-CG1 3.49Å; I481-I485 PolarHBondContact O-N 2.8Å; L482-I485 PolarHBondContact O-N 3.24Å; I485-K487 VanDerWaalsContact C-N 3.3Å; I485-K487 PolarHBondContact O-N 3.27Å; I485-A488 PolarHBondContact O-N 3.34Å; I485-P494 HydrophobicContact CD1-CG 4.2Å; I485-V496 HydrophobicContact CD1-CG2 3.68Å
486	D	91.8	Very high	92.5	Very high	49 Å²	49	45.5 Å²	45.5	26%	0.262	24%	0.235	S	C	.	.	H	α-helix	trans	-57.7	-45.2	174.2	-69.2	-17.4	0	0	0	110.8	L482 D483 N489 R539 K753 N754	L482-D486 PolarHBondContact O-N 3.36Å; L482-D486 VanDerWaalsContact O-N 3.12Å; D483-D486 WeakPolarHBondContact O-CB 3.44Å; D483-D486 PolarHBondContact O-N 2.98Å; D486-N489 PolarHBondContact O-N 3.08Å; D486-R539 IonicContact OD1-NH1 3.46Å; D486-R539 PolarHBondContact OD1-NH1 3.25Å; D486-R539 IonicContact OD2-CZ 2.73Å; D486-R539 IonicContact OD2-NH1 3.97Å; D486-R539 PolarHBondContact OD2-NH1 2.81Å; D486-R539 IonicContact OD2-NH2 2.79Å; D486-R539 PolarHBondContact OD2-NH2 3.13Å; D486-K753 IonicContact OD2-NZ 2.64Å; D486-K753 PolarHBondContact OD2-NZ 3.43Å; D486-N754 PolarHBondContact OD1-ND2 2.61Å
487	K	92.1	Very high	92.9	Very high	123 Å²	123	43.8 Å²	43.8	54%	0.535	22%	0.218	S	C	.	.	H	α-helix	trans	-69.5	-30.8	-179	-72.3	168.7	175.3	167.8	0	113.7	M455 D483 F484 I485 N489	M455-K487 HydrophobicContact CE-CB 4.15Å; D483-K487 WeakPolarHBondContact O-CG 3.44Å; D483-K487 PolarHBondContact O-N 3.13Å; D483-K487 WeakPolarHBondContact OD2-CE 3.27Å; D483-K487 IonicContact OD2-NZ 3.51Å; D483-K487 PolarHBondContact OD2-NZ 3.26Å; F484-K487 PolarHBondContact O-N 3.45Å; I485-K487 VanDerWaalsContact C-N 3.3Å; I485-K487 PolarHBondContact O-N 3.27Å; K487-N489 PolarHBondContact O-N 3.37Å
488	A	90	Very high	93.1	Very high	5 Å²	5	43.5 Å²	43.5	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-66.6	-21.6	-179.3	0	0	0	0	0	112.5	M455 L458 R462 F484 I485 L490	M455-A488 HydrophobicContact SD-CB 4.3Å; L458-A488 HydrophobicContact CB-CB 4.21Å; L458-A488 HydrophobicContact CD1-CB 4.09Å; R462-A488 VanDerWaalsContact CZ-O 3.32Å; R462-A488 PolarHBondContact NH1-O 3.13Å; R462-A488 PolarHBondContact NH2-O 3.13Å; F484-A488 WeakPolarHBondContact O-CB 3.24Å; F484-A488 PolarHBondContact O-N 3.08Å; I485-A488 PolarHBondContact O-N 3.34Å; A488-L490 HydrophobicContact CB-CD1 4.48Å; A488-L490 HydrophobicContact CB-CD2 4.17Å; A488-L490 HydrophobicContact CB-CG 3.95Å; A488-L490 PolarHBondContact O-N 3.46Å
489	N	87	Confident	93.1	Very high	125 Å²	125	43.8 Å²	43.8	67%	0.668	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	56.4	179.4	-168.7	44.2	0	0	0	111.3	R462 D486 K487	R462-N489 PolarHBondContact NH2-O 3.33Å; D486-N489 PolarHBondContact O-N 3.08Å; K487-N489 PolarHBondContact O-N 3.37Å
490	L	88.8	Confident	93.1	Very high	21 Å²	21	43.3 Å²	43.3	11%	0.11	21%	0.212	C	C	.	.			trans	-76.3	149.2	177.7	-58.5	174.8	0	0	0	110	R462 F467 A488 R492 P494	R462-L490 HydrophobicContact CB-CD2 4.36Å; R462-L490 HydrophobicContact CG-CD2 3.98Å; F467-L490 HydrophobicContact CE1-CD1 4.23Å; F467-L490 HydrophobicContact CZ-CD1 3.85Å; A488-L490 HydrophobicContact CB-CD1 4.48Å; A488-L490 HydrophobicContact CB-CD2 4.17Å; A488-L490 HydrophobicContact CB-CG 3.95Å; A488-L490 PolarHBondContact O-N 3.46Å; L490-R492 PolarHBondContact O-N 3.03Å; L490-P494 HydrophobicContact CD1-CG 4.33Å
491	D	84.8	Confident	92.8	Very high	179 Å²	179	38.7 Å²	38.7	96%	0.957	19%	0.194	S	C	*	.	S	Bend	trans	-59	-36.5	178.9	-69.8	-17.5	0	0	0	112.1
492	R	88.1	Confident	92.1	Very high	135 Å²	135	39.3 Å²	39.3	51%	0.509	20%	0.201	S	C	.	.	S	Bend	trans	-133.6	127.3	172	-174.7	179	179.6	-176.1	0.6	109	D466 L490 E534	D466-R492 IonicContact OD1-CZ 2.86Å; D466-R492 IonicContact OD1-NH1 2.71Å; D466-R492 PolarHBondContact OD1-NH1 3.49Å; L490-R492 PolarHBondContact O-N 3.03Å; R492-E534 IonicContact NH2-OE2 2.82Å
493	S	92.4	Very high	91.3	Very high	46 Å²	46	40.6 Å²	40.6	32%	0.322	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-67.3	124.4	173.7	-63.1	0	0	0	0	110.2
494	P	96.4	Very high	90.6	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.032	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-72.8	146.1	-179.9	32	-38.2	0	0	0	110.7	F467 V469 I485 L490	F467-P494 HydrophobicContact CD1-CB 4.29Å; F467-P494 HydrophobicContact CD2-CB 3.96Å; F467-P494 HydrophobicContact CD2-CG 4.45Å; F467-P494 HydrophobicContact CE1-CB 4.03Å; F467-P494 HydrophobicContact CE1-CG 4.18Å; F467-P494 HydrophobicContact CE2-CB 3.65Å; F467-P494 HydrophobicContact CE2-CG 3.64Å; F467-P494 HydrophobicContact CG-CB 4.29Å; F467-P494 HydrophobicContact CZ-CB 3.71Å; F467-P494 HydrophobicContact CZ-CG 3.51Å; F467-P494 VanDerWaalsContact O-CB 3.28Å; F467-P494 WeakPolarHBondContact O-CB 3.43Å; V469-P494 HydrophobicContact CG2-CB 3.98Å; V469-P494 HydrophobicContact CG2-CG 3.69Å; I485-P494 HydrophobicContact CD1-CG 4.2Å; L490-P494 HydrophobicContact CD1-CG 4.33Å
495	P	97.6	Very high	90.3	Very high	13 Å²	13	38 Å²	38	8%	0.084	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-73.2	138.9	174.1	33.3	-37.1	0	0	0	111.1	R468 V469 E534 H757 L759	R468-P495 HydrophobicContact CG-CG 4.1Å; V469-P495 PolarHBondContact N-O 3.45Å; P495-E534 HydrophobicContact CB-CG 4.16Å; P495-H757 CarbonylContact C-O 3.59Å; P495-H757 VanDerWaalsContact CA-O 3.29Å; P495-H757 WeakPolarHBondContact CA-O 3.08Å; P495-H757 HydrophobicContact CB-CB 4.01Å; P495-L759 HydrophobicContact CB-CD2 3.69Å; P495-L759 HydrophobicContact CB-CG 3.88Å; P495-L759 HydrophobicContact CG-CD2 3.98Å; P495-L759 HydrophobicContact CG-CG 4.33Å
496	V	98.3	Very high	90	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.1	-174.9	-174.2	0	0	0	0	111.6	V469 L482 I485 H757 M758 L759	V469-V496 HydrophobicContact CB-CG2 4.2Å; V469-V496 HydrophobicContact CG1-CG1 4.35Å; V469-V496 CarbonylContact O-C 3.54Å; V469-V496 WeakPolarHBondContact O-CA 3.45Å; L482-V496 HydrophobicContact CD2-CG2 3.85Å; I485-V496 HydrophobicContact CD1-CG2 3.68Å; V496-H757 PolarHBondContact N-O 2.7Å; V496-M758 HydrophobicContact CB-CE 4.09Å; V496-M758 HydrophobicContact CB-SD 3.9Å; V496-M758 HydrophobicContact CG1-CE 4.33Å; V496-M758 CarbonylContact O-C 3.6Å; V496-M758 WeakPolarHBondContact O-CA 3.37Å; V496-L759 PolarHBondContact O-N 2.94Å
497	C	96.9	Very high	90.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	159.9	167.1	60.3	0	0	0	0	111.5	V469 L470 T471 W513 I529 L759	V469-C497 PolarHBondContact O-N 3.45Å; V469-C497 PolarHBondContact O-SG 3.18Å; L470-C497 WeakPolarHBondContact CA-SG 3.39Å; L470-C497 HydrophobicContact CD1-CB 4.45Å; L470-C497 WeakPolarHBondContact CD1-SG 3.14Å; T471-C497 PolarHBondContact N-O 3.48Å; C497-W513 HydrophobicContact CB-CZ2 3.85Å; C497-I529 HydrophobicContact CB-CG1 4.4Å; C497-L759 HydrophobicContact CB-CB 3.9Å; C497-L759 HydrophobicContact CB-CD1 3.94Å; C497-L759 HydrophobicContact CB-CG 4.39Å
498	I	95.9	Very high	90.1	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.1	-172.6	-52.2	169.6	0	0	0	109.9	T471 V478 L507 A508 L511 W513 M758	T471-I498 WeakPolarHBondContact O-CA 3.28Å; V478-I498 HydrophobicContact CG1-CD1 4.16Å; V478-I498 HydrophobicContact CG1-CG1 4.35Å; V478-I498 HydrophobicContact CG2-CD1 3.88Å; V478-I498 HydrophobicContact CG2-CG1 3.83Å; V478-I498 HydrophobicContact CG2-CG2 3.98Å; I498-L507 HydrophobicContact CD1-CB 4.11Å; I498-L507 HydrophobicContact CD1-CD2 3.9Å; I498-L507 HydrophobicContact CD1-CG 3.72Å; I498-A508 HydrophobicContact CB-CB 4.19Å; I498-A508 HydrophobicContact CD1-CB 4.38Å; I498-A508 HydrophobicContact CG2-CB 3.85Å; I498-L511 HydrophobicContact CD1-CD1 3.91Å; I498-W513 WeakPolarHBondContact O-CB 3.03Å; I498-M758 HydrophobicContact CD1-CE 4.08Å; I498-M758 HydrophobicContact CG1-CE 4.37Å
499	L	94.5	Very high	90.2	Very high	6 Å²	6	31.9 Å²	31.9	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	108.1	161	-175.9	71	0	0	0	108.3	I433 F437 L470 T471 C472 G473 L501 Y517 L522 I525	I433-L499 HydrophobicContact CD1-CD2 3.96Å; I433-L499 HydrophobicContact CG2-CD2 3.95Å; F437-L499 HydrophobicContact CE2-CD2 4.33Å; L470-L499 HydrophobicContact CD1-CB 4.07Å; T471-L499 PolarHBondContact O-N 3.1Å; C472-L499 HydrophobicContact CB-CB 4.2Å; C472-L499 HydrophobicContact CB-CD2 4.12Å; G473-L499 PolarHBondContact N-O 3.29Å; G473-L499 VanDerWaalsContact N-O 3.16Å; L499-L501 HydrophobicContact CD2-CD2 4.32Å; L499-L501 HydrophobicContact CG-CD2 4.29Å; L499-L501 PolarHBondContact O-N 3.48Å; L499-Y517 HydrophobicContact CD1-CD2 3.74Å; L499-Y517 HydrophobicContact CD1-CE2 4.33Å; L499-Y517 HydrophobicContact CD1-CG 4.27Å; L499-Y517 HydrophobicContact CG-CD2 4.45Å; L499-L522 HydrophobicContact CD2-CD2 4.48Å; L499-I525 HydrophobicContact CD1-CD1 3.58Å; L499-I525 HydrophobicContact CD1-CG1 4.43Å; L499-I525 HydrophobicContact CD1-CG2 4.46Å
500	P	92.4	Very high	90.3	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.026	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	97.3	-167.6	27.6	-34.2	0	0	0	112.3	N505 A508 G516 Y517	P500-N505 HydrophobicContact CB-CB 3.79Å; P500-A508 HydrophobicContact CB-CB 3.82Å; P500-A508 HydrophobicContact CG-CB 4.36Å; P500-G516 CarbonylContact O-C 3.56Å; P500-G516 WeakPolarHBondContact O-CA 2.98Å; P500-Y517 PolarHBondContact O-N 2.96Å
501	L	87.7	Confident	90.5	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.142	C	C	.	.			trans	-99.2	-14.3	176	-56.9	-172.8	0	0	0	113	G425 I433 C472 G473 L499 Y517	G425-L501 WeakPolarHBondContact CA-O 3.29Å; G425-L501 PolarHBondContact N-O 3.22Å; I433-L501 HydrophobicContact CD1-CD1 3.64Å; I433-L501 HydrophobicContact CD1-CD2 3.37Å; I433-L501 HydrophobicContact CD1-CG 4.13Å; C472-L501 HydrophobicContact CB-CD1 3.84Å; C472-L501 HydrophobicContact CB-CG 4.43Å; G473-L501 PolarHBondContact O-N 3.11Å; L499-L501 HydrophobicContact CD2-CD2 4.32Å; L499-L501 HydrophobicContact CG-CD2 4.29Å; L499-L501 PolarHBondContact O-N 3.48Å; L501-Y517 HydrophobicContact CD2-CD1 4.06Å; L501-Y517 HydrophobicContact CD2-CG 4.17Å
502	G	81.1	Confident	90.8	Very high	13 Å²	13	23.1 Å²	23.1	13%	0.134	12%	0.118	C	C	.	.	S	Bend	trans	-71.6	-175.5	178.7	0	0	0	0	0	114.3	G473 N505 R591	G473-G502 PolarHBondContact O-N 2.86Å; G502-N505 VanDerWaalsContact C-ND2 3.31Å; G502-N505 WeakPolarHBondContact CA-OD1 3.16Å; G502-N505 PolarHBondContact N-OD1 3.29Å; G502-N505 PolarHBondContact O-ND2 3.11Å; G502-R591 WeakPolarHBondContact O-CD 3.3Å
503	T	77.9	Confident	91	Very high	30 Å²	30	18.5 Å²	18.5	18%	0.184	10%	0.1	C	C	.	.	S	Bend	trans	-93.3	-42.9	172.9	-55.6	0	0	0	0	111.5	R591 N594 K595	T503-R591 HydrophobicContact CG2-CB 4.42Å; T503-N594 HydrophobicContact CG2-CB 3.68Å; T503-N594 PolarHBondContact OG1-ND2 3.13Å; T503-K595 HydrophobicContact CG2-CG 3.93Å
504	G	78.3	Confident	90.9	Very high	29 Å²	29	17.4 Å²	17.4	30%	0.299	10%	0.096	S	C	.	.			trans	-66.6	-74	176.9	0	0	0	0	0	111.3	D506 R509	G504-D506 VanDerWaalsContact C-N 3.32Å; G504-D506 PolarHBondContact O-N 3.27Å; G504-R509 VanDerWaalsContact O-CZ 3.29Å; G504-R509 PolarHBondContact O-NH1 2.71Å; G504-R509 PolarHBondContact O-NH2 2.64Å
505	N	88.3	Confident	90.3	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.005	11%	0.109	C	C	.	.			trans	54.4	39.2	178.4	-50.9	-40.3	0	0	0	113.7	D475 P500 G502 A508 R509 G515	D475-N505 WeakPolarHBondContact OD2-CA 3.21Å; D475-N505 PolarHBondContact OD2-N 2.86Å; P500-N505 HydrophobicContact CB-CB 3.79Å; G502-N505 VanDerWaalsContact C-ND2 3.31Å; G502-N505 WeakPolarHBondContact CA-OD1 3.16Å; G502-N505 PolarHBondContact N-OD1 3.29Å; G502-N505 PolarHBondContact O-ND2 3.11Å; N505-A508 HydrophobicContact CB-CB 4.12Å; N505-A508 PolarHBondContact O-N 3.32Å; N505-R509 PolarHBondContact O-N 2.72Å; N505-R509 VanDerWaalsContact O-N 3.16Å; N505-R509 PolarHBondContact O-NH1 3.42Å; N505-G515 PolarHBondContact ND2-O 3.43Å
506	D	90.6	Very high	89.8	Confident	4 Å²	4	18.7 Å²	18.7	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-67.4	-42.3	-177	-76.9	-64.9	0	0	0	111.6	D475 G504 A508 R509 C510 I642 S644 M645 G647 G648	D475-D506 PolarHBondContact OD1-N 3.18Å; D475-D506 PolarHBondContact OD2-N 2.96Å; G504-D506 VanDerWaalsContact C-N 3.32Å; G504-D506 PolarHBondContact O-N 3.27Å; D506-A508 VanDerWaalsContact C-N 3.32Å; D506-A508 PolarHBondContact O-N 2.88Å; D506-R509 PolarHBondContact O-N 3.4Å; D506-C510 PolarHBondContact O-N 3.48Å; D506-I642 HydrophobicContact CB-CD1 4.02Å; D506-S644 PolarHBondContact OD1-OG 3.18Å; D506-M645 VanDerWaalsContact OD1-C 3.29Å; D506-M645 WeakPolarHBondContact OD1-CA 3.31Å; D506-M645 PolarHBondContact OD1-N 3.45Å; D506-G647 WeakPolarHBondContact OD1-CA 3.35Å; D506-G647 PolarHBondContact OD1-N 3.19Å; D506-G647 PolarHBondContact OD2-N 2.89Å; D506-G647 VanDerWaalsContact OD2-N 3.09Å; D506-G648 PolarHBondContact OD1-N 3.49Å
507	L	92.6	Very high	89.2	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-64	-40.3	177.6	-172.2	56.8	0	0	0	111.6	D475 V478 I498 R509 C510 L511 L537 I642 M758	D475-L507 WeakPolarHBondContact OD1-CB 3.08Å; D475-L507 PolarHBondContact OD1-N 2.72Å; V478-L507 HydrophobicContact CB-CD2 4.42Å; V478-L507 HydrophobicContact CG1-CD2 3.79Å; I498-L507 HydrophobicContact CD1-CB 4.11Å; I498-L507 HydrophobicContact CD1-CD2 3.9Å; I498-L507 HydrophobicContact CD1-CG 3.72Å; L507-R509 VanDerWaalsContact C-N 3.32Å; L507-R509 PolarHBondContact O-N 3.03Å; L507-C510 PolarHBondContact O-N 2.92Å; L507-L511 HydrophobicContact CD1-CD1 4.16Å; L507-L511 HydrophobicContact CD1-CG 4.46Å; L507-L511 HydrophobicContact CG-CD1 4.08Å; L507-L511 WeakPolarHBondContact O-CB 3.29Å; L507-L511 WeakPolarHBondContact O-CG 3.35Å; L507-L511 PolarHBondContact O-N 3.35Å; L507-L537 HydrophobicContact CD1-CD1 4.12Å; L507-L537 HydrophobicContact CD1-CD2 3.98Å; L507-L537 HydrophobicContact CD2-CD2 4.12Å; L507-I642 HydrophobicContact CB-CD1 4.43Å; L507-I642 HydrophobicContact CD1-CD1 4.44Å; L507-I642 HydrophobicContact CD1-CG2 4.18Å; L507-M758 HydrophobicContact CD2-CE 4.14Å
508	A	93.4	Very high	88.4	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.1	-36.6	176.6	0	0	0	0	0	112.5	I498 P500 N505 D506 L511 R512 W513	I498-A508 HydrophobicContact CB-CB 4.19Å; I498-A508 HydrophobicContact CD1-CB 4.38Å; I498-A508 HydrophobicContact CG2-CB 3.85Å; P500-A508 HydrophobicContact CB-CB 3.82Å; P500-A508 HydrophobicContact CG-CB 4.36Å; N505-A508 HydrophobicContact CB-CB 4.12Å; N505-A508 PolarHBondContact O-N 3.32Å; D506-A508 VanDerWaalsContact C-N 3.32Å; D506-A508 PolarHBondContact O-N 2.88Å; A508-L511 CarbonylContact O-C 3.08Å; A508-L511 PolarHBondContact O-N 2.79Å; A508-R512 PolarHBondContact O-N 3.17Å; A508-R512 VanDerWaalsContact O-N 3.11Å; A508-W513 HydrophobicContact CB-CB 4.26Å; A508-W513 PolarHBondContact O-N 2.83Å
509	R	90.4	Very high	87.6	Confident	52 Å²	52	29.5 Å²	29.5	20%	0.196	18%	0.175	C	C	.	.	H	α-helix	trans	-68.7	-44.6	175.2	-76.3	178.1	-172.6	76.1	-20.3	111.8	G504 N505 D506 L507 L511 R512 G647	G504-R509 VanDerWaalsContact O-CZ 3.29Å; G504-R509 PolarHBondContact O-NH1 2.71Å; G504-R509 PolarHBondContact O-NH2 2.64Å; N505-R509 PolarHBondContact O-N 2.72Å; N505-R509 VanDerWaalsContact O-N 3.16Å; N505-R509 PolarHBondContact O-NH1 3.42Å; D506-R509 PolarHBondContact O-N 3.4Å; L507-R509 VanDerWaalsContact C-N 3.32Å; L507-R509 PolarHBondContact O-N 3.03Å; R509-L511 PolarHBondContact O-N 3.21Å; R509-R512 PolarHBondContact O-N 2.69Å; R509-G647 VanDerWaalsContact CZ-C 3.46Å; R509-G647 PolarHBondContact NE-O 3.23Å; R509-G647 PolarHBondContact NH2-O 2.93Å
510	C	90.1	Very high	87.1	Confident	20 Å²	20	33.4 Å²	33.4	14%	0.135	19%	0.193	C	C	.	.	H	α-helix	trans	-55.3	-42.7	173.8	-78.4	0	0	0	0	111.9	D506 L507 R512 S644 L688	D506-C510 PolarHBondContact O-N 3.48Å; L507-C510 PolarHBondContact O-N 2.92Å; C510-R512 VanDerWaalsContact C-N 3.25Å; C510-R512 PolarHBondContact O-N 2.91Å; C510-S644 WeakPolarHBondContact SG-CB 3.43Å; C510-S644 PolarHBondContact SG-N 2.72Å; C510-S644 VanDerWaalsContact SG-N 3.43Å; C510-L688 HydrophobicContact CB-CD2 4.42Å
511	L	92.5	Very high	86.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	9.2	178.6	-64.2	174	0	0	0	113.9	I498 L507 A508 R509 W513 V535 L688 M758 M760 G761	I498-L511 HydrophobicContact CD1-CD1 3.91Å; L507-L511 HydrophobicContact CD1-CD1 4.16Å; L507-L511 HydrophobicContact CD1-CG 4.46Å; L507-L511 HydrophobicContact CG-CD1 4.08Å; L507-L511 WeakPolarHBondContact O-CB 3.29Å; L507-L511 WeakPolarHBondContact O-CG 3.35Å; L507-L511 PolarHBondContact O-N 3.35Å; A508-L511 CarbonylContact O-C 3.08Å; A508-L511 PolarHBondContact O-N 2.79Å; R509-L511 PolarHBondContact O-N 3.21Å; L511-W513 VanDerWaalsContact C-N 3.27Å; L511-W513 PolarHBondContact O-N 3.26Å; L511-V535 HydrophobicContact CD2-CG2 3.63Å; L511-L688 HydrophobicContact CD2-CD2 4.33Å; L511-M758 HydrophobicContact CD1-CB 3.91Å; L511-M758 HydrophobicContact CD1-CE 3.54Å; L511-M758 HydrophobicContact CD1-CG 4.27Å; L511-M758 HydrophobicContact CD2-CB 4.07Å; L511-M760 HydrophobicContact CD2-CB 4.35Å; L511-M760 HydrophobicContact CD2-CE 4.18Å; L511-M760 CarbonylContact O-C 3.5Å; L511-M760 WeakPolarHBondContact O-CA 3.4Å; L511-G761 PolarHBondContact O-N 2.9Å
512	R	92.1	Very high	87.1	Confident	120 Å²	120	37.7 Å²	37.7	45%	0.453	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	21	175.4	-52.4	177.5	-179.3	162.9	4.7	116	A508 R509 C510 G514 M760 G761	A508-R512 PolarHBondContact O-N 3.17Å; A508-R512 VanDerWaalsContact O-N 3.11Å; R509-R512 PolarHBondContact O-N 2.69Å; C510-R512 VanDerWaalsContact C-N 3.25Å; C510-R512 PolarHBondContact O-N 2.91Å; R512-G514 VanDerWaalsContact C-N 3.29Å; R512-M760 HydrophobicContact CG-CG 4.25Å; R512-G761 WeakPolarHBondContact CD-O 3.48Å
513	W	92.3	Very high	87.5	Confident	38 Å²	38	39.4 Å²	39.4	14%	0.144	22%	0.221	C	C	.	.	S	Bend	trans	-83.1	-7	171.9	-64.1	111.8	0	0	0	113.6	C497 I498 A508 L511 D528 I529 L759	C497-W513 HydrophobicContact CB-CZ2 3.85Å; I498-W513 WeakPolarHBondContact O-CB 3.03Å; A508-W513 HydrophobicContact CB-CB 4.26Å; A508-W513 PolarHBondContact O-N 2.83Å; L511-W513 VanDerWaalsContact C-N 3.27Å; L511-W513 PolarHBondContact O-N 3.26Å; W513-D528 HydrophobicContact CZ3-CB 4Å; W513-I529 HydrophobicContact CH2-CB 4.46Å; W513-I529 HydrophobicContact CH2-CG1 3.8Å; W513-I529 HydrophobicContact CZ3-CG1 4.18Å; W513-L759 HydrophobicContact CZ2-CB 4.16Å; W513-L759 PolarHBondContact NE1-O 3.48Å
514	G	89.1	Confident	88.2	Confident	23 Å²	23	42.2 Å²	42.2	24%	0.237	23%	0.231	C	C	.	.			trans	95.2	176.4	175.2	0	0	0	0	0	113.7	R512	R512-G514 VanDerWaalsContact C-N 3.29Å
515	G	83.9	Confident	88.9	Confident	29 Å²	29	41.5 Å²	41.5	30%	0.299	22%	0.22	S	C	.	.	S	Bend	trans	-88.9	-10.5	-173.1	0	0	0	0	0	115.5	N505	N505-G515 PolarHBondContact ND2-O 3.43Å
516	G	86.7	Confident	89.2	Confident	17 Å²	17	41.4 Å²	41.4	18%	0.175	22%	0.22	C	C	.	.			trans	173.4	141.1	-178.7	0	0	0	0	0	112.2	P500 R591	P500-G516 CarbonylContact O-C 3.56Å; P500-G516 WeakPolarHBondContact O-CA 2.98Å; G516-R591 VanDerWaalsContact C-NH1 3.29Å
517	Y	85.8	Confident	89.4	Confident	24 Å²	24	47.4 Å²	47.4	9%	0.094	24%	0.242	C	C	.	.			trans	-70.8	131.6	172.3	-179.4	-110.7	0	0	0	110.7	I433 L499 P500 L501 G519 E520 L522 I525 R591	I433-Y517 HydrophobicContact CD1-CD1 3.88Å; I433-Y517 HydrophobicContact CD1-CE1 3.86Å; I433-Y517 HydrophobicContact CG1-CE1 4.04Å; L499-Y517 HydrophobicContact CD1-CD2 3.74Å; L499-Y517 HydrophobicContact CD1-CE2 4.33Å; L499-Y517 HydrophobicContact CD1-CG 4.27Å; L499-Y517 HydrophobicContact CG-CD2 4.45Å; P500-Y517 PolarHBondContact O-N 2.96Å; L501-Y517 HydrophobicContact CD2-CD1 4.06Å; L501-Y517 HydrophobicContact CD2-CG 4.17Å; Y517-G519 VanDerWaalsContact CZ-CA 3.5Å; Y517-E520 HydrophobicContact CD2-CB 4.44Å; Y517-E520 HydrophobicContact CE2-CB 4.05Å; Y517-E520 WeakPolarHBondContact CE2-O 3.49Å; Y517-E520 PolarHBondContact OH-O 3.39Å; Y517-L522 HydrophobicContact CE2-CD2 3.79Å; Y517-L522 WeakPolarHBondContact OH-CD2 3.25Å; Y517-I525 HydrophobicContact CD2-CD1 4.13Å; Y517-I525 HydrophobicContact CE2-CD1 3.79Å; Y517-R591 VanDerWaalsContact N-NH1 3.11Å; Y517-R591 PolarHBondContact O-NH1 3Å; Y517-R591 PolarHBondContact O-NH2 2.7Å
518	E	80.7	Confident	89.4	Confident	162 Å²	162	49.9 Å²	49.9	76%	0.757	26%	0.255	S	S	*	.			trans	-122.2	26.9	-178.9	-64	-170.6	160.2	0	0	112.2
519	G	79.6	Confident	89.5	Confident	45 Å²	45	49.9 Å²	49.9	46%	0.464	26%	0.255	S	S	.	.	S	Bend	trans	83.8	23.5	-178.1	0	0	0	0	0	114.1	Y517	Y517-G519 VanDerWaalsContact CZ-CA 3.5Å
520	E	83.5	Confident	89.7	Confident	87 Å²	87	51.6 Å²	51.6	41%	0.407	27%	0.265	S	S	.	.			trans	-56.3	154.2	172.4	-65.6	-168.3	-150.1	0	0	112.1	Y517 L522 K524 I525	Y517-E520 HydrophobicContact CD2-CB 4.44Å; Y517-E520 HydrophobicContact CE2-CB 4.05Å; Y517-E520 WeakPolarHBondContact CE2-O 3.49Å; Y517-E520 PolarHBondContact OH-O 3.39Å; E520-L522 PolarHBondContact O-N 2.89Å; E520-L522 VanDerWaalsContact O-N 3.15Å; E520-K524 IonicContact OE2-NZ 3.65Å; E520-K524 PolarHBondContact OE2-NZ 2.96Å; E520-I525 HydrophobicContact CB-CD1 4.4Å
521	N	87.9	Confident	89.8	Confident	89 Å²	89	55.8 Å²	55.8	48%	0.476	29%	0.287	S	S	.	.			trans	-66.1	118.2	178.9	-174.1	-14.9	0	0	0	110.8	L523 K524 I525	N521-L523 PolarHBondContact O-N 3.15Å; N521-L523 VanDerWaalsContact O-N 3.14Å; N521-L523 WeakPolarHBondContact OD1-CB 3.34Å; N521-L523 PolarHBondContact OD1-N 3.3Å; N521-K524 HydrophobicContact CB-CB 4.46Å; N521-K524 WeakPolarHBondContact O-CA 3.34Å; N521-K524 VanDerWaalsContact O-CB 3.24Å; N521-K524 WeakPolarHBondContact O-CB 3.34Å; N521-K524 PolarHBondContact O-N 3.48Å; N521-I525 PolarHBondContact O-N 3.46Å
