RABEK_HUMAN Loading...

Rab9 effector protein with kelch motifs

Rab9 effector required for endosome to trans-Golgi network (TGN) transport.

AlphaFold DB , UniProt , Accession Q7Z6M1, Species HUMAN (Homo sapiens, Human), Gene RABEPK, Length 372 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	54.7	Low	85.7	Confident	234 Å²	234	88.9 Å²	88.9	100%	1.153	46%	0.455	S	S	*	.				0	137.1	0	-77	167.5	179.7	0	0	107.8	Q3	M1-Q3 PolarHBondContact O-N 3.43Å
2	K	65	Low	86.4	Confident	184 Å²	184	95.3 Å²	95.3	80%	0.8	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-68.9	127	171.4	-74.5	-178.2	179.7	-178.4	0	107.5	L288	K2-L288 HydrophobicContact CB-CD1 3.18Å; K2-L288 HydrophobicContact CD-CD1 4.07Å; K2-L288 HydrophobicContact CG-CD1 4.27Å; K2-L288 WeakPolarHBondContact O-CD1 3.47Å
3	Q	86.5	Confident	87	Confident	175 Å²	175	88.7 Å²	88.7	82%	0.818	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-89.7	158.3	179.8	-68.7	176.8	-17.7	0	0	110.2	M1	M1-Q3 PolarHBondContact O-N 3.43Å
4	L	94.8	Very high	87.6	Confident	22 Å²	22	93.9 Å²	93.9	12%	0.115	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-63.1	148.7	168	-62.6	176.3	0	0	0	109.5	W18 L288 P290 I367	L4-W18 HydrophobicContact CD1-CB 4.15Å; L4-W18 HydrophobicContact CD2-CB 3.85Å; L4-L288 HydrophobicContact CD2-CB 4.21Å; L4-L288 WeakPolarHBondContact CD2-O 3.41Å; L4-P290 HydrophobicContact CD1-CB 4.27Å; L4-I367 HydrophobicContact CD1-CB 4.45Å; L4-I367 HydrophobicContact CD1-CG2 3.83Å
5	P	95.6	Very high	88.1	Confident	49 Å²	49	95.7 Å²	95.7	32%	0.318	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-59.7	144.9	170.3	27.2	-35	0	0	0	110.4	T17 W18 Y19 T20 T287	P5-T17 HydrophobicContact CG-CG2 4.06Å; P5-W18 VanDerWaalsContact CD-O 3.3Å; P5-W18 WeakPolarHBondContact CD-O 3.32Å; P5-W18 VanDerWaalsContact CG-O 3.32Å; P5-W18 WeakPolarHBondContact CG-O 3.3Å; P5-Y19 HydrophobicContact CB-CD1 3.97Å; P5-Y19 HydrophobicContact CB-CE1 4.25Å; P5-Y19 HydrophobicContact CG-CD1 3.68Å; P5-Y19 HydrophobicContact CG-CE1 3.96Å; P5-Y19 HydrophobicContact CG-CG 4.32Å; P5-Y19 CarbonylContact O-C 3.6Å; P5-Y19 WeakPolarHBondContact O-CA 3.34Å; P5-Y19 WeakPolarHBondContact O-CB 3.27Å; P5-T20 PolarHBondContact O-N 3.27Å; P5-T287 HydrophobicContact CG-CG2 4.45Å
6	V	95.3	Very high	88.6	Confident	64 Å²	64	91.9 Å²	91.9	39%	0.388	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-81	136.5	172.5	-177.4	0	0	0	0	108.9	E8 T20	V6-E8 HydrophobicContact CG1-CG 4.43Å; V6-E8 VanDerWaalsContact CG1-OE1 3.27Å; V6-E8 WeakPolarHBondContact CG1-OE1 3.13Å; V6-T20 WeakPolarHBondContact CA-O 3.38Å
7	L	95.1	Very high	89.1	Confident	2 Å²	2	86.6 Å²	86.6	1%	0.01	42%	0.424	C	S	.	.			trans	-98.1	111.1	169.8	-175.8	69.5	0	0	0	109.1	D11 P13 Y19 T20 W303 L349 V368	L7-D11 HydrophobicContact CD1-CB 3.65Å; L7-P13 HydrophobicContact CD1-CB 3.98Å; L7-P13 HydrophobicContact CD2-CB 4.29Å; L7-Y19 HydrophobicContact CB-CD1 3.86Å; L7-Y19 HydrophobicContact CB-CG 3.82Å; L7-Y19 HydrophobicContact CD1-CD1 4.21Å; L7-Y19 HydrophobicContact CD1-CE1 4.3Å; L7-Y19 HydrophobicContact CD1-CG 4.45Å; L7-T20 PolarHBondContact N-O 3.08Å; L7-W303 HydrophobicContact CD2-CD2 4.26Å; L7-W303 HydrophobicContact CD2-CH2 4.36Å; L7-W303 HydrophobicContact CD2-CZ2 3.87Å; L7-W303 HydrophobicContact CG-CZ2 3.88Å; L7-L349 HydrophobicContact CD2-CD1 3.67Å; L7-V368 HydrophobicContact CD2-CG2 3.85Å
8	E	92.3	Very high	89.6	Confident	99 Å²	99	81.8 Å²	81.8	46%	0.463	40%	0.401	S	S	.	.			trans	-89.1	152.8	-179.7	-63.2	-66	165.4	0	0	111.4	V6 G10 D11 W303	V6-E8 HydrophobicContact CG1-CG 4.43Å; V6-E8 VanDerWaalsContact CG1-OE1 3.27Å; V6-E8 WeakPolarHBondContact CG1-OE1 3.13Å; E8-G10 PolarHBondContact O-N 2.83Å; E8-D11 WeakPolarHBondContact CB-OD2 3.38Å; E8-D11 PolarHBondContact N-OD2 3.12Å; E8-D11 VanDerWaalsContact O-CB 3.26Å; E8-D11 WeakPolarHBondContact O-CB 3.33Å; E8-D11 PolarHBondContact O-N 3.29Å; E8-W303 WeakPolarHBondContact O-CZ2 3.3Å
9	P	87.4	Confident	90	Very high	61 Å²	61	78.2 Å²	78.2	40%	0.396	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	123.8	172.9	-32.4	39.6	0	0	0	113.9	D11 H73	P9-D11 VanDerWaalsContact C-N 3.34Å; P9-H73 HydrophobicContact CG-CB 3.89Å; P9-H73 VanDerWaalsContact CG-CG 3.43Å; P9-H73 WeakPolarHBondContact CG-ND1 3.44Å
10	G	83.8	Confident	90.3	Very high	14 Å²	14	76 Å²	76	14%	0.144	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	-11.8	178.9	0	0	0	0	0	115.1	E8 T306	E8-G10 PolarHBondContact O-N 2.83Å; G10-T306 WeakPolarHBondContact CA-OG1 3.3Å; G10-T306 PolarHBondContact O-N 2.63Å; G10-T306 PolarHBondContact O-OG1 3.02Å
11	D	92.4	Very high	90.5	Very high	74 Å²	74	72.7 Å²	72.7	40%	0.396	36%	0.358	S	S	.	.			trans	-59.7	145.7	173.6	-76.3	-14.8	0	0	0	111.4	L7 E8 P9 P13 W303	L7-D11 HydrophobicContact CD1-CB 3.65Å; E8-D11 WeakPolarHBondContact CB-OD2 3.38Å; E8-D11 PolarHBondContact N-OD2 3.12Å; E8-D11 VanDerWaalsContact O-CB 3.26Å; E8-D11 WeakPolarHBondContact O-CB 3.33Å; E8-D11 PolarHBondContact O-N 3.29Å; P9-D11 VanDerWaalsContact C-N 3.34Å; D11-P13 WeakPolarHBondContact O-CD 3.41Å; D11-W303 PolarHBondContact O-NE1 3.01Å
12	K	93.6	Very high	92.3	Very high	165 Å²	165	65.8 Å²	65.8	72%	0.717	33%	0.329	S	S	*	.			trans	-86.2	104.8	170.5	-172	171.9	-177.6	173.7	0	109.3	R14 V305	K12-R14 PolarHBondContact O-N 3.44Å; K12-V305 HydrophobicContact CB-CG1 3.56Å; K12-V305 HydrophobicContact CB-CG2 4.43Å; K12-V305 HydrophobicContact CD-CG1 4.13Å; K12-V305 HydrophobicContact CG-CG1 3.79Å; K12-V305 HydrophobicContact CG-CG2 4.22Å
13	P	94.9	Very high	93.5	Very high	10 Å²	10	58 Å²	58	7%	0.065	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-67.4	137.2	179.6	30.7	-36.5	0	0	0	110	L7 D11 Y19 T347 L349 V370	L7-P13 HydrophobicContact CD1-CB 3.98Å; L7-P13 HydrophobicContact CD2-CB 4.29Å; D11-P13 WeakPolarHBondContact O-CD 3.41Å; P13-Y19 HydrophobicContact CB-CE2 4.13Å; P13-T347 HydrophobicContact CG-CG2 3.86Å; P13-L349 HydrophobicContact CB-CD2 4.13Å; P13-L349 HydrophobicContact CG-CD2 3.98Å; P13-V370 HydrophobicContact CB-CG2 3.68Å; P13-V370 HydrophobicContact CG-CG2 3.86Å
14	R	95	Very high	93.8	Very high	162 Å²	162	53.9 Å²	53.9	61%	0.611	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-81.9	144.6	171.3	-59.8	-179.6	-66.8	-178.9	1.1	110.3	K12 Y19	K12-R14 PolarHBondContact O-N 3.44Å; R14-Y19 WeakPolarHBondContact CB-OH 3.41Å; R14-Y19 PolarHBondContact N-OH 3.2Å
15	K	95	Very high	93.8	Very high	121 Å²	121	55.4 Å²	55.4	53%	0.526	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	161.6	167.2	-66.5	-168.6	173.7	-159.3	0	110.8	T17 V370 D372	K15-T17 PolarHBondContact O-N 3.41Å; K15-T17 VanDerWaalsContact O-N 3.08Å; K15-T17 PolarHBondContact O-OG1 2.86Å; K15-V370 HydrophobicContact CG-CG1 4.12Å; K15-D372 WeakPolarHBondContact CE-OD1 3.27Å; K15-D372 IonicContact NZ-OD1 2.68Å; K15-D372 PolarHBondContact NZ-OD1 3.45Å; K15-D372 IonicContact NZ-OD2 3.38Å; K15-D372 PolarHBondContact NZ-OD2 2.81Å
16	A	95.9	Very high	93.8	Very high	34 Å²	34	58 Å²	58	28%	0.281	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	32.4	177.6	0	0	0	0	0	113.6	F285 D286	A16-F285 VanDerWaalsContact C-CD1 3.49Å; A16-F285 CarbonylContact O-C 3.5Å; A16-F285 VanDerWaalsContact O-CA 3.3Å; A16-F285 WeakPolarHBondContact O-CA 3.45Å; A16-D286 PolarHBondContact O-N 3.31Å
17	T	97.2	Very high	93.7	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.012	32%	0.318	C	S	.	.			trans	-133.6	129.5	179.9	-58.7	0	0	0	0	110.1	P5 K15 Y19 T287 T369	P5-T17 HydrophobicContact CG-CG2 4.06Å; K15-T17 PolarHBondContact O-N 3.41Å; K15-T17 VanDerWaalsContact O-N 3.08Å; K15-T17 PolarHBondContact O-OG1 2.86Å; T17-Y19 HydrophobicContact CG2-CD1 4.35Å; T17-Y19 HydrophobicContact CG2-CD2 3.93Å; T17-Y19 HydrophobicContact CG2-CE1 3.83Å; T17-Y19 HydrophobicContact CG2-CE2 3.35Å; T17-Y19 HydrophobicContact CG2-CG 4.38Å; T17-Y19 WeakPolarHBondContact CG2-OH 3.15Å; T17-T287 HydrophobicContact CG2-CG2 3.5Å; T17-T369 PolarHBondContact O-OG1 3.44Å
18	W	97.9	Very high	93.8	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	138.3	166.1	-79.9	102.5	0	0	0	110.2	L4 P5 F258 M270 F285 T287 P290 V352 I367 V368 T369	L4-W18 HydrophobicContact CD1-CB 4.15Å; L4-W18 HydrophobicContact CD2-CB 3.85Å; P5-W18 VanDerWaalsContact CD-O 3.3Å; P5-W18 WeakPolarHBondContact CD-O 3.32Å; P5-W18 VanDerWaalsContact CG-O 3.32Å; P5-W18 WeakPolarHBondContact CG-O 3.3Å; W18-F258 HydrophobicContact CH2-CD2 4.3Å; W18-F258 HydrophobicContact CH2-CE2 4.24Å; W18-F258 HydrophobicContact CH2-CG 4.45Å; W18-F258 HydrophobicContact CH2-CZ 4.37Å; W18-F258 AromaticContact CZ2-CD2 3.86Å; W18-F258 HydrophobicContact CZ2-CD2 3.86Å; W18-F258 AromaticContact CZ2-CE2 3.74Å; W18-F258 HydrophobicContact CZ2-CE2 3.74Å; W18-F258 HydrophobicContact CZ2-CG 4.43Å; W18-F258 HydrophobicContact CZ2-CZ 4.26Å; W18-M270 HydrophobicContact CH2-SD 4.38Å; W18-M270 HydrophobicContact CZ2-SD 3.84Å; W18-F285 AromaticContact CD1-CD1 3.43Å; W18-F285 VanDerWaalsContact CD1-CD1 3.43Å; W18-F285 AromaticContact CD1-CE1 3.68Å; W18-F285 AromaticContact CD1-CG 3.64Å; W18-F285 HydrophobicContact CG-CD1 4.33Å; W18-F285 HydrophobicContact CG-CE1 4.46Å; W18-F285 HydrophobicContact CZ2-CZ 4.38Å; W18-F285 AromaticContact NE1-CD1 3.61Å; W18-F285 AromaticContact NE1-CD2 3.75Å; W18-F285 AromaticContact NE1-CE1 3.38Å; W18-F285 AromaticContact NE1-CE2 3.51Å; W18-F285 AromaticContact NE1-CG 3.8Å; W18-F285 AromaticContact NE1-CZ 3.33Å; W18-F285 VanDerWaalsContact NE1-CZ 3.33Å; W18-T287 PolarHBondContact N-OG1 2.82Å; W18-T287 VanDerWaalsContact N-OG1 3.12Å; W18-P290 HydrophobicContact CD2-CG 4.11Å; W18-P290 HydrophobicContact CE3-CG 4.49Å; W18-P290 HydrophobicContact CG-CG 4.39Å; W18-P290 HydrophobicContact CZ2-CG 4.49Å; W18-V352 HydrophobicContact CH2-CG2 3.99Å; W18-V352 HydrophobicContact CZ3-CG2 4.19Å; W18-I367 HydrophobicContact CE3-CB 4.1Å; W18-I367 HydrophobicContact CE3-CD1 4.11Å; W18-I367 HydrophobicContact CE3-CG1 4.12Å; W18-I367 HydrophobicContact CH2-CD1 4.45Å; W18-I367 HydrophobicContact CZ3-CB 4.24Å; W18-I367 HydrophobicContact CZ3-CD1 3.87Å; W18-I367 HydrophobicContact CZ3-CG1 3.81Å; W18-V368 WeakPolarHBondContact CA-O 3.49Å; W18-T369 HydrophobicContact CD2-CG2 4.26Å; W18-T369 HydrophobicContact CE3-CG2 4.14Å; W18-T369 HydrophobicContact CH2-CG2 3.63Å; W18-T369 HydrophobicContact CZ2-CG2 3.74Å; W18-T369 HydrophobicContact CZ3-CG2 3.83Å