522	L	91.3	Very high	89.9	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-58.9	-26.6	178.8	-59.1	-171.2	0	0	0	113.7	K436 F437 L440 L499 Y517 E520 K524 I525 L526	K436-L522 HydrophobicContact CB-CD1 3.71Å; K436-L522 HydrophobicContact CG-CD1 3.55Å; K436-L522 HydrophobicContact CG-CG 4.3Å; F437-L522 HydrophobicContact CD1-CD1 4.43Å; F437-L522 HydrophobicContact CD2-CD1 4.09Å; F437-L522 HydrophobicContact CE1-CB 4.35Å; F437-L522 HydrophobicContact CE1-CD1 4.18Å; F437-L522 HydrophobicContact CE2-CD1 3.86Å; F437-L522 HydrophobicContact CE2-CD2 4.41Å; F437-L522 HydrophobicContact CG-CD1 4.37Å; F437-L522 HydrophobicContact CZ-CB 4.38Å; F437-L522 HydrophobicContact CZ-CD1 3.89Å; F437-L522 HydrophobicContact CZ-CD2 4.15Å; F437-L522 HydrophobicContact CZ-CG 4.37Å; L440-L522 HydrophobicContact CD1-CB 3.94Å; L499-L522 HydrophobicContact CD2-CD2 4.48Å; Y517-L522 HydrophobicContact CE2-CD2 3.79Å; Y517-L522 WeakPolarHBondContact OH-CD2 3.25Å; E520-L522 PolarHBondContact O-N 2.89Å; E520-L522 VanDerWaalsContact O-N 3.15Å; L522-K524 VanDerWaalsContact C-N 3.25Å; L522-K524 PolarHBondContact O-N 3.21Å; L522-I525 HydrophobicContact CD2-CD1 3.66Å; L522-I525 PolarHBondContact O-N 2.9Å; L522-L526 WeakPolarHBondContact O-CG 3.27Å; L522-L526 PolarHBondContact O-N 3.03Å
523	L	91.1	Very high	90.1	Very high	49 Å²	49	55 Å²	55	26%	0.257	30%	0.296	S	S	.	.	H	α-helix	trans	-66.8	-26.2	172.8	-69.2	172.9	0	0	0	113	L357 L440 N521 R527	L357-L523 HydrophobicContact CD1-CD2 3.76Å; L357-L523 HydrophobicContact CD2-CD2 3.86Å; L357-L523 HydrophobicContact CG-CD2 4.16Å; L440-L523 HydrophobicContact CD1-CD2 4.1Å; L440-L523 HydrophobicContact CD1-CG 4.33Å; L440-L523 HydrophobicContact CD2-CD2 3.72Å; L440-L523 HydrophobicContact CD2-CG 4.26Å; L440-L523 HydrophobicContact CG-CD2 4.5Å; N521-L523 PolarHBondContact O-N 3.15Å; N521-L523 VanDerWaalsContact O-N 3.14Å; N521-L523 WeakPolarHBondContact OD1-CB 3.34Å; N521-L523 PolarHBondContact OD1-N 3.3Å; L523-R527 WeakPolarHBondContact O-CG 3.35Å; L523-R527 PolarHBondContact O-N 3.31Å; L523-R527 PolarHBondContact O-NE 2.86Å
524	K	92.1	Very high	90.2	Very high	89 Å²	89	57.2 Å²	57.2	39%	0.387	31%	0.308	S	S	.	.	H	α-helix	trans	-73	-46.1	172	-178.7	-166.6	157.8	-152.2	0	109.2	E520 N521 L522 L526 R527 D528	E520-K524 IonicContact OE2-NZ 3.65Å; E520-K524 PolarHBondContact OE2-NZ 2.96Å; N521-K524 HydrophobicContact CB-CB 4.46Å; N521-K524 WeakPolarHBondContact O-CA 3.34Å; N521-K524 VanDerWaalsContact O-CB 3.24Å; N521-K524 WeakPolarHBondContact O-CB 3.34Å; N521-K524 PolarHBondContact O-N 3.48Å; L522-K524 VanDerWaalsContact C-N 3.25Å; L522-K524 PolarHBondContact O-N 3.21Å; K524-L526 VanDerWaalsContact C-N 3.34Å; K524-L526 PolarHBondContact O-N 2.73Å; K524-R527 CarbonylContact O-C 3.52Å; K524-R527 WeakPolarHBondContact O-CA 3.45Å; K524-R527 WeakPolarHBondContact O-CB 3.5Å; K524-R527 PolarHBondContact O-N 3.01Å; K524-D528 VanDerWaalsContact O-CG 3.28Å; K524-D528 PolarHBondContact O-N 3.3Å
525	I	93	Very high	90.5	Very high	14 Å²	14	57.7 Å²	57.7	7%	0.072	31%	0.306	C	S	.	.	H	α-helix	trans	-58	-44.3	177.6	-69	155.7	0	0	0	111.6	L499 Y517 E520 N521 L522 R527 D528 I529	L499-I525 HydrophobicContact CD1-CD1 3.58Å; L499-I525 HydrophobicContact CD1-CG1 4.43Å; L499-I525 HydrophobicContact CD1-CG2 4.46Å; Y517-I525 HydrophobicContact CD2-CD1 4.13Å; Y517-I525 HydrophobicContact CE2-CD1 3.79Å; E520-I525 HydrophobicContact CB-CD1 4.4Å; N521-I525 PolarHBondContact O-N 3.46Å; L522-I525 HydrophobicContact CD2-CD1 3.66Å; L522-I525 PolarHBondContact O-N 2.9Å; I525-R527 VanDerWaalsContact C-N 3.3Å; I525-R527 PolarHBondContact O-N 3.16Å; I525-D528 PolarHBondContact O-N 3.43Å; I525-D528 VanDerWaalsContact O-N 3.1Å; I525-I529 HydrophobicContact CG2-CD1 4.04Å; I525-I529 VanDerWaalsContact O-CG1 3.32Å; I525-I529 WeakPolarHBondContact O-CG1 3.3Å; I525-I529 PolarHBondContact O-N 3.45Å
526	L	94.9	Very high	91.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.9	-39	175.8	-69.9	171	0	0	0	112.4	L357 H360 L416 F437 L440 L522 K524 I529 E530	L357-L526 HydrophobicContact CD1-CD1 4.25Å; L357-L526 HydrophobicContact CD2-CB 4.13Å; L357-L526 HydrophobicContact CD2-CD1 3.69Å; H360-L526 PolarHBondContact CE1-O 3Å; H360-L526 PolarHBondContact NE2-O 3.39Å; L416-L526 HydrophobicContact CD2-CD2 3.42Å; L416-L526 VanDerWaalsContact CD2-CD2 3.42Å; F437-L526 HydrophobicContact CE1-CD1 4.43Å; F437-L526 HydrophobicContact CE1-CD2 4.05Å; F437-L526 HydrophobicContact CE1-CG 4.27Å; L440-L526 HydrophobicContact CB-CD1 4.45Å; L440-L526 HydrophobicContact CD1-CD1 4.15Å; L522-L526 WeakPolarHBondContact O-CG 3.27Å; L522-L526 PolarHBondContact O-N 3.03Å; K524-L526 VanDerWaalsContact C-N 3.34Å; K524-L526 PolarHBondContact O-N 2.73Å; L526-I529 HydrophobicContact CD2-CD1 4.48Å; L526-I529 PolarHBondContact O-N 3.5Å; L526-E530 PolarHBondContact O-N 2.9Å; L526-E530 VanDerWaalsContact O-N 3.16Å
527	R	93.8	Very high	91.6	Very high	129 Å²	129	57.9 Å²	57.9	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-68.8	-36.7	173.3	-75.3	178.9	-76.9	162	-5.2	112.4	L523 K524 I525 I529 E530 N531	L523-R527 WeakPolarHBondContact O-CG 3.35Å; L523-R527 PolarHBondContact O-N 3.31Å; L523-R527 PolarHBondContact O-NE 2.86Å; K524-R527 CarbonylContact O-C 3.52Å; K524-R527 WeakPolarHBondContact O-CA 3.45Å; K524-R527 WeakPolarHBondContact O-CB 3.5Å; K524-R527 PolarHBondContact O-N 3.01Å; I525-R527 VanDerWaalsContact C-N 3.3Å; I525-R527 PolarHBondContact O-N 3.16Å; R527-I529 VanDerWaalsContact C-N 3.29Å; R527-I529 PolarHBondContact O-N 3.41Å; R527-E530 PolarHBondContact O-N 2.93Å; R527-N531 PolarHBondContact O-N 3.42Å; R527-N531 VanDerWaalsContact O-N 3.13Å; R527-N531 PolarHBondContact O-ND2 3.17Å
528	D	93.7	Very high	92.2	Very high	54 Å²	54	56.8 Å²	56.8	29%	0.289	29%	0.291	S	S	.	.	H	α-helix	trans	-67.4	-33.1	177.2	-64.4	-21.9	0	0	0	111.1	W513 K524 I525 N531 S532	W513-D528 HydrophobicContact CZ3-CB 4Å; K524-D528 VanDerWaalsContact O-CG 3.28Å; K524-D528 PolarHBondContact O-N 3.3Å; I525-D528 PolarHBondContact O-N 3.43Å; I525-D528 VanDerWaalsContact O-N 3.1Å; D528-N531 CarbonylContact O-C 3.24Å; D528-N531 PolarHBondContact O-N 3.18Å; D528-S532 PolarHBondContact O-N 3.29Å; D528-S532 VanDerWaalsContact O-N 3.12Å
529	I	95.4	Very high	92.9	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-65	-44.2	171.6	-66.3	164.6	0	0	0	111.1	L416 L470 C497 W513 I525 L526 R527 N531 S532 L759	L416-I529 HydrophobicContact CD1-CG2 4.47Å; L416-I529 HydrophobicContact CD2-CD1 4.21Å; L470-I529 HydrophobicContact CD1-CD1 4.15Å; L470-I529 HydrophobicContact CD2-CD1 4.2Å; C497-I529 HydrophobicContact CB-CG1 4.4Å; W513-I529 HydrophobicContact CH2-CB 4.46Å; W513-I529 HydrophobicContact CH2-CG1 3.8Å; W513-I529 HydrophobicContact CZ3-CG1 4.18Å; I525-I529 HydrophobicContact CG2-CD1 4.04Å; I525-I529 VanDerWaalsContact O-CG1 3.32Å; I525-I529 WeakPolarHBondContact O-CG1 3.3Å; I525-I529 PolarHBondContact O-N 3.45Å; L526-I529 HydrophobicContact CD2-CD1 4.48Å; L526-I529 PolarHBondContact O-N 3.5Å; R527-I529 VanDerWaalsContact C-N 3.29Å; R527-I529 PolarHBondContact O-N 3.41Å; I529-N531 VanDerWaalsContact C-N 3.25Å; I529-N531 PolarHBondContact O-N 2.81Å; I529-S532 VanDerWaalsContact O-CB 3.3Å; I529-S532 WeakPolarHBondContact O-CB 3.49Å; I529-S532 PolarHBondContact O-N 2.89Å; I529-S532 VanDerWaalsContact O-N 3.14Å; I529-S532 PolarHBondContact O-OG 2.93Å; I529-L759 HydrophobicContact CG2-CD1 4.08Å
530	E	93.3	Very high	93.8	Very high	87 Å²	87	47 Å²	47	41%	0.407	23%	0.233	S	C	.	.	H	α-helix	trans	-60.2	-36.3	176.5	-172.9	-176.7	170.6	0	0	112.2	L526 R527 S532	L526-E530 PolarHBondContact O-N 2.9Å; L526-E530 VanDerWaalsContact O-N 3.16Å; R527-E530 PolarHBondContact O-N 2.93Å; E530-S532 VanDerWaalsContact C-N 3.33Å
531	N	92.8	Very high	94.4	Very high	108 Å²	108	46.7 Å²	46.7	58%	0.578	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	7.2	178.9	-66.3	-69.1	0	0	0	114	R527 D528 I529	R527-N531 PolarHBondContact O-N 3.42Å; R527-N531 VanDerWaalsContact O-N 3.13Å; R527-N531 PolarHBondContact O-ND2 3.17Å; D528-N531 CarbonylContact O-C 3.24Å; D528-N531 PolarHBondContact O-N 3.18Å; I529-N531 VanDerWaalsContact C-N 3.25Å; I529-N531 PolarHBondContact O-N 2.81Å
532	S	95.4	Very high	94.7	Very high	21 Å²	21	42.6 Å²	42.6	15%	0.147	21%	0.209	C	C	.	.			trans	-77.6	159.8	-178	70.5	0	0	0	0	112	D528 I529 E530 M760	D528-S532 PolarHBondContact O-N 3.29Å; D528-S532 VanDerWaalsContact O-N 3.12Å; I529-S532 VanDerWaalsContact O-CB 3.3Å; I529-S532 WeakPolarHBondContact O-CB 3.49Å; I529-S532 PolarHBondContact O-N 2.89Å; I529-S532 VanDerWaalsContact O-N 3.14Å; I529-S532 PolarHBondContact O-OG 2.93Å; E530-S532 VanDerWaalsContact C-N 3.33Å; S532-M760 WeakPolarHBondContact CA-O 3.28Å; S532-M760 VanDerWaalsContact CB-O 3.3Å; S532-M760 WeakPolarHBondContact CB-O 3.48Å
533	T	95.1	Very high	94.9	Very high	82 Å²	82	44.9 Å²	44.9	50%	0.503	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.3	176.1	55.2	0	0	0	0	110.4	M760	T533-M760 PolarHBondContact N-O 2.96Å; T533-M760 PolarHBondContact O-N 3.39Å
534	E	95.3	Very high	95	Very high	86 Å²	86	44.3 Å²	44.3	40%	0.402	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	134.2	174.7	-165.8	177.5	150	0	0	111.1	R492 P495 H757 M758 L759	R492-E534 IonicContact NH2-OE2 2.82Å; P495-E534 HydrophobicContact CB-CG 4.16Å; E534-H757 IonicContact OE1-CE1 3.85Å; E534-H757 IonicContact OE1-CG 3.87Å; E534-H757 IonicContact OE1-ND1 3.6Å; E534-H757 PolarHBondContact OE1-ND1 3.09Å; E534-M758 CarbonylContact C-O 3.5Å; E534-M758 WeakPolarHBondContact CA-O 3.34Å; E534-L759 HydrophobicContact CB-CD2 4.42Å
535	V	95.6	Very high	95	Very high	32 Å²	32	44.5 Å²	44.5	19%	0.194	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	151.2	175.7	-59.9	0	0	0	0	109.3	L511 L688 M758 M760	L511-V535 HydrophobicContact CD2-CG2 3.63Å; V535-L688 HydrophobicContact CG2-CD1 4.34Å; V535-M758 HydrophobicContact CG2-CB 4.02Å; V535-M758 PolarHBondContact N-O 3.21Å; V535-M758 PolarHBondContact O-N 2.77Å; V535-M760 HydrophobicContact CG1-CB 3.98Å; V535-M760 HydrophobicContact CG1-CE 3.98Å; V535-M760 HydrophobicContact CG1-SD 4.41Å; V535-M760 HydrophobicContact CG2-CB 4.13Å; V535-M760 HydrophobicContact CG2-CE 4.17Å
536	M	96.5	Very high	94.6	Very high	51 Å²	51	46.6 Å²	46.6	25%	0.251	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.6	174.7	-57.5	-55.6	-63.5	0	0	109.5	L688 S689 Q755 A756 H757	M536-L688 WeakPolarHBondContact O-CD1 3.5Å; M536-S689 VanDerWaalsContact O-CB 3.3Å; M536-S689 WeakPolarHBondContact O-CB 3.38Å; M536-Q755 HydrophobicContact CB-CB 4.35Å; M536-Q755 HydrophobicContact CE-CB 3.41Å; M536-Q755 VanDerWaalsContact CE-CB 3.41Å; M536-Q755 HydrophobicContact CE-CG 4.43Å; M536-A756 CarbonylContact C-O 3.54Å; M536-A756 WeakPolarHBondContact CA-O 3.48Å; M536-H757 VanDerWaalsContact SD-CE1 3.57Å
537	L	97.1	Very high	93.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.9	170.8	172.9	67.9	0	0	0	108.7	L482 L507 I642 L688 Q755 A756 M758	L482-L537 HydrophobicContact CD1-CD2 4.38Å; L507-L537 HydrophobicContact CD1-CD1 4.12Å; L507-L537 HydrophobicContact CD1-CD2 3.98Å; L507-L537 HydrophobicContact CD2-CD2 4.12Å; L537-I642 HydrophobicContact CD1-CG2 3.98Å; L537-L688 CarbonylContact C-O 3.57Å; L537-L688 WeakPolarHBondContact CA-O 3.42Å; L537-L688 HydrophobicContact CD1-CB 4.1Å; L537-Q755 CarbonylContact O-C 3.53Å; L537-Q755 WeakPolarHBondContact O-CA 3.47Å; L537-A756 HydrophobicContact CB-CB 4.47Å; L537-A756 PolarHBondContact N-O 3.19Å; L537-A756 PolarHBondContact O-N 2.91Å; L537-M758 HydrophobicContact CB-CG 3.54Å; L537-M758 HydrophobicContact CD2-CG 4Å; L537-M758 HydrophobicContact CD2-SD 4.17Å; L537-M758 HydrophobicContact CG-CG 4.41Å
538	D	97.4	Very high	92.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	138.5	171.6	-67.5	-40.6	0	0	0	110.3	W540 N641 L688 S689 D690 Q691 H752 Q755	D538-W540 HydrophobicContact CB-CZ2 4.31Å; D538-N641 PolarHBondContact O-ND2 3.24Å; D538-L688 PolarHBondContact N-O 3.35Å; D538-S689 WeakPolarHBondContact OD2-CA 3.35Å; D538-S689 PolarHBondContact OD2-N 2.72Å; D538-D690 PolarHBondContact OD2-N 2.74Å; D538-Q691 VanDerWaalsContact OD2-CA 3.3Å; D538-Q691 WeakPolarHBondContact OD2-CA 3.5Å; D538-Q691 PolarHBondContact OD2-N 3.03Å; D538-H752 IonicContact OD1-CD2 3.53Å; D538-H752 IonicContact OD1-NE2 3.64Å; D538-Q755 VanDerWaalsContact OD1-CG 3.22Å; D538-Q755 WeakPolarHBondContact OD1-CG 3.44Å; D538-Q755 PolarHBondContact OD1-NE2 2.89Å
539	R	96.8	Very high	91.1	Very high	2 Å²	2	56 Å²	56	1%	0.008	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.8	176.6	-65.8	175.2	64.6	-151.7	-2.1	108.8	D486 I560 N562 K753 N754 A756	D486-R539 IonicContact OD1-NH1 3.46Å; D486-R539 PolarHBondContact OD1-NH1 3.25Å; D486-R539 IonicContact OD2-CZ 2.73Å; D486-R539 IonicContact OD2-NH1 3.97Å; D486-R539 PolarHBondContact OD2-NH1 2.81Å; D486-R539 IonicContact OD2-NH2 2.79Å; D486-R539 PolarHBondContact OD2-NH2 3.13Å; R539-I560 HydrophobicContact CB-CG2 4.32Å; R539-N562 PolarHBondContact NE-OD1 3.4Å; R539-K753 WeakPolarHBondContact O-CA 3.28Å; R539-K753 VanDerWaalsContact O-CB 3.28Å; R539-K753 WeakPolarHBondContact O-CB 3.22Å; R539-K753 PolarHBondContact O-N 2.66Å; R539-N754 WeakPolarHBondContact CB-OD1 3.48Å; R539-N754 PolarHBondContact N-O 2.75Å; R539-N754 PolarHBondContact O-N 2.92Å; R539-A756 HydrophobicContact CG-CB 4.47Å
540	W	97.2	Very high	89.4	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.7	-166.6	-61.5	86.7	0	0	0	110	D538 I560 M561 N641 Q691 L693 S722 I750 V751 H752	D538-W540 HydrophobicContact CB-CZ2 4.31Å; W540-I560 CarbonylContact O-C 3.59Å; W540-I560 VanDerWaalsContact O-CA 3.3Å; W540-I560 WeakPolarHBondContact O-CA 3.49Å; W540-M561 HydrophobicContact CB-CB 4.28Å; W540-M561 HydrophobicContact CB-CE 3.71Å; W540-M561 HydrophobicContact CG-CE 3.76Å; W540-M561 PolarHBondContact N-O 2.73Å; W540-M561 PolarHBondContact O-N 3.45Å; W540-N641 VanDerWaalsContact NE1-CG 3.33Å; W540-N641 PolarHBondContact NE1-OD1 3.19Å; W540-Q691 WeakPolarHBondContact CH2-O 3.15Å; W540-L693 HydrophobicContact CD2-CD1 3.75Å; W540-L693 HydrophobicContact CD2-CD2 3.71Å; W540-L693 HydrophobicContact CD2-CG 3.79Å; W540-L693 VanDerWaalsContact CE2-CD2 3.43Å; W540-L693 HydrophobicContact CE3-CD1 3.47Å; W540-L693 VanDerWaalsContact CE3-CD1 3.47Å; W540-L693 HydrophobicContact CE3-CD2 4.3Å; W540-L693 HydrophobicContact CE3-CG 3.87Å; W540-L693 HydrophobicContact CG-CD1 4.43Å; W540-L693 HydrophobicContact CG-CD2 4Å; W540-L693 HydrophobicContact CH2-CD1 4.04Å; W540-L693 HydrophobicContact CH2-CD2 4.42Å; W540-L693 HydrophobicContact CH2-CG 3.68Å; W540-L693 HydrophobicContact CZ2-CD1 4.28Å; W540-L693 HydrophobicContact CZ2-CD2 3.84Å; W540-L693 HydrophobicContact CZ2-CG 3.58Å; W540-L693 HydrophobicContact CZ3-CD1 3.62Å; W540-L693 HydrophobicContact CZ3-CG 3.82Å; W540-S722 VanDerWaalsContact CZ3-O 3.3Å; W540-S722 WeakPolarHBondContact CZ3-O 3.23Å; W540-I750 HydrophobicContact CB-CG2 4.02Å; W540-I750 HydrophobicContact CE3-CG2 4.38Å; W540-V751 CarbonylContact C-O 3.52Å; W540-V751 WeakPolarHBondContact CA-O 3.25Å; W540-H752 HydrophobicContact CE3-CB 4.06Å; W540-H752 VanDerWaalsContact CE3-N 3.26Å; W540-H752 HydrophobicContact CH2-CB 4.11Å; W540-H752 HydrophobicContact CZ3-CB 3.74Å
541	K	96.6	Very high	88	Confident	80 Å²	80	66.1 Å²	66.1	35%	0.348	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	133.5	173.2	-169.5	-175.1	-178.2	-139.6	0	108.6	D543 S559 I750 V751 K753	K541-D543 WeakPolarHBondContact CE-OD1 3.25Å; K541-D543 WeakPolarHBondContact CE-OD2 3.5Å; K541-D543 IonicContact NZ-OD1 2.9Å; K541-D543 PolarHBondContact NZ-OD1 3.11Å; K541-D543 IonicContact NZ-OD2 3.83Å; K541-D543 PolarHBondContact NZ-OD2 3.4Å; K541-S559 CarbonylContact C-O 3.57Å; K541-S559 WeakPolarHBondContact CA-O 3.28Å; K541-I750 WeakPolarHBondContact O-CA 3.33Å; K541-V751 HydrophobicContact CB-CG2 4.22Å; K541-V751 PolarHBondContact N-O 3.45Å; K541-V751 PolarHBondContact O-N 2.77Å; K541-K753 HydrophobicContact CB-CB 4.12Å
542	I	95.6	Very high	86.5	Confident	4 Å²	4	72.8 Å²	72.8	2%	0.021	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.1	172	-55.9	-163.6	0	0	0	108	V544 S559 M561 F565 I736 I748 Q749 I750	I542-V544 HydrophobicContact CG2-CG2 4.01Å; I542-S559 PolarHBondContact N-O 2.86Å; I542-M561 HydrophobicContact CD1-CB 3.87Å; I542-M561 HydrophobicContact CD1-SD 4.32Å; I542-M561 HydrophobicContact CG1-CB 4.2Å; I542-F565 HydrophobicContact CD1-CB 3.93Å; I542-F565 HydrophobicContact CD1-CD2 3.91Å; I542-F565 HydrophobicContact CD1-CG 3.98Å; I542-I736 HydrophobicContact CD1-CD1 3.69Å; I542-I736 HydrophobicContact CD1-CG1 4.17Å; I542-I736 HydrophobicContact CG1-CD1 4.31Å; I542-I748 HydrophobicContact CG2-CG2 3.69Å; I542-Q749 WeakPolarHBondContact CA-O 3.37Å; I542-I750 HydrophobicContact CD1-CD1 4.24Å; I542-I750 HydrophobicContact CD1-CG1 4.32Å; I542-I750 HydrophobicContact CG1-CG1 4.15Å; I542-I750 HydrophobicContact CG1-CG2 4.35Å
543	D	94.7	Very high	85.1	Confident	53 Å²	53	73.5 Å²	73.5	28%	0.283	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.7	172.4	-71.6	-47.8	0	0	0	108.8	K541 I748 Q749	K541-D543 WeakPolarHBondContact CE-OD1 3.25Å; K541-D543 WeakPolarHBondContact CE-OD2 3.5Å; K541-D543 IonicContact NZ-OD1 2.9Å; K541-D543 PolarHBondContact NZ-OD1 3.11Å; K541-D543 IonicContact NZ-OD2 3.83Å; K541-D543 PolarHBondContact NZ-OD2 3.4Å; D543-I748 CarbonylContact O-C 3.5Å; D543-I748 WeakPolarHBondContact O-CA 3.45Å; D543-Q749 HydrophobicContact CB-CB 4.49Å; D543-Q749 PolarHBondContact N-O 3.26Å; D543-Q749 PolarHBondContact O-N 3.27Å
544	V	93.5	Very high	84.2	Confident	38 Å²	38	73.2 Å²	73.2	23%	0.23	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121	178.8	-175.4	0	0	0	0	108.8	I542 V556 Q743 C746 I748	I542-V544 HydrophobicContact CG2-CG2 4.01Å; V544-V556 HydrophobicContact CB-CG2 4Å; V544-V556 HydrophobicContact CG1-CG2 4.27Å; V544-V556 HydrophobicContact CG2-CG1 4.29Å; V544-V556 HydrophobicContact CG2-CG2 3.95Å; V544-Q743 HydrophobicContact CG1-CG 4.4Å; V544-C746 HydrophobicContact CG1-CB 3.94Å; V544-I748 HydrophobicContact CG1-CG1 4.45Å; V544-I748 HydrophobicContact CG2-CG1 4.4Å; V544-I748 HydrophobicContact CG2-CG2 4.43Å
545	T	91.9	Very high	83.6	Confident	93 Å²	93	74.5 Å²	74.5	57%	0.571	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	110.5	177.5	-53.9	0	0	0	0	109	C746 T747	T545-C746 CarbonylContact O-C 3.57Å; T545-C746 VanDerWaalsContact O-CA 3.3Å; T545-C746 WeakPolarHBondContact O-CA 3.36Å; T545-C746 WeakPolarHBondContact O-CB 3.1Å; T545-T747 PolarHBondContact N-O 3.18Å; T545-T747 PolarHBondContact O-N 2.79Å
546	S	84.6	Confident	83.1	Confident	58 Å²	58	75.6 Å²	75.6	41%	0.406	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	139.5	176.4	-56	0	0	0	0	111.1
547	A	77.3	Confident	82.4	Confident	69 Å²	69	75.6 Å²	75.6	57%	0.57	40%	0.4	S	S	*	.	S	Bend	trans	-72.2	-36.2	175	0	0	0	0	0	111.6	P745	A547-P745 HydrophobicContact CB-CB 4.26Å; A547-P745 WeakPolarHBondContact CB-O 3.4Å; A547-P745 PolarHBondContact N-O 3.37Å
548	D	70.3	Confident	81.7	Confident	98 Å²	98	81.7 Å²	81.7	52%	0.524	42%	0.424	S	S	.	.			trans	-117.5	134.5	179	-78.3	-47.2	0	0	0	111.8
549	K	61.4	Low	81.4	Confident	212 Å²	212	84.8 Å²	84.8	92%	0.922	45%	0.446	S	S	*	.	S	Bend	trans	-84.1	-11.5	-179.7	-68.5	-175.3	179.6	179.9	0	113.9
550	E	60	Low	81.2	Confident	185 Å²	185	85.6 Å²	85.6	86%	0.864	45%	0.45	S	S	*	.	S	Bend	trans	-97.3	-25.2	-172.3	-64.5	-171.9	169.6	0	0	113.8
551	E	63.7	Low	81.1	Confident	116 Å²	116	85.6 Å²	85.6	54%	0.542	45%	0.45	S	S	.	.			trans	-83.1	119.3	175.9	-70.9	-165.4	159.3	0	0	111.7	G553 T744	E551-G553 PolarHBondContact O-N 2.82Å; E551-T744 HydrophobicContact CB-CG2 4.07Å
552	R	59.9	Low	81.1	Confident	248 Å²	248	82.2 Å²	82.2	94%	0.936	44%	0.436	S	S	*	.			trans	-85.3	101.3	174	-65.3	-175.5	-166.7	-175	3.8	110
553	G	66.2	Low	81	Confident	36 Å²	36	82.2 Å²	82.2	37%	0.371	44%	0.436	S	S	.	.			trans	-83.4	-178.6	163.9	0	0	0	0	0	112.5	E551	E551-G553 PolarHBondContact O-N 2.82Å
554	D	77.6	Confident	80.9	Confident	76 Å²	76	80.5 Å²	80.5	41%	0.406	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-68	146.8	172	-64.5	-25.4	0	0	0	110.2	W741 M742	D554-W741 HydrophobicContact CB-CB 3.97Å; D554-M742 PolarHBondContact N-O 2.96Å; D554-M742 WeakPolarHBondContact OD2-CB 3.31Å; D554-M742 PolarHBondContact OD2-N 3.4Å
555	P	81.8	Confident	81	Confident	113 Å²	113	78.8 Å²	78.8	73%	0.734	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-65.7	140.1	174.9	27.9	-33.8	0	0	0	110.9
556	V	84.6	Confident	81.1	Confident	56 Å²	56	74.3 Å²	74.3	34%	0.339	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-64.4	124.6	174.3	-178	0	0	0	0	108.9	V544 Y558 W741	V544-V556 HydrophobicContact CB-CG2 4Å; V544-V556 HydrophobicContact CG1-CG2 4.27Å; V544-V556 HydrophobicContact CG2-CG1 4.29Å; V544-V556 HydrophobicContact CG2-CG2 3.95Å; V556-Y558 WeakPolarHBondContact CG1-O 3.41Å; V556-W741 HydrophobicContact CG1-CH2 4.37Å; V556-W741 HydrophobicContact CG1-CZ2 4.07Å; V556-W741 HydrophobicContact CG2-CZ2 4.46Å
557	P	82.6	Confident	81.6	Confident	51 Å²	51	71.6 Å²	71.6	33%	0.331	37%	0.368	S	S	.	.	S	Bend	trans	-71.3	-38.1	-170	26.1	-34.4	0	0	0	113	I736 E739 W741	P557-I736 HydrophobicContact CG-CG2 3.81Å; P557-E739 HydrophobicContact CB-CB 4.48Å; P557-E739 HydrophobicContact CG-CB 4.43Å; P557-W741 HydrophobicContact CG-CD2 4.23Å; P557-W741 HydrophobicContact CG-CE3 3.58Å; P557-W741 HydrophobicContact CG-CZ3 3.84Å
558	Y	83.1	Confident	82.4	Confident	127 Å²	127	68.3 Å²	68.3	50%	0.498	34%	0.341	S	S	.	.			trans	-146.6	151.2	178.4	-52.5	-81.9	0	0	0	111.5	V556 I736 E739	V556-Y558 WeakPolarHBondContact CG1-O 3.41Å; Y558-I736 HydrophobicContact CD2-CG2 3.98Å; Y558-E739 HydrophobicContact CD2-CB 4.37Å; Y558-E739 HydrophobicContact CE2-CB 3.85Å; Y558-E739 HydrophobicContact CE2-CG 3.77Å
559	S	89.7	Confident	83.2	Confident	65 Å²	65	63.7 Å²	63.7	46%	0.455	32%	0.317	S	S	.	.	S	Bend	trans	-99.3	6.6	173.9	59.1	0	0	0	0	113.6	K541 I542	K541-S559 CarbonylContact C-O 3.57Å; K541-S559 WeakPolarHBondContact CA-O 3.28Å; I542-S559 PolarHBondContact N-O 2.86Å
560	I	94	Very high	84.4	Confident	20 Å²	20	53.8 Å²	53.8	10%	0.103	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.1	-176.8	-53.8	163	0	0	0	109.7	R539 W540 I736 K753	R539-I560 HydrophobicContact CB-CG2 4.32Å; W540-I560 CarbonylContact O-C 3.59Å; W540-I560 VanDerWaalsContact O-CA 3.3Å; W540-I560 WeakPolarHBondContact O-CA 3.49Å; I560-I736 WeakPolarHBondContact O-CD1 3.36Å; I560-K753 HydrophobicContact CD1-CD 4.22Å; I560-K753 HydrophobicContact CG1-CD 4.1Å; I560-K753 HydrophobicContact CG2-CD 4.4Å
561	M	94.9	Very high	85.8	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.5	175.1	179.8	-173.1	75.3	0	0	110.2	W540 I542 F565 I639 N641 L693 I736 I750	W540-M561 HydrophobicContact CB-CB 4.28Å; W540-M561 HydrophobicContact CB-CE 3.71Å; W540-M561 HydrophobicContact CG-CE 3.76Å; W540-M561 PolarHBondContact N-O 2.73Å; W540-M561 PolarHBondContact O-N 3.45Å; I542-M561 HydrophobicContact CD1-CB 3.87Å; I542-M561 HydrophobicContact CD1-SD 4.32Å; I542-M561 HydrophobicContact CG1-CB 4.2Å; M561-F565 HydrophobicContact CG-CB 4.48Å; M561-F565 HydrophobicContact SD-CB 3.42Å; M561-F565 WeakPolarHBondContact SD-CB 3.48Å; M561-F565 PolarHBondContact SD-N 3.09Å; M561-I639 HydrophobicContact CE-CG2 4.4Å; M561-N641 HydrophobicContact CE-CB 4.36Å; M561-L693 HydrophobicContact CE-CD1 4.49Å; M561-L693 HydrophobicContact CE-CD2 3.58Å; M561-I736 HydrophobicContact CB-CD1 3.94Å; M561-I736 HydrophobicContact CB-CG1 4Å; M561-I736 HydrophobicContact CG-CG1 4.28Å; M561-I750 HydrophobicContact CE-CG2 4.23Å
562	N	94.9	Very high	87	Confident	9 Å²	9	40.1 Å²	40.1	5%	0.048	21%	0.212	C	C	.	.	S	Bend	trans	-110.7	-30.3	176.6	-47.5	-82.4	0	0	0	112	R539 N641 D737	R539-N562 PolarHBondContact NE-OD1 3.4Å; N562-N641 PolarHBondContact O-ND2 3.12Å; N562-D737 WeakPolarHBondContact CB-OD2 3.36Å; N562-D737 PolarHBondContact N-OD1 3.42Å; N562-D737 PolarHBondContact N-OD2 2.92Å; N562-D737 PolarHBondContact ND2-OD2 2.94Å
563	N	94	Very high	88.2	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.016	17%	0.167	C	C	.	.	S	Bend	trans	-111.6	-67.5	-177	-63.5	-10.1	0	0	0	111.2	D475 N641 I642 D737	D475-N563 PolarHBondContact OD1-ND2 2.89Å; N563-N641 VanDerWaalsContact O-CB 3.31Å; N563-N641 WeakPolarHBondContact O-CB 3.36Å; N563-N641 PolarHBondContact O-N 2.89Å; N563-I642 HydrophobicContact CB-CD1 3.74Å; N563-I642 HydrophobicContact CB-CG1 4.04Å; N563-I642 PolarHBondContact O-N 3.28Å; N563-D737 WeakPolarHBondContact CA-OD1 3.49Å; N563-D737 VanDerWaalsContact CB-OD1 3.3Å; N563-D737 WeakPolarHBondContact CB-OD1 3.33Å; N563-D737 PolarHBondContact N-OD1 3.5Å
564	Y	93.9	Very high	89.2	Confident	18 Å²	18	26.9 Å²	26.9	7%	0.071	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	156.7	-178	60.9	-90.1	0	0	0	112.7	I639 L640 M645 D737	Y564-I639 CarbonylContact C-O 3.59Å; Y564-I639 WeakPolarHBondContact CA-O 3.4Å; Y564-I639 VanDerWaalsContact CB-O 3.26Å; Y564-I639 WeakPolarHBondContact CB-O 3.28Å; Y564-L640 HydrophobicContact CD2-CD2 4.5Å; Y564-L640 HydrophobicContact CG-CD2 4.05Å; Y564-M645 HydrophobicContact CD1-CB 4.25Å; Y564-M645 HydrophobicContact CE1-CB 4Å; Y564-D737 PolarHBondContact N-OD1 2.84Å; Y564-D737 PolarHBondContact O-N 2.8Å
565	F	95.4	Very high	89.7	Confident	1 Å²	1	25.9 Å²	25.9	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.8	174.3	167.8	-97.3	0	0	0	108.6	I542 M561 I567 A638 I639 I726 M734 Q735 I736 W741 I748 I750	I542-F565 HydrophobicContact CD1-CB 3.93Å; I542-F565 HydrophobicContact CD1-CD2 3.91Å; I542-F565 HydrophobicContact CD1-CG 3.98Å; M561-F565 HydrophobicContact CG-CB 4.48Å; M561-F565 HydrophobicContact SD-CB 3.42Å; M561-F565 WeakPolarHBondContact SD-CB 3.48Å; M561-F565 PolarHBondContact SD-N 3.09Å; F565-I567 HydrophobicContact CE1-CD1 3.73Å; F565-I567 HydrophobicContact CE1-CG1 3.49Å; F565-I567 VanDerWaalsContact CE1-CG1 3.49Å; F565-I567 HydrophobicContact CZ-CD1 3.92Å; F565-I567 HydrophobicContact CZ-CG1 3.53Å; F565-A638 CarbonylContact O-C 3.43Å; F565-A638 WeakPolarHBondContact O-CA 3.14Å; F565-I639 HydrophobicContact CB-CB 4.47Å; F565-I639 HydrophobicContact CD1-CG1 4.04Å; F565-I639 PolarHBondContact N-O 2.89Å; F565-I639 PolarHBondContact O-N 3.07Å; F565-I726 HydrophobicContact CE1-CD1 4.17Å; F565-M734 HydrophobicContact CE2-CB 4.1Å; F565-M734 HydrophobicContact CE2-SD 4.35Å; F565-M734 HydrophobicContact CZ-CB 4.31Å; F565-M734 HydrophobicContact CZ-CG 4.38Å; F565-M734 HydrophobicContact CZ-SD 3.91Å; F565-Q735 WeakPolarHBondContact CA-O 3.43Å; F565-Q735 WeakPolarHBondContact CD2-O 3.25Å; F565-I736 HydrophobicContact CD2-CB 4.38Å; F565-W741 HydrophobicContact CD2-CH2 4.18Å; F565-W741 AromaticContact CE2-CH2 3.63Å; F565-W741 HydrophobicContact CE2-CH2 3.63Å; F565-W741 HydrophobicContact CE2-CZ2 4.21Å; F565-W741 HydrophobicContact CE2-CZ3 4.47Å; F565-I748 HydrophobicContact CE1-CD1 4.24Å; F565-I748 HydrophobicContact CZ-CD1 3.7Å; F565-I750 HydrophobicContact CD1-CD1 3.85Å; F565-I750 HydrophobicContact CE1-CD1 4.44Å; F565-I750 HydrophobicContact CG-CD1 4.32Å
566	S	94.3	Very high	89.9	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154	175.9	69	0	0	0	0	113	D570 I637 M734 Q735	S566-D570 WeakPolarHBondContact CB-OD2 3.46Å; S566-D570 PolarHBondContact OG-OD2 3.41Å; S566-I637 CarbonylContact C-O 3.52Å; S566-I637 WeakPolarHBondContact CA-O 3.29Å; S566-I637 VanDerWaalsContact CB-O 3.32Å; S566-I637 WeakPolarHBondContact CB-O 3.41Å; S566-M734 WeakPolarHBondContact O-CA 3.24Å; S566-Q735 PolarHBondContact N-O 3.23Å; S566-Q735 PolarHBondContact O-N 3.04Å; S566-Q735 WeakPolarHBondContact OG-CG 3.37Å; S566-Q735 PolarHBondContact OG-NE2 3.34Å
567	I	94.9	Very high	89.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139.5	176.3	-51.1	174.3	0	0	0	108.1	F565 L618 G636 I637 I726 L732 P733 M734 I748	F565-I567 HydrophobicContact CE1-CD1 3.73Å; F565-I567 HydrophobicContact CE1-CG1 3.49Å; F565-I567 VanDerWaalsContact CE1-CG1 3.49Å; F565-I567 HydrophobicContact CZ-CD1 3.92Å; F565-I567 HydrophobicContact CZ-CG1 3.53Å; I567-L618 HydrophobicContact CD1-CD2 3.95Å; I567-G636 VanDerWaalsContact O-CA 3.27Å; I567-G636 WeakPolarHBondContact O-CA 3.46Å; I567-I637 HydrophobicContact CB-CG2 3.79Å; I567-I637 HydrophobicContact CD1-CG2 4.21Å; I567-I637 HydrophobicContact CG1-CG2 4.18Å; I567-I637 PolarHBondContact N-O 3.39Å; I567-I637 PolarHBondContact O-N 2.9Å; I567-I726 HydrophobicContact CD1-CD1 4.05Å; I567-I726 HydrophobicContact CD1-CG2 3.87Å; I567-L732 HydrophobicContact CG2-CB 3.91Å; I567-L732 HydrophobicContact CG2-CD1 3.85Å; I567-L732 HydrophobicContact CG2-CG 4.39Å; I567-P733 WeakPolarHBondContact CA-O 3.25Å; I567-M734 HydrophobicContact CD1-CE 4.07Å; I567-M734 HydrophobicContact CD1-SD 4.42Å; I567-M734 HydrophobicContact CG1-CE 4.33Å; I567-M734 HydrophobicContact CG1-CG 4.04Å; I567-M734 HydrophobicContact CG1-SD 4.28Å; I567-M734 HydrophobicContact CG2-CE 4.3Å; I567-M734 HydrophobicContact CG2-CG 4.25Å; I567-I748 HydrophobicContact CD1-CD1 4.11Å
568	G	92.8	Very high	89.8	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	98.3	-137.4	173.9	0	0	0	0	0	113.4	D570 A571 S572 P733	G568-D570 VanDerWaalsContact C-N 3.3Å; G568-D570 PolarHBondContact O-N 2.87Å; G568-A571 PolarHBondContact O-N 3.35Å; G568-A571 VanDerWaalsContact O-N 3.11Å; G568-S572 PolarHBondContact O-N 2.78Å; G568-P733 PolarHBondContact N-O 3.09Å
569	V	87.2	Confident	89.9	Confident	2 Å²	2	16.4 Å²	16.4	1%	0.012	9%	0.086	C	C	.	.	H	α-helix	trans	-54.6	-40.8	-167.2	66.5	0	0	0	0	113.9	S572 I573 E605 C611 E635 A701 M704	V569-S572 PolarHBondContact O-N 3.24Å; V569-I573 HydrophobicContact CG2-CD1 4.31Å; V569-I573 VanDerWaalsContact O-CG1 3.32Å; V569-I573 WeakPolarHBondContact O-CG1 3.38Å; V569-I573 PolarHBondContact O-N 3.46Å; V569-I573 VanDerWaalsContact O-N 3.1Å; V569-E605 HydrophobicContact CG2-CB 4.45Å; V569-C611 HydrophobicContact CB-CB 4.49Å; V569-E635 HydrophobicContact CB-CB 4.3Å; V569-E635 HydrophobicContact CG1-CB 4.28Å; V569-E635 PolarHBondContact N-O 3.41Å; V569-A701 HydrophobicContact CG2-CB 3.83Å; V569-M704 HydrophobicContact CG1-CG 4.09Å
570	D	86.4	Confident	89.5	Confident	4 Å²	4	15.9 Å²	15.9	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-64.3	-50.7	177.9	176.9	48.1	0	0	0	112	S566 G568 S572 I573 A574 H646 L698 M704	S566-D570 WeakPolarHBondContact CB-OD2 3.46Å; S566-D570 PolarHBondContact OG-OD2 3.41Å; G568-D570 VanDerWaalsContact C-N 3.3Å; G568-D570 PolarHBondContact O-N 2.87Å; D570-S572 VanDerWaalsContact C-N 3.26Å; D570-S572 PolarHBondContact O-N 3.42Å; D570-I573 PolarHBondContact O-N 2.77Å; D570-I573 VanDerWaalsContact O-N 3.16Å; D570-A574 PolarHBondContact O-N 3.31Å; D570-H646 IonicContact OD1-CE1 3.34Å; D570-H646 PolarHBondContact OD1-CE1 3.08Å; D570-H646 IonicContact OD1-ND1 2.72Å; D570-H646 PolarHBondContact OD1-ND1 2.75Å; D570-H646 IonicContact OD1-NE2 3.61Å; D570-H646 IonicContact OD2-CE1 3.18Å; D570-H646 PolarHBondContact OD2-CE1 3.16Å; D570-L698 HydrophobicContact CB-CD1 4.39Å; D570-M704 HydrophobicContact CB-CE 3.69Å; D570-M704 HydrophobicContact CB-SD 4.39Å; D570-M704 VanDerWaalsContact OD1-CE 3.24Å; D570-M704 WeakPolarHBondContact OD1-CE 3.44Å
571	A	90.4	Very high	88.8	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.8	-35.7	176.6	0	0	0	0	0	112.3	G568 A574 H575 P733 M734 Q735	G568-A571 PolarHBondContact O-N 3.35Å; G568-A571 VanDerWaalsContact O-N 3.11Å; A571-A574 PolarHBondContact O-N 3.25Å; A571-H575 VanDerWaalsContact O-CB 3.3Å; A571-H575 WeakPolarHBondContact O-CB 3.34Å; A571-H575 PolarHBondContact O-N 2.8Å; A571-P733 VanDerWaalsContact CB-C 3.48Å; A571-P733 HydrophobicContact CB-CB 4.07Å; A571-P733 WeakPolarHBondContact CB-O 3.46Å; A571-M734 VanDerWaalsContact CB-CA 3.48Å; A571-Q735 HydrophobicContact CB-CB 4.1Å; A571-Q735 HydrophobicContact CB-CG 3.98Å
572	S	89.3	Confident	88	Confident	14 Å²	14	25.5 Å²	25.5	10%	0.098	12%	0.118	C	C	.	.	H	α-helix	trans	-63.7	-43	175.1	-165.3	0	0	0	0	112.1	G568 V569 D570 H575 R576 E605	G568-S572 PolarHBondContact O-N 2.78Å; V569-S572 PolarHBondContact O-N 3.24Å; D570-S572 VanDerWaalsContact C-N 3.26Å; D570-S572 PolarHBondContact O-N 3.42Å; S572-H575 PolarHBondContact O-N 3.29Å; S572-R576 WeakPolarHBondContact O-CG 3.32Å; S572-R576 PolarHBondContact O-N 3.13Å; S572-E605 PolarHBondContact OG-OE1 2.76Å
573	I	85.1	Confident	87.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-45.5	175.3	-65	163	0	0	0	110.2	V569 D570 H575 R576 F577 Y598 F601 E605	V569-I573 HydrophobicContact CG2-CD1 4.31Å; V569-I573 VanDerWaalsContact O-CG1 3.32Å; V569-I573 WeakPolarHBondContact O-CG1 3.38Å; V569-I573 PolarHBondContact O-N 3.46Å; V569-I573 VanDerWaalsContact O-N 3.1Å; D570-I573 PolarHBondContact O-N 2.77Å; D570-I573 VanDerWaalsContact O-N 3.16Å; I573-H575 VanDerWaalsContact C-N 3.33Å; I573-H575 PolarHBondContact O-N 3.46Å; I573-R576 PolarHBondContact O-N 3.39Å; I573-F577 WeakPolarHBondContact O-CB 3.24Å; I573-F577 PolarHBondContact O-N 3Å; I573-Y598 HydrophobicContact CG2-CD1 3.92Å; I573-Y598 HydrophobicContact CG2-CE1 4.42Å; I573-F601 HydrophobicContact CG2-CB 4.13Å; I573-E605 HydrophobicContact CG1-CB 4.17Å; I573-E605 HydrophobicContact CG1-CG 3.86Å
574	A	86.9	Confident	86.7	Confident	6 Å²	6	34.9 Å²	34.9	5%	0.05	16%	0.159	C	C	.	.	H	α-helix	trans	-59.3	-44.4	176.5	0	0	0	0	0	111.4	D570 A571 F577 H578 Q735 P740	D570-A574 PolarHBondContact O-N 3.31Å; A571-A574 PolarHBondContact O-N 3.25Å; A574-F577 WeakPolarHBondContact O-CB 3.46Å; A574-F577 PolarHBondContact O-N 3.35Å; A574-H578 WeakPolarHBondContact O-CB 3.3Å; A574-H578 PolarHBondContact O-N 3.46Å; A574-Q735 HydrophobicContact CB-CB 4.4Å; A574-Q735 HydrophobicContact CB-CG 4.42Å; A574-P740 HydrophobicContact CB-CB 4.03Å; A574-P740 HydrophobicContact CB-CG 4.34Å
575	H	87.6	Confident	85.7	Confident	55 Å²	55	37.9 Å²	37.9	26%	0.255	18%	0.18	S	C	.	.	H	α-helix	trans	-59.7	-49.6	176.9	-174.7	-96.8	0	0	0	112	A571 S572 I573 F577 H578 V579 P740	A571-H575 VanDerWaalsContact O-CB 3.3Å; A571-H575 WeakPolarHBondContact O-CB 3.34Å; A571-H575 PolarHBondContact O-N 2.8Å; S572-H575 PolarHBondContact O-N 3.29Å; I573-H575 VanDerWaalsContact C-N 3.33Å; I573-H575 PolarHBondContact O-N 3.46Å; H575-F577 VanDerWaalsContact C-N 3.31Å; H575-F577 PolarHBondContact O-N 2.64Å; H575-H578 PolarHBondContact O-N 3.07Å; H575-V579 WeakPolarHBondContact O-CG2 3.23Å; H575-V579 PolarHBondContact O-N 3.03Å; H575-P740 VanDerWaalsContact CA-CG 3.47Å; H575-P740 HydrophobicContact CB-CB 3.89Å; H575-P740 HydrophobicContact CB-CG 4.22Å
576	R	84.9	Confident	84.7	Confident	70 Å²	70	42.8 Å²	42.8	26%	0.264	20%	0.203	S	C	.	.	H	α-helix	trans	-59.2	-42.9	175.6	-70.7	-177.3	-172.2	-160.3	0.4	112.1	S572 I573 M580 F601 S604 E605	S572-R576 WeakPolarHBondContact O-CG 3.32Å; S572-R576 PolarHBondContact O-N 3.13Å; I573-R576 PolarHBondContact O-N 3.39Å; R576-M580 WeakPolarHBondContact O-CB 3.47Å; R576-M580 WeakPolarHBondContact O-CG 3.43Å; R576-M580 PolarHBondContact O-N 3.09Å; R576-F601 HydrophobicContact CB-CD2 4.5Å; R576-F601 HydrophobicContact CB-CG 4.37Å; R576-S604 PolarHBondContact NH1-OG 2.83Å; R576-E605 VanDerWaalsContact CZ-CD 3.4Å; R576-E605 IonicContact CZ-OE1 3.6Å; R576-E605 IonicContact NE-OE1 3.76Å; R576-E605 PolarHBondContact NE-OE1 2.8Å; R576-E605 IonicContact NH1-OE1 3.03Å; R576-E605 IonicContact NH2-OE1 2.73Å; R576-E605 PolarHBondContact NH2-OE1 3.43Å; R576-E605 IonicContact NH2-OE2 2.64Å
577	F	83.6	Confident	83.8	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-45.3	176.6	-180	-88	0	0	0	111.6	I573 A574 H575 M580 R581 F588 N594 W597 Y598 F601	I573-F577 WeakPolarHBondContact O-CB 3.24Å; I573-F577 PolarHBondContact O-N 3Å; A574-F577 WeakPolarHBondContact O-CB 3.46Å; A574-F577 PolarHBondContact O-N 3.35Å; H575-F577 VanDerWaalsContact C-N 3.31Å; H575-F577 PolarHBondContact O-N 2.64Å; F577-M580 PolarHBondContact O-N 3.24Å; F577-R581 VanDerWaalsContact O-CB 3.26Å; F577-R581 WeakPolarHBondContact O-CB 3.27Å; F577-R581 PolarHBondContact O-N 2.96Å; F577-F588 HydrophobicContact CD2-CD1 4.45Å; F577-F588 AromaticContact CD2-CE1 3.81Å; F577-F588 HydrophobicContact CD2-CE1 3.81Å; F577-F588 HydrophobicContact CE1-CD1 4.42Å; F577-F588 AromaticContact CE2-CD1 3.63Å; F577-F588 HydrophobicContact CE2-CD1 3.63Å; F577-F588 AromaticContact CE2-CE1 3.39Å; F577-F588 HydrophobicContact CE2-CE1 3.39Å; F577-F588 AromaticContact CZ-CD1 3.6Å; F577-F588 HydrophobicContact CZ-CD1 3.6Å; F577-F588 AromaticContact CZ-CE1 3.8Å; F577-F588 HydrophobicContact CZ-CE1 3.8Å; F577-N594 HydrophobicContact CE2-CB 4.21Å; F577-N594 HydrophobicContact CZ-CB 4.1Å; F577-W597 HydrophobicContact CD2-CB 4.15Å; F577-W597 HydrophobicContact CE2-CB 4.11Å; F577-Y598 HydrophobicContact CB-CE1 4.02Å; F577-Y598 HydrophobicContact CB-CE2 4.4Å; F577-Y598 HydrophobicContact CD1-CE1 4.43Å; F577-Y598 AromaticContact CD1-CE2 3.61Å; F577-Y598 HydrophobicContact CD1-CE2 3.61Å; F577-Y598 AromaticContact CD1-CZ 3.52Å; F577-Y598 VanDerWaalsContact CD1-OH 3.26Å; F577-Y598 WeakPolarHBondContact CD1-OH 3.22Å; F577-Y598 HydrophobicContact CD2-CD1 4.39Å; F577-Y598 AromaticContact CD2-CD2 3.45Å; F577-Y598 HydrophobicContact CD2-CD2 3.45Å; F577-Y598 VanDerWaalsContact CD2-CD2 3.45Å; F577-Y598 HydrophobicContact CD2-CE1 4.29Å; F577-Y598 AromaticContact CD2-CE2 3.33Å; F577-Y598 HydrophobicContact CD2-CE2 3.33Å; F577-Y598 AromaticContact CD2-CG 4Å; F577-Y598 HydrophobicContact CD2-CG 4Å; F577-Y598 AromaticContact CD2-CZ 3.78Å; F577-Y598 AromaticContact CE1-CE2 3.57Å; F577-Y598 HydrophobicContact CE1-CE2 3.57Å; F577-Y598 AromaticContact CE1-CZ 3.92Å; F577-Y598 AromaticContact CE2-CD2 3.41Å; F577-Y598 HydrophobicContact CE2-CD2 3.41Å; F577-Y598 VanDerWaalsContact CE2-CD2 3.41Å; F577-Y598 AromaticContact CE2-CE2 3.28Å; F577-Y598 HydrophobicContact CE2-CE2 3.28Å; F577-Y598 HydrophobicContact CE2-CG 4.36Å; F577-Y598 HydrophobicContact CG-CD1 4.49Å; F577-Y598 HydrophobicContact CG-CD2 4.05Å; F577-Y598 AromaticContact CG-CE1 4Å; F577-Y598 HydrophobicContact CG-CE1 4Å; F577-Y598 AromaticContact CG-CE2 3.5Å; F577-Y598 HydrophobicContact CG-CE2 3.5Å; F577-Y598 VanDerWaalsContact CG-CE2 3.5Å; F577-Y598 AromaticContact CG-CZ 3.45Å; F577-Y598 VanDerWaalsContact CG-CZ 3.45Å; F577-Y598 HydrophobicContact CZ-CD2 4Å; F577-Y598 AromaticContact CZ-CE2 3.42Å; F577-Y598 HydrophobicContact CZ-CE2 3.42Å; F577-Y598 VanDerWaalsContact CZ-CE2 3.42Å; F577-F601 HydrophobicContact CB-CD2 4.07Å; F577-F601 HydrophobicContact CB-CE2 4.26Å; F577-F601 HydrophobicContact CD2-CD2 4.37Å; F577-F601 HydrophobicContact CD2-CE2 4.23Å
578	H	83.4	Confident	82.7	Confident	33 Å²	33	47.6 Å²	47.6	15%	0.153	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-52.7	178.9	-172	104.4	0	0	0	111.3	A574 H575 M580 R581 E582 E739 P740	A574-H578 WeakPolarHBondContact O-CB 3.3Å; A574-H578 PolarHBondContact O-N 3.46Å; H575-H578 PolarHBondContact O-N 3.07Å; H578-M580 VanDerWaalsContact C-N 3.3Å; H578-M580 PolarHBondContact O-N 3.34Å; H578-R581 PolarHBondContact ND1-NH2 3.18Å; H578-R581 WeakPolarHBondContact O-CB 3.27Å; H578-R581 PolarHBondContact O-N 3.07Å; H578-E582 VanDerWaalsContact CD2-CD 3.47Å; H578-E582 IonicContact CD2-OE1 3.75Å; H578-E582 IonicContact CD2-OE2 3.88Å; H578-E582 IonicContact NE2-OE1 3Å; H578-E582 PolarHBondContact NE2-OE1 3.2Å; H578-E582 VanDerWaalsContact NE2-OE1 3.13Å; H578-E582 IonicContact NE2-OE2 2.78Å; H578-E582 WeakPolarHBondContact O-CG 3.47Å; H578-E582 PolarHBondContact O-N 2.93Å; H578-E739 IonicContact CE1-OE2 2.79Å; H578-E739 PolarHBondContact CE1-OE2 3.46Å; H578-E739 IonicContact ND1-OE2 3.16Å; H578-P740 HydrophobicContact CB-CG 3.61Å
579	V	84.1	Confident	81.5	Confident	39 Å²	39	51.8 Å²	51.8	24%	0.236	25%	0.247	C	C	.	.	H	α-helix	trans	-58.5	-41	179.1	172.4	0	0	0	0	111.8	H575 K583	H575-V579 WeakPolarHBondContact O-CG2 3.23Å; H575-V579 PolarHBondContact O-N 3.03Å; V579-K583 HydrophobicContact CG1-CD 3.99Å; V579-K583 WeakPolarHBondContact O-CB 3.34Å; V579-K583 VanDerWaalsContact O-CG 3.29Å; V579-K583 WeakPolarHBondContact O-CG 3.45Å; V579-K583 PolarHBondContact O-N 3.38Å
580	M	81.5	Confident	80.8	Confident	53 Å²	53	53.6 Å²	53.6	26%	0.261	26%	0.26	S	S	.	.	H	α-helix	trans	-69.4	-36.9	176.8	-77.4	-73.2	-76.8	0	0	112.3	R576 F577 H578 K583 H584 F588 W597 F601	R576-M580 WeakPolarHBondContact O-CB 3.47Å; R576-M580 WeakPolarHBondContact O-CG 3.43Å; R576-M580 PolarHBondContact O-N 3.09Å; F577-M580 PolarHBondContact O-N 3.24Å; H578-M580 VanDerWaalsContact C-N 3.3Å; H578-M580 PolarHBondContact O-N 3.34Å; M580-K583 PolarHBondContact O-N 3.41Å; M580-H584 PolarHBondContact O-N 3.46Å; M580-F588 VanDerWaalsContact C-CE2 3.48Å; M580-F588 HydrophobicContact CB-CE2 4.19Å; M580-F588 HydrophobicContact CB-CZ 3.77Å; M580-F588 VanDerWaalsContact O-CE2 3.3Å; M580-F588 WeakPolarHBondContact O-CE2 3.44Å; M580-W597 HydrophobicContact CE-CZ3 4.45Å; M580-F601 HydrophobicContact CB-CE2 4.29Å; M580-F601 HydrophobicContact CB-CZ 3.98Å; M580-F601 HydrophobicContact CE-CZ 4.19Å; M580-F601 HydrophobicContact CG-CE1 4.32Å; M580-F601 HydrophobicContact CG-CE2 4.36Å; M580-F601 HydrophobicContact CG-CZ 3.68Å
581	R	80	Confident	80.3	Confident	92 Å²	92	56 Å²	56	35%	0.347	27%	0.268	S	S	.	.	H	α-helix	trans	-66.4	-38.5	176.4	-176.6	-179.6	69.6	178.2	1	112.2	F577 H578 P585 F588	F577-R581 VanDerWaalsContact O-CB 3.26Å; F577-R581 WeakPolarHBondContact O-CB 3.27Å; F577-R581 PolarHBondContact O-N 2.96Å; H578-R581 PolarHBondContact ND1-NH2 3.18Å; H578-R581 WeakPolarHBondContact O-CB 3.27Å; H578-R581 PolarHBondContact O-N 3.07Å; R581-P585 VanDerWaalsContact O-CA 3.31Å; R581-P585 WeakPolarHBondContact O-CA 3.09Å; R581-F588 VanDerWaalsContact CA-CE2 3.48Å; R581-F588 HydrophobicContact CB-CD1 4.12Å; R581-F588 HydrophobicContact CB-CD2 4.02Å; R581-F588 HydrophobicContact CB-CE1 4.26Å; R581-F588 HydrophobicContact CB-CE2 4.19Å; R581-F588 HydrophobicContact CB-CG 4Å; R581-F588 HydrophobicContact CB-CZ 4.3Å; R581-F588 HydrophobicContact CG-CB 3.99Å; R581-F588 HydrophobicContact CG-CD1 4.26Å; R581-F588 HydrophobicContact CG-CD2 4.18Å; R581-F588 HydrophobicContact CG-CG 3.88Å
582	E	78.4	Confident	79.5	Confident	130 Å²	130	61.3 Å²	61.3	61%	0.607	30%	0.301	S	S	*	.	H	α-helix	trans	-70	-41.4	175.6	-70.6	-170.7	135.9	0	0	112.2	H578	H578-E582 VanDerWaalsContact CD2-CD 3.47Å; H578-E582 IonicContact CD2-OE1 3.75Å; H578-E582 IonicContact CD2-OE2 3.88Å; H578-E582 IonicContact NE2-OE1 3Å; H578-E582 PolarHBondContact NE2-OE1 3.2Å; H578-E582 VanDerWaalsContact NE2-OE1 3.13Å; H578-E582 IonicContact NE2-OE2 2.78Å; H578-E582 WeakPolarHBondContact O-CG 3.47Å; H578-E582 PolarHBondContact O-N 2.93Å
583	K	81.4	Confident	78.9	Confident	144 Å²	144	65.8 Å²	65.8	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-72.3	-32	179.4	-72.9	176.7	-179.5	176.7	0	113.7	V579 M580	V579-K583 HydrophobicContact CG1-CD 3.99Å; V579-K583 WeakPolarHBondContact O-CB 3.34Å; V579-K583 VanDerWaalsContact O-CG 3.29Å; V579-K583 WeakPolarHBondContact O-CG 3.45Å; V579-K583 PolarHBondContact O-N 3.38Å; M580-K583 PolarHBondContact O-N 3.41Å
584	H	78.3	Confident	78.6	Confident	65 Å²	65	66.3 Å²	66.3	30%	0.301	32%	0.322	S	S	.	.			trans	-137.6	58.1	-172.3	-62.4	-58.6	0	0	0	112.9	M580 E586 K587 F588	M580-H584 PolarHBondContact O-N 3.46Å; H584-E586 VanDerWaalsContact CA-OE2 3.23Å; H584-E586 WeakPolarHBondContact CA-OE2 3.28Å; H584-E586 WeakPolarHBondContact CB-OE1 3.39Å; H584-E586 IonicContact CG-OE1 3.59Å; H584-E586 IonicContact ND1-OE1 2.63Å; H584-E586 PolarHBondContact O-N 3.15Å; H584-K587 HydrophobicContact CB-CB 4.42Å; H584-K587 HydrophobicContact CB-CD 3.84Å; H584-K587 HydrophobicContact CB-CG 4.16Å; H584-K587 WeakPolarHBondContact O-CB 3.44Å; H584-K587 PolarHBondContact O-N 2.91Å; H584-F588 WeakPolarHBondContact O-CD2 3.23Å
585	P	74	Confident	78.1	Confident	81 Å²	81	71.2 Å²	71.2	53%	0.526	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-56.6	-28.9	-174	24.4	-34.9	0	0	0	113.6	R581 K587 F588	R581-P585 VanDerWaalsContact O-CA 3.31Å; R581-P585 WeakPolarHBondContact O-CA 3.09Å; P585-K587 PolarHBondContact O-N 3.31Å; P585-F588 PolarHBondContact O-N 3.38Å