19	Y	97.6	Very high	94	Very high	14 Å²	14	55.5 Å²	55.5	6%	0.055	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	152.1	174.3	-57.6	-97.8	0	0	0	110.6	P5 L7 P13 R14 T17 I367 V368	P5-Y19 HydrophobicContact CB-CD1 3.97Å; P5-Y19 HydrophobicContact CB-CE1 4.25Å; P5-Y19 HydrophobicContact CG-CD1 3.68Å; P5-Y19 HydrophobicContact CG-CE1 3.96Å; P5-Y19 HydrophobicContact CG-CG 4.32Å; P5-Y19 CarbonylContact O-C 3.6Å; P5-Y19 WeakPolarHBondContact O-CA 3.34Å; P5-Y19 WeakPolarHBondContact O-CB 3.27Å; L7-Y19 HydrophobicContact CB-CD1 3.86Å; L7-Y19 HydrophobicContact CB-CG 3.82Å; L7-Y19 HydrophobicContact CD1-CD1 4.21Å; L7-Y19 HydrophobicContact CD1-CE1 4.3Å; L7-Y19 HydrophobicContact CD1-CG 4.45Å; P13-Y19 HydrophobicContact CB-CE2 4.13Å; R14-Y19 WeakPolarHBondContact CB-OH 3.41Å; R14-Y19 PolarHBondContact N-OH 3.2Å; T17-Y19 HydrophobicContact CG2-CD1 4.35Å; T17-Y19 HydrophobicContact CG2-CD2 3.93Å; T17-Y19 HydrophobicContact CG2-CE1 3.83Å; T17-Y19 HydrophobicContact CG2-CE2 3.35Å; T17-Y19 HydrophobicContact CG2-CG 4.38Å; T17-Y19 WeakPolarHBondContact CG2-OH 3.15Å; Y19-I367 CarbonylContact O-C 3.49Å; Y19-I367 VanDerWaalsContact O-CA 3.23Å; Y19-I367 WeakPolarHBondContact O-CA 3.44Å; Y19-V368 PolarHBondContact N-O 2.87Å; Y19-V368 PolarHBondContact O-N 2.71Å
20	T	96.7	Very high	94.5	Very high	34 Å²	34	53.8 Å²	53.8	21%	0.209	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131.7	159.1	-62.2	0	0	0	0	108.6	P5 V6 L7	P5-T20 PolarHBondContact O-N 3.27Å; V6-T20 WeakPolarHBondContact CA-O 3.38Å; L7-T20 PolarHBondContact N-O 3.08Å
21	L	94.7	Very high	95.1	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.037	30%	0.298	C	S	.	.			trans	-101.1	103.3	172.4	-179.5	63.3	0	0	0	108.5	V23 M68 W303 L351 C366 V368	L21-V23 HydrophobicContact CD1-CG2 4.21Å; L21-V23 HydrophobicContact CD2-CG2 4.41Å; L21-V23 HydrophobicContact CG-CG2 3.92Å; L21-M68 HydrophobicContact CD2-CE 4.06Å; L21-M68 HydrophobicContact CD2-SD 3.89Å; L21-W303 HydrophobicContact CD1-CH2 3.77Å; L21-W303 HydrophobicContact CD1-CZ3 4.04Å; L21-L351 HydrophobicContact CD2-CD1 4.13Å; L21-C366 HydrophobicContact CB-CB 4.01Å; L21-C366 PolarHBondContact N-O 3.28Å; L21-C366 WeakPolarHBondContact O-CB 3.43Å; L21-V368 HydrophobicContact CB-CG1 4.12Å; L21-V368 HydrophobicContact CB-CG2 4.45Å; L21-V368 HydrophobicContact CD2-CG1 4.13Å
22	T	91.2	Very high	95.4	Very high	88 Å²	88	50.5 Å²	50.5	54%	0.54	28%	0.284	S	S	.	.			trans	-96	113.6	-179.5	-51.4	0	0	0	0	109.2
23	V	90.6	Very high	95.6	Very high	20 Å²	20	42.7 Å²	42.7	12%	0.121	25%	0.25	C	C	.	.			trans	-120.9	126	-178	175.4	0	0	0	0	108.9	L21 M68 H73 Q74 W75	L21-V23 HydrophobicContact CD1-CG2 4.21Å; L21-V23 HydrophobicContact CD2-CG2 4.41Å; L21-V23 HydrophobicContact CG-CG2 3.92Å; V23-M68 HydrophobicContact CB-SD 4.28Å; V23-M68 HydrophobicContact CG1-CG 4.1Å; V23-M68 HydrophobicContact CG1-SD 4.47Å; V23-M68 HydrophobicContact CG2-CG 4.35Å; V23-M68 HydrophobicContact CG2-SD 3.74Å; V23-H73 VanDerWaalsContact CG1-C 3.48Å; V23-H73 WeakPolarHBondContact CG1-O 3.21Å; V23-Q74 VanDerWaalsContact CG1-C 3.46Å; V23-W75 HydrophobicContact CG1-CG 4.31Å
24	P	93.6	Very high	95.8	Very high	90 Å²	90	42.6 Å²	42.6	58%	0.584	25%	0.249	S	C	*	.			trans	-69.1	161.9	178.3	29.8	-37.4	0	0	0	112	H73 Q74 W75	P24-H73 VanDerWaalsContact CD-O 3.31Å; P24-H73 WeakPolarHBondContact CD-O 3.12Å; P24-H73 WeakPolarHBondContact CG-O 3.26Å; P24-Q74 CarbonylContact O-C 3.57Å; P24-Q74 VanDerWaalsContact O-CA 3.27Å; P24-Q74 WeakPolarHBondContact O-CA 3.07Å; P24-W75 PolarHBondContact O-N 3Å
25	G	94.4	Very high	96	Very high	54 Å²	54	35.4 Å²	35.4	56%	0.557	22%	0.223	S	C	*	.	B	Isolated β-bridge	trans	113.7	-162	173.7	0	0	0	0	0	113.4	S27 W75	G25-S27 VanDerWaalsContact C-N 3.26Å; G25-S27 PolarHBondContact O-N 3.47Å; G25-W75 WeakPolarHBondContact CA-O 3.49Å
26	D	94.4	Very high	96.1	Very high	102 Å²	102	30.1 Å²	30.1	55%	0.545	20%	0.202	S	C	.	.	S	Bend	trans	-81.5	69	-174.8	-64.8	-42.4	0	0	0	111.3	H66 W75 L77	D26-H66 PolarHBondContact O-ND1 2.96Å; D26-W75 PolarHBondContact N-O 3.48Å; D26-W75 VanDerWaalsContact N-O 3.1Å; D26-L77 HydrophobicContact CB-CB 3.76Å
27	S	94.7	Very high	96.1	Very high	57 Å²	57	29.3 Å²	29.3	40%	0.399	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-64.8	153.7	179.1	68.6	0	0	0	0	111.9	G25 C29	G25-S27 VanDerWaalsContact C-N 3.26Å; G25-S27 PolarHBondContact O-N 3.47Å; S27-C29 PolarHBondContact O-N 2.99Å
28	P	96	Very high	96	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-66	134.6	174.4	-2.2	14.2	0	0	0	110.3	R31 I52 H66 W75 F353	P28-R31 VanDerWaalsContact CB-CZ 3.42Å; P28-R31 VanDerWaalsContact CB-NE 3.35Å; P28-I52 HydrophobicContact CB-CG2 4.3Å; P28-I52 HydrophobicContact CG-CB 4.02Å; P28-I52 HydrophobicContact CG-CG1 4.05Å; P28-I52 HydrophobicContact CG-CG2 4Å; P28-H66 HydrophobicContact CB-CB 4.3Å; P28-H66 HydrophobicContact CG-CB 3.66Å; P28-W75 HydrophobicContact CG-CE3 4.45Å; P28-W75 HydrophobicContact CG-CH2 4.16Å; P28-W75 HydrophobicContact CG-CZ3 4.04Å; P28-F353 HydrophobicContact CB-CE1 3.76Å; P28-F353 HydrophobicContact CB-CZ 3.57Å; P28-F353 HydrophobicContact CG-CE1 3.65Å; P28-F353 HydrophobicContact CG-CE2 4.07Å; P28-F353 HydrophobicContact CG-CZ 3.36Å
29	C	96.2	Very high	95.8	Very high	56 Å²	56	32.1 Å²	32.1	38%	0.378	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-62	166.2	167.8	67	0	0	0	0	112.2	S27 R31 F62	S27-C29 PolarHBondContact O-N 2.99Å; C29-R31 WeakPolarHBondContact O-CG 3.44Å; C29-R31 PolarHBondContact O-N 3.4Å; C29-R31 PolarHBondContact O-NE 3.46Å; C29-F62 WeakPolarHBondContact SG-CE1 3.45Å; C29-F62 WeakPolarHBondContact SG-CZ 3.45Å
30	A	97.8	Very high	95.5	Very high	26 Å²	26	34.9 Å²	34.9	22%	0.215	23%	0.225	C	C	.	.	S	Bend	trans	-48.7	123.5	178.1	0	0	0	0	0	112.4	I362 Y363 D364	A30-I362 HydrophobicContact CB-CB 4.02Å; A30-I362 HydrophobicContact CB-CG2 3.79Å; A30-I362 WeakPolarHBondContact CB-O 3.48Å; A30-Y363 WeakPolarHBondContact CA-O 3.46Å; A30-D364 HydrophobicContact CB-CB 4.16Å
31	R	98.2	Very high	95	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	23%	0.233	C	C	.	.			trans	-157.2	154.8	-173	64.1	-177	69.2	-162.2	4.1	114.2	P28 C29 G54 A56 F62 D64 H66 F353 G355 Y363	P28-R31 VanDerWaalsContact CB-CZ 3.42Å; P28-R31 VanDerWaalsContact CB-NE 3.35Å; C29-R31 WeakPolarHBondContact O-CG 3.44Å; C29-R31 PolarHBondContact O-N 3.4Å; C29-R31 PolarHBondContact O-NE 3.46Å; R31-G54 PolarHBondContact NH1-O 3.46Å; R31-A56 VanDerWaalsContact CA-O 3.3Å; R31-A56 WeakPolarHBondContact CA-O 3.22Å; R31-F62 HydrophobicContact CB-CD2 4.03Å; R31-F62 HydrophobicContact CB-CE2 3.56Å; R31-F62 HydrophobicContact CB-CZ 4.49Å; R31-D64 IonicContact CZ-OD1 2.84Å; R31-D64 IonicContact NH1-OD1 3.75Å; R31-D64 PolarHBondContact NH1-OD1 2.97Å; R31-D64 IonicContact NH2-OD1 3.59Å; R31-H66 PolarHBondContact NH2-NE2 3.08Å; R31-F353 HydrophobicContact CG-CE1 3.95Å; R31-G355 PolarHBondContact O-N 3.38Å; R31-G355 VanDerWaalsContact O-N 3.11Å; R31-Y363 PolarHBondContact N-O 2.72Å
32	V	98.4	Very high	94.3	Very high	18 Å²	18	40 Å²	40	11%	0.109	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-122.6	162.2	174.6	-59.1	0	0	0	0	111.2	H34 G55 A56 D295 M356 I362	V32-H34 PolarHBondContact O-N 3.1Å; V32-H34 VanDerWaalsContact O-N 3.11Å; V32-G55 CarbonylContact O-C 3.43Å; V32-G55 WeakPolarHBondContact O-CA 3.41Å; V32-A56 PolarHBondContact N-O 2.84Å; V32-A56 PolarHBondContact O-N 3.17Å; V32-D295 CarbonylContact C-O 3.5Å; V32-D295 WeakPolarHBondContact CA-O 3.43Å; V32-D295 HydrophobicContact CB-CB 3.74Å; V32-D295 HydrophobicContact CG1-CB 4.24Å; V32-M356 HydrophobicContact CG1-CB 3.79Å; V32-M356 HydrophobicContact CG1-CG 3.76Å; V32-M356 HydrophobicContact CG1-SD 3.88Å; V32-I362 HydrophobicContact CG1-CG2 3.98Å
33	G	98.1	Very high	93.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	61.6	23.1	172.7	0	0	0	0	0	114.2	Y87 E88 D295	G33-Y87 CarbonylContact O-C 3.51Å; G33-Y87 WeakPolarHBondContact O-CA 3.26Å; G33-E88 PolarHBondContact O-N 3.11Å; G33-D295 PolarHBondContact N-O 2.84Å
34	H	98.5	Very high	93.2	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.037	30%	0.304	C	S	.	.			trans	-84	170.3	172	58.5	-81.3	0	0	0	109.6	V32 I52 V53 G54 S297 F353	V32-H34 PolarHBondContact O-N 3.1Å; V32-H34 VanDerWaalsContact O-N 3.11Å; H34-I52 HydrophobicContact CB-CG2 4.17Å; H34-V53 WeakPolarHBondContact CA-O 3.32Å; H34-G54 WeakPolarHBondContact CB-O 3.46Å; H34-S297 PolarHBondContact CD2-OG 2.82Å; H34-S297 PolarHBondContact NE2-OG 2.84Å; H34-S297 WeakPolarHBondContact O-CB 3.39Å; H34-F353 AromaticContact CD2-CD1 3.87Å; H34-F353 AromaticContact CE1-CD1 3.75Å; H34-F353 PolarHBondContact CE1-O 3.43Å; H34-F353 AromaticContact NE2-CD1 3.38Å; H34-F353 WeakPolarHBondContact NE2-CD1 3.45Å; H34-F353 PolarHBondContact NE2-O 2.95Å; H34-F353 VanDerWaalsContact NE2-O 3.11Å
35	S	98.1	Very high	92.7	Very high	11 Å²	11	44.4 Å²	44.4	8%	0.077	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	142.7	168.6	59.2	0	0	0	0	111	I52 V53 H89 S91	S35-I52 WeakPolarHBondContact O-CA 3.31Å; S35-V53 PolarHBondContact N-O 2.8Å; S35-V53 VanDerWaalsContact N-O 3.12Å; S35-V53 PolarHBondContact O-N 3.44Å; S35-H89 WeakPolarHBondContact CB-NE2 3.49Å; S35-H89 PolarHBondContact OG-NE2 3.16Å; S35-S91 VanDerWaalsContact CB-CB 3.47Å