586	E	75.1	Confident	77.6	Confident	104 Å²	104	73.9 Å²	73.9	49%	0.486	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-60.6	-27.9	176.9	76.1	-68.9	166.4	0	0	113.1	H584 F588 N589	H584-E586 VanDerWaalsContact CA-OE2 3.23Å; H584-E586 WeakPolarHBondContact CA-OE2 3.28Å; H584-E586 WeakPolarHBondContact CB-OE1 3.39Å; H584-E586 IonicContact CG-OE1 3.59Å; H584-E586 IonicContact ND1-OE1 2.63Å; H584-E586 PolarHBondContact O-N 3.15Å; E586-F588 VanDerWaalsContact C-N 3.3Å; E586-N589 PolarHBondContact O-ND2 2.94Å
587	K	75.3	Confident	77.3	Confident	84 Å²	84	73.1 Å²	73.1	37%	0.365	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-78.9	-14.1	177.1	-63.8	-179.9	-172	167.2	0	112.8	H584 P585 W597	H584-K587 HydrophobicContact CB-CB 4.42Å; H584-K587 HydrophobicContact CB-CD 3.84Å; H584-K587 HydrophobicContact CB-CG 4.16Å; H584-K587 WeakPolarHBondContact O-CB 3.44Å; H584-K587 PolarHBondContact O-N 2.91Å; P585-K587 PolarHBondContact O-N 3.31Å; K587-W597 HydrophobicContact CD-CZ2 4.26Å
588	F	71.9	Confident	76.8	Confident	18 Å²	18	75 Å²	75	8%	0.079	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-109	28.2	-173	-64.3	-94.8	0	0	0	114.1	F577 M580 R581 H584 P585 E586 S590 N594 W597	F577-F588 HydrophobicContact CD2-CD1 4.45Å; F577-F588 AromaticContact CD2-CE1 3.81Å; F577-F588 HydrophobicContact CD2-CE1 3.81Å; F577-F588 HydrophobicContact CE1-CD1 4.42Å; F577-F588 AromaticContact CE2-CD1 3.63Å; F577-F588 HydrophobicContact CE2-CD1 3.63Å; F577-F588 AromaticContact CE2-CE1 3.39Å; F577-F588 HydrophobicContact CE2-CE1 3.39Å; F577-F588 AromaticContact CZ-CD1 3.6Å; F577-F588 HydrophobicContact CZ-CD1 3.6Å; F577-F588 AromaticContact CZ-CE1 3.8Å; F577-F588 HydrophobicContact CZ-CE1 3.8Å; M580-F588 VanDerWaalsContact C-CE2 3.48Å; M580-F588 HydrophobicContact CB-CE2 4.19Å; M580-F588 HydrophobicContact CB-CZ 3.77Å; M580-F588 VanDerWaalsContact O-CE2 3.3Å; M580-F588 WeakPolarHBondContact O-CE2 3.44Å; R581-F588 VanDerWaalsContact CA-CE2 3.48Å; R581-F588 HydrophobicContact CB-CD1 4.12Å; R581-F588 HydrophobicContact CB-CD2 4.02Å; R581-F588 HydrophobicContact CB-CE1 4.26Å; R581-F588 HydrophobicContact CB-CE2 4.19Å; R581-F588 HydrophobicContact CB-CG 4Å; R581-F588 HydrophobicContact CB-CZ 4.3Å; R581-F588 HydrophobicContact CG-CB 3.99Å; R581-F588 HydrophobicContact CG-CD1 4.26Å; R581-F588 HydrophobicContact CG-CD2 4.18Å; R581-F588 HydrophobicContact CG-CG 3.88Å; H584-F588 WeakPolarHBondContact O-CD2 3.23Å; P585-F588 PolarHBondContact O-N 3.38Å; E586-F588 VanDerWaalsContact C-N 3.3Å; F588-S590 PolarHBondContact O-N 3.34Å; F588-N594 VanDerWaalsContact C-OD1 3.29Å; F588-N594 WeakPolarHBondContact CA-OD1 3.35Å; F588-N594 WeakPolarHBondContact CB-OD1 3.41Å; F588-N594 PolarHBondContact O-ND2 3.46Å; F588-N594 PolarHBondContact O-OD1 2.87Å; F588-W597 AromaticContact CD1-CD1 3.95Å; F588-W597 HydrophobicContact CE1-CB 4.01Å; F588-W597 AromaticContact CE1-CD1 3.52Å; F588-W597 AromaticContact CE1-CG 3.79Å; F588-W597 HydrophobicContact CE1-CG 3.79Å; F588-W597 AromaticContact CZ-CD1 3.89Å; F588-W597 HydrophobicContact CZ-CD2 4.39Å; F588-W597 HydrophobicContact CZ-CG 4.07Å
589	N	67.3	Low	76.4	Confident	88 Å²	88	78.4 Å²	78.4	47%	0.471	38%	0.376	S	S	.	.	S	Bend	trans	-84	-0.8	-176.4	62.5	20.3	0	0	0	115.4	E586	E586-N589 PolarHBondContact O-ND2 2.94Å
590	S	72.6	Confident	76.2	Confident	40 Å²	40	81.1 Å²	81.1	28%	0.28	39%	0.386	S	S	.	.			trans	-138	132.2	-176.6	170.2	0	0	0	0	111.5	F588 T592 K593 N594	F588-S590 PolarHBondContact O-N 3.34Å; S590-T592 PolarHBondContact O-N 3.27Å; S590-T592 PolarHBondContact OG-N 3.05Å; S590-K593 PolarHBondContact O-N 2.98Å; S590-K593 VanDerWaalsContact O-N 3.13Å; S590-N594 WeakPolarHBondContact O-CB 3.23Å; S590-N594 PolarHBondContact O-N 3.44Å; S590-N594 PolarHBondContact O-ND2 2.9Å; S590-N594 PolarHBondContact O-OD1 3.16Å; S590-N594 VanDerWaalsContact O-OD1 3.1Å
591	R	74.9	Confident	76.1	Confident	53 Å²	53	79.5 Å²	79.5	20%	0.2	38%	0.378	C	S	.	.	H	α-helix	trans	-55.8	-39.3	176.8	-64	-171.7	-59.4	-146.3	-0.4	112.3	G502 T503 G516 Y517 N594 K595	G502-R591 WeakPolarHBondContact O-CD 3.3Å; T503-R591 HydrophobicContact CG2-CB 4.42Å; G516-R591 VanDerWaalsContact C-NH1 3.29Å; Y517-R591 VanDerWaalsContact N-NH1 3.11Å; Y517-R591 PolarHBondContact O-NH1 3Å; Y517-R591 PolarHBondContact O-NH2 2.7Å; R591-N594 PolarHBondContact O-N 2.95Å; R591-K595 WeakPolarHBondContact O-CG 3.37Å; R591-K595 PolarHBondContact O-N 2.65Å
592	T	74.3	Confident	75.8	Confident	113 Å²	113	75.6 Å²	75.6	69%	0.693	37%	0.366	S	S	*	.	H	α-helix	trans	-67.3	-42.4	179.6	-50.6	0	0	0	0	111.2	S590 K595 L596	S590-T592 PolarHBondContact O-N 3.27Å; S590-T592 PolarHBondContact OG-N 3.05Å; T592-K595 PolarHBondContact O-N 3.27Å; T592-L596 PolarHBondContact O-N 2.65Å; T592-L596 VanDerWaalsContact O-N 3.13Å
593	K	76.7	Confident	75.4	Confident	107 Å²	107	71.9 Å²	71.9	47%	0.465	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-42.6	174.7	-66.8	-177	-178.6	175	0	111.4	S590 K595 L596 W597	S590-K593 PolarHBondContact O-N 2.98Å; S590-K593 VanDerWaalsContact O-N 3.13Å; K593-K595 VanDerWaalsContact C-N 3.33Å; K593-K595 PolarHBondContact O-N 3.45Å; K593-L596 WeakPolarHBondContact O-CB 3.44Å; K593-L596 PolarHBondContact O-N 3.26Å; K593-L596 VanDerWaalsContact O-N 3.08Å; K593-W597 VanDerWaalsContact O-CD1 3.31Å; K593-W597 PolarHBondContact O-N 2.63Å
594	N	77.9	Confident	75	Confident	12 Å²	12	66.8 Å²	66.8	6%	0.064	34%	0.335	C	S	.	.	H	α-helix	trans	-61.2	-43	179	-64.7	-3.7	0	0	0	111.3	T503 F577 F588 S590 R591 L596 W597 Y598	T503-N594 HydrophobicContact CG2-CB 3.68Å; T503-N594 PolarHBondContact OG1-ND2 3.13Å; F577-N594 HydrophobicContact CE2-CB 4.21Å; F577-N594 HydrophobicContact CZ-CB 4.1Å; F588-N594 VanDerWaalsContact C-OD1 3.29Å; F588-N594 WeakPolarHBondContact CA-OD1 3.35Å; F588-N594 WeakPolarHBondContact CB-OD1 3.41Å; F588-N594 PolarHBondContact O-ND2 3.46Å; F588-N594 PolarHBondContact O-OD1 2.87Å; S590-N594 WeakPolarHBondContact O-CB 3.23Å; S590-N594 PolarHBondContact O-N 3.44Å; S590-N594 PolarHBondContact O-ND2 2.9Å; S590-N594 PolarHBondContact O-OD1 3.16Å; S590-N594 VanDerWaalsContact O-OD1 3.1Å; R591-N594 PolarHBondContact O-N 2.95Å; N594-L596 VanDerWaalsContact C-N 3.31Å; N594-L596 PolarHBondContact O-N 3.21Å; N594-W597 PolarHBondContact O-N 3.04Å; N594-Y598 WeakPolarHBondContact O-CD2 3.07Å; N594-Y598 PolarHBondContact O-N 3.42Å; N594-Y598 VanDerWaalsContact O-N 3.11Å
595	K	75.9	Confident	74.7	Confident	109 Å²	109	63.7 Å²	63.7	47%	0.474	32%	0.321	S	S	.	.	H	α-helix	trans	-62.1	-37.8	173.8	-73.7	-179.1	179.1	-171.8	0	112.5	T503 R591 T592 K593 Y598 F599	T503-K595 HydrophobicContact CG2-CG 3.93Å; R591-K595 WeakPolarHBondContact O-CG 3.37Å; R591-K595 PolarHBondContact O-N 2.65Å; T592-K595 PolarHBondContact O-N 3.27Å; K593-K595 VanDerWaalsContact C-N 3.33Å; K593-K595 PolarHBondContact O-N 3.45Å; K595-Y598 PolarHBondContact O-N 2.98Å; K595-F599 PolarHBondContact O-N 3.36Å; K595-F599 VanDerWaalsContact O-N 3.08Å
596	L	77.4	Confident	74.4	Confident	110 Å²	110	62.2 Å²	62.2	58%	0.576	31%	0.31	S	S	*	.	H	α-helix	trans	-64.9	-41.1	176.1	-174.2	63.8	0	0	0	111.6	T592 K593 N594 Y598 F599 E600	T592-L596 PolarHBondContact O-N 2.65Å; T592-L596 VanDerWaalsContact O-N 3.13Å; K593-L596 WeakPolarHBondContact O-CB 3.44Å; K593-L596 PolarHBondContact O-N 3.26Å; K593-L596 VanDerWaalsContact O-N 3.08Å; N594-L596 VanDerWaalsContact C-N 3.31Å; N594-L596 PolarHBondContact O-N 3.21Å; L596-Y598 PolarHBondContact O-N 3.24Å; L596-F599 WeakPolarHBondContact O-CB 3.4Å; L596-F599 PolarHBondContact O-N 3.46Å; L596-E600 PolarHBondContact O-N 3.02Å
597	W	78.6	Confident	73.8	Confident	54 Å²	54	65.8 Å²	65.8	21%	0.205	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-44.2	173.6	-77.1	122.1	0	0	0	112.5	F577 M580 K587 F588 K593 N594 F599 E600 F601	F577-W597 HydrophobicContact CD2-CB 4.15Å; F577-W597 HydrophobicContact CE2-CB 4.11Å; M580-W597 HydrophobicContact CE-CZ3 4.45Å; K587-W597 HydrophobicContact CD-CZ2 4.26Å; F588-W597 AromaticContact CD1-CD1 3.95Å; F588-W597 HydrophobicContact CE1-CB 4.01Å; F588-W597 AromaticContact CE1-CD1 3.52Å; F588-W597 AromaticContact CE1-CG 3.79Å; F588-W597 HydrophobicContact CE1-CG 3.79Å; F588-W597 AromaticContact CZ-CD1 3.89Å; F588-W597 HydrophobicContact CZ-CD2 4.39Å; F588-W597 HydrophobicContact CZ-CG 4.07Å; K593-W597 VanDerWaalsContact O-CD1 3.31Å; K593-W597 PolarHBondContact O-N 2.63Å; N594-W597 PolarHBondContact O-N 3.04Å; W597-F599 VanDerWaalsContact C-N 3.3Å; W597-F599 PolarHBondContact O-N 2.81Å; W597-E600 VanDerWaalsContact CZ3-OE2 3.3Å; W597-E600 WeakPolarHBondContact CZ3-OE2 3.04Å; W597-E600 PolarHBondContact O-N 3.15Å; W597-F601 HydrophobicContact CB-CD2 4.44Å; W597-F601 HydrophobicContact CB-CE2 3.96Å; W597-F601 HydrophobicContact CB-CZ 4.49Å; W597-F601 HydrophobicContact CD2-CZ 4.26Å; W597-F601 AromaticContact CE3-CE1 3.97Å; W597-F601 HydrophobicContact CE3-CE1 3.97Å; W597-F601 HydrophobicContact CE3-CE2 4.18Å; W597-F601 AromaticContact CE3-CZ 3.56Å; W597-F601 HydrophobicContact CE3-CZ 3.56Å; W597-F601 HydrophobicContact CZ3-CE1 4.31Å; W597-F601 HydrophobicContact CZ3-CZ 4.16Å; W597-F601 WeakPolarHBondContact O-CD2 3.47Å; W597-F601 VanDerWaalsContact O-CG 3.28Å; W597-F601 WeakPolarHBondContact O-CG 3.43Å; W597-F601 PolarHBondContact O-N 3.47Å
598	Y	74.8	Confident	73.4	Confident	45 Å²	45	64.8 Å²	64.8	18%	0.176	33%	0.328	C	S	.	.	H	α-helix	trans	-58.5	-42.2	174.1	-90.5	-78.6	0	0	0	112.3	I573 F577 N594 K595 L596 G602 Y708	I573-Y598 HydrophobicContact CG2-CD1 3.92Å; I573-Y598 HydrophobicContact CG2-CE1 4.42Å; F577-Y598 HydrophobicContact CB-CE1 4.02Å; F577-Y598 HydrophobicContact CB-CE2 4.4Å; F577-Y598 HydrophobicContact CD1-CE1 4.43Å; F577-Y598 AromaticContact CD1-CE2 3.61Å; F577-Y598 HydrophobicContact CD1-CE2 3.61Å; F577-Y598 AromaticContact CD1-CZ 3.52Å; F577-Y598 VanDerWaalsContact CD1-OH 3.26Å; F577-Y598 WeakPolarHBondContact CD1-OH 3.22Å; F577-Y598 HydrophobicContact CD2-CD1 4.39Å; F577-Y598 AromaticContact CD2-CD2 3.45Å; F577-Y598 HydrophobicContact CD2-CD2 3.45Å; F577-Y598 VanDerWaalsContact CD2-CD2 3.45Å; F577-Y598 HydrophobicContact CD2-CE1 4.29Å; F577-Y598 AromaticContact CD2-CE2 3.33Å; F577-Y598 HydrophobicContact CD2-CE2 3.33Å; F577-Y598 AromaticContact CD2-CG 4Å; F577-Y598 HydrophobicContact CD2-CG 4Å; F577-Y598 AromaticContact CD2-CZ 3.78Å; F577-Y598 AromaticContact CE1-CE2 3.57Å; F577-Y598 HydrophobicContact CE1-CE2 3.57Å; F577-Y598 AromaticContact CE1-CZ 3.92Å; F577-Y598 AromaticContact CE2-CD2 3.41Å; F577-Y598 HydrophobicContact CE2-CD2 3.41Å; F577-Y598 VanDerWaalsContact CE2-CD2 3.41Å; F577-Y598 AromaticContact CE2-CE2 3.28Å; F577-Y598 HydrophobicContact CE2-CE2 3.28Å; F577-Y598 HydrophobicContact CE2-CG 4.36Å; F577-Y598 HydrophobicContact CG-CD1 4.49Å; F577-Y598 HydrophobicContact CG-CD2 4.05Å; F577-Y598 AromaticContact CG-CE1 4Å; F577-Y598 HydrophobicContact CG-CE1 4Å; F577-Y598 AromaticContact CG-CE2 3.5Å; F577-Y598 HydrophobicContact CG-CE2 3.5Å; F577-Y598 VanDerWaalsContact CG-CE2 3.5Å; F577-Y598 AromaticContact CG-CZ 3.45Å; F577-Y598 VanDerWaalsContact CG-CZ 3.45Å; F577-Y598 HydrophobicContact CZ-CD2 4Å; F577-Y598 AromaticContact CZ-CE2 3.42Å; F577-Y598 HydrophobicContact CZ-CE2 3.42Å; F577-Y598 VanDerWaalsContact CZ-CE2 3.42Å; N594-Y598 WeakPolarHBondContact O-CD2 3.07Å; N594-Y598 PolarHBondContact O-N 3.42Å; N594-Y598 VanDerWaalsContact O-N 3.11Å; K595-Y598 PolarHBondContact O-N 2.98Å; L596-Y598 PolarHBondContact O-N 3.24Å; Y598-G602 PolarHBondContact O-N 3.27Å; Y598-Y708 HydrophobicContact CD1-CE1 4.38Å
599	F	74.3	Confident	73.3	Confident	105 Å²	105	65 Å²	65	46%	0.461	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-47.5	175.8	-180	-96	0	0	0	111.7	K595 L596 W597 G602 T603	K595-F599 PolarHBondContact O-N 3.36Å; K595-F599 VanDerWaalsContact O-N 3.08Å; L596-F599 WeakPolarHBondContact O-CB 3.4Å; L596-F599 PolarHBondContact O-N 3.46Å; W597-F599 VanDerWaalsContact C-N 3.3Å; W597-F599 PolarHBondContact O-N 2.81Å; F599-G602 PolarHBondContact O-N 3.41Å; F599-T603 HydrophobicContact CD1-CG2 4.37Å; F599-T603 HydrophobicContact CE1-CG2 3.95Å; F599-T603 HydrophobicContact CE2-CG2 4.46Å; F599-T603 HydrophobicContact CZ-CG2 4Å; F599-T603 WeakPolarHBondContact O-CG2 3.42Å; F599-T603 PolarHBondContact O-N 2.81Å
600	E	79.8	Confident	73.6	Confident	96 Å²	96	64.1 Å²	64.1	45%	0.449	33%	0.33	S	S	.	.	H	α-helix	trans	-59.7	-48.7	178.3	-173.7	175.6	166.9	0	0	111.5	L596 W597 G602 T603 S604	L596-E600 PolarHBondContact O-N 3.02Å; W597-E600 VanDerWaalsContact CZ3-OE2 3.3Å; W597-E600 WeakPolarHBondContact CZ3-OE2 3.04Å; W597-E600 PolarHBondContact O-N 3.15Å; E600-G602 VanDerWaalsContact C-N 3.35Å; E600-G602 PolarHBondContact O-N 2.92Å; E600-T603 PolarHBondContact O-N 3.02Å; E600-T603 PolarHBondContact O-OG1 2.78Å; E600-S604 PolarHBondContact O-N 3.13Å
601	F	80.1	Confident	73.9	Confident	20 Å²	20	62.4 Å²	62.4	9%	0.088	32%	0.319	C	S	.	.	H	α-helix	trans	-63.9	-39.5	177.7	-61.3	-35.3	0	0	0	112.3	I573 R576 F577 M580 W597 T603 S604 E605	I573-F601 HydrophobicContact CG2-CB 4.13Å; R576-F601 HydrophobicContact CB-CD2 4.5Å; R576-F601 HydrophobicContact CB-CG 4.37Å; F577-F601 HydrophobicContact CB-CD2 4.07Å; F577-F601 HydrophobicContact CB-CE2 4.26Å; F577-F601 HydrophobicContact CD2-CD2 4.37Å; F577-F601 HydrophobicContact CD2-CE2 4.23Å; M580-F601 HydrophobicContact CB-CE2 4.29Å; M580-F601 HydrophobicContact CB-CZ 3.98Å; M580-F601 HydrophobicContact CE-CZ 4.19Å; M580-F601 HydrophobicContact CG-CE1 4.32Å; M580-F601 HydrophobicContact CG-CE2 4.36Å; M580-F601 HydrophobicContact CG-CZ 3.68Å; W597-F601 HydrophobicContact CB-CD2 4.44Å; W597-F601 HydrophobicContact CB-CE2 3.96Å; W597-F601 HydrophobicContact CB-CZ 4.49Å; W597-F601 HydrophobicContact CD2-CZ 4.26Å; W597-F601 AromaticContact CE3-CE1 3.97Å; W597-F601 HydrophobicContact CE3-CE1 3.97Å; W597-F601 HydrophobicContact CE3-CE2 4.18Å; W597-F601 AromaticContact CE3-CZ 3.56Å; W597-F601 HydrophobicContact CE3-CZ 3.56Å; W597-F601 HydrophobicContact CZ3-CE1 4.31Å; W597-F601 HydrophobicContact CZ3-CZ 4.16Å; W597-F601 WeakPolarHBondContact O-CD2 3.47Å; W597-F601 VanDerWaalsContact O-CG 3.28Å; W597-F601 WeakPolarHBondContact O-CG 3.43Å; W597-F601 PolarHBondContact O-N 3.47Å; F601-T603 PolarHBondContact O-N 3.02Å; F601-S604 WeakPolarHBondContact CA-OG 3.29Å; F601-S604 PolarHBondContact O-N 3.2Å; F601-S604 PolarHBondContact O-OG 2.95Å; F601-E605 PolarHBondContact O-N 3.28Å
602	G	73	Confident	74.3	Confident	9 Å²	9	65.7 Å²	65.7	9%	0.093	33%	0.334	C	S	.	.	H	α-helix	trans	-59.6	-43	173	0	0	0	0	0	113.2	Y598 F599 E600 E605 T606	Y598-G602 PolarHBondContact O-N 3.27Å; F599-G602 PolarHBondContact O-N 3.41Å; E600-G602 VanDerWaalsContact C-N 3.35Å; E600-G602 PolarHBondContact O-N 2.92Å; G602-E605 PolarHBondContact O-N 3.25Å; G602-T606 PolarHBondContact O-N 3.19Å; G602-T606 PolarHBondContact O-OG1 3.34Å
603	T	70.7	Confident	74.9	Confident	53 Å²	53	66.2 Å²	66.2	33%	0.325	33%	0.327	S	S	.	.	H	α-helix	trans	-64.6	-41.2	174.4	60.8	0	0	0	0	111.8	F599 E600 F601 E605 T606 F607	F599-T603 HydrophobicContact CD1-CG2 4.37Å; F599-T603 HydrophobicContact CE1-CG2 3.95Å; F599-T603 HydrophobicContact CE2-CG2 4.46Å; F599-T603 HydrophobicContact CZ-CG2 4Å; F599-T603 WeakPolarHBondContact O-CG2 3.42Å; F599-T603 PolarHBondContact O-N 2.81Å; E600-T603 PolarHBondContact O-N 3.02Å; E600-T603 PolarHBondContact O-OG1 2.78Å; F601-T603 PolarHBondContact O-N 3.02Å; T603-E605 VanDerWaalsContact C-N 3.34Å; T603-E605 PolarHBondContact O-N 2.82Å; T603-T606 VanDerWaalsContact O-CB 3.27Å; T603-T606 WeakPolarHBondContact O-CB 3.25Å; T603-T606 PolarHBondContact O-N 3.13Å; T603-F607 WeakPolarHBondContact O-CD2 3.29Å
604	S	72.3	Confident	75.5	Confident	36 Å²	36	61.1 Å²	61.1	25%	0.252	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-35.6	178.5	78.8	0	0	0	0	113.5	R576 E600 F601 T606 F607 S608	R576-S604 PolarHBondContact NH1-OG 2.83Å; E600-S604 PolarHBondContact O-N 3.13Å; F601-S604 WeakPolarHBondContact CA-OG 3.29Å; F601-S604 PolarHBondContact O-N 3.2Å; F601-S604 PolarHBondContact O-OG 2.95Å; S604-T606 VanDerWaalsContact C-N 3.34Å; S604-F607 PolarHBondContact O-N 2.8Å; S604-S608 WeakPolarHBondContact O-CB 3.15Å; S604-S608 PolarHBondContact O-N 2.84Å; S604-S608 PolarHBondContact O-OG 3.47Å
605	E	73	Confident	76.1	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-70.1	-31.9	176.1	-83.8	-69.1	179.3	0	0	112	V569 S572 I573 R576 F601 G602 T603 F607 S608 A609 T610	V569-E605 HydrophobicContact CG2-CB 4.45Å; S572-E605 PolarHBondContact OG-OE1 2.76Å; I573-E605 HydrophobicContact CG1-CB 4.17Å; I573-E605 HydrophobicContact CG1-CG 3.86Å; R576-E605 VanDerWaalsContact CZ-CD 3.4Å; R576-E605 IonicContact CZ-OE1 3.6Å; R576-E605 IonicContact NE-OE1 3.76Å; R576-E605 PolarHBondContact NE-OE1 2.8Å; R576-E605 IonicContact NH1-OE1 3.03Å; R576-E605 IonicContact NH2-OE1 2.73Å; R576-E605 PolarHBondContact NH2-OE1 3.43Å; R576-E605 IonicContact NH2-OE2 2.64Å; F601-E605 PolarHBondContact O-N 3.28Å; G602-E605 PolarHBondContact O-N 3.25Å; T603-E605 VanDerWaalsContact C-N 3.34Å; T603-E605 PolarHBondContact O-N 2.82Å; E605-F607 PolarHBondContact O-N 3.09Å; E605-S608 PolarHBondContact O-N 3.1Å; E605-A609 PolarHBondContact O-N 3.31Å; E605-T610 PolarHBondContact OE1-OG1 2.74Å; E605-T610 WeakPolarHBondContact OE2-CG2 3.49Å; E605-T610 PolarHBondContact OE2-OG1 3.23Å
606	T	66.9	Low	76.8	Confident	49 Å²	49	61.6 Å²	61.6	30%	0.301	31%	0.311	S	S	.	.	H	α-helix	trans	-57.5	-38	172.8	-50.5	0	0	0	0	111.9	G602 T603 S604 A701 M702	G602-T606 PolarHBondContact O-N 3.19Å; G602-T606 PolarHBondContact O-OG1 3.34Å; T603-T606 VanDerWaalsContact O-CB 3.27Å; T603-T606 WeakPolarHBondContact O-CB 3.25Å; T603-T606 PolarHBondContact O-N 3.13Å; S604-T606 VanDerWaalsContact C-N 3.34Å; T606-A701 HydrophobicContact CG2-CB 4.3Å; T606-A701 WeakPolarHBondContact OG1-CB 3.41Å; T606-M702 HydrophobicContact CG2-CG 3.68Å
607	F	61.8	Low	77.4	Confident	180 Å²	180	59.4 Å²	59.4	79%	0.789	30%	0.297	S	S	*	.	H	α-helix	trans	-81.5	-35.9	177.4	-65.7	-73.3	0	0	0	112.9	T603 S604 E605	T603-F607 WeakPolarHBondContact O-CD2 3.29Å; S604-F607 PolarHBondContact O-N 2.8Å; E605-F607 PolarHBondContact O-N 3.09Å
608	S	66.7	Low	78.1	Confident	63 Å²	63	57.8 Å²	57.8	44%	0.441	29%	0.292	S	S	.	.	H	α-helix	trans	-77.2	-29.8	-175.7	-53.4	0	0	0	0	112.7	S604 E605 T610	S604-S608 WeakPolarHBondContact O-CB 3.15Å; S604-S608 PolarHBondContact O-N 2.84Å; S604-S608 PolarHBondContact O-OG 3.47Å; E605-S608 PolarHBondContact O-N 3.1Å; S608-T610 VanDerWaalsContact C-N 3.25Å; S608-T610 PolarHBondContact O-N 3.09Å
609	A	70.8	Confident	79.1	Confident	21 Å²	21	59.4 Å²	59.4	17%	0.174	30%	0.301	C	S	.	.			trans	53	37.3	173.7	0	0	0	0	0	114.9	E605 C611 K612	E605-A609 PolarHBondContact O-N 3.31Å; A609-C611 PolarHBondContact O-N 2.86Å; A609-C611 VanDerWaalsContact O-N 3.14Å; A609-K612 HydrophobicContact CB-CD 3.61Å; A609-K612 HydrophobicContact CB-CG 3.92Å; A609-K612 PolarHBondContact O-N 3.2Å
610	T	72.6	Confident	80.2	Confident	70 Å²	70	54.4 Å²	54.4	43%	0.429	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.3	-171.2	55.5	0	0	0	0	113.9	E605 S608	E605-T610 PolarHBondContact OE1-OG1 2.74Å; E605-T610 WeakPolarHBondContact OE2-CG2 3.49Å; E605-T610 PolarHBondContact OE2-OG1 3.23Å; S608-T610 VanDerWaalsContact C-N 3.25Å; S608-T610 PolarHBondContact O-N 3.09Å
611	C	80	Confident	81	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.034	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	19.7	-174	-61.3	0	0	0	0	113.8	V569 A609 E635	V569-C611 HydrophobicContact CB-CB 4.49Å; A609-C611 PolarHBondContact O-N 2.86Å; A609-C611 VanDerWaalsContact O-N 3.14Å; C611-E635 VanDerWaalsContact CB-O 3.31Å; C611-E635 WeakPolarHBondContact CB-O 3.45Å; C611-E635 WeakPolarHBondContact O-CA 3.16Å
612	K	83.9	Confident	81.8	Confident	122 Å²	122	50.8 Å²	50.8	53%	0.53	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	145.9	179.4	-88.8	-178.2	179.8	160.9	0	113.2	A609 L614 E635	A609-K612 HydrophobicContact CB-CD 3.61Å; A609-K612 HydrophobicContact CB-CG 3.92Å; A609-K612 PolarHBondContact O-N 3.2Å; K612-L614 VanDerWaalsContact C-N 3.26Å; K612-L614 PolarHBondContact O-N 3.28Å; K612-E635 HydrophobicContact CG-CG 4.45Å; K612-E635 VanDerWaalsContact CG-OE1 3.3Å; K612-E635 WeakPolarHBondContact CG-OE1 3.43Å
613	K	85.3	Confident	82.8	Confident	123 Å²	123	52.1 Å²	52.1	54%	0.535	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	45.7	-179.5	-55.5	-176.1	178.4	-174.7	0	112.3	H615 D616 F617	K613-H615 PolarHBondContact O-N 3.13Å; K613-D616 WeakPolarHBondContact CB-OD2 3.41Å; K613-D616 WeakPolarHBondContact CD-OD2 3.31Å; K613-D616 WeakPolarHBondContact O-CB 3.49Å; K613-D616 PolarHBondContact O-N 2.96Å; K613-D616 VanDerWaalsContact O-N 3.11Å; K613-F617 WeakPolarHBondContact O-CD2 3.44Å; K613-F617 WeakPolarHBondContact O-CE2 3.37Å
614	L	89.3	Confident	83.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-56.9	-37.3	-177.7	-174.9	61.7	0	0	0	111.4	K612 D616 F617 L618 L634 L732	K612-L614 VanDerWaalsContact C-N 3.26Å; K612-L614 PolarHBondContact O-N 3.28Å; L614-D616 PolarHBondContact O-N 2.98Å; L614-D616 VanDerWaalsContact O-N 3.15Å; L614-F617 PolarHBondContact O-N 3.37Å; L614-L618 HydrophobicContact CB-CD1 4.38Å; L614-L618 HydrophobicContact CD1-CD1 3.24Å; L614-L618 HydrophobicContact CD2-CD1 3.81Å; L614-L618 HydrophobicContact CG-CD1 3.17Å; L614-L618 WeakPolarHBondContact O-CD1 3.32Å; L614-L634 HydrophobicContact CB-CB 4.28Å; L614-L634 WeakPolarHBondContact CB-O 3.41Å; L614-L634 PolarHBondContact N-O 3.09Å; L614-L732 HydrophobicContact CD1-CD1 3.99Å; L614-L732 HydrophobicContact CD1-CD2 3.61Å; L614-L732 HydrophobicContact CD1-CG 4.47Å