36	C	96.9	Very high	92	Very high	11 Å²	11	51.2 Å²	51.2	7%	0.074	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.5	173.4	-177.1	0	0	0	0	109.5	V50 F51 I52 S297 C299	C36-V50 WeakPolarHBondContact SG-CG1 3.2Å; C36-F51 VanDerWaalsContact CA-O 3.32Å; C36-F51 WeakPolarHBondContact CA-O 3.32Å; C36-I52 HydrophobicContact CB-CD1 3.77Å; C36-S297 WeakPolarHBondContact CB-OG 3.4Å; C36-S297 PolarHBondContact N-OG 2.9Å; C36-S297 VanDerWaalsContact N-OG 3.17Å; C36-C299 PolarHBondContact SG-SG 2.9Å
37	S	95.9	Very high	91.7	Very high	16 Å²	16	50.8 Å²	50.8	11%	0.112	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	134.5	-177.3	-58.1	0	0	0	0	110.9	V50 F51	S37-V50 CarbonylContact O-C 3.57Å; S37-V50 WeakPolarHBondContact O-CA 3.46Å; S37-F51 PolarHBondContact N-O 3.37Å; S37-F51 PolarHBondContact O-N 3Å
38	Y	95.8	Very high	91.6	Very high	52 Å²	52	48.1 Å²	48.1	20%	0.204	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.1	174	171.5	-104.8	0	0	0	109.9	P40 K49 V50 L70 I301 P302	Y38-P40 HydrophobicContact CE1-CB 4.36Å; Y38-K49 WeakPolarHBondContact CA-O 3.09Å; Y38-V50 HydrophobicContact CD2-CG2 4.42Å; Y38-L70 HydrophobicContact CD2-CD1 4.14Å; Y38-L70 HydrophobicContact CE2-CD1 3.78Å; Y38-I301 HydrophobicContact CD2-CG2 4Å; Y38-I301 HydrophobicContact CG-CG2 4.29Å; Y38-P302 HydrophobicContact CE1-CG 4.11Å; Y38-P302 HydrophobicContact CE2-CG 4.21Å; Y38-P302 VanDerWaalsContact CZ-CD 3.43Å; Y38-P302 VanDerWaalsContact OH-CG 3.26Å; Y38-P302 WeakPolarHBondContact OH-CG 3.41Å
39	L	93.8	Very high	91.5	Very high	10 Å²	10	51.3 Å²	51.3	5%	0.052	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.3	166	-67.2	-175.2	0	0	0	109.7	G48 K49 F51 I93 I101 P121	L39-G48 CarbonylContact O-C 3.58Å; L39-G48 WeakPolarHBondContact O-CA 3.36Å; L39-K49 PolarHBondContact N-O 2.94Å; L39-K49 PolarHBondContact O-N 3.45Å; L39-F51 HydrophobicContact CB-CD2 4.45Å; L39-F51 HydrophobicContact CB-CE2 3.97Å; L39-F51 HydrophobicContact CD1-CD2 4.11Å; L39-F51 HydrophobicContact CD1-CE2 3.51Å; L39-F51 HydrophobicContact CD1-CZ 3.85Å; L39-F51 HydrophobicContact CG-CD2 4.06Å; L39-F51 HydrophobicContact CG-CE2 3.79Å; L39-I93 HydrophobicContact CD2-CD1 3.37Å; L39-I93 HydrophobicContact CD2-CG1 3.83Å; L39-I93 HydrophobicContact CD2-CG2 4.14Å; L39-I93 HydrophobicContact CG-CD1 4.43Å; L39-I101 HydrophobicContact CD1-CD1 4.14Å; L39-I101 HydrophobicContact CD1-CG1 4.11Å; L39-I101 HydrophobicContact CD2-CG1 4.42Å; L39-I101 HydrophobicContact CG-CD1 4.37Å; L39-I101 HydrophobicContact CG-CG1 4.42Å; L39-P121 HydrophobicContact CD1-CG 4.34Å
40	P	90.9	Very high	91.5	Very high	71 Å²	71	48.7 Å²	48.7	46%	0.461	28%	0.278	S	S	.	.			trans	-62.5	163.9	173.3	28.4	-34.3	0	0	0	111.6	Y38 V42	Y38-P40 HydrophobicContact CE1-CB 4.36Å; P40-V42 PolarHBondContact O-N 3.49Å
41	P	87.4	Confident	91.4	Very high	60 Å²	60	47.8 Å²	47.8	39%	0.39	27%	0.27	S	S	.	.			trans	-56.2	137.5	176.2	19.3	-28.8	0	0	0	111.9	A45	P41-A45 HydrophobicContact CB-CB 4.06Å; P41-A45 WeakPolarHBondContact CB-O 3.2Å
42	V	78.6	Confident	91.4	Very high	88 Å²	88	47.8 Å²	47.8	53%	0.533	27%	0.269	S	S	.	.			trans	-118.1	141.9	173.3	-175.6	0	0	0	0	109	P40 N44 A45	P40-V42 PolarHBondContact O-N 3.49Å; V42-N44 PolarHBondContact O-N 3.05Å; V42-A45 WeakPolarHBondContact O-CB 3.12Å; V42-A45 PolarHBondContact O-N 3.42Å
43	G	80	Confident	91.4	Very high	73 Å²	73	46.9 Å²	46.9	75%	0.753	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	-126.6	-179.9	0	0	0	0	0	112.3	A45	G43-A45 VanDerWaalsContact C-N 3.32Å; G43-A45 PolarHBondContact O-N 3.08Å
44	N	79.8	Confident	91.3	Very high	169 Å²	169	46.9 Å²	46.9	90%	0.904	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	2.7	-176.8	-64.4	-15.8	0	0	0	113.9	V42 K46	V42-N44 PolarHBondContact O-N 3.05Å; N44-K46 PolarHBondContact O-N 3.36Å
45	A	82.2	Confident	91.3	Very high	49 Å²	49	46.5 Å²	46.5	41%	0.405	26%	0.263	S	S	.	.			trans	-66.6	131.5	178.8	0	0	0	0	0	110	P41 V42 G43 R47	P41-A45 HydrophobicContact CB-CB 4.06Å; P41-A45 WeakPolarHBondContact CB-O 3.2Å; V42-A45 WeakPolarHBondContact O-CB 3.12Å; V42-A45 PolarHBondContact O-N 3.42Å; G43-A45 VanDerWaalsContact C-N 3.32Å; G43-A45 PolarHBondContact O-N 3.08Å; A45-R47 VanDerWaalsContact C-N 3.34Å
46	K	80	Confident	91.3	Very high	198 Å²	198	46.4 Å²	46.4	86%	0.861	26%	0.262	S	S	*	.	S	Bend	trans	-76.8	-23.9	175.7	-66.9	-171	177.6	-174	0	112.7	N44	N44-K46 PolarHBondContact O-N 3.36Å
47	R	88.2	Confident	91.3	Very high	93 Å²	93	47.8 Å²	47.8	35%	0.351	27%	0.269	S	S	.	.	S	Bend	trans	-140.1	157	-176.2	-59.6	-166.1	-175.9	-72.8	-9.1	111	A45 L70 P304	A45-R47 VanDerWaalsContact C-N 3.34Å; R47-L70 HydrophobicContact CB-CB 4.18Å; R47-L70 VanDerWaalsContact CD-O 3.29Å; R47-L70 WeakPolarHBondContact CD-O 3.48Å; R47-P304 VanDerWaalsContact NH1-CB 3.27Å; R47-P304 VanDerWaalsContact NH1-CG 3.3Å; R47-P304 VanDerWaalsContact NH2-CG 3.31Å
48	G	92.8	Very high	91.3	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.01	30%	0.299	C	S	.	.			trans	-77	-176.1	177.7	0	0	0	0	0	113.3	L39 L70	L39-G48 CarbonylContact O-C 3.58Å; L39-G48 WeakPolarHBondContact O-CA 3.36Å; G48-L70 WeakPolarHBondContact O-CB 3.4Å; G48-L70 PolarHBondContact O-N 2.64Å
49	K	94.4	Very high	91.2	Very high	67 Å²	67	56.9 Å²	56.9	29%	0.291	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.1	179.9	-56.3	-168.7	176.2	-166.5	0	111	Y38 L39 F51 M68 D69	Y38-K49 WeakPolarHBondContact CA-O 3.09Å; L39-K49 PolarHBondContact N-O 2.94Å; L39-K49 PolarHBondContact O-N 3.45Å; K49-F51 HydrophobicContact CB-CD2 4.29Å; K49-F51 HydrophobicContact CB-CE2 3.74Å; K49-F51 HydrophobicContact CB-CZ 4.46Å; K49-M68 VanDerWaalsContact CA-O 3.29Å; K49-M68 WeakPolarHBondContact CA-O 3.48Å; K49-D69 VanDerWaalsContact CE-OD2 3.27Å; K49-D69 WeakPolarHBondContact CE-OD2 3.3Å; K49-D69 HydrophobicContact CG-CB 4.48Å; K49-D69 IonicContact NZ-OD2 2.64Å
50	V	96.1	Very high	91.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.4	168	-179.4	0	0	0	0	108.8	C36 S37 Y38 I52 T67 M68 L70 I301 L351	C36-V50 WeakPolarHBondContact SG-CG1 3.2Å; S37-V50 CarbonylContact O-C 3.57Å; S37-V50 WeakPolarHBondContact O-CA 3.46Å; Y38-V50 HydrophobicContact CD2-CG2 4.42Å; V50-I52 HydrophobicContact CG1-CD1 4.4Å; V50-T67 CarbonylContact O-C 3.4Å; V50-T67 VanDerWaalsContact O-CA 3.24Å; V50-T67 WeakPolarHBondContact O-CA 3.47Å; V50-M68 HydrophobicContact CB-CB 4.21Å; V50-M68 HydrophobicContact CB-CE 3.83Å; V50-M68 HydrophobicContact CG1-CE 4.47Å; V50-M68 HydrophobicContact CG2-CE 3.57Å; V50-M68 PolarHBondContact N-O 2.89Å; V50-M68 PolarHBondContact O-N 2.99Å; V50-L70 HydrophobicContact CG2-CD1 4.5Å; V50-L70 HydrophobicContact CG2-CD2 4.45Å; V50-I301 HydrophobicContact CG2-CG2 3.47Å; V50-I301 VanDerWaalsContact CG2-CG2 3.47Å; V50-L351 HydrophobicContact CG1-CD2 4.49Å; V50-L351 HydrophobicContact CG2-CD1 4.49Å
51	F	96.1	Very high	91.7	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.035	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.3	178.6	-72.3	-106.6	0	0	0	109.8	C36 S37 L39 K49 V53 V65 H66 T67 I101 L119	C36-F51 VanDerWaalsContact CA-O 3.32Å; C36-F51 WeakPolarHBondContact CA-O 3.32Å; S37-F51 PolarHBondContact N-O 3.37Å; S37-F51 PolarHBondContact O-N 3Å; L39-F51 HydrophobicContact CB-CD2 4.45Å; L39-F51 HydrophobicContact CB-CE2 3.97Å; L39-F51 HydrophobicContact CD1-CD2 4.11Å; L39-F51 HydrophobicContact CD1-CE2 3.51Å; L39-F51 HydrophobicContact CD1-CZ 3.85Å; L39-F51 HydrophobicContact CG-CD2 4.06Å; L39-F51 HydrophobicContact CG-CE2 3.79Å; K49-F51 HydrophobicContact CB-CD2 4.29Å; K49-F51 HydrophobicContact CB-CE2 3.74Å; K49-F51 HydrophobicContact CB-CZ 4.46Å; F51-V53 HydrophobicContact CB-CG2 4.37Å; F51-V65 HydrophobicContact CD1-CG1 3.78Å; F51-V65 HydrophobicContact CE1-CG1 4.49Å; F51-H66 WeakPolarHBondContact CA-O 3.46Å; F51-T67 HydrophobicContact CD1-CG2 3.48Å; F51-T67 VanDerWaalsContact CD1-CG2 3.48Å; F51-T67 HydrophobicContact CE1-CG2 3.37Å; F51-T67 HydrophobicContact CE2-CG2 4.43Å; F51-T67 HydrophobicContact CG-CG2 4.08Å; F51-T67 HydrophobicContact CZ-CG2 3.88Å; F51-I101 HydrophobicContact CB-CD1 3.5Å; F51-I101 HydrophobicContact CD1-CD1 3.57Å; F51-I101 HydrophobicContact CD2-CD1 3.79Å; F51-I101 HydrophobicContact CE1-CD1 4.22Å; F51-I101 HydrophobicContact CE2-CD1 4.4Å; F51-I101 HydrophobicContact CG-CD1 3.33Å; F51-L119 HydrophobicContact CD1-CD2 4.29Å; F51-L119 HydrophobicContact CE1-CD2 4.22Å
52	I	97.4	Very high	92.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	114.8	167.9	-56.2	-58	0	0	0	107.5	P28 H34 S35 C36 V50 V65 H66 W75 F353	P28-I52 HydrophobicContact CB-CG2 4.3Å; P28-I52 HydrophobicContact CG-CB 4.02Å; P28-I52 HydrophobicContact CG-CG1 4.05Å; P28-I52 HydrophobicContact CG-CG2 4Å; H34-I52 HydrophobicContact CB-CG2 4.17Å; S35-I52 WeakPolarHBondContact O-CA 3.31Å; C36-I52 HydrophobicContact CB-CD1 3.77Å; V50-I52 HydrophobicContact CG1-CD1 4.4Å; I52-V65 WeakPolarHBondContact O-CA 3.15Å; I52-H66 HydrophobicContact CB-CB 4.39Å; I52-H66 PolarHBondContact N-O 2.95Å; I52-H66 PolarHBondContact O-N 2.79Å; I52-W75 HydrophobicContact CD1-CH2 4.46Å; I52-W75 HydrophobicContact CG1-CH2 3.58Å; I52-W75 HydrophobicContact CG1-CZ3 3.86Å; I52-F353 HydrophobicContact CD1-CB 3.89Å; I52-F353 HydrophobicContact CD1-CD1 3.75Å; I52-F353 HydrophobicContact CD1-CG 3.89Å; I52-F353 HydrophobicContact CG1-CD1 3.96Å; I52-F353 HydrophobicContact CG1-CE1 4.37Å; I52-F353 HydrophobicContact CG1-CG 4.29Å; I52-F353 HydrophobicContact CG2-CD1 3.88Å; I52-F353 HydrophobicContact CG2-CE1 3.89Å