615	H	90.3	Very high	84.8	Confident	37 Å²	37	53.3 Å²	53.3	17%	0.171	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-55.9	-25.6	177	59.6	-83.3	0	0	0	115	K613 F617 L629 I632 L634	K613-H615 PolarHBondContact O-N 3.13Å; H615-F617 PolarHBondContact O-N 3.24Å; H615-L629 HydrophobicContact CB-CB 4.05Å; H615-I632 PolarHBondContact CE1-O 3.36Å; H615-I632 PolarHBondContact ND1-O 3.33Å; H615-L634 HydrophobicContact CB-CB 4.44Å; H615-L634 HydrophobicContact CB-CD1 4.45Å; H615-L634 PolarHBondContact ND1-N 3.05Å
616	D	90.5	Very high	85.8	Confident	93 Å²	93	57 Å²	57	50%	0.497	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-68.9	-16.5	177.8	-70.3	-20.9	0	0	0	112.6	K613 L614	K613-D616 WeakPolarHBondContact CB-OD2 3.41Å; K613-D616 WeakPolarHBondContact CD-OD2 3.31Å; K613-D616 WeakPolarHBondContact O-CB 3.49Å; K613-D616 PolarHBondContact O-N 2.96Å; K613-D616 VanDerWaalsContact O-N 3.11Å; L614-D616 PolarHBondContact O-N 2.98Å; L614-D616 VanDerWaalsContact O-N 3.15Å
617	F	91.6	Very high	87.1	Confident	65 Å²	65	55.7 Å²	55.7	29%	0.285	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-121	8.9	-171.6	-50.7	-78.3	0	0	0	113.6	K613 L614 H615 T728 T729 K730	K613-F617 WeakPolarHBondContact O-CD2 3.44Å; K613-F617 WeakPolarHBondContact O-CE2 3.37Å; L614-F617 PolarHBondContact O-N 3.37Å; H615-F617 PolarHBondContact O-N 3.24Å; F617-T728 WeakPolarHBondContact O-CA 3.18Å; F617-T729 WeakPolarHBondContact CA-OG1 3.35Å; F617-T729 PolarHBondContact O-N 2.93Å; F617-T729 VanDerWaalsContact O-N 3.13Å; F617-T729 PolarHBondContact O-OG1 3.34Å; F617-K730 HydrophobicContact CB-CD 3.97Å; F617-K730 HydrophobicContact CB-CG 3.9Å; F617-K730 HydrophobicContact CD1-CB 4.39Å; F617-K730 HydrophobicContact CD1-CD 3.64Å; F617-K730 HydrophobicContact CD1-CG 4.1Å; F617-K730 HydrophobicContact CD2-CD 3.76Å; F617-K730 HydrophobicContact CE1-CD 4.01Å; F617-K730 HydrophobicContact CE2-CD 4.13Å; F617-K730 HydrophobicContact CG-CD 3.48Å; F617-K730 VanDerWaalsContact CG-CD 3.48Å; F617-K730 VanDerWaalsContact CG-CE 3.49Å; F617-K730 HydrophobicContact CG-CG 3.95Å; F617-K730 HydrophobicContact CZ-CD 4.23Å
618	L	92.8	Very high	88.4	Confident	19 Å²	19	52.6 Å²	52.6	10%	0.099	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.5	-171.8	-85.4	141.5	0	0	0	111.3	I567 L614 I726 R727 T728 L732	I567-L618 HydrophobicContact CD1-CD2 3.95Å; L614-L618 HydrophobicContact CB-CD1 4.38Å; L614-L618 HydrophobicContact CD1-CD1 3.24Å; L614-L618 HydrophobicContact CD2-CD1 3.81Å; L614-L618 HydrophobicContact CG-CD1 3.17Å; L614-L618 WeakPolarHBondContact O-CD1 3.32Å; L618-I726 HydrophobicContact CD2-CG2 3.3Å; L618-R727 WeakPolarHBondContact CA-O 3.39Å; L618-T728 HydrophobicContact CD2-CG2 3.69Å; L618-T728 HydrophobicContact CG-CG2 4.26Å; L618-L732 HydrophobicContact CD1-CD1 3.88Å; L618-L732 HydrophobicContact CG-CD1 4.16Å
619	E	95.6	Very high	89.5	Confident	79 Å²	79	50.2 Å²	50.2	37%	0.369	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.9	164.7	-168.5	-166.6	151.3	0	0	108.4	T626 I726 R727	E619-T626 HydrophobicContact CG-CG2 3.89Å; E619-I726 CarbonylContact O-C 2.99Å; E619-I726 WeakPolarHBondContact O-CA 3.48Å; E619-R727 HydrophobicContact CB-CB 4.25Å; E619-R727 PolarHBondContact N-O 3.01Å; E619-R727 PolarHBondContact O-N 2.81Å; E619-R727 IonicContact OE1-NH1 3.41Å; E619-R727 PolarHBondContact OE1-NH1 3.13Å; E619-R727 VanDerWaalsContact OE1-NH1 3.08Å; E619-R727 IonicContact OE2-NH1 2.92Å
620	V	96.8	Very high	90.1	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	123.9	-179.1	-176.3	0	0	0	0	109	T626 L627 L629 I637 V695 V724 I726	V620-T626 WeakPolarHBondContact O-CA 3.44Å; V620-L627 HydrophobicContact CB-CD1 4.27Å; V620-L627 HydrophobicContact CG1-CD1 3.85Å; V620-L627 HydrophobicContact CG1-CG 4.41Å; V620-L627 PolarHBondContact O-N 3.06Å; V620-L629 HydrophobicContact CB-CD1 4.36Å; V620-L629 HydrophobicContact CG2-CD1 3.89Å; V620-I637 HydrophobicContact CB-CD1 4.43Å; V620-I637 HydrophobicContact CG1-CD1 4.15Å; V620-I637 HydrophobicContact CG2-CD1 3.55Å; V620-V695 HydrophobicContact CG1-CG1 4.35Å; V620-V724 HydrophobicContact CG1-CG1 4.13Å; V620-I726 HydrophobicContact CG1-CG1 4.45Å; V620-I726 HydrophobicContact CG2-CG1 4.5Å; V620-I726 HydrophobicContact CG2-CG2 4.41Å
621	E	96.8	Very high	90.4	Very high	40 Å²	40	54.5 Å²	54.5	19%	0.187	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.3	-179.3	-174.2	-169	135.9	0	0	108.8	G624 V625 V724 T725 R727	E621-G624 WeakPolarHBondContact OE1-CA 3.36Å; E621-V625 WeakPolarHBondContact CA-O 3.37Å; E621-V724 CarbonylContact O-C 3.58Å; E621-V724 WeakPolarHBondContact O-CA 3.13Å; E621-T725 PolarHBondContact N-O 3.24Å; E621-T725 PolarHBondContact O-N 2.85Å; E621-R727 IonicContact OE2-CZ 2.81Å; E621-R727 IonicContact OE2-NH1 3.13Å; E621-R727 PolarHBondContact OE2-NH1 3.43Å; E621-R727 IonicContact OE2-NH2 3.53Å; E621-R727 PolarHBondContact OE2-NH2 2.97Å
622	C	96.5	Very high	90.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.2	-179.6	-63.6	0	0	0	0	108.8	G624 V625 P674 A719 C721 S723	C622-G624 PolarHBondContact O-N 3.24Å; C622-V625 PolarHBondContact N-O 3.16Å; C622-V625 WeakPolarHBondContact O-CB 3.38Å; C622-V625 PolarHBondContact O-N 2.94Å; C622-P674 HydrophobicContact CB-CB 4.12Å; C622-P674 WeakPolarHBondContact O-CG 3.42Å; C622-A719 HydrophobicContact CB-CB 4.29Å; C622-C721 HydrophobicContact CB-CB 3.8Å; C622-S723 WeakPolarHBondContact CA-O 3.24Å
623	D	94.4	Very high	90.6	Very high	36 Å²	36	52 Å²	52	19%	0.193	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	36.1	-177.9	-62.3	-35.8	0	0	0	114.2	P674 C721 S722 S723	D623-P674 HydrophobicContact CB-CB 4.07Å; D623-P674 HydrophobicContact CB-CG 4.05Å; D623-C721 WeakPolarHBondContact OD2-CA 3.49Å; D623-C721 WeakPolarHBondContact OD2-CB 3.13Å; D623-S722 VanDerWaalsContact CG-N 3.33Å; D623-S722 WeakPolarHBondContact OD1-CA 3.23Å; D623-S722 PolarHBondContact OD1-N 2.87Å; D623-S722 PolarHBondContact OD1-OG 2.81Å; D623-S722 PolarHBondContact OD2-N 3.49Å; D623-S723 PolarHBondContact N-O 3.28Å; D623-S723 PolarHBondContact OD1-N 3.33Å; D623-S723 PolarHBondContact OD1-OG 3.24Å
624	G	91.5	Very high	90.8	Very high	52 Å²	52	46.3 Å²	46.3	54%	0.536	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	-1.1	-177.8	0	0	0	0	0	115.7	E621 C622	E621-G624 WeakPolarHBondContact OE1-CA 3.36Å; C622-G624 PolarHBondContact O-N 3.24Å
625	V	94.1	Very high	90.8	Very high	63 Å²	63	47.3 Å²	47.3	38%	0.382	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	115.5	179.9	-177.2	0	0	0	0	110	E621 C622 P674	E621-V625 WeakPolarHBondContact CA-O 3.37Å; C622-V625 PolarHBondContact N-O 3.16Å; C622-V625 WeakPolarHBondContact O-CB 3.38Å; C622-V625 PolarHBondContact O-N 2.94Å; V625-P674 HydrophobicContact CB-CG 3.83Å; V625-P674 HydrophobicContact CG2-CG 3.57Å
626	T	94.8	Very high	90.8	Very high	78 Å²	78	45.6 Å²	45.6	48%	0.479	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	130.5	173.9	-50.4	0	0	0	0	110.7	E619 V620	E619-T626 HydrophobicContact CG-CG2 3.89Å; V620-T626 WeakPolarHBondContact O-CA 3.44Å
627	L	93.3	Very high	91	Very high	22 Å²	22	41.3 Å²	41.3	12%	0.115	25%	0.25	C	C	.	.			trans	-81.4	136.7	177	-58.7	-175.7	0	0	0	110.9	V620 L629 V676 V695 L718 A719	V620-L627 HydrophobicContact CB-CD1 4.27Å; V620-L627 HydrophobicContact CG1-CD1 3.85Å; V620-L627 HydrophobicContact CG1-CG 4.41Å; V620-L627 PolarHBondContact O-N 3.06Å; L627-L629 HydrophobicContact CB-CD2 4.04Å; L627-L629 HydrophobicContact CB-CG 4.39Å; L627-L629 PolarHBondContact O-N 2.84Å; L627-V676 HydrophobicContact CD2-CB 4.46Å; L627-V676 HydrophobicContact CD2-CG1 3.68Å; L627-V695 HydrophobicContact CD1-CG1 4.14Å; L627-L718 HydrophobicContact CD1-CB 4.08Å; L627-A719 HydrophobicContact CD1-CB 4.34Å; L627-A719 HydrophobicContact CD2-CB 4.22Å
628	D	89.8	Confident	91.1	Very high	114 Å²	114	38.2 Å²	38.2	61%	0.61	24%	0.236	S	C	*	.			trans	-82.8	103.6	170.2	179.3	15.7	0	0	0	110.6	S630	D628-S630 WeakPolarHBondContact OD1-CB 3.08Å; D628-S630 PolarHBondContact OD1-N 3.49Å; D628-S630 PolarHBondContact OD1-OG 3.38Å
629	L	89.5	Confident	91.3	Very high	13 Å²	13	37.4 Å²	37.4	7%	0.068	23%	0.232	C	C	.	.			trans	-99	-2.8	179.3	-53.9	-179.5	0	0	0	113	H615 V620 L627 S631 I632 L634 L718	H615-L629 HydrophobicContact CB-CB 4.05Å; V620-L629 HydrophobicContact CB-CD1 4.36Å; V620-L629 HydrophobicContact CG2-CD1 3.89Å; L627-L629 HydrophobicContact CB-CD2 4.04Å; L627-L629 HydrophobicContact CB-CG 4.39Å; L627-L629 PolarHBondContact O-N 2.84Å; L629-S631 PolarHBondContact O-N 3.45Å; L629-S631 VanDerWaalsContact O-N 3.15Å; L629-I632 PolarHBondContact O-N 2.89Å; L629-L634 HydrophobicContact CB-CD1 4.46Å; L629-L634 HydrophobicContact CD1-CD1 4.1Å; L629-L634 HydrophobicContact CD2-CD1 4.17Å; L629-L634 HydrophobicContact CG-CD1 4.48Å; L629-L718 HydrophobicContact CD2-CD1 3.99Å
630	S	82.6	Confident	91.2	Very high	93 Å²	93	33.7 Å²	33.7	65%	0.65	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-25	-171.5	65.7	0	0	0	0	114.2	D628 I632	D628-S630 WeakPolarHBondContact OD1-CB 3.08Å; D628-S630 PolarHBondContact OD1-N 3.49Å; D628-S630 PolarHBondContact OD1-OG 3.38Å; S630-I632 VanDerWaalsContact C-N 3.34Å
631	S	79.9	Confident	91.1	Very high	88 Å²	88	33.6 Å²	33.6	62%	0.615	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	2.1	179	62	0	0	0	0	114.1	L629	L629-S631 PolarHBondContact O-N 3.45Å; L629-S631 VanDerWaalsContact O-N 3.15Å
632	I	82.8	Confident	90.9	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.041	21%	0.206	C	C	.	.			trans	-126.7	121.6	-169.5	-47	176.3	0	0	0	110.3	H615 L629 S630 L634 E699 L718	H615-I632 PolarHBondContact CE1-O 3.36Å; H615-I632 PolarHBondContact ND1-O 3.33Å; L629-I632 PolarHBondContact O-N 2.89Å; S630-I632 VanDerWaalsContact C-N 3.34Å; I632-L634 VanDerWaalsContact C-N 3.26Å; I632-L634 HydrophobicContact CB-CD2 4.44Å; I632-L634 HydrophobicContact CB-CG 4.23Å; I632-L634 HydrophobicContact CG2-CD2 3.52Å; I632-L634 HydrophobicContact CG2-CG 3.78Å; I632-L634 PolarHBondContact O-N 3.03Å; I632-E699 HydrophobicContact CG2-CG 3.95Å; I632-E699 WeakPolarHBondContact CG2-OE1 3.23Å; I632-L718 HydrophobicContact CD1-CD2 3.63Å
633	S	85.2	Confident	90.3	Very high	67 Å²	67	33.4 Å²	33.4	47%	0.469	22%	0.216	S	C	.	.			trans	-79.9	70.8	175.3	-178.5	0	0	0	0	111.8
634	L	88.1	Confident	89.6	Confident	4 Å²	4	32 Å²	32	2%	0.021	21%	0.209	C	C	.	.			trans	-67.8	138.8	179.2	-63.4	176.9	0	0	0	112.7	L614 H615 L629 I632 G697 L698	L614-L634 HydrophobicContact CB-CB 4.28Å; L614-L634 WeakPolarHBondContact CB-O 3.41Å; L614-L634 PolarHBondContact N-O 3.09Å; H615-L634 HydrophobicContact CB-CB 4.44Å; H615-L634 HydrophobicContact CB-CD1 4.45Å; H615-L634 PolarHBondContact ND1-N 3.05Å; L629-L634 HydrophobicContact CB-CD1 4.46Å; L629-L634 HydrophobicContact CD1-CD1 4.1Å; L629-L634 HydrophobicContact CD2-CD1 4.17Å; L629-L634 HydrophobicContact CG-CD1 4.48Å; I632-L634 VanDerWaalsContact C-N 3.26Å; I632-L634 HydrophobicContact CB-CD2 4.44Å; I632-L634 HydrophobicContact CB-CG 4.23Å; I632-L634 HydrophobicContact CG2-CD2 3.52Å; I632-L634 HydrophobicContact CG2-CG 3.78Å; I632-L634 PolarHBondContact O-N 3.03Å; L634-G697 VanDerWaalsContact CD2-CA 3.48Å; L634-L698 WeakPolarHBondContact CA-O 3.47Å
635	E	89.8	Confident	88.9	Confident	22 Å²	22	29.6 Å²	29.6	10%	0.103	18%	0.184	C	C	.	.	S	Bend	trans	-113.6	-11.2	162.9	-61.9	-168.3	170.7	0	0	112	V569 C611 K612 L698 G700 A701	V569-E635 HydrophobicContact CB-CB 4.3Å; V569-E635 HydrophobicContact CG1-CB 4.28Å; V569-E635 PolarHBondContact N-O 3.41Å; C611-E635 VanDerWaalsContact CB-O 3.31Å; C611-E635 WeakPolarHBondContact CB-O 3.45Å; C611-E635 WeakPolarHBondContact O-CA 3.16Å; K612-E635 HydrophobicContact CG-CG 4.45Å; K612-E635 VanDerWaalsContact CG-OE1 3.3Å; K612-E635 WeakPolarHBondContact CG-OE1 3.43Å; E635-L698 PolarHBondContact N-O 2.85Å; E635-G700 VanDerWaalsContact OE2-CA 3.27Å; E635-G700 WeakPolarHBondContact OE2-CA 3.26Å; E635-A701 PolarHBondContact OE2-N 3.27Å
636	G	91.3	Very high	87.8	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	156.5	175.1	0	0	0	0	0	113.2	I567 L698	I567-G636 VanDerWaalsContact O-CA 3.27Å; I567-G636 WeakPolarHBondContact O-CA 3.46Å; G636-L698 PolarHBondContact N-O 2.83Å; G636-L698 VanDerWaalsContact N-O 3.09Å; G636-L698 PolarHBondContact O-N 3.05Å
637	I	93.6	Very high	86.5	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.7	166.8	-172.8	168.3	0	0	0	109.1	S566 I567 V620 I639 V695 V696	S566-I637 CarbonylContact C-O 3.52Å; S566-I637 WeakPolarHBondContact CA-O 3.29Å; S566-I637 VanDerWaalsContact CB-O 3.32Å; S566-I637 WeakPolarHBondContact CB-O 3.41Å; I567-I637 HydrophobicContact CB-CG2 3.79Å; I567-I637 HydrophobicContact CD1-CG2 4.21Å; I567-I637 HydrophobicContact CG1-CG2 4.18Å; I567-I637 PolarHBondContact N-O 3.39Å; I567-I637 PolarHBondContact O-N 2.9Å; V620-I637 HydrophobicContact CB-CD1 4.43Å; V620-I637 HydrophobicContact CG1-CD1 4.15Å; V620-I637 HydrophobicContact CG2-CD1 3.55Å; I637-I639 HydrophobicContact CG1-CD1 4.41Å; I637-V695 HydrophobicContact CD1-CG1 3.93Å; I637-V695 HydrophobicContact CG1-CG1 4.32Å; I637-V696 CarbonylContact C-O 3.56Å; I637-V696 WeakPolarHBondContact CA-O 3.47Å
638	A	94	Very high	85.2	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.5	177.5	0	0	0	0	0	110.6	F565 L640 M645 V696	F565-A638 CarbonylContact O-C 3.43Å; F565-A638 WeakPolarHBondContact O-CA 3.14Å; A638-L640 HydrophobicContact CB-CD2 3.9Å; A638-M645 HydrophobicContact CB-CE 4.36Å; A638-V696 HydrophobicContact CB-CB 4.48Å; A638-V696 PolarHBondContact N-O 3.43Å; A638-V696 PolarHBondContact O-N 3.42Å
639	I	96.2	Very high	84.2	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	109.5	175.8	-49.1	-58.5	0	0	0	106.6	M561 Y564 F565 I637 L693 E694 V695 V724 I726 I750	M561-I639 HydrophobicContact CE-CG2 4.4Å; Y564-I639 CarbonylContact C-O 3.59Å; Y564-I639 WeakPolarHBondContact CA-O 3.4Å; Y564-I639 VanDerWaalsContact CB-O 3.26Å; Y564-I639 WeakPolarHBondContact CB-O 3.28Å; F565-I639 HydrophobicContact CB-CB 4.47Å; F565-I639 HydrophobicContact CD1-CG1 4.04Å; F565-I639 PolarHBondContact N-O 2.89Å; F565-I639 PolarHBondContact O-N 3.07Å; I637-I639 HydrophobicContact CG1-CD1 4.41Å; I639-L693 HydrophobicContact CG2-CB 4.1Å; I639-L693 HydrophobicContact CG2-CD1 3.78Å; I639-L693 HydrophobicContact CG2-CD2 4.14Å; I639-L693 HydrophobicContact CG2-CG 4.23Å; I639-E694 CarbonylContact C-O 3.58Å; I639-E694 WeakPolarHBondContact CA-O 3.49Å; I639-V695 HydrophobicContact CD1-CB 4.2Å; I639-V695 HydrophobicContact CD1-CG1 3.79Å; I639-V695 HydrophobicContact CD1-CG2 3.91Å; I639-V724 HydrophobicContact CD1-CG1 4.1Å; I639-V724 HydrophobicContact CD1-CG2 4.44Å; I639-V724 HydrophobicContact CG2-CG2 4.26Å; I639-I726 HydrophobicContact CD1-CD1 4.26Å; I639-I726 HydrophobicContact CG1-CD1 4.23Å; I639-I750 HydrophobicContact CB-CD1 4.26Å; I639-I750 HydrophobicContact CG1-CD1 4.02Å; I639-I750 HydrophobicContact CG2-CD1 4.12Å
640	L	94.7	Very high	83.6	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.3	-171.1	-45.7	178.6	0	0	0	110.6	Y564 A638 M645 L651 W652 L693 E694 V696	Y564-L640 HydrophobicContact CD2-CD2 4.5Å; Y564-L640 HydrophobicContact CG-CD2 4.05Å; A638-L640 HydrophobicContact CB-CD2 3.9Å; L640-M645 HydrophobicContact CD1-CE 4.5Å; L640-M645 HydrophobicContact CD1-SD 3.51Å; L640-M645 VanDerWaalsContact CD1-SD 3.51Å; L640-M645 HydrophobicContact CD2-CE 3.93Å; L640-M645 HydrophobicContact CD2-SD 3.75Å; L640-M645 HydrophobicContact CG-SD 4.3Å; L640-L651 HydrophobicContact CD1-CD1 3.96Å; L640-W652 HydrophobicContact CD1-CZ2 4.43Å; L640-L693 WeakPolarHBondContact O-CD2 3.38Å; L640-E694 HydrophobicContact CB-CB 4.21Å; L640-E694 PolarHBondContact N-O 3.15Å; L640-E694 PolarHBondContact O-N 3.42Å; L640-E694 VanDerWaalsContact O-OE2 3.1Å; L640-V696 HydrophobicContact CD1-CG2 3.73Å; L640-V696 HydrophobicContact CG-CG2 4.08Å
641	N	94.9	Very high	83.2	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	-98.7	-31.8	166.5	-178.6	52.2	0	0	0	111.7	D538 W540 M561 N562 N563 L693	D538-N641 PolarHBondContact O-ND2 3.24Å; W540-N641 VanDerWaalsContact NE1-CG 3.33Å; W540-N641 PolarHBondContact NE1-OD1 3.19Å; M561-N641 HydrophobicContact CE-CB 4.36Å; N562-N641 PolarHBondContact O-ND2 3.12Å; N563-N641 VanDerWaalsContact O-CB 3.31Å; N563-N641 WeakPolarHBondContact O-CB 3.36Å; N563-N641 PolarHBondContact O-N 2.89Å; N641-L693 HydrophobicContact CB-CD2 4.13Å
642	I	91.8	Very high	82.9	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.005	11%	0.11	C	C	.	.	S	Bend	trans	-116.1	151.1	-177.5	67.6	169	0	0	0	112.2	D506 L507 L537 N563 S644 Q686 L688	D506-I642 HydrophobicContact CB-CD1 4.02Å; L507-I642 HydrophobicContact CB-CD1 4.43Å; L507-I642 HydrophobicContact CD1-CD1 4.44Å; L507-I642 HydrophobicContact CD1-CG2 4.18Å; L537-I642 HydrophobicContact CD1-CG2 3.98Å; N563-I642 HydrophobicContact CB-CD1 3.74Å; N563-I642 HydrophobicContact CB-CG1 4.04Å; N563-I642 PolarHBondContact O-N 3.28Å; I642-S644 WeakPolarHBondContact CD1-O 3.44Å; I642-S644 WeakPolarHBondContact CG1-O 3.49Å; I642-S644 PolarHBondContact O-N 3.26Å; I642-S644 VanDerWaalsContact O-N 3.13Å; I642-Q686 VanDerWaalsContact C-NE2 3.3Å; I642-Q686 PolarHBondContact O-NE2 2.92Å; I642-Q686 VanDerWaalsContact O-NE2 3.13Å; I642-L688 HydrophobicContact CG2-CB 4.27Å
643	P	84.3	Confident	82	Confident	34 Å²	34	17.9 Å²	17.9	22%	0.221	11%	0.113	C	C	.	.	S	Bend	trans	-79.3	14.1	-179.3	32.6	-37.5	0	0	0	115.3	N650 Q686	P643-N650 VanDerWaalsContact O-CA 3.31Å; P643-N650 WeakPolarHBondContact O-CA 3.4Å; P643-N650 WeakPolarHBondContact O-CB 3.4Å; P643-Q686 HydrophobicContact CB-CG 4.13Å
644	S	79.6	Confident	80.6	Confident	7 Å²	7	23.4 Å²	23.4	5%	0.049	13%	0.132	C	C	.	.			trans	-124.8	128.3	175.4	-175	0	0	0	0	109.5	D506 C510 I642 G648	D506-S644 PolarHBondContact OD1-OG 3.18Å; C510-S644 WeakPolarHBondContact SG-CB 3.43Å; C510-S644 PolarHBondContact SG-N 2.72Å; C510-S644 VanDerWaalsContact SG-N 3.43Å; I642-S644 WeakPolarHBondContact CD1-O 3.44Å; I642-S644 WeakPolarHBondContact CG1-O 3.49Å; I642-S644 PolarHBondContact O-N 3.26Å; I642-S644 VanDerWaalsContact O-N 3.13Å; S644-G648 WeakPolarHBondContact OG-CA 3.37Å
645	M	77.7	Confident	78.8	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.01	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-139.8	157	173.5	55.8	-165.2	-68.5	0	0	110.4	D506 Y564 A638 L640 G647 G648 S649 L651 I707	D506-M645 VanDerWaalsContact OD1-C 3.29Å; D506-M645 WeakPolarHBondContact OD1-CA 3.31Å; D506-M645 PolarHBondContact OD1-N 3.45Å; Y564-M645 HydrophobicContact CD1-CB 4.25Å; Y564-M645 HydrophobicContact CE1-CB 4Å; A638-M645 HydrophobicContact CB-CE 4.36Å; L640-M645 HydrophobicContact CD1-CE 4.5Å; L640-M645 HydrophobicContact CD1-SD 3.51Å; L640-M645 VanDerWaalsContact CD1-SD 3.51Å; L640-M645 HydrophobicContact CD2-CE 3.93Å; L640-M645 HydrophobicContact CD2-SD 3.75Å; L640-M645 HydrophobicContact CG-SD 4.3Å; M645-G647 VanDerWaalsContact C-N 3.34Å; M645-G647 PolarHBondContact O-N 2.94Å; M645-G648 PolarHBondContact O-N 2.65Å; M645-S649 PolarHBondContact N-O 2.89Å; M645-S649 WeakPolarHBondContact O-CB 3.43Å; M645-S649 PolarHBondContact O-N 3.17Å; M645-L651 HydrophobicContact CE-CD1 4.19Å; M645-L651 HydrophobicContact CG-CD2 4.39Å; M645-L651 HydrophobicContact CG-CG 4.31Å; M645-L651 HydrophobicContact SD-CD1 3.34Å; M645-L651 WeakPolarHBondContact SD-CD1 3.37Å; M645-L651 HydrophobicContact SD-CD2 3.84Å; M645-L651 HydrophobicContact SD-CG 3.46Å; M645-L651 WeakPolarHBondContact SD-CG 3.5Å; M645-I707 HydrophobicContact CG-CG2 4.49Å
646	H	70.4	Confident	76.5	Confident	14 Å²	14	35.1 Å²	35.1	7%	0.065	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	41.4	175.7	-54.3	-53.3	0	0	0	114.6	D570 I707 Y708	D570-H646 IonicContact OD1-CE1 3.34Å; D570-H646 PolarHBondContact OD1-CE1 3.08Å; D570-H646 IonicContact OD1-ND1 2.72Å; D570-H646 PolarHBondContact OD1-ND1 2.75Å; D570-H646 IonicContact OD1-NE2 3.61Å; D570-H646 IonicContact OD2-CE1 3.18Å; D570-H646 PolarHBondContact OD2-CE1 3.16Å; H646-I707 HydrophobicContact CB-CG2 4.3Å; H646-Y708 HydrophobicContact CB-CD1 3.91Å; H646-Y708 HydrophobicContact CB-CE1 3.63Å; H646-Y708 HydrophobicContact CB-CE2 4.42Å; H646-Y708 HydrophobicContact CB-CG 4.44Å; H646-Y708 AromaticContact CG-CZ 3.9Å; H646-Y708 AromaticContact ND1-CZ 3.76Å; H646-Y708 PolarHBondContact ND1-OH 3.26Å
647	G	66.6	Low	74.1	Confident	21 Å²	21	44.5 Å²	44.5	22%	0.216	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	32.4	175.8	0	0	0	0	0	114.3	D506 R509 M645	D506-G647 WeakPolarHBondContact OD1-CA 3.35Å; D506-G647 PolarHBondContact OD1-N 3.19Å; D506-G647 PolarHBondContact OD2-N 2.89Å; D506-G647 VanDerWaalsContact OD2-N 3.09Å; R509-G647 VanDerWaalsContact CZ-C 3.46Å; R509-G647 PolarHBondContact NE-O 3.23Å; R509-G647 PolarHBondContact NH2-O 2.93Å; M645-G647 VanDerWaalsContact C-N 3.34Å; M645-G647 PolarHBondContact O-N 2.94Å
648	G	66.8	Low	71.7	Confident	33 Å²	33	53 Å²	53	34%	0.34	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	120	6.3	168.3	0	0	0	0	0	117.2	D506 S644 M645	D506-G648 PolarHBondContact OD1-N 3.49Å; S644-G648 WeakPolarHBondContact OG-CA 3.37Å; M645-G648 PolarHBondContact O-N 2.65Å
649	S	67.9	Low	69.1	Low	13 Å²	13	65.5 Å²	65.5	9%	0.091	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-85.1	122.9	-173.9	-62.3	0	0	0	0	110.7	M645 I707	M645-S649 PolarHBondContact N-O 2.89Å; M645-S649 WeakPolarHBondContact O-CB 3.43Å; M645-S649 PolarHBondContact O-N 3.17Å; S649-I707 VanDerWaalsContact CB-O 3.24Å; S649-I707 WeakPolarHBondContact CB-O 3.4Å; S649-I707 PolarHBondContact OG-O 3.02Å
650	N	77.4	Confident	66.5	Low	65 Å²	65	68.8 Å²	68.8	35%	0.348	35%	0.345	S	S	.	.			trans	-98.5	110.5	171.1	176.8	-19.4	0	0	0	108.2	P643 W652 G653	P643-N650 VanDerWaalsContact O-CA 3.31Å; P643-N650 WeakPolarHBondContact O-CA 3.4Å; P643-N650 WeakPolarHBondContact O-CB 3.4Å; N650-W652 PolarHBondContact O-N 3.47Å; N650-W652 WeakPolarHBondContact OD1-CA 3.35Å; N650-W652 WeakPolarHBondContact OD1-CB 3.36Å; N650-W652 PolarHBondContact OD1-N 3.09Å; N650-G653 PolarHBondContact ND2-O 3.4Å; N650-G653 PolarHBondContact O-N 2.89Å; N650-G653 PolarHBondContact OD1-N 3Å; N650-G653 VanDerWaalsContact OD1-N 3.09Å
651	L	73.8	Confident	63.9	Low	7 Å²	7	77.3 Å²	77.3	4%	0.037	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.2	-177.6	-61.5	-173.6	0	0	0	113.1	L640 M645 V696 I707 S713	L640-L651 HydrophobicContact CD1-CD1 3.96Å; M645-L651 HydrophobicContact CE-CD1 4.19Å; M645-L651 HydrophobicContact CG-CD2 4.39Å; M645-L651 HydrophobicContact CG-CG 4.31Å; M645-L651 HydrophobicContact SD-CD1 3.34Å; M645-L651 WeakPolarHBondContact SD-CD1 3.37Å; M645-L651 HydrophobicContact SD-CD2 3.84Å; M645-L651 HydrophobicContact SD-CG 3.46Å; M645-L651 WeakPolarHBondContact SD-CG 3.5Å; L651-V696 HydrophobicContact CD1-CG1 3.77Å; L651-V696 HydrophobicContact CD1-CG2 4.3Å; L651-I707 HydrophobicContact CD2-CB 4.43Å; L651-I707 HydrophobicContact CD2-CD1 3.76Å; L651-I707 HydrophobicContact CD2-CG1 3.69Å; L651-I707 HydrophobicContact CD2-CG2 3.84Å; L651-S713 PolarHBondContact O-N 3.21Å
652	W	73.3	Confident	61.3	Low	68 Å²	68	88.5 Å²	88.5	26%	0.258	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-19.9	-171.8	-36.9	122.3	0	0	0	113.6	L640 N650 E694 V696 R717	L640-W652 HydrophobicContact CD1-CZ2 4.43Å; N650-W652 PolarHBondContact O-N 3.47Å; N650-W652 WeakPolarHBondContact OD1-CA 3.35Å; N650-W652 WeakPolarHBondContact OD1-CB 3.36Å; N650-W652 PolarHBondContact OD1-N 3.09Å; W652-E694 HydrophobicContact CZ2-CB 4.28Å; W652-E694 HydrophobicContact CZ2-CG 4.24Å; W652-V696 HydrophobicContact CH2-CG1 4.31Å; W652-V696 HydrophobicContact CH2-CG2 3.66Å; W652-V696 HydrophobicContact CZ2-CG2 3.79Å; W652-R717 HydrophobicContact CH2-CB 3.7Å; W652-R717 HydrophobicContact CH2-CG 3.72Å; W652-R717 HydrophobicContact CZ2-CG 4.34Å; W652-R717 HydrophobicContact CZ3-CB 3.7Å; W652-R717 HydrophobicContact CZ3-CG 4.1Å
653	G	64.1	Low	59	Low	11 Å²	11	98.4 Å²	98.4	11%	0.113	47%	0.47	C	S	.	.			trans	71.6	-158.5	-172.2	0	0	0	0	0	114.1	N650 S655	N650-G653 PolarHBondContact ND2-O 3.4Å; N650-G653 PolarHBondContact O-N 2.89Å; N650-G653 PolarHBondContact OD1-N 3Å; N650-G653 VanDerWaalsContact OD1-N 3.09Å; G653-S655 PolarHBondContact O-N 3.01Å
654	E	55.8	Low	56.7	Low	183 Å²	183	101.9 Å²	101.9	86%	0.855	50%	0.501	S	S	*	.	S	Bend	trans	-74.1	116.4	173.8	-74.5	-175.4	165.2	0	0	109.8	K656	E654-K656 PolarHBondContact O-N 2.84Å
655	S	50.3	Low	54.6	Low	70 Å²	70	104.8 Å²	104.8	49%	0.49	53%	0.532	S	S	.	.			trans	-57.3	121.8	179.9	-49.1	0	0	0	0	111.3	G653 K657	G653-S655 PolarHBondContact O-N 3.01Å; S655-K657 PolarHBondContact O-N 3.25Å
656	K	42.2	Very low	53	Low	203 Å²	203	115.4 Å²	115.4	88%	0.883	58%	0.578	S	S	*	*			trans	-71.1	91.3	170.4	-70.1	-176.8	-178.3	175.7	0	108.9	E654 R658	E654-K656 PolarHBondContact O-N 2.84Å; K656-R658 PolarHBondContact O-N 2.93Å
657	K	41.6	Very low	51.4	Low	196 Å²	196	124.5 Å²	124.5	85%	0.852	62%	0.618	S	S	*	*			trans	-58	125.3	172.3	-72	-172.4	177.4	-176.6	0	109.8	S655 R659	S655-K657 PolarHBondContact O-N 3.25Å; K657-R659 PolarHBondContact O-N 3.21Å
658	R	42.9	Very low	50	Low	184 Å²	184	128.9 Å²	128.9	69%	0.694	65%	0.645	S	S	*	*			trans	-57.8	119.1	163.5	-94.2	-176.2	168.6	-173.5	-2.5	108.2	K656 G660	K656-R658 PolarHBondContact O-N 2.93Å; R658-G660 VanDerWaalsContact C-N 3.34Å; R658-G660 PolarHBondContact O-N 2.9Å
659	R	38.6	Very low	49.1	Very low	262 Å²	262	138.6 Å²	138.6	99%	0.989	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	97.1	159.2	-78.8	-178.5	173.2	-179.7	-2	106.5	K657	K657-R659 PolarHBondContact O-N 3.21Å
660	G	42.3	Very low	47.9	Very low	70 Å²	70	146.4 Å²	146.4	72%	0.722	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.2	-38.2	174.4	0	0	0	0	0	119.2	R658 R662	R658-G660 VanDerWaalsContact C-N 3.34Å; R658-G660 PolarHBondContact O-N 2.9Å; G660-R662 PolarHBondContact O-N 3.22Å
661	Q	39.3	Very low	46.4	Very low	180 Å²	180	153.5 Å²	153.5	84%	0.841	73%	0.734	S	S	*	*			trans	-100.4	86	-174.8	-86.6	176.1	-28.1	0	0	112.1
662	R	40.8	Very low	46	Very low	235 Å²	235	161.2 Å²	161.2	89%	0.887	76%	0.763	S	S	*	*			trans	-80.8	128.3	156.9	-83.8	-179.8	169.5	175.7	-2.8	108.4	G660	G660-R662 PolarHBondContact O-N 3.22Å
663	K	44.4	Very low	46.2	Very low	209 Å²	209	163.7 Å²	163.7	91%	0.909	79%	0.785	S	S	*	*			trans	62	91.6	160.1	-62.2	-176.5	176	-177.1	0	116.4
664	A	34.8	Very low	47.3	Very low	107 Å²	107	163.8 Å²	163.8	88%	0.884	78%	0.784	S	S	*	*			trans	-111.1	117.9	142.9	0	0	0	0	0	107.3
665	G	36.5	Very low	48.9	Very low	67 Å²	67	156.8 Å²	156.8	69%	0.691	75%	0.754	S	S	*	*			trans	-64.3	158.1	-174.7	0	0	0	0	0	113.3	K667	G665-K667 PolarHBondContact O-N 2.79Å
666	K	42.6	Very low	50.8	Low	225 Å²	225	156.3 Å²	156.3	98%	0.978	75%	0.748	S	S	*	*			trans	-43.7	94.5	165.6	-144.5	173.6	-171.7	178.3	0	109.4
667	K	36.5	Very low	52.9	Low	205 Å²	205	150 Å²	150	89%	0.891	72%	0.723	S	S	*	*			trans	-113.9	137.2	168	-95.2	-169.5	176.3	-175	0	109.4	G665	G665-K667 PolarHBondContact O-N 2.79Å
668	S	38.8	Very low	55	Low	113 Å²	113	144.9 Å²	144.9	79%	0.79	71%	0.71	S	S	*	*			trans	-26.1	142.6	177.8	-175.3	0	0	0	0	117.7	E670	S668-E670 PolarHBondContact O-N 2.89Å; S668-E670 VanDerWaalsContact O-N 3.13Å
669	R	46.8	Very low	56.9	Low	238 Å²	238	143.6 Å²	143.6	90%	0.898	71%	0.71	S	S	*	*			trans	-47	102.9	165.3	-84.1	166.5	131.1	172.1	-5.5	111.7
670	E	42.3	Very low	59.1	Low	176 Å²	176	136.7 Å²	136.7	82%	0.822	69%	0.689	S	S	*	*			trans	-113.9	145.5	150.7	-91.3	179.6	157	0	0	107.6	S668 R672	S668-E670 PolarHBondContact O-N 2.89Å; S668-E670 VanDerWaalsContact O-N 3.13Å; E670-R672 PolarHBondContact O-N 2.77Å
671	K	47.8	Very low	61.2	Low	215 Å²	215	133.7 Å²	133.7	94%	0.935	66%	0.656	S	S	*	*			trans	-45.1	107.5	-179.3	-83.7	-179.7	172.6	-177.3	0	109.5	T673	K671-T673 PolarHBondContact O-N 2.94Å
672	R	64.8	Low	63.1	Low	169 Å²	169	132.2 Å²	132.2	64%	0.638	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-69.5	118.2	174.2	-71.6	-177.8	175.1	175.6	-1.2	106.6	E670	E670-R672 PolarHBondContact O-N 2.77Å
673	T	76.3	Confident	65	Low	119 Å²	119	126.7 Å²	126.7	73%	0.73	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-63.7	144.6	166.2	47.6	0	0	0	0	108.8	K671	K671-T673 PolarHBondContact O-N 2.94Å
674	P	87.3	Confident	66.9	Low	14 Å²	14	117.9 Å²	117.9	9%	0.091	60%	0.6	C	S	.	*	P	Polyproline II helix	trans	-65	141.9	178.8	31	-35.1	0	0	0	109.3	C622 D623 V625 V676 C721	C622-P674 HydrophobicContact CB-CB 4.12Å; C622-P674 WeakPolarHBondContact O-CG 3.42Å; D623-P674 HydrophobicContact CB-CB 4.07Å; D623-P674 HydrophobicContact CB-CG 4.05Å; V625-P674 HydrophobicContact CB-CG 3.83Å; V625-P674 HydrophobicContact CG2-CG 3.57Å; P674-V676 HydrophobicContact CB-CG1 4.21Å; P674-V676 HydrophobicContact CG-CG1 4.32Å; P674-V676 PolarHBondContact O-N 3.13Å; P674-C721 HydrophobicContact CB-CB 3.93Å
675	V	90	Very high	69.3	Low	36 Å²	36	116.6 Å²	116.6	22%	0.218	58%	0.581	C	S	.	*	B	Isolated β-bridge	trans	-84.3	110.8	172.5	-175.3	0	0	0	0	107.3	E680 L681 A719 Q720	V675-E680 HydrophobicContact CG1-CB 3.62Å; V675-L681 HydrophobicContact CB-CD2 4.22Å; V675-L681 HydrophobicContact CG1-CD2 3.89Å; V675-L681 HydrophobicContact CG1-CG 4.08Å; V675-L681 WeakPolarHBondContact O-CD2 2.95Å; V675-A719 CarbonylContact O-C 3.56Å; V675-A719 VanDerWaalsContact O-CA 3.23Å; V675-A719 WeakPolarHBondContact O-CA 3.37Å; V675-Q720 HydrophobicContact CB-CB 4.38Å; V675-Q720 PolarHBondContact N-O 3.5Å; V675-Q720 PolarHBondContact O-N 3.46Å
676	V	89.8	Confident	71.8	Confident	59 Å²	59	114.2 Å²	114.2	36%	0.358	55%	0.552	S	S	.	*			trans	-120.9	-16.1	-179.1	-61	0	0	0	0	113.2	L627 P674 P678 A719	L627-V676 HydrophobicContact CD2-CB 4.46Å; L627-V676 HydrophobicContact CD2-CG1 3.68Å; P674-V676 HydrophobicContact CB-CG1 4.21Å; P674-V676 HydrophobicContact CG-CG1 4.32Å; P674-V676 PolarHBondContact O-N 3.13Å; V676-P678 VanDerWaalsContact O-CD 3.32Å; V676-P678 WeakPolarHBondContact O-CD 3.47Å; V676-A719 HydrophobicContact CG1-CB 4.07Å
677	D	86.8	Confident	73.9	Confident	70 Å²	70	106.7 Å²	106.7	37%	0.374	52%	0.522	S	S	.	.			trans	-67.6	121.2	177.2	-179.6	-6.7	0	0	0	109.8	K679 E680 L681	D677-K679 PolarHBondContact O-N 3.44Å; D677-K679 VanDerWaalsContact O-N 3.07Å; D677-K679 PolarHBondContact OD1-N 2.91Å; D677-E680 HydrophobicContact CB-CB 4.32Å; D677-E680 HydrophobicContact CB-CG 4.14Å; D677-E680 PolarHBondContact O-N 3.49Å; D677-L681 WeakPolarHBondContact O-CG 3.09Å; D677-L681 PolarHBondContact O-N 3.36Å
678	P	84.9	Confident	76.5	Confident	89 Å²	89	97.6 Å²	97.6	58%	0.578	48%	0.483	S	S	*	.	H	α-helix	trans	-50.5	-34	176.4	-28.9	36	0	0	0	114.3	V676 M682	V676-P678 VanDerWaalsContact O-CD 3.32Å; V676-P678 WeakPolarHBondContact O-CD 3.47Å; P678-M682 WeakPolarHBondContact O-CG 3.49Å; P678-M682 PolarHBondContact O-N 3.5Å
679	K	83.8	Confident	79.1	Confident	157 Å²	157	94.6 Å²	94.6	68%	0.683	46%	0.462	S	S	*	.	H	α-helix	trans	-70.1	-34.4	179.5	-68.5	177.7	-177.6	169.7	0	112.6	D677 F683	D677-K679 PolarHBondContact O-N 3.44Å; D677-K679 VanDerWaalsContact O-N 3.07Å; D677-K679 PolarHBondContact OD1-N 2.91Å; K679-F683 WeakPolarHBondContact O-CD2 3.43Å; K679-F683 WeakPolarHBondContact O-CE2 3.05Å
680	E	85.4	Confident	81.3	Confident	117 Å²	117	85.2 Å²	85.2	55%	0.547	43%	0.43	S	S	.	.	H	α-helix	trans	-79.2	-39.8	176.8	-63.7	-168.1	168	0	0	111	V675 D677 M682 F683 A684	V675-E680 HydrophobicContact CG1-CB 3.62Å; D677-E680 HydrophobicContact CB-CB 4.32Å; D677-E680 HydrophobicContact CB-CG 4.14Å; D677-E680 PolarHBondContact O-N 3.49Å; E680-M682 PolarHBondContact O-N 2.82Å; E680-F683 PolarHBondContact O-N 2.81Å; E680-A684 PolarHBondContact O-N 3.07Å
681	L	85.3	Confident	83.9	Confident	7 Å²	7	80.8 Å²	80.8	4%	0.037	41%	0.409	C	S	.	.	H	α-helix	trans	-58.3	-28.2	176.2	-76	176.3	0	0	0	113.6	V675 D677 F683 R717 L718 Q720	V675-L681 HydrophobicContact CB-CD2 4.22Å; V675-L681 HydrophobicContact CG1-CD2 3.89Å; V675-L681 HydrophobicContact CG1-CG 4.08Å; V675-L681 WeakPolarHBondContact O-CD2 2.95Å; D677-L681 WeakPolarHBondContact O-CG 3.09Å; D677-L681 PolarHBondContact O-N 3.36Å; L681-F683 PolarHBondContact O-N 2.99Å; L681-R717 HydrophobicContact CB-CG 4.4Å; L681-R717 HydrophobicContact CD1-CG 4.37Å; L681-R717 HydrophobicContact CD2-CG 4.04Å; L681-R717 PolarHBondContact O-NH1 3.01Å; L681-L718 WeakPolarHBondContact CD1-O 3.49Å; L681-Q720 HydrophobicContact CD2-CB 4.24Å
682	M	79.2	Confident	86.1	Confident	150 Å²	150	71.5 Å²	71.5	74%	0.739	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.5	172.8	-78.9	-179.8	56.2	0	0	114.1	P678 E680	P678-M682 WeakPolarHBondContact O-CG 3.49Å; P678-M682 PolarHBondContact O-N 3.5Å; E680-M682 PolarHBondContact O-N 2.82Å
683	F	82.1	Confident	87.6	Confident	119 Å²	119	63.4 Å²	63.4	52%	0.522	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-12.4	-177	-59.4	-73.8	0	0	0	113.3	K679 E680 L681	K679-F683 WeakPolarHBondContact O-CD2 3.43Å; K679-F683 WeakPolarHBondContact O-CE2 3.05Å; E680-F683 PolarHBondContact O-N 2.81Å; L681-F683 PolarHBondContact O-N 2.99Å
684	A	84.1	Confident	88.4	Confident	24 Å²	24	57.8 Å²	57.8	20%	0.198	31%	0.305	C	S	.	.			trans	-61.3	137.4	175.3	0	0	0	0	0	110.4	E680 R717	E680-A684 PolarHBondContact O-N 3.07Å; A684-R717 VanDerWaalsContact CB-CZ 3.49Å; A684-R717 VanDerWaalsContact CB-NH1 3.28Å; A684-R717 PolarHBondContact O-NH1 3.29Å
685	V	85.1	Confident	88.8	Confident	79 Å²	79	57.1 Å²	57.1	48%	0.479	30%	0.3	S	S	.	.			trans	-105.7	128.8	179.7	177.8	0	0	0	0	107	Q720	V685-Q720 PolarHBondContact O-NE2 3.2Å
686	Q	87.8	Confident	88.9	Confident	18 Å²	18	55.4 Å²	55.4	8%	0.084	29%	0.29	C	S	.	.			trans	-78.5	126.6	169.6	176.8	167.4	35.3	0	0	109.1	I642 P643 E694	I642-Q686 VanDerWaalsContact C-NE2 3.3Å; I642-Q686 PolarHBondContact O-NE2 2.92Å; I642-Q686 VanDerWaalsContact O-NE2 3.13Å; P643-Q686 HydrophobicContact CB-CG 4.13Å; Q686-E694 VanDerWaalsContact CA-OE1 3.28Å; Q686-E694 WeakPolarHBondContact CA-OE1 3.27Å; Q686-E694 HydrophobicContact CB-CG 4.17Å; Q686-E694 VanDerWaalsContact CB-OE1 3.31Å; Q686-E694 WeakPolarHBondContact CB-OE1 3.48Å; Q686-E694 HydrophobicContact CG-CG 4.19Å; Q686-E694 WeakPolarHBondContact CG-OE1 3.15Å; Q686-E694 WeakPolarHBondContact CG-OE2 3.4Å; Q686-E694 PolarHBondContact NE2-OE2 2.97Å
687	D	88.1	Confident	89	Confident	66 Å²	66	52.6 Å²	52.6	35%	0.353	27%	0.273	S	S	.	.			trans	-134.7	141.6	177.3	-168	-78.9	0	0	0	109	S689 D690	D687-S689 PolarHBondContact O-N 2.87Å; D687-S689 WeakPolarHBondContact OD1-CB 3.35Å; D687-S689 PolarHBondContact OD1-N 3Å; D687-S689 PolarHBondContact OD1-OG 3.06Å; D687-D690 HydrophobicContact CB-CB 4.04Å
688	L	91	Very high	89	Confident	14 Å²	14	49.2 Å²	49.2	7%	0.073	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	4.8	-175.1	52.3	77.1	0	0	0	113.4	C510 L511 V535 M536 L537 D538 I642	C510-L688 HydrophobicContact CB-CD2 4.42Å; L511-L688 HydrophobicContact CD2-CD2 4.33Å; V535-L688 HydrophobicContact CG2-CD1 4.34Å; M536-L688 WeakPolarHBondContact O-CD1 3.5Å; L537-L688 CarbonylContact C-O 3.57Å; L537-L688 WeakPolarHBondContact CA-O 3.42Å; L537-L688 HydrophobicContact CD1-CB 4.1Å; D538-L688 PolarHBondContact N-O 3.35Å; I642-L688 HydrophobicContact CG2-CB 4.27Å
689	S	92.8	Very high	88.7	Confident	50 Å²	50	48.5 Å²	48.5	35%	0.35	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.2	5.6	-174.4	71	0	0	0	0	115.1	M536 D538 D687 Q755	M536-S689 VanDerWaalsContact O-CB 3.3Å; M536-S689 WeakPolarHBondContact O-CB 3.38Å; D538-S689 WeakPolarHBondContact OD2-CA 3.35Å; D538-S689 PolarHBondContact OD2-N 2.72Å; D687-S689 PolarHBondContact O-N 2.87Å; D687-S689 WeakPolarHBondContact OD1-CB 3.35Å; D687-S689 PolarHBondContact OD1-N 3Å; D687-S689 PolarHBondContact OD1-OG 3.06Å; S689-Q755 PolarHBondContact O-NE2 3.14Å
690	D	93.6	Very high	88	Confident	42 Å²	42	41.5 Å²	41.5	23%	0.225	22%	0.216	C	C	.	.	S	Bend	trans	-90.5	1	-172.6	70.5	-1	0	0	0	114.7	D538 D687 L692	D538-D690 PolarHBondContact OD2-N 2.74Å; D687-D690 HydrophobicContact CB-CB 4.04Å; D690-L692 PolarHBondContact O-N 3.5Å; D690-L692 WeakPolarHBondContact OD1-CB 3.46Å; D690-L692 PolarHBondContact OD1-N 3.37Å
691	Q	95.5	Very high	87	Confident	82 Å²	82	36 Å²	36	38%	0.383	19%	0.191	S	C	.	.	S	Bend	trans	60.2	32.5	-175.4	-55.1	177.9	-0.4	0	0	112.9	D538 W540	D538-Q691 VanDerWaalsContact OD2-CA 3.3Å; D538-Q691 WeakPolarHBondContact OD2-CA 3.5Å; D538-Q691 PolarHBondContact OD2-N 3.03Å; W540-Q691 WeakPolarHBondContact CH2-O 3.15Å
692	L	95.3	Very high	85.9	Confident	20 Å²	20	42.2 Å²	42.2	11%	0.105	22%	0.221	C	C	.	.			trans	-121.4	157.2	174.5	-56.8	174	0	0	0	111.1	D690 Q720 C721	D690-L692 PolarHBondContact O-N 3.5Å; D690-L692 WeakPolarHBondContact OD1-CB 3.46Å; D690-L692 PolarHBondContact OD1-N 3.37Å; L692-Q720 HydrophobicContact CB-CG 3.92Å; L692-Q720 HydrophobicContact CD1-CG 4.03Å; L692-C721 CarbonylContact C-O 3.48Å; L692-C721 VanDerWaalsContact CA-O 3.27Å; L692-C721 WeakPolarHBondContact CA-O 3.21Å
693	L	95.3	Very high	85.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.1	175.3	-71.3	170.3	0	0	0	109.7	W540 M561 I639 L640 N641 Q720 C721 V724 I750	W540-L693 HydrophobicContact CD2-CD1 3.75Å; W540-L693 HydrophobicContact CD2-CD2 3.71Å; W540-L693 HydrophobicContact CD2-CG 3.79Å; W540-L693 VanDerWaalsContact CE2-CD2 3.43Å; W540-L693 HydrophobicContact CE3-CD1 3.47Å; W540-L693 VanDerWaalsContact CE3-CD1 3.47Å; W540-L693 HydrophobicContact CE3-CD2 4.3Å; W540-L693 HydrophobicContact CE3-CG 3.87Å; W540-L693 HydrophobicContact CG-CD1 4.43Å; W540-L693 HydrophobicContact CG-CD2 4Å; W540-L693 HydrophobicContact CH2-CD1 4.04Å; W540-L693 HydrophobicContact CH2-CD2 4.42Å; W540-L693 HydrophobicContact CH2-CG 3.68Å; W540-L693 HydrophobicContact CZ2-CD1 4.28Å; W540-L693 HydrophobicContact CZ2-CD2 3.84Å; W540-L693 HydrophobicContact CZ2-CG 3.58Å; W540-L693 HydrophobicContact CZ3-CD1 3.62Å; W540-L693 HydrophobicContact CZ3-CG 3.82Å; M561-L693 HydrophobicContact CE-CD1 4.49Å; M561-L693 HydrophobicContact CE-CD2 3.58Å; I639-L693 HydrophobicContact CG2-CB 4.1Å; I639-L693 HydrophobicContact CG2-CD1 3.78Å; I639-L693 HydrophobicContact CG2-CD2 4.14Å; I639-L693 HydrophobicContact CG2-CG 4.23Å; L640-L693 WeakPolarHBondContact O-CD2 3.38Å; N641-L693 HydrophobicContact CB-CD2 4.13Å; L693-Q720 VanDerWaalsContact O-CA 3.31Å; L693-Q720 WeakPolarHBondContact O-CA 3.21Å; L693-C721 PolarHBondContact N-O 2.88Å; L693-C721 PolarHBondContact O-N 2.9Å; L693-V724 HydrophobicContact CD1-CG2 4.16Å; L693-I750 HydrophobicContact CD1-CG2 3.74Å
694	E	94.6	Very high	84.4	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.7	169.7	-71.9	66.3	-154.5	0	0	110.1	I639 L640 W652 Q686 V696 R717 Q720	I639-E694 CarbonylContact C-O 3.58Å; I639-E694 WeakPolarHBondContact CA-O 3.49Å; L640-E694 HydrophobicContact CB-CB 4.21Å; L640-E694 PolarHBondContact N-O 3.15Å; L640-E694 PolarHBondContact O-N 3.42Å; L640-E694 VanDerWaalsContact O-OE2 3.1Å; W652-E694 HydrophobicContact CZ2-CB 4.28Å; W652-E694 HydrophobicContact CZ2-CG 4.24Å; Q686-E694 VanDerWaalsContact CA-OE1 3.28Å; Q686-E694 WeakPolarHBondContact CA-OE1 3.27Å; Q686-E694 HydrophobicContact CB-CG 4.17Å; Q686-E694 VanDerWaalsContact CB-OE1 3.31Å; Q686-E694 WeakPolarHBondContact CB-OE1 3.48Å; Q686-E694 HydrophobicContact CG-CG 4.19Å; Q686-E694 WeakPolarHBondContact CG-OE1 3.15Å; Q686-E694 WeakPolarHBondContact CG-OE2 3.4Å; Q686-E694 PolarHBondContact NE2-OE2 2.97Å; E694-V696 HydrophobicContact CB-CG2 4.29Å; E694-R717 IonicContact OE1-NH2 3.08Å; E694-R717 PolarHBondContact OE1-NH2 3.44Å; E694-Q720 PolarHBondContact OE1-NE2 3.12Å
695	V	95	Very high	83.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.4	172	-173.8	0	0	0	0	108.3	V620 L627 I637 I639 L718 A719 V724	V620-V695 HydrophobicContact CG1-CG1 4.35Å; L627-V695 HydrophobicContact CD1-CG1 4.14Å; I637-V695 HydrophobicContact CD1-CG1 3.93Å; I637-V695 HydrophobicContact CG1-CG1 4.32Å; I639-V695 HydrophobicContact CD1-CB 4.2Å; I639-V695 HydrophobicContact CD1-CG1 3.79Å; I639-V695 HydrophobicContact CD1-CG2 3.91Å; V695-L718 HydrophobicContact CB-CB 4.43Å; V695-L718 HydrophobicContact CG1-CB 4.19Å; V695-L718 HydrophobicContact CG1-CD1 4.31Å; V695-L718 WeakPolarHBondContact O-CB 3.41Å; V695-L718 PolarHBondContact O-N 2.81Å; V695-A719 HydrophobicContact CB-CB 4.02Å; V695-A719 HydrophobicContact CG2-CB 4.11Å; V695-A719 PolarHBondContact N-O 3.49Å; V695-A719 PolarHBondContact O-N 3.26Å; V695-V724 HydrophobicContact CG2-CG2 3.97Å
696	V	92.3	Very high	82.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.6	-171.8	-171.9	0	0	0	0	110.4	I637 A638 L640 L651 W652 E694 R716	I637-V696 CarbonylContact C-O 3.56Å; I637-V696 WeakPolarHBondContact CA-O 3.47Å; A638-V696 HydrophobicContact CB-CB 4.48Å; A638-V696 PolarHBondContact N-O 3.43Å; A638-V696 PolarHBondContact O-N 3.42Å; L640-V696 HydrophobicContact CD1-CG2 3.73Å; L640-V696 HydrophobicContact CG-CG2 4.08Å; L651-V696 HydrophobicContact CD1-CG1 3.77Å; L651-V696 HydrophobicContact CD1-CG2 4.3Å; W652-V696 HydrophobicContact CH2-CG1 4.31Å; W652-V696 HydrophobicContact CH2-CG2 3.66Å; W652-V696 HydrophobicContact CZ2-CG2 3.79Å; E694-V696 HydrophobicContact CB-CG2 4.29Å; V696-R716 CarbonylContact C-O 3.58Å; V696-R716 WeakPolarHBondContact CA-O 3.45Å
697	G	91.2	Very high	81.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	140.9	171.3	0	0	0	0	0	111.9	L634 R716	L634-G697 VanDerWaalsContact CD2-CA 3.48Å; G697-R716 PolarHBondContact N-O 3.07Å; G697-R716 PolarHBondContact O-N 3.34Å
698	L	86.5	Confident	79.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.5	176.4	-54.5	170.7	0	0	0	108.3	D570 L634 E635 G636 M704 I707	D570-L698 HydrophobicContact CB-CD1 4.39Å; L634-L698 WeakPolarHBondContact CA-O 3.47Å; E635-L698 PolarHBondContact N-O 2.85Å; G636-L698 PolarHBondContact N-O 2.83Å; G636-L698 VanDerWaalsContact N-O 3.09Å; G636-L698 PolarHBondContact O-N 3.05Å; L698-M704 HydrophobicContact CD1-SD 3.7Å; L698-M704 HydrophobicContact CD2-SD 4.25Å; L698-I707 HydrophobicContact CD2-CD1 3.88Å
699	E	79.1	Confident	78.1	Confident	74 Å²	74	34.3 Å²	34.3	35%	0.346	18%	0.183	S	C	.	.			trans	-88.2	-10.8	-174.4	-60.6	-175.6	-176.7	0	0	112.3	I632 E703 R716	I632-E699 HydrophobicContact CG2-CG 3.95Å; I632-E699 WeakPolarHBondContact CG2-OE1 3.23Å; E699-E703 WeakPolarHBondContact CA-OE2 3.25Å; E699-E703 WeakPolarHBondContact CB-OE2 3.45Å; E699-E703 PolarHBondContact N-OE2 2.9Å; E699-R716 WeakPolarHBondContact OE1-CD 3.49Å; E699-R716 IonicContact OE1-NH1 3.48Å; E699-R716 PolarHBondContact OE1-NH1 3.41Å
700	G	69.1	Low	76.4	Confident	9 Å²	9	34.1 Å²	34.1	9%	0.093	19%	0.189	C	C	.	.			trans	175.4	172.9	165.4	0	0	0	0	0	117.5	E635 M702 E703 M704	E635-G700 VanDerWaalsContact OE2-CA 3.27Å; E635-G700 WeakPolarHBondContact OE2-CA 3.26Å; G700-M702 PolarHBondContact O-N 3.29Å; G700-E703 WeakPolarHBondContact O-CB 3.45Å; G700-E703 PolarHBondContact O-N 3.21Å; G700-E703 VanDerWaalsContact O-N 3.09Å; G700-M704 PolarHBondContact O-N 3.21Å
701	A	63.5	Low	74.7	Confident	3 Å²	3	36.9 Å²	36.9	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-24.5	179	0	0	0	0	0	114.7	V569 T606 E635 M704 G705	V569-A701 HydrophobicContact CG2-CB 3.83Å; T606-A701 HydrophobicContact CG2-CB 4.3Å; T606-A701 WeakPolarHBondContact OG1-CB 3.41Å; E635-A701 PolarHBondContact OE2-N 3.27Å; A701-M704 WeakPolarHBondContact O-CB 3.42Å; A701-M704 PolarHBondContact O-N 3.07Å; A701-G705 PolarHBondContact O-N 3.16Å; A701-G705 VanDerWaalsContact O-N 3.1Å
702	M	63.7	Low	72.8	Confident	137 Å²	137	40 Å²	40	68%	0.675	22%	0.215	S	C	*	.	H	α-helix	trans	-65.5	-38.5	172.7	-75.4	-172.6	66.3	0	0	112.2	T606 G700 M704 G705 Q706	T606-M702 HydrophobicContact CG2-CG 3.68Å; G700-M702 PolarHBondContact O-N 3.29Å; M702-M704 VanDerWaalsContact C-N 3.32Å; M702-G705 PolarHBondContact O-N 3.1Å; M702-Q706 WeakPolarHBondContact O-CG 3.36Å; M702-Q706 PolarHBondContact O-N 3.21Å; M702-Q706 VanDerWaalsContact O-N 3.13Å