53	V	97.4	Very high	93	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126	-174.8	-178.7	0	0	0	0	110.3	H34 S35 F51 V65 L83 H89 V103 W126	H34-V53 WeakPolarHBondContact CA-O 3.32Å; S35-V53 PolarHBondContact N-O 2.8Å; S35-V53 VanDerWaalsContact N-O 3.12Å; S35-V53 PolarHBondContact O-N 3.44Å; F51-V53 HydrophobicContact CB-CG2 4.37Å; V53-V65 HydrophobicContact CG1-CG2 4.3Å; V53-V65 HydrophobicContact CG2-CG1 4.18Å; V53-V65 HydrophobicContact CG2-CG2 4.23Å; V53-L83 HydrophobicContact CG1-CD2 3.75Å; V53-H89 PolarHBondContact O-CE1 3.35Å; V53-H89 PolarHBondContact O-NE2 2.72Å; V53-V103 HydrophobicContact CG1-CG1 4.14Å; V53-W126 HydrophobicContact CG1-CH2 3.77Å; V53-W126 HydrophobicContact CG1-CZ2 3.64Å; V53-W126 HydrophobicContact CG2-CZ2 4.39Å
54	G	97.4	Very high	93.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.265	C	S	.	.			trans	64.4	-140.8	173.6	0	0	0	0	0	113.6	R31 H34 D64	R31-G54 PolarHBondContact NH1-O 3.46Å; H34-G54 WeakPolarHBondContact CB-O 3.46Å; G54-D64 PolarHBondContact N-O 3.04Å; G54-D64 VanDerWaalsContact N-O 3.14Å
55	G	98.2	Very high	94.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.			trans	98.7	-172.8	-172.6	0	0	0	0	0	112.5	V32 F62 R86 Y87	V32-G55 CarbonylContact O-C 3.43Å; V32-G55 WeakPolarHBondContact O-CA 3.41Å; G55-F62 VanDerWaalsContact O-CD2 3.29Å; G55-F62 WeakPolarHBondContact O-CD2 3.23Å; G55-F62 PolarHBondContact O-N 2.91Å; G55-R86 PolarHBondContact N-O 3.22Å; G55-R86 VanDerWaalsContact O-O 3.11Å; G55-Y87 VanDerWaalsContact C-CB 3.47Å
56	A	97.9	Very high	95.1	Very high	8 Å²	8	41.7 Å²	41.7	7%	0.066	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-147.6	162.9	176.3	0	0	0	0	0	112.5	R31 V32 R60 F62 Y87	R31-A56 VanDerWaalsContact CA-O 3.3Å; R31-A56 WeakPolarHBondContact CA-O 3.22Å; V32-A56 PolarHBondContact N-O 2.84Å; V32-A56 PolarHBondContact O-N 3.17Å; A56-R60 VanDerWaalsContact CA-O 3.3Å; A56-R60 WeakPolarHBondContact CA-O 3.47Å; A56-F62 VanDerWaalsContact C-CE2 3.43Å; A56-Y87 HydrophobicContact CB-CD1 3.63Å; A56-Y87 HydrophobicContact CB-CD2 4.37Å; A56-Y87 HydrophobicContact CB-CE1 4.29Å; A56-Y87 HydrophobicContact CB-CG 3.69Å
57	N	97	Very high	95.9	Very high	41 Å²	41	32.4 Å²	32.4	22%	0.219	17%	0.166	C	C	.	.			trans	-132.5	179.1	161	73.1	10.9	0	0	0	108.2	N59 R60 F62 I362	N57-N59 PolarHBondContact O-N 3.26Å; N57-N59 WeakPolarHBondContact OD1-CA 3.33Å; N57-N59 WeakPolarHBondContact OD1-CB 3.39Å; N57-N59 PolarHBondContact OD1-N 2.92Å; N57-R60 PolarHBondContact N-O 2.98Å; N57-R60 PolarHBondContact O-N 3.38Å; N57-R60 PolarHBondContact OD1-N 3.22Å; N57-F62 HydrophobicContact CB-CE2 4.11Å; N57-F62 HydrophobicContact CB-CZ 4.05Å; N57-F62 WeakPolarHBondContact ND2-CZ 3.34Å; N57-I362 HydrophobicContact CB-CD1 4.3Å
58	P	95.1	Very high	96.2	Very high	116 Å²	116	28.1 Å²	28.1	75%	0.753	15%	0.15	S	C	*	.	S	Bend	trans	-59	-21.1	-177.4	-28	36.8	0	0	0	114.3	I362	P58-I362 VanDerWaalsContact CD-CD1 3.45Å; P58-I362 HydrophobicContact CG-CD1 4.04Å
59	N	95	Very high	96.2	Very high	142 Å²	142	28.7 Å²	28.7	76%	0.759	15%	0.153	S	C	*	.	S	Bend	trans	-89.8	-36.5	-177.5	-58.1	-45.2	0	0	0	112.4	N57	N57-N59 PolarHBondContact O-N 3.26Å; N57-N59 WeakPolarHBondContact OD1-CA 3.33Å; N57-N59 WeakPolarHBondContact OD1-CB 3.39Å; N57-N59 PolarHBondContact OD1-N 2.92Å
60	R	96.4	Very high	96.1	Very high	108 Å²	108	25.9 Å²	25.9	41%	0.408	14%	0.141	S	C	.	.			trans	-159.7	156.5	-175.2	61.5	-175.5	-99.4	-113.5	0.2	114.9	A56 N57 F62 D64 Q109	A56-R60 VanDerWaalsContact CA-O 3.3Å; A56-R60 WeakPolarHBondContact CA-O 3.47Å; N57-R60 PolarHBondContact N-O 2.98Å; N57-R60 PolarHBondContact O-N 3.38Å; N57-R60 PolarHBondContact OD1-N 3.22Å; R60-F62 HydrophobicContact CG-CD1 4.4Å; R60-F62 HydrophobicContact CG-CE1 4.1Å; R60-F62 VanDerWaalsContact NH1-CE1 3.28Å; R60-D64 IonicContact NH2-OD2 3.81Å; R60-D64 PolarHBondContact NH2-OD2 3.39Å; R60-Q109 VanDerWaalsContact CA-NE2 3.3Å
61	S	97.5	Very high	95.8	Very high	6 Å²	6	27.6 Å²	27.6	4%	0.042	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-78.8	136.9	155.1	-47.6	0	0	0	0	110	Y87 N108	S61-Y87 WeakPolarHBondContact OG-CD1 3.4Å; S61-Y87 WeakPolarHBondContact OG-CE1 3.36Å; S61-N108 WeakPolarHBondContact OG-CA 3.49Å
62	F	97.1	Very high	95.5	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.182	C	C	.	.			trans	-87.4	150.8	-179.9	-60.3	-74.4	0	0	0	111.2	C29 R31 G55 A56 N57 R60 P85 R86	C29-F62 WeakPolarHBondContact SG-CE1 3.45Å; C29-F62 WeakPolarHBondContact SG-CZ 3.45Å; R31-F62 HydrophobicContact CB-CD2 4.03Å; R31-F62 HydrophobicContact CB-CE2 3.56Å; R31-F62 HydrophobicContact CB-CZ 4.49Å; G55-F62 VanDerWaalsContact O-CD2 3.29Å; G55-F62 WeakPolarHBondContact O-CD2 3.23Å; G55-F62 PolarHBondContact O-N 2.91Å; A56-F62 VanDerWaalsContact C-CE2 3.43Å; N57-F62 HydrophobicContact CB-CE2 4.11Å; N57-F62 HydrophobicContact CB-CZ 4.05Å; N57-F62 WeakPolarHBondContact ND2-CZ 3.34Å; R60-F62 HydrophobicContact CG-CD1 4.4Å; R60-F62 HydrophobicContact CG-CE1 4.1Å; R60-F62 VanDerWaalsContact NH1-CE1 3.28Å; F62-P85 VanDerWaalsContact O-CA 3.31Å; F62-P85 WeakPolarHBondContact O-CA 3.45Å; F62-R86 PolarHBondContact O-N 2.87Å
63	S	96.2	Very high	95.2	Very high	45 Å²	45	35.3 Å²	35.3	32%	0.315	19%	0.192	S	C	.	.			trans	-132.3	21.8	173.8	60.4	0	0	0	0	110.7	L83	S63-L83 VanDerWaalsContact CB-O 3.31Å; S63-L83 WeakPolarHBondContact CB-O 3.31Å
64	D	95.3	Very high	95	Very high	29 Å²	29	38.3 Å²	38.3	16%	0.155	21%	0.206	C	C	.	.			trans	-99.5	164	178.8	45.4	44	0	0	0	110.8	R31 G54 R60 H66 L77	R31-D64 IonicContact CZ-OD1 2.84Å; R31-D64 IonicContact NH1-OD1 3.75Å; R31-D64 PolarHBondContact NH1-OD1 2.97Å; R31-D64 IonicContact NH2-OD1 3.59Å; G54-D64 PolarHBondContact N-O 3.04Å; G54-D64 VanDerWaalsContact N-O 3.14Å; R60-D64 IonicContact NH2-OD2 3.81Å; R60-D64 PolarHBondContact NH2-OD2 3.39Å; D64-H66 IonicContact OD1-CD2 3.14Å; D64-H66 IonicContact OD1-NE2 3.67Å; D64-L77 HydrophobicContact CB-CD1 4.26Å
65	V	96	Very high	95	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.7	174.3	-179.8	0	0	0	0	106.9	F51 I52 V53 T67 D78 C80 L83 L119 W126	F51-V65 HydrophobicContact CD1-CG1 3.78Å; F51-V65 HydrophobicContact CE1-CG1 4.49Å; I52-V65 WeakPolarHBondContact O-CA 3.15Å; V53-V65 HydrophobicContact CG1-CG2 4.3Å; V53-V65 HydrophobicContact CG2-CG1 4.18Å; V53-V65 HydrophobicContact CG2-CG2 4.23Å; V65-T67 HydrophobicContact CG1-CG2 4.34Å; V65-D78 HydrophobicContact CB-CB 4.42Å; V65-D78 HydrophobicContact CG1-CB 4.4Å; V65-D78 PolarHBondContact O-N 2.86Å; V65-C80 HydrophobicContact CG2-CB 4.21Å; V65-L83 HydrophobicContact CG2-CD2 4.4Å; V65-L119 HydrophobicContact CG1-CD2 4.4Å; V65-W126 HydrophobicContact CG2-CZ2 3.73Å
66	H	96.1	Very high	94.7	Very high	14 Å²	14	40.8 Å²	40.8	7%	0.065	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	140.5	172.4	-66.3	-102.7	0	0	0	108.6	D26 P28 R31 F51 I52 D64 W75	D26-H66 PolarHBondContact O-ND1 2.96Å; P28-H66 HydrophobicContact CB-CB 4.3Å; P28-H66 HydrophobicContact CG-CB 3.66Å; R31-H66 PolarHBondContact NH2-NE2 3.08Å; F51-H66 WeakPolarHBondContact CA-O 3.46Å; I52-H66 HydrophobicContact CB-CB 4.39Å; I52-H66 PolarHBondContact N-O 2.95Å; I52-H66 PolarHBondContact O-N 2.79Å; D64-H66 IonicContact OD1-CD2 3.14Å; D64-H66 IonicContact OD1-NE2 3.67Å; H66-W75 HydrophobicContact CB-CE3 3.93Å; H66-W75 HydrophobicContact CB-CZ3 3.88Å
67	T	95.4	Very high	94.3	Very high	3 Å²	3	44 Å²	44	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	126.3	178.7	65.7	0	0	0	0	111	V50 F51 V65 W75 D76 D78	V50-T67 CarbonylContact O-C 3.4Å; V50-T67 VanDerWaalsContact O-CA 3.24Å; V50-T67 WeakPolarHBondContact O-CA 3.47Å; F51-T67 HydrophobicContact CD1-CG2 3.48Å; F51-T67 VanDerWaalsContact CD1-CG2 3.48Å; F51-T67 HydrophobicContact CE1-CG2 3.37Å; F51-T67 HydrophobicContact CE2-CG2 4.43Å; F51-T67 HydrophobicContact CG-CG2 4.08Å; F51-T67 HydrophobicContact CZ-CG2 3.88Å; V65-T67 HydrophobicContact CG1-CG2 4.34Å; T67-W75 VanDerWaalsContact C-CE3 3.44Å; T67-W75 CarbonylContact O-C 3.55Å; T67-W75 WeakPolarHBondContact O-CA 3.41Å; T67-D76 PolarHBondContact N-O 2.82Å; T67-D76 PolarHBondContact O-N 3.06Å; T67-D78 HydrophobicContact CG2-CB 4.13Å
68	M	95	Very high	93.5	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	109.2	167.5	-176.7	177.1	58.5	0	0	108.5	L21 V23 K49 V50 L70 Q74 W75 L351	L21-M68 HydrophobicContact CD2-CE 4.06Å; L21-M68 HydrophobicContact CD2-SD 3.89Å; V23-M68 HydrophobicContact CB-SD 4.28Å; V23-M68 HydrophobicContact CG1-CG 4.1Å; V23-M68 HydrophobicContact CG1-SD 4.47Å; V23-M68 HydrophobicContact CG2-CG 4.35Å; V23-M68 HydrophobicContact CG2-SD 3.74Å; K49-M68 VanDerWaalsContact CA-O 3.29Å; K49-M68 WeakPolarHBondContact CA-O 3.48Å; V50-M68 HydrophobicContact CB-CB 4.21Å; V50-M68 HydrophobicContact CB-CE 3.83Å; V50-M68 HydrophobicContact CG1-CE 4.47Å; V50-M68 HydrophobicContact CG2-CE 3.57Å; V50-M68 PolarHBondContact N-O 2.89Å; V50-M68 PolarHBondContact O-N 2.99Å; M68-L70 HydrophobicContact CE-CD2 3.61Å; M68-L70 HydrophobicContact CG-CD2 4.33Å; M68-L70 PolarHBondContact O-N 3.05Å; M68-L70 HydrophobicContact SD-CD2 4.33Å; M68-Q74 WeakPolarHBondContact CA-O 3.2Å; M68-W75 HydrophobicContact CB-CD2 3.88Å; M68-W75 HydrophobicContact CB-CE3 3.81Å; M68-W75 HydrophobicContact CB-CH2 3.72Å; M68-W75 HydrophobicContact CB-CZ2 3.79Å; M68-W75 HydrophobicContact CB-CZ3 3.73Å; M68-W75 HydrophobicContact CG-CD2 4.43Å; M68-W75 HydrophobicContact CG-CZ2 4.29Å; M68-W75 HydrophobicContact SD-CZ2 4.04Å; M68-L351 HydrophobicContact CE-CD1 3.35Å
69	D	93.3	Very high	92.6	Very high	14 Å²	14	41.9 Å²	41.9	8%	0.075	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	107.5	175.2	-171.6	-43.6	0	0	0	109.3	K49 G71 K72 H73 Q74	K49-D69 VanDerWaalsContact CE-OD2 3.27Å; K49-D69 WeakPolarHBondContact CE-OD2 3.3Å; K49-D69 HydrophobicContact CG-CB 4.48Å; K49-D69 IonicContact NZ-OD2 2.64Å; D69-G71 PolarHBondContact O-N 2.83Å; D69-G71 WeakPolarHBondContact OD1-CA 3.45Å; D69-G71 PolarHBondContact OD1-N 3.22Å; D69-K72 HydrophobicContact CB-CB 4.14Å; D69-K72 HydrophobicContact CB-CD 4.35Å; D