703	E	66	Low	71.1	Confident	46 Å²	46	43.9 Å²	43.9	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-66.8	-37	174.7	-66.6	-176.6	154	0	0	110.6	E699 G700 G705 Q706 I707 A714	E699-E703 WeakPolarHBondContact CA-OE2 3.25Å; E699-E703 WeakPolarHBondContact CB-OE2 3.45Å; E699-E703 PolarHBondContact N-OE2 2.9Å; G700-E703 WeakPolarHBondContact O-CB 3.45Å; G700-E703 PolarHBondContact O-N 3.21Å; G700-E703 VanDerWaalsContact O-N 3.09Å; E703-G705 VanDerWaalsContact C-N 3.32Å; E703-G705 PolarHBondContact O-N 3.21Å; E703-Q706 CarbonylContact O-C 3.55Å; E703-Q706 WeakPolarHBondContact O-CA 3.46Å; E703-Q706 WeakPolarHBondContact O-CB 3.37Å; E703-Q706 PolarHBondContact O-N 3.05Å; E703-I707 WeakPolarHBondContact O-CG1 3.42Å; E703-I707 PolarHBondContact O-N 3.49Å; E703-A714 HydrophobicContact CB-CB 4.35Å; E703-A714 WeakPolarHBondContact CB-O 3.44Å
704	M	64	Low	69.5	Low	1 Å²	1	44 Å²	44	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-56.8	-45.6	170.9	-68.3	-63.3	-67.2	0	0	111.5	V569 D570 L698 G700 A701 M702 Q706 I707 Y708	V569-M704 HydrophobicContact CG1-CG 4.09Å; D570-M704 HydrophobicContact CB-CE 3.69Å; D570-M704 HydrophobicContact CB-SD 4.39Å; D570-M704 VanDerWaalsContact OD1-CE 3.24Å; D570-M704 WeakPolarHBondContact OD1-CE 3.44Å; L698-M704 HydrophobicContact CD1-SD 3.7Å; L698-M704 HydrophobicContact CD2-SD 4.25Å; G700-M704 PolarHBondContact O-N 3.21Å; A701-M704 WeakPolarHBondContact O-CB 3.42Å; A701-M704 PolarHBondContact O-N 3.07Å; M702-M704 VanDerWaalsContact C-N 3.32Å; M704-Q706 VanDerWaalsContact C-N 3.26Å; M704-Q706 PolarHBondContact O-N 3.44Å; M704-I707 CarbonylContact O-C 3.56Å; M704-I707 WeakPolarHBondContact O-CB 3.35Å; M704-I707 PolarHBondContact O-N 2.9Å; M704-I707 VanDerWaalsContact O-N 3.1Å; M704-I707 HydrophobicContact SD-CD1 4.01Å; M704-Y708 HydrophobicContact CE-CE2 3.92Å; M704-Y708 WeakPolarHBondContact O-CD2 3.42Å; M704-Y708 PolarHBondContact O-N 2.9Å
705	G	59.8	Low	68.5	Low	24 Å²	24	44.6 Å²	44.6	25%	0.247	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-35.3	173.8	0	0	0	0	0	113.6	A701 M702 E703 T709	A701-G705 PolarHBondContact O-N 3.16Å; A701-G705 VanDerWaalsContact O-N 3.1Å; M702-G705 PolarHBondContact O-N 3.1Å; E703-G705 VanDerWaalsContact C-N 3.32Å; E703-G705 PolarHBondContact O-N 3.21Å; G705-T709 WeakPolarHBondContact O-CG2 3.21Å; G705-T709 PolarHBondContact O-N 2.98Å; G705-T709 VanDerWaalsContact O-N 3.13Å; G705-T709 PolarHBondContact O-OG1 3.2Å
706	Q	63.3	Low	68.1	Low	80 Å²	80	49.8 Å²	49.8	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-69.7	-40.3	173.6	-67.3	178	-6.5	0	0	111.9	M702 E703 M704 T709 G710 L711 A714	M702-Q706 WeakPolarHBondContact O-CG 3.36Å; M702-Q706 PolarHBondContact O-N 3.21Å; M702-Q706 VanDerWaalsContact O-N 3.13Å; E703-Q706 CarbonylContact O-C 3.55Å; E703-Q706 WeakPolarHBondContact O-CA 3.46Å; E703-Q706 WeakPolarHBondContact O-CB 3.37Å; E703-Q706 PolarHBondContact O-N 3.05Å; M704-Q706 VanDerWaalsContact C-N 3.26Å; M704-Q706 PolarHBondContact O-N 3.44Å; Q706-T709 WeakPolarHBondContact CA-OG1 3.48Å; Q706-T709 PolarHBondContact O-N 3.32Å; Q706-T709 PolarHBondContact O-OG1 2.88Å; Q706-G710 PolarHBondContact O-N 3.27Å; Q706-G710 VanDerWaalsContact O-N 3.14Å; Q706-L711 HydrophobicContact CB-CB 4Å; Q706-L711 HydrophobicContact CB-CD1 4.06Å; Q706-L711 HydrophobicContact CG-CD1 3.89Å; Q706-L711 WeakPolarHBondContact O-CB 3.38Å; Q706-L711 PolarHBondContact O-N 3.07Å; Q706-A714 HydrophobicContact CB-CB 3.81Å
707	I	63	Low	67.9	Low	1 Å²	1	51.4 Å²	51.4	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-48.4	173.1	-61	166.9	0	0	0	109.4	M645 H646 S649 L651 L698 E703 M704 T709 G710 A714	M645-I707 HydrophobicContact CG-CG2 4.49Å; H646-I707 HydrophobicContact CB-CG2 4.3Å; S649-I707 VanDerWaalsContact CB-O 3.24Å; S649-I707 WeakPolarHBondContact CB-O 3.4Å; S649-I707 PolarHBondContact OG-O 3.02Å; L651-I707 HydrophobicContact CD2-CB 4.43Å; L651-I707 HydrophobicContact CD2-CD1 3.76Å; L651-I707 HydrophobicContact CD2-CG1 3.69Å; L651-I707 HydrophobicContact CD2-CG2 3.84Å; L698-I707 HydrophobicContact CD2-CD1 3.88Å; E703-I707 WeakPolarHBondContact O-CG1 3.42Å; E703-I707 PolarHBondContact O-N 3.49Å; M704-I707 CarbonylContact O-C 3.56Å; M704-I707 WeakPolarHBondContact O-CB 3.35Å; M704-I707 PolarHBondContact O-N 2.9Å; M704-I707 VanDerWaalsContact O-N 3.1Å; M704-I707 HydrophobicContact SD-CD1 4.01Å; I707-T709 PolarHBondContact O-N 2.76Å; I707-G710 PolarHBondContact O-N 3.42Å; I707-A714 HydrophobicContact CD1-CB 4.32Å; I707-A714 HydrophobicContact CG1-CB 3.53Å
708	Y	60	Low	67.9	Low	62 Å²	62	52.3 Å²	52.3	24%	0.243	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-26.6	177.8	-81.7	-74.2	0	0	0	114	Y598 H646 M704	Y598-Y708 HydrophobicContact CD1-CE1 4.38Å; H646-Y708 HydrophobicContact CB-CD1 3.91Å; H646-Y708 HydrophobicContact CB-CE1 3.63Å; H646-Y708 HydrophobicContact CB-CE2 4.42Å; H646-Y708 HydrophobicContact CB-CG 4.44Å; H646-Y708 AromaticContact CG-CZ 3.9Å; H646-Y708 AromaticContact ND1-CZ 3.76Å; H646-Y708 PolarHBondContact ND1-OH 3.26Å; M704-Y708 HydrophobicContact CE-CE2 3.92Å; M704-Y708 WeakPolarHBondContact O-CD2 3.42Å; M704-Y708 PolarHBondContact O-N 2.9Å
709	T	56.9	Low	68.3	Low	90 Å²	90	52.3 Å²	52.3	55%	0.552	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-0.9	176.2	53	0	0	0	0	113.6	G705 Q706 I707	G705-T709 WeakPolarHBondContact O-CG2 3.21Å; G705-T709 PolarHBondContact O-N 2.98Å; G705-T709 VanDerWaalsContact O-N 3.13Å; G705-T709 PolarHBondContact O-OG1 3.2Å; Q706-T709 WeakPolarHBondContact CA-OG1 3.48Å; Q706-T709 PolarHBondContact O-N 3.32Å; Q706-T709 PolarHBondContact O-OG1 2.88Å; I707-T709 PolarHBondContact O-N 2.76Å
710	G	57.3	Low	69.1	Low	46 Å²	46	49.5 Å²	49.5	47%	0.474	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	18.3	177.8	0	0	0	0	0	114.4	Q706 I707	Q706-G710 PolarHBondContact O-N 3.27Å; Q706-G710 VanDerWaalsContact O-N 3.14Å; I707-G710 PolarHBondContact O-N 3.42Å
711	L	57.3	Low	70.4	Confident	100 Å²	100	49.1 Å²	49.1	52%	0.524	27%	0.265	S	S	.	.			trans	-70.4	135.5	171.9	-76	162	0	0	0	109.8	Q706	Q706-L711 HydrophobicContact CB-CB 4Å; Q706-L711 HydrophobicContact CB-CD1 4.06Å; Q706-L711 HydrophobicContact CG-CD1 3.89Å; Q706-L711 WeakPolarHBondContact O-CB 3.38Å; Q706-L711 PolarHBondContact O-N 3.07Å
712	K	56	Low	71.9	Confident	147 Å²	147	51.2 Å²	51.2	64%	0.639	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	149.1	-174.5	-61.1	178.6	-179.7	-180	0	110.6
713	S	58.3	Low	73.4	Confident	102 Å²	102	46.4 Å²	46.4	71%	0.713	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	20.4	173.4	-43.5	0	0	0	0	117	L651 G715	L651-S713 PolarHBondContact O-N 3.21Å; S713-G715 PolarHBondContact O-N 3.03Å
714	A	62.9	Low	75	Confident	2 Å²	2	44.2 Å²	44.2	2%	0.017	25%	0.248	C	C	.	.			trans	-83.6	15.3	-179.7	0	0	0	0	0	114.3	E703 Q706 I707	E703-A714 HydrophobicContact CB-CB 4.35Å; E703-A714 WeakPolarHBondContact CB-O 3.44Å; Q706-A714 HydrophobicContact CB-CB 3.81Å; I707-A714 HydrophobicContact CD1-CB 4.32Å; I707-A714 HydrophobicContact CG1-CB 3.53Å
715	G	73.9	Confident	76.6	Confident	13 Å²	13	45.1 Å²	45.1	13%	0.134	25%	0.254	C	S	.	.	S	Bend	trans	-143.4	140.6	174.7	0	0	0	0	0	110.8	S713	S713-G715 PolarHBondContact O-N 3.03Å
716	R	85.3	Confident	78.4	Confident	109 Å²	109	44 Å²	44	41%	0.411	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	116	-178.2	-174.3	167.7	179	162.8	-4.6	110	V696 G697 E699 L718	V696-R716 CarbonylContact C-O 3.58Å; V696-R716 WeakPolarHBondContact CA-O 3.45Å; G697-R716 PolarHBondContact N-O 3.07Å; G697-R716 PolarHBondContact O-N 3.34Å; E699-R716 WeakPolarHBondContact OE1-CD 3.49Å; E699-R716 IonicContact OE1-NH1 3.48Å; E699-R716 PolarHBondContact OE1-NH1 3.41Å; R716-L718 HydrophobicContact CG-CD2 4.1Å; R716-L718 PolarHBondContact O-N 2.82Å
717	R	88.6	Confident	79.9	Confident	34 Å²	34	44 Å²	44	13%	0.128	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	118.8	174.6	-160	172.5	-176.2	175	10.6	109.5	W652 L681 A684 E694	W652-R717 HydrophobicContact CH2-CB 3.7Å; W652-R717 HydrophobicContact CH2-CG 3.72Å; W652-R717 HydrophobicContact CZ2-CG 4.34Å; W652-R717 HydrophobicContact CZ3-CB 3.7Å; W652-R717 HydrophobicContact CZ3-CG 4.1Å; L681-R717 HydrophobicContact CB-CG 4.4Å; L681-R717 HydrophobicContact CD1-CG 4.37Å; L681-R717 HydrophobicContact CD2-CG 4.04Å; L681-R717 PolarHBondContact O-NH1 3.01Å; A684-R717 VanDerWaalsContact CB-CZ 3.49Å; A684-R717 VanDerWaalsContact CB-NH1 3.28Å; A684-R717 PolarHBondContact O-NH1 3.29Å; E694-R717 IonicContact OE1-NH2 3.08Å; E694-R717 PolarHBondContact OE1-NH2 3.44Å
718	L	92.4	Very high	81.4	Confident	18 Å²	18	44.4 Å²	44.4	9%	0.094	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-40.3	-176.7	-58.8	176.6	0	0	0	112	L627 L629 I632 L681 V695 R716	L627-L718 HydrophobicContact CD1-CB 4.08Å; L629-L718 HydrophobicContact CD2-CD1 3.99Å; I632-L718 HydrophobicContact CD1-CD2 3.63Å; L681-L718 WeakPolarHBondContact CD1-O 3.49Å; V695-L718 HydrophobicContact CB-CB 4.43Å; V695-L718 HydrophobicContact CG1-CB 4.19Å; V695-L718 HydrophobicContact CG1-CD1 4.31Å; V695-L718 WeakPolarHBondContact O-CB 3.41Å; V695-L718 PolarHBondContact O-N 2.81Å; R716-L718 HydrophobicContact CG-CD2 4.1Å; R716-L718 PolarHBondContact O-N 2.82Å
719	A	94.8	Very high	83	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	161.6	177.9	0	0	0	0	0	112.8	C622 L627 V675 V676 V695	C622-A719 HydrophobicContact CB-CB 4.29Å; L627-A719 HydrophobicContact CD1-CB 4.34Å; L627-A719 HydrophobicContact CD2-CB 4.22Å; V675-A719 CarbonylContact O-C 3.56Å; V675-A719 VanDerWaalsContact O-CA 3.23Å; V675-A719 WeakPolarHBondContact O-CA 3.37Å; V676-A719 HydrophobicContact CG1-CB 4.07Å; V695-A719 HydrophobicContact CB-CB 4.02Å; V695-A719 HydrophobicContact CG2-CB 4.11Å; V695-A719 PolarHBondContact N-O 3.49Å; V695-A719 PolarHBondContact O-N 3.26Å
720	Q	94.9	Very high	84.6	Confident	16 Å²	16	44.7 Å²	44.7	8%	0.075	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123.9	158	-171.5	-179.3	53.9	0	0	108.3	V675 L681 V685 L692 L693 E694	V675-Q720 HydrophobicContact CB-CB 4.38Å; V675-Q720 PolarHBondContact N-O 3.5Å; V675-Q720 PolarHBondContact O-N 3.46Å; L681-Q720 HydrophobicContact CD2-CB 4.24Å; V685-Q720 PolarHBondContact O-NE2 3.2Å; L692-Q720 HydrophobicContact CB-CG 3.92Å; L692-Q720 HydrophobicContact CD1-CG 4.03Å; L693-Q720 VanDerWaalsContact O-CA 3.31Å; L693-Q720 WeakPolarHBondContact O-CA 3.21Å; E694-Q720 PolarHBondContact OE1-NE2 3.12Å
721	C	95.7	Very high	86.2	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	168.2	-166.4	62.5	0	0	0	0	112.5	C622 D623 P674 L692 L693 V724	C622-C721 HydrophobicContact CB-CB 3.8Å; D623-C721 WeakPolarHBondContact OD2-CA 3.49Å; D623-C721 WeakPolarHBondContact OD2-CB 3.13Å; P674-C721 HydrophobicContact CB-CB 3.93Å; L692-C721 CarbonylContact C-O 3.48Å; L692-C721 VanDerWaalsContact CA-O 3.27Å; L692-C721 WeakPolarHBondContact CA-O 3.21Å; L693-C721 PolarHBondContact N-O 2.88Å; L693-C721 PolarHBondContact O-N 2.9Å; C721-V724 VanDerWaalsContact SG-CG2 3.52Å
722	S	95.5	Very high	87.9	Confident	47 Å²	47	40.8 Å²	40.8	33%	0.329	22%	0.219	S	C	.	.	S	Bend	trans	-101.1	-6	179.9	67.6	0	0	0	0	114.5	W540 D623	W540-S722 VanDerWaalsContact CZ3-O 3.3Å; W540-S722 WeakPolarHBondContact CZ3-O 3.23Å; D623-S722 VanDerWaalsContact CG-N 3.33Å; D623-S722 WeakPolarHBondContact OD1-CA 3.23Å; D623-S722 PolarHBondContact OD1-N 2.87Å; D623-S722 PolarHBondContact OD1-OG 2.81Å; D623-S722 PolarHBondContact OD2-N 3.49Å
723	S	96.3	Very high	89.7	Confident	35 Å²	35	34.4 Å²	34.4	25%	0.245	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	144	178.7	59.9	0	0	0	0	110.3	C622 D623 I750	C622-S723 WeakPolarHBondContact CA-O 3.24Å; D623-S723 PolarHBondContact N-O 3.28Å; D623-S723 PolarHBondContact OD1-N 3.33Å; D623-S723 PolarHBondContact OD1-OG 3.24Å; S723-I750 WeakPolarHBondContact CA-O 3.24Å
724	V	98	Very high	91.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.4	179.2	-171.7	0	0	0	0	109.1	V620 E621 I639 L693 V695 C721 I726 I750	V620-V724 HydrophobicContact CG1-CG1 4.13Å; E621-V724 CarbonylContact O-C 3.58Å; E621-V724 WeakPolarHBondContact O-CA 3.13Å; I639-V724 HydrophobicContact CD1-CG1 4.1Å; I639-V724 HydrophobicContact CD1-CG2 4.44Å; I639-V724 HydrophobicContact CG2-CG2 4.26Å; L693-V724 HydrophobicContact CD1-CG2 4.16Å; V695-V724 HydrophobicContact CG2-CG2 3.97Å; C721-V724 VanDerWaalsContact SG-CG2 3.52Å; V724-I726 HydrophobicContact CG1-CD1 4.15Å; V724-I726 HydrophobicContact CG1-CG1 3.75Å; V724-I750 HydrophobicContact CB-CB 4.31Å; V724-I750 PolarHBondContact N-O 3.4Å; V724-I750 PolarHBondContact O-N 3.49Å
725	T	97.8	Very high	92.9	Very high	21 Å²	21	29.5 Å²	29.5	13%	0.129	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.4	166.5	-56.8	0	0	0	0	108.9	E621 T747 I748	E621-T725 PolarHBondContact N-O 3.24Å; E621-T725 PolarHBondContact O-N 2.85Å; T725-T747 HydrophobicContact CG2-CG2 3.87Å; T725-I748 CarbonylContact C-O 3.52Å; T725-I748 VanDerWaalsContact CA-O 3.29Å; T725-I748 WeakPolarHBondContact CA-O 3.41Å
726	I	97.3	Very high	93.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.1	179.3	-53.6	179.1	0	0	0	108.4	F565 I567 L618 E619 V620 I639 V724 T728 T747 I748	F565-I726 HydrophobicContact CE1-CD1 4.17Å; I567-I726 HydrophobicContact CD1-CD1 4.05Å; I567-I726 HydrophobicContact CD1-CG2 3.87Å; L618-I726 HydrophobicContact CD2-CG2 3.3Å; E619-I726 CarbonylContact O-C 2.99Å; E619-I726 WeakPolarHBondContact O-CA 3.48Å; V620-I726 HydrophobicContact CG1-CG1 4.45Å; V620-I726 HydrophobicContact CG2-CG1 4.5Å; V620-I726 HydrophobicContact CG2-CG2 4.41Å; I639-I726 HydrophobicContact CD1-CD1 4.26Å; I639-I726 HydrophobicContact CG1-CD1 4.23Å; V724-I726 HydrophobicContact CG1-CD1 4.15Å; V724-I726 HydrophobicContact CG1-CG1 3.75Å; I726-T728 HydrophobicContact CG2-CG2 4.38Å; I726-T747 CarbonylContact O-C 3.55Å; I726-T747 WeakPolarHBondContact O-CA 3.4Å; I726-I748 HydrophobicContact CB-CB 4.33Å; I726-I748 PolarHBondContact N-O 3.22Å; I726-I748 PolarHBondContact O-N 2.89Å
727	R	96.3	Very high	94	Very high	81 Å²	81	24.9 Å²	24.9	31%	0.306	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.6	176.3	-57.1	177.1	-176.5	91.4	9.5	109.1	L618 E619 E621 T747	L618-R727 WeakPolarHBondContact CA-O 3.39Å; E619-R727 HydrophobicContact CB-CB 4.25Å; E619-R727 PolarHBondContact N-O 3.01Å; E619-R727 PolarHBondContact O-N 2.81Å; E619-R727 IonicContact OE1-NH1 3.41Å; E619-R727 PolarHBondContact OE1-NH1 3.13Å; E619-R727 VanDerWaalsContact OE1-NH1 3.08Å; E619-R727 IonicContact OE2-NH1 2.92Å; E621-R727 IonicContact OE2-CZ 2.81Å; E621-R727 IonicContact OE2-NH1 3.13Å; E621-R727 PolarHBondContact OE2-NH1 3.43Å; E621-R727 IonicContact OE2-NH2 3.53Å; E621-R727 PolarHBondContact OE2-NH2 2.97Å; R727-T747 HydrophobicContact CG-CG2 4.17Å
728	T	94.9	Very high	94	Very high	9 Å²	9	24.5 Å²	24.5	6%	0.055	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.7	179.6	69	0	0	0	0	111.2	F617 L618 I726 L732 M734 C746	F617-T728 WeakPolarHBondContact O-CA 3.18Å; L618-T728 HydrophobicContact CD2-CG2 3.69Å; L618-T728 HydrophobicContact CG-CG2 4.26Å; I726-T728 HydrophobicContact CG2-CG2 4.38Å; T728-L732 HydrophobicContact CG2-CD1 3.94Å; T728-M734 HydrophobicContact CG2-CE 3.95Å; T728-C746 PolarHBondContact N-O 2.7Å; T728-C746 PolarHBondContact OG1-N 2.95Å; T728-C746 PolarHBondContact OG1-O 2.93Å
729	T	92.9	Very high	93.8	Very high	102 Å²	102	25.8 Å²	25.8	63%	0.626	15%	0.15	S	C	*	.	S	Bend	trans	-106.6	-4.5	179.2	58	0	0	0	0	113.7	F617	F617-T729 WeakPolarHBondContact CA-OG1 3.35Å; F617-T729 PolarHBondContact O-N 2.93Å; F617-T729 VanDerWaalsContact O-N 3.13Å; F617-T729 PolarHBondContact O-OG1 3.34Å
730	K	90.7	Very high	93.7	Very high	56 Å²	56	26.6 Å²	26.6	24%	0.243	16%	0.155	C	C	.	.	S	Bend	trans	-138.4	164.7	176.2	75.2	178.2	-179.8	-175.4	0	111.4	F617 L732	F617-K730 HydrophobicContact CB-CD 3.97Å; F617-K730 HydrophobicContact CB-CG 3.9Å; F617-K730 HydrophobicContact CD1-CB 4.39Å; F617-K730 HydrophobicContact CD1-CD 3.64Å; F617-K730 HydrophobicContact CD1-CG 4.1Å; F617-K730 HydrophobicContact CD2-CD 3.76Å; F617-K730 HydrophobicContact CE1-CD 4.01Å; F617-K730 HydrophobicContact CE2-CD 4.13Å; F617-K730 HydrophobicContact CG-CD 3.48Å; F617-K730 VanDerWaalsContact CG-CD 3.48Å; F617-K730 VanDerWaalsContact CG-CE 3.49Å; F617-K730 HydrophobicContact CG-CG 3.95Å; F617-K730 HydrophobicContact CZ-CD 4.23Å; K730-L732 HydrophobicContact CD-CD2 4.28Å; K730-L732 HydrophobicContact CG-CD1 4.41Å; K730-L732 HydrophobicContact CG-CD2 4.07Å; K730-L732 HydrophobicContact CG-CG 3.92Å; K730-L732 PolarHBondContact O-N 3.39Å
731	S	91	Very high	93.6	Very high	60 Å²	60	26.1 Å²	26.1	42%	0.42	15%	0.153	S	C	.	.			trans	-66.3	129.2	171	-175	0	0	0	0	110.9	Q743	S731-Q743 CarbonylContact C-O 3.51Å; S731-Q743 WeakPolarHBondContact CA-O 3.27Å; S731-Q743 PolarHBondContact OG-O 3.47Å
732	L	92.7	Very high	93.4	Very high	4 Å²	4	29 Å²	29	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	143.9	-172.9	-74.8	171.7	0	0	0	111.3	I567 L614 L618 T728 K730 M734 Q743	I567-L732 HydrophobicContact CG2-CB 3.91Å; I567-L732 HydrophobicContact CG2-CD1 3.85Å; I567-L732 HydrophobicContact CG2-CG 4.39Å; L614-L732 HydrophobicContact CD1-CD1 3.99Å; L614-L732 HydrophobicContact CD1-CD2 3.61Å; L614-L732 HydrophobicContact CD1-CG 4.47Å; L618-L732 HydrophobicContact CD1-CD1 3.88Å; L618-L732 HydrophobicContact CG-CD1 4.16Å; T728-L732 HydrophobicContact CG2-CD1 3.94Å; K730-L732 HydrophobicContact CD-CD2 4.28Å; K730-L732 HydrophobicContact CG-CD1 4.41Å; K730-L732 HydrophobicContact CG-CD2 4.07Å; K730-L732 HydrophobicContact CG-CG 3.92Å; K730-L732 PolarHBondContact O-N 3.39Å; L732-M734 HydrophobicContact CB-CE 4.26Å; L732-Q743 PolarHBondContact N-O 3.35Å; L732-Q743 PolarHBondContact O-N 3.08Å
733	P	93.2	Very high	93.2	Very high	12 Å²	12	27.1 Å²	27.1	8%	0.078	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.4	169.4	29.3	-32.9	0	0	0	109.8	I567 G568 A571 M742	I567-P733 WeakPolarHBondContact CA-O 3.25Å; G568-P733 PolarHBondContact N-O 3.09Å; A571-P733 VanDerWaalsContact CB-C 3.48Å; A571-P733 HydrophobicContact CB-CB 4.07Å; A571-P733 WeakPolarHBondContact CB-O 3.46Å; P733-M742 HydrophobicContact CB-SD 3.74Å
734	M	95.1	Very high	93	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	156	177.7	-57.4	-169.6	-177.8	0	0	110.3	F565 S566 I567 A571 T728 L732 P740 W741 Q743 I748	F565-M734 HydrophobicContact CE2-CB 4.1Å; F565-M734 HydrophobicContact CE2-SD 4.35Å; F565-M734 HydrophobicContact CZ-CB 4.31Å; F565-M734 HydrophobicContact CZ-CG 4.38Å; F565-M734 HydrophobicContact CZ-SD 3.91Å; S566-M734 WeakPolarHBondContact O-CA 3.24Å; I567-M734 HydrophobicContact CD1-CE 4.07Å; I567-M734 HydrophobicContact CD1-SD 4.42Å; I567-M734 HydrophobicContact CG1-CE 4.33Å; I567-M734 HydrophobicContact CG1-CG 4.04Å; I567-M734 HydrophobicContact CG1-SD 4.28Å; I567-M734 HydrophobicContact CG2-CE 4.3Å; I567-M734 HydrophobicContact CG2-CG 4.25Å; A571-M734 VanDerWaalsContact CB-CA 3.48Å; T728-M734 HydrophobicContact CG2-CE 3.95Å; L732-M734 HydrophobicContact CB-CE 4.26Å; M734-P740 CarbonylContact O-C 3.59Å; M734-P740 VanDerWaalsContact O-CA 3.24Å; M734-P740 WeakPolarHBondContact O-CA 3.42Å; M734-W741 HydrophobicContact CB-CD2 4.05Å; M734-W741 HydrophobicContact CB-CE3 4.17Å; M734-W741 HydrophobicContact CB-CH2 3.87Å; M734-W741 HydrophobicContact CB-CZ2 3.68Å; M734-W741 HydrophobicContact CB-CZ3 4.1Å; M734-W741 HydrophobicContact CG-CZ2 4.48Å; M734-W741 PolarHBondContact N-O 2.88Å; M734-W741 PolarHBondContact O-N 3.39Å; M734-W741 HydrophobicContact SD-CZ2 4.14Å; M734-Q743 HydrophobicContact CE-CB 3.62Å; M734-Q743 HydrophobicContact CE-CG 3.63Å; M734-Q743 HydrophobicContact CG-CB 3.88Å; M734-Q743 HydrophobicContact SD-CB 3.46Å; M734-Q743 WeakPolarHBondContact SD-CB 3.46Å; M734-Q743 HydrophobicContact SD-CG 3.57Å; M734-Q743 VanDerWaalsContact SD-CG 3.57Å; M734-I748 HydrophobicContact CE-CD1 3.72Å; M734-I748 HydrophobicContact SD-CD1 3.48Å; M734-I748 WeakPolarHBondContact SD-CD1 3.5Å
735	Q	93.1	Very high	92.9	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	153	171.2	71.5	77.1	37.3	0	0	111.2	F565 S566 A571 A574 E739 P740	F565-Q735 WeakPolarHBondContact CA-O 3.43Å; F565-Q735 WeakPolarHBondContact CD2-O 3.25Å; S566-Q735 PolarHBondContact N-O 3.23Å; S566-Q735 PolarHBondContact O-N 3.04Å; S566-Q735 WeakPolarHBondContact OG-CG 3.37Å; S566-Q735 PolarHBondContact OG-NE2 3.34Å; A571-Q735 HydrophobicContact CB-CB 4.1Å; A571-Q735 HydrophobicContact CB-CG 3.98Å; A574-Q735 HydrophobicContact CB-CB 4.4Å; A574-Q735 HydrophobicContact CB-CG 4.42Å; Q735-E739 WeakPolarHBondContact CA-O 3.48Å; Q735-P740 HydrophobicContact CB-CB 4.02Å
736	I	92.9	Very high	92.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	124	174.8	-169.7	-178.5	0	0	0	108.7	I542 P557 Y558 I560 M561 F565 G738 E739 W741	I542-I736 HydrophobicContact CD1-CD1 3.69Å; I542-I736 HydrophobicContact CD1-CG1 4.17Å; I542-I736 HydrophobicContact CG1-CD1 4.31Å; P557-I736 HydrophobicContact CG-CG2 3.81Å; Y558-I736 HydrophobicContact CD2-CG2 3.98Å; I560-I736 WeakPolarHBondContact O-CD1 3.36Å; M561-I736 HydrophobicContact CB-CD1 3.94Å; M561-I736 HydrophobicContact CB-CG1 4Å; M561-I736 HydrophobicContact CG-CG1 4.28Å; F565-I736 HydrophobicContact CD2-CB 4.38Å; I736-G738 PolarHBondContact O-N 3.25Å; I736-E739 PolarHBondContact N-O 3.37Å; I736-E739 PolarHBondContact O-N 3.14Å; I736-W741 HydrophobicContact CB-CH2 4.39Å; I736-W741 HydrophobicContact CB-CZ3 4.03Å; I736-W741 HydrophobicContact CG2-CH2 4.39Å; I736-W741 HydrophobicContact CG2-CZ3 3.8Å
737	D	90.9	Very high	92.6	Very high	25 Å²	25	28.9 Å²	28.9	13%	0.134	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	28.9	178.9	-65.8	-10	0	0	0	114.7	N562 N563 Y564	N562-D737 WeakPolarHBondContact CB-OD2 3.36Å; N562-D737 PolarHBondContact N-OD1 3.42Å; N562-D737 PolarHBondContact N-OD2 2.92Å; N562-D737 PolarHBondContact ND2-OD2 2.94Å; N563-D737 WeakPolarHBondContact CA-OD1 3.49Å; N563-D737 VanDerWaalsContact CB-OD1 3.3Å; N563-D737 WeakPolarHBondContact CB-OD1 3.33Å; N563-D737 PolarHBondContact N-OD1 3.5Å; Y564-D737 PolarHBondContact N-OD1 2.84Å; Y564-D737 PolarHBondContact O-N 2.8Å
738	G	86.7	Confident	92.7	Very high	25 Å²	25	25 Å²	25	26%	0.258	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	0.5	-179.5	0	0	0	0	0	115.6	I736 P740	I736-G738 PolarHBondContact O-N 3.25Å; G738-P740 WeakPolarHBondContact O-CD 3.32Å
739	E	89.3	Confident	92.8	Very high	46 Å²	46	29 Å²	29	22%	0.215	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	108.9	-179.9	-63.3	-64.9	155.8	0	0	110.1	P557 Y558 H578 Q735 I736	P557-E739 HydrophobicContact CB-CB 4.48Å; P557-E739 HydrophobicContact CG-CB 4.43Å; Y558-E739 HydrophobicContact CD2-CB 4.37Å; Y558-E739 HydrophobicContact CE2-CB 3.85Å; Y558-E739 HydrophobicContact CE2-CG 3.77Å; H578-E739 IonicContact CE1-OE2 2.79Å; H578-E739 PolarHBondContact CE1-OE2 3.46Å; H578-E739 IonicContact ND1-OE2 3.16Å; Q735-E739 WeakPolarHBondContact CA-O 3.48Å; I736-E739 PolarHBondContact N-O 3.37Å; I736-E739 PolarHBondContact O-N 3.14Å
740	P	92.3	Very high	93	Very high	16 Å²	16	24.2 Å²	24.2	10%	0.104	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	156.5	-169.9	37.8	-36.2	0	0	0	113.7	A574 H575 H578 M734 Q735 G738	A574-P740 HydrophobicContact CB-CB 4.03Å; A574-P740 HydrophobicContact CB-CG 4.34Å; H575-P740 VanDerWaalsContact CA-CG 3.47Å; H575-P740 HydrophobicContact CB-CB 3.89Å; H575-P740 HydrophobicContact CB-CG 4.22Å; H578-P740 HydrophobicContact CB-CG 3.61Å; M734-P740 CarbonylContact O-C 3.59Å; M734-P740 VanDerWaalsContact O-CA 3.24Å; M734-P740 WeakPolarHBondContact O-CA 3.42Å; Q735-P740 HydrophobicContact CB-CB 4.02Å; G738-P740 WeakPolarHBondContact O-CD 3.32Å
741	W	92.6	Very high	93.3	Very high	7 Å²	7	23.4 Å²	23.4	3%	0.027	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	165.3	171.9	75.7	105.8	0	0	0	112	D554 V556 P557 F565 M734 I736	D554-W741 HydrophobicContact CB-CB 3.97Å; V556-W741 HydrophobicContact CG1-CH2 4.37Å; V556-W741 HydrophobicContact CG1-CZ2 4.07Å; V556-W741 HydrophobicContact CG2-CZ2 4.46Å; P557-W741 HydrophobicContact CG-CD2 4.23Å; P557-W741 HydrophobicContact CG-CE3 3.58Å; P557-W741 HydrophobicContact CG-CZ3 3.84Å; F565-W741 HydrophobicContact CD2-CH2 4.18Å; F565-W741 AromaticContact CE2-CH2 3.63Å; F565-W741 HydrophobicContact CE2-CH2 3.63Å; F565-W741 HydrophobicContact CE2-CZ2 4.21Å; F565-W741 HydrophobicContact CE2-CZ3 4.47Å; M734-W741 HydrophobicContact CB-CD2 4.05Å; M734-W741 HydrophobicContact CB-CE3 4.17Å; M734-W741 HydrophobicContact CB-CH2 3.87Å; M734-W741 HydrophobicContact CB-CZ2 3.68Å; M734-W741 HydrophobicContact CB-CZ3 4.1Å; M734-W741 HydrophobicContact CG-CZ2 4.48Å; M734-W741 PolarHBondContact N-O 2.88Å; M734-W741 PolarHBondContact O-N 3.39Å; M734-W741 HydrophobicContact SD-CZ2 4.14Å; I736-W741 HydrophobicContact CB-CH2 4.39Å; I736-W741 HydrophobicContact CB-CZ3 4.03Å; I736-W741 HydrophobicContact CG2-CH2 4.39Å; I736-W741 HydrophobicContact CG2-CZ3 3.8Å
742	M	91.8	Very high	93.6	Very high	61 Å²	61	23.5 Å²	23.5	30%	0.3	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.4	170	-71.5	-60.8	-53.8	0	0	111.5	D554 P733	D554-M742 PolarHBondContact N-O 2.96Å; D554-M742 WeakPolarHBondContact OD2-CB 3.31Å; D554-M742 PolarHBondContact OD2-N 3.4Å; P733-M742 HydrophobicContact CB-SD 3.74Å
743	Q	92.2	Very high	93.7	Very high	7 Å²	7	27 Å²	27	3%	0.033	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.1	-176	-174.6	54.5	66.2	0	0	111.3	V544 S731 L732 M734 C746	V544-Q743 HydrophobicContact CG1-CG 4.4Å; S731-Q743 CarbonylContact C-O 3.51Å; S731-Q743 WeakPolarHBondContact CA-O 3.27Å; S731-Q743 PolarHBondContact OG-O 3.47Å; L732-Q743 PolarHBondContact N-O 3.35Å; L732-Q743 PolarHBondContact O-N 3.08Å; M734-Q743 HydrophobicContact CE-CB 3.62Å; M734-Q743 HydrophobicContact CE-CG 3.63Å; M734-Q743 HydrophobicContact CG-CB 3.88Å; M734-Q743 HydrophobicContact SD-CB 3.46Å; M734-Q743 WeakPolarHBondContact SD-CB 3.46Å; M734-Q743 HydrophobicContact SD-CG 3.57Å; M734-Q743 VanDerWaalsContact SD-CG 3.57Å; Q743-C746 HydrophobicContact CG-CB 4.35Å; Q743-C746 WeakPolarHBondContact CG-SG 3.29Å
744	T	92.5	Very high	93.8	Very high	13 Å²	13	28.6 Å²	28.6	8%	0.08	15%	0.153	C	C	.	.			trans	-64.6	165	170.2	52	0	0	0	0	111.6	E551 C746	E551-T744 HydrophobicContact CB-CG2 4.07Å; T744-C746 WeakPolarHBondContact O-CB 3.45Å; T744-C746 PolarHBondContact O-N 3.05Å
745	P	94.1	Very high	93.8	Very high	23 Å²	23	31.4 Å²	31.4	15%	0.149	17%	0.166	C	C	.	.	S	Bend	trans	-46.4	125.7	176.9	-28.6	35.4	0	0	0	112.3	A547	A547-P745 HydrophobicContact CB-CB 4.26Å; A547-P745 WeakPolarHBondContact CB-O 3.4Å; A547-P745 PolarHBondContact N-O 3.37Å
746	C	94.1	Very high	93.9	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.014	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	166.6	-170.9	67.1	0	0	0	0	112.6	V544 T545 T728 Q743 T744	V544-C746 HydrophobicContact CG1-CB 3.94Å; T545-C746 CarbonylContact O-C 3.57Å; T545-C746 VanDerWaalsContact O-CA 3.3Å; T545-C746 WeakPolarHBondContact O-CA 3.36Å; T545-C746 WeakPolarHBondContact O-CB 3.1Å; T728-C746 PolarHBondContact N-O 2.7Å; T728-C746 PolarHBondContact OG1-N 2.95Å; T728-C746 PolarHBondContact OG1-O 2.93Å; Q743-C746 HydrophobicContact CG-CB 4.35Å; Q743-C746 WeakPolarHBondContact CG-SG 3.29Å; T744-C746 WeakPolarHBondContact O-CB 3.45Å; T744-C746 PolarHBondContact O-N 3.05Å
747	T	96.1	Very high	94.1	Very high	55 Å²	55	34 Å²	34	34%	0.337	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.3	162.8	-61	0	0	0	0	108.7	T545 T725 I726 R727	T545-T747 PolarHBondContact N-O 3.18Å; T545-T747 PolarHBondContact O-N 2.79Å; T725-T747 HydrophobicContact CG2-CG2 3.87Å; I726-T747 CarbonylContact O-C 3.55Å; I726-T747 WeakPolarHBondContact O-CA 3.4Å; R727-T747 HydrophobicContact CG-CG2 4.17Å
748	I	96.8	Very high	94.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.9	179.2	-52.4	174.3	0	0	0	107.9	I542 D543 V544 F565 I567 T725 I726 M734 I750	I542-I748 HydrophobicContact CG2-CG2 3.69Å; D543-I748 CarbonylContact O-C 3.5Å; D543-I748 WeakPolarHBondContact O-CA 3.45Å; V544-I748 HydrophobicContact CG1-CG1 4.45Å; V544-I748 HydrophobicContact CG2-CG1 4.4Å; V544-I748 HydrophobicContact CG2-CG2 4.43Å; F565-I748 HydrophobicContact CE1-CD1 4.24Å; F565-I748 HydrophobicContact CZ-CD1 3.7Å; I567-I748 HydrophobicContact CD1-CD1 4.11Å; T725-I748 CarbonylContact C-O 3.52Å; T725-I748 VanDerWaalsContact CA-O 3.29Å; T725-I748 WeakPolarHBondContact CA-O 3.41Å; I726-I748 HydrophobicContact CB-CB 4.33Å; I726-I748 PolarHBondContact N-O 3.22Å; I726-I748 PolarHBondContact O-N 2.89Å; M734-I748 HydrophobicContact CE-CD1 3.72Å; M734-I748 HydrophobicContact SD-CD1 3.48Å; M734-I748 WeakPolarHBondContact SD-CD1 3.5Å; I748-I750 HydrophobicContact CG2-CG1 4.1Å
749	Q	97.3	Very high	94.9	Very high	94 Å²	94	31.8 Å²	31.8	44%	0.439	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123.7	174.1	-172.5	176.5	11.7	0	0	109.7	I542 D543 V751	I542-Q749 WeakPolarHBondContact CA-O 3.37Å; D543-Q749 HydrophobicContact CB-CB 4.49Å; D543-Q749 PolarHBondContact N-O 3.26Å; D543-Q749 PolarHBondContact O-N 3.27Å; Q749-V751 HydrophobicContact CG-CG1 3.99Å
750	I	97.8	Very high	95.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.1	178.1	-50.4	179.9	0	0	0	108.5	W540 K541 I542 M561 F565 I639 L693 S723 V724 I748	W540-I750 HydrophobicContact CB-CG2 4.02Å; W540-I750 HydrophobicContact CE3-CG2 4.38Å; K541-I750 WeakPolarHBondContact O-CA 3.33Å; I542-I750 HydrophobicContact CD1-CD1 4.24Å; I542-I750 HydrophobicContact CD1-CG1 4.32Å; I542-I750 HydrophobicContact CG1-CG1 4.15Å; I542-I750 HydrophobicContact CG1-CG2 4.35Å; M561-I750 HydrophobicContact CE-CG2 4.23Å; F565-I750 HydrophobicContact CD1-CD1 3.85Å; F565-I750 HydrophobicContact CE1-CD1 4.44Å; F565-I750 HydrophobicContact CG-CD1 4.32Å; I639-I750 HydrophobicContact CB-CD1 4.26Å; I639-I750 HydrophobicContact CG1-CD1 4.02Å; I639-I750 HydrophobicContact CG2-CD1 4.12Å; L693-I750 HydrophobicContact CD1-CG2 3.74Å; S723-I750 WeakPolarHBondContact CA-O 3.24Å; V724-I750 HydrophobicContact CB-CB 4.31Å; V724-I750 PolarHBondContact N-O 3.4Å; V724-I750 PolarHBondContact O-N 3.49Å; I748-I750 HydrophobicContact CG2-CG1 4.1Å
751	V	97.1	Very high	95.1	Very high	40 Å²	40	30.3 Å²	30.3	24%	0.242	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.8	-176.8	-68.3	0	0	0	0	111.4	W540 K541 Q749 K753	W540-V751 CarbonylContact C-O 3.52Å; W540-V751 WeakPolarHBondContact CA-O 3.25Å; K541-V751 HydrophobicContact CB-CG2 4.22Å; K541-V751 PolarHBondContact N-O 3.45Å; K541-V751 PolarHBondContact O-N 2.77Å; Q749-V751 HydrophobicContact CG-CG1 3.99Å; V751-K753 PolarHBondContact O-N 2.79Å
752	H	97.1	Very high	94.7	Very high	62 Å²	62	32 Å²	32	29%	0.287	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	126.4	179.1	175.6	-80.7	0	0	0	110.9	D538 W540	D538-H752 IonicContact OD1-CD2 3.53Å; D538-H752 IonicContact OD1-NE2 3.64Å; W540-H752 HydrophobicContact CE3-CB 4.06Å; W540-H752 VanDerWaalsContact CE3-N 3.26Å; W540-H752 HydrophobicContact CH2-CB 4.11Å; W540-H752 HydrophobicContact CZ3-CB 3.74Å
753	K	94.9	Very high	93.9	Very high	78 Å²	78	33.9 Å²	33.9	34%	0.339	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-69.3	176.9	-174.6	-164.7	178.5	-163.2	0	110.4	D486 R539 K541 I560 V751	D486-K753 IonicContact OD2-NZ 2.64Å; D486-K753 PolarHBondContact OD2-NZ 3.43Å; R539-K753 WeakPolarHBondContact O-CA 3.28Å; R539-K753 VanDerWaalsContact O-CB 3.28Å; R539-K753 WeakPolarHBondContact O-CB 3.22Å; R539-K753 PolarHBondContact O-N 2.66Å; K541-K753 HydrophobicContact CB-CB 4.12Å; I560-K753 HydrophobicContact CD1-CD 4.22Å; I560-K753 HydrophobicContact CG1-CD 4.1Å; I560-K753 HydrophobicContact CG2-CD 4.4Å; V751-K753 PolarHBondContact O-N 2.79Å
754	N	94.7	Very high	92.3	Very high	44 Å²	44	41.4 Å²	41.4	24%	0.235	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	-179.4	-175.9	65.4	-4.8	0	0	0	109.8	D486 R539	D486-N754 PolarHBondContact OD1-ND2 2.61Å; R539-N754 WeakPolarHBondContact CB-OD1 3.48Å; R539-N754 PolarHBondContact N-O 2.75Å; R539-N754 PolarHBondContact O-N 2.92Å
755	Q	95.5	Very high	90.1	Very high	60 Å²	60	44 Å²	44	28%	0.28	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143	171.2	-61.9	-172.7	-56.7	0	0	110.1	M536 L537 D538 S689	M536-Q755 HydrophobicContact CB-CB 4.35Å; M536-Q755 HydrophobicContact CE-CB 3.41Å; M536-Q755 VanDerWaalsContact CE-CB 3.41Å; M536-Q755 HydrophobicContact CE-CG 4.43Å; L537-Q755 CarbonylContact O-C 3.53Å; L537-Q755 WeakPolarHBondContact O-CA 3.47Å; D538-Q755 VanDerWaalsContact OD1-CG 3.22Å; D538-Q755 WeakPolarHBondContact OD1-CG 3.44Å; D538-Q755 PolarHBondContact OD1-NE2 2.89Å; S689-Q755 PolarHBondContact O-NE2 3.14Å
756	A	96.4	Very high	87.3	Confident	8 Å²	8	54.1 Å²	54.1	7%	0.066	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	146.5	170.9	0	0	0	0	0	111.1	L482 M536 L537 R539 M758	L482-A756 HydrophobicContact CD1-CB 4.41Å; L482-A756 HydrophobicContact CD2-CB 3.77Å; M536-A756 CarbonylContact C-O 3.54Å; M536-A756 WeakPolarHBondContact CA-O 3.48Å; L537-A756 HydrophobicContact CB-CB 4.47Å; L537-A756 PolarHBondContact N-O 3.19Å; L537-A756 PolarHBondContact O-N 2.91Å; R539-A756 HydrophobicContact CG-CB 4.47Å; A756-M758 HydrophobicContact CB-SD 4.4Å
757	H	96.8	Very high	84.5	Confident	47 Å²	47	57.3 Å²	57.3	22%	0.218	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.5	173.4	-66	-100.5	0	0	0	108.9	P495 V496 E534 M536	P495-H757 CarbonylContact C-O 3.59Å; P495-H757 VanDerWaalsContact CA-O 3.29Å; P495-H757 WeakPolarHBondContact CA-O 3.08Å; P495-H757 HydrophobicContact CB-CB 4.01Å; V496-H757 PolarHBondContact N-O 2.7Å; E534-H757 IonicContact OE1-CE1 3.85Å; E534-H757 IonicContact OE1-CG 3.87Å; E534-H757 IonicContact OE1-ND1 3.6Å; E534-H757 PolarHBondContact OE1-ND1 3.09Å; M536-H757 VanDerWaalsContact SD-CE1 3.57Å
758	M	97.6	Very high	81.7	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151.4	-179.9	-57.1	-59	-68.5	0	0	110.2	V478 L482 V496 I498 L507 L511 E534 V535 L537 A756	V478-M758 HydrophobicContact CG1-CE 4.16Å; L482-M758 HydrophobicContact CD1-SD 4.4Å; L482-M758 HydrophobicContact CD2-SD 4.1Å; V496-M758 HydrophobicContact CB-CE 4.09Å; V496-M758 HydrophobicContact CB-SD 3.9Å; V496-M758 HydrophobicContact CG1-CE 4.33Å; V496-M758 CarbonylContact O-C 3.6Å; V496-M758 WeakPolarHBondContact O-CA 3.37Å; I498-M758 HydrophobicContact CD1-CE 4.08Å; I498-M758 HydrophobicContact CG1-CE 4.37Å; L507-M758 HydrophobicContact CD2-CE 4.14Å; L511-M758 HydrophobicContact CD1-CB 3.91Å; L511-M758 HydrophobicContact CD1-CE 3.54Å; L511-M758 HydrophobicContact CD1-CG 4.27Å; L511-M758 HydrophobicContact CD2-CB 4.07Å; E534-M758 CarbonylContact C-O 3.5Å; E534-M758 WeakPolarHBondContact CA-O 3.34Å; V535-M758 HydrophobicContact CG2-CB 4.02Å; V535-M758 PolarHBondContact N-O 3.21Å; V535-M758 PolarHBondContact O-N 2.77Å; L537-M758 HydrophobicContact CB-CG 3.54Å; L537-M758 HydrophobicContact CD2-CG 4Å; L537-M758 HydrophobicContact CD2-SD 4.17Å; L537-M758 HydrophobicContact CG-CG 4.41Å; A756-M758 HydrophobicContact CB-SD 4.4Å
759	L	97.2	Very high	78.8	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.026	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129	171	-64	178.4	0	0	0	109.4	R468 P495 V496 C497 W513 I529 E534	R468-L759 HydrophobicContact CB-CD1 4.39Å; R468-L759 HydrophobicContact CG-CD1 4.29Å; P495-L759 HydrophobicContact CB-CD2 3.69Å; P495-L759 HydrophobicContact CB-CG 3.88Å; P495-L759 HydrophobicContact CG-CD2 3.98Å; P495-L759 HydrophobicContact CG-CG 4.33Å; V496-L759 PolarHBondContact O-N 2.94Å; C497-L759 HydrophobicContact CB-CB 3.9Å; C497-L759 HydrophobicContact CB-CD1 3.94Å; C497-L759 HydrophobicContact CB-CG 4.39Å; W513-L759 HydrophobicContact CZ2-CB 4.16Å; W513-L759 PolarHBondContact NE1-O 3.48Å; I529-L759 HydrophobicContact CG2-CD1 4.08Å; E534-L759 HydrophobicContact CB-CD2 4.42Å
760	M	94.8	Very high	75.7	Confident	27 Å²	27	67 Å²	67	13%	0.133	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.5	173.7	-175	178.2	-70.4	0	0	109.6	L511 R512 S532 T533 V535	L511-M760 HydrophobicContact CD2-CB 4.35Å; L511-M760 HydrophobicContact CD2-CE 4.18Å; L511-M760 CarbonylContact O-C 3.5Å; L511-M760 WeakPolarHBondContact O-CA 3.4Å; R512-M760 HydrophobicContact CG-CG 4.25Å; S532-M760 WeakPolarHBondContact CA-O 3.28Å; S532-M760 VanDerWaalsContact CB-O 3.3Å; S532-M760 WeakPolarHBondContact CB-O 3.48Å; T533-M760 PolarHBondContact N-O 2.96Å; T533-M760 PolarHBondContact O-N 3.39Å; V535-M760 HydrophobicContact CG1-CB 3.98Å; V535-M760 HydrophobicContact CG1-CE 3.98Å; V535-M760 HydrophobicContact CG1-SD 4.41Å; V535-M760 HydrophobicContact CG2-CB 4.13Å; V535-M760 HydrophobicContact CG2-CE 4.17Å
761	G	91	Very high	72.6	Confident	4 Å²	4	69.8 Å²	69.8	4%	0.041	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-60.2	152.3	177.2	0	0	0	0	0	112.4	L511 R512	L511-G761 PolarHBondContact O-N 2.9Å; R512-G761 WeakPolarHBondContact CD-O 3.48Å
762	A	83.1	Confident	69.8	Low	43 Å²	43	72 Å²	72	36%	0.355	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-55.8	147.9	179.2	0	0	0	0	0	111.5	Q764	A762-Q764 PolarHBondContact O-N 2.85Å; A762-Q764 VanDerWaalsContact O-N 3.12Å
763	P	74.8	Confident	67	Low	100 Å²	100	75 Å²	75	65%	0.649	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-55.8	123	174	-15.7	26.1	0	0	0	109.4	G765	P763-G765 PolarHBondContact O-N 3.3Å
764	Q	59.8	Low	64.3	Low	164 Å²	164	80.9 Å²	80.9	77%	0.766	43%	0.425	S	S	*	.			trans	-60.2	113.2	176.5	-67.7	-175.3	0.2	0	0	108.8	A762 R766	A762-Q764 PolarHBondContact O-N 2.85Å; A762-Q764 VanDerWaalsContact O-N 3.12Å; Q764-R766 PolarHBondContact O-N 3.46Å
765	G	44.5	Very low	61.5	Low	69 Å²	69	87.2 Å²	87.2	71%	0.711	45%	0.446	S	S	*	.			trans	-54.9	135.2	170.3	0	0	0	0	0	109	P763 S767	P763-G765 PolarHBondContact O-N 3.3Å; G765-S767 PolarHBondContact O-N 3.26Å
766	R	35.4	Very low	58.7	Low	234 Å²	234	88.3 Å²	88.3	88%	0.883	46%	0.457	S	S	*	.			trans	-51.5	111.1	-178.1	-70.3	178.9	175.8	177.7	-1	109.8	Q764 F768	Q764-R766 PolarHBondContact O-N 3.46Å; R766-F768 PolarHBondContact O-N 3.06Å
767	S	36.1	Very low	55.8	Low	69 Å²	69	97.8 Å²	97.8	48%	0.483	49%	0.491	S	S	.	.			trans	-57.2	128.5	171.9	166.2	0	0	0	0	109.5	G765 L769 S770	G765-S767 PolarHBondContact O-N 3.26Å; S767-L769 PolarHBondContact O-N 3.44Å; S767-S770 WeakPolarHBondContact O-CB 3.46Å; S767-S770 PolarHBondContact O-N 3.05Å; S767-S770 PolarHBondContact O-OG 3.25Å
768	F	36.1	Very low	53	Low	165 Å²	165	98.9 Å²	98.9	72%	0.724	50%	0.504	S	S	*	.	H	α-helix	trans	-55.8	-24.1	-178.8	-157.1	-97.9	0	0	0	113	R766 S771 I772	R766-F768 PolarHBondContact O-N 3.06Å; F768-S771 VanDerWaalsContact C-OG 3.31Å; F768-S771 WeakPolarHBondContact CA-OG 3.41Å; F768-S771 PolarHBondContact O-N 3.19Å; F768-S771 PolarHBondContact O-OG 3.43Å; F768-I772 HydrophobicContact CD1-CD1 3.93Å; F768-I772 HydrophobicContact CE1-CD1 4.08Å; F768-I772 PolarHBondContact O-N 2.98Å
769	L	36.2	Very low	50.1	Low	125 Å²	125	105.9 Å²	105.9	65%	0.654	54%	0.537	S	S	*	.	H	α-helix	trans	-71.6	-32.1	176.7	-69.4	166.3	0	0	0	112.8	S767 S771 I772 L773	S767-L769 PolarHBondContact O-N 3.44Å; L769-S771 VanDerWaalsContact C-N 3.33Å; L769-S771 PolarHBondContact O-N 2.99Å; L769-I772 PolarHBondContact O-N 3.45Å; L769-L773 PolarHBondContact O-N 3.42Å
770	S	33.6	Very low	47.3	Very low	63 Å²	63	109.9 Å²	109.9	44%	0.441	57%	0.565	S	S	.	*	H	α-helix	trans	-71.2	-28.8	176.9	71.4	0	0	0	0	112.8	S767 R774	S767-S770 WeakPolarHBondContact O-CB 3.46Å; S767-S770 PolarHBondContact O-N 3.05Å; S767-S770 PolarHBondContact O-OG 3.25Å; S770-R774 PolarHBondContact O-N 2.76Å
771	S	32	Very low	44.7	Very low	58 Å²	58	117 Å²	117	41%	0.406	60%	0.596	S	S	.	*	H	α-helix	trans	-72.1	-34.9	174.3	32.6	0	0	0	0	112.6	F768 L769 R775	F768-S771 VanDerWaalsContact C-OG 3.31Å; F768-S771 WeakPolarHBondContact CA-OG 3.41Å; F768-S771 PolarHBondContact O-N 3.19Å; F768-S771 PolarHBondContact O-OG 3.43Å; L769-S771 VanDerWaalsContact C-N 3.33Å; L769-S771 PolarHBondContact O-N 2.99Å; S771-R775 WeakPolarHBondContact O-CB 3.12Å; S771-R775 PolarHBondContact O-N 3.12Å; S771-R775 VanDerWaalsContact O-N 3.08Å
772	I	38.5	Very low	42.1	Very low	86 Å²	86	127.8 Å²	127.8	44%	0.441	65%	0.652	S	S	.	*	H	α-helix	trans	-71.3	-43.5	179.6	-66.3	168.6	0	0	0	110.6	F768 L769 R774 R775 T776	F768-I772 HydrophobicContact CD1-CD1 3.93Å; F768-I772 HydrophobicContact CE1-CD1 4.08Å; F768-I772 PolarHBondContact O-N 2.98Å; L769-I772 PolarHBondContact O-N 3.45Å; I772-R774 VanDerWaalsContact C-N 3.28Å; I772-R774 PolarHBondContact O-N 3.42Å; I772-R775 PolarHBondContact O-N 2.71Å; I772-R775 VanDerWaalsContact O-N 3.13Å; I772-T776 PolarHBondContact O-N 3.47Å; I772-T776 PolarHBondContact O-OG1 3.24Å
773	L	38.4	Very low	40	Very low	125 Å²	125	132 Å²	132	65%	0.654	67%	0.667	S	S	*	*	H	α-helix	trans	-66.8	-24.4	177.3	-84	155.7	0	0	0	114	L769 T776	L769-L773 PolarHBondContact O-N 3.42Å; L773-T776 PolarHBondContact O-OG1 2.81Å
774	R	38.6	Very low	38.2	Very low	202 Å²	202	133.7 Å²	133.7	76%	0.762	67%	0.668	S	S	*	*	H	α-helix	trans	-81	-33	170	-87.5	-173.2	179.9	179.8	2.3	112.6	S770 I772 R777 S778	S770-R774 PolarHBondContact O-N 2.76Å; I772-R774 VanDerWaalsContact C-N 3.28Å; I772-R774 PolarHBondContact O-N 3.42Å; R774-R777 PolarHBondContact O-N 3.03Å; R774-S778 PolarHBondContact O-N 3.49Å; R774-S778 VanDerWaalsContact O-N 3.13Å
775	R	35	Very low	37	Very low	177 Å²	177	132 Å²	132	67%	0.668	66%	0.662	S	S	*	*	H	α-helix	trans	-69.9	-38	180	-147.4	173	179.8	176.1	-0.7	111.8	S771 I772 R777 S778 E779	S771-R775 WeakPolarHBondContact O-CB 3.12Å; S771-R775 PolarHBondContact O-N 3.12Å; S771-R775 VanDerWaalsContact O-N 3.08Å; I772-R775 PolarHBondContact O-N 2.71Å; I772-R775 VanDerWaalsContact O-N 3.13Å; R775-R777 PolarHBondContact O-N 3.27Å; R775-S778 PolarHBondContact O-N 3.4Å; R775-S778 PolarHBondContact O-OG 3.38Å; R775-E779 PolarHBondContact O-N 3.33Å
776	T	37.3	Very low	36.5	Very low	84 Å²	84	135.7 Å²	135.7	52%	0.515	66%	0.659	S	S	.	*	H	α-helix	trans	-69.4	-20.8	172.8	48.6	0	0	0	0	113.6	I772 L773	I772-T776 PolarHBondContact O-N 3.47Å; I772-T776 PolarHBondContact O-OG1 3.24Å; L773-T776 PolarHBondContact O-OG1 2.81Å
777	R	35.8	Very low	36.6	Very low	206 Å²	206	129.6 Å²	129.6	78%	0.777	65%	0.645	S	S	*	*	H	α-helix	trans	-91.3	-15.6	177.7	-141.2	178.5	-175.9	-173.6	1.4	113.7	R774 R775	R774-R777 PolarHBondContact O-N 3.03Å; R775-R777 PolarHBondContact O-N 3.27Å
778	S	36.2	Very low	36.6	Very low	71 Å²	71	133.6 Å²	133.6	50%	0.497	66%	0.656	S	S	.	*	H	α-helix	trans	-87.9	-25.7	171.2	58.8	0	0	0	0	112.9	R774 R775 S780	R774-S778 PolarHBondContact O-N 3.49Å; R774-S778 VanDerWaalsContact O-N 3.13Å; R775-S778 PolarHBondContact O-N 3.4Å; R775-S778 PolarHBondContact O-OG 3.38Å; S778-S780 VanDerWaalsContact C-N 3.33Å
779	E	37.8	Very low	36.7	Very low	146 Å²	146	131.4 Å²	131.4	68%	0.682	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-2	178.5	-72.9	176.7	176.1	0	0	113.9	R775	R775-E779 PolarHBondContact O-N 3.33Å
780	S	38.3	Very low	36.7	Very low	89 Å²	89	131.8 Å²	131.8	62%	0.622	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	13.8	174.6	82.6	0	0	0	0	113.5	S778	S778-S780 VanDerWaalsContact C-N 3.33Å
781	K	40.8	Very low	37	Very low	178 Å²	178	137.6 Å²	137.6	77%	0.774	67%	0.669	S	S	*	*			trans	-137.3	62.8	171.6	-79.6	-166.3	174	-170.8	0	108.8
782	D	34.7	Very low	37.4	Very low	229 Å²	229	144.8 Å²	144.8	100%	1.225	69%	0.693	S	S	*	*			trans	-143.3	0	150.2	-83.2	-36.8	0	0	0	107.9

Retrieved 782 of 782 residues in 732.7 ms (Link to these results)

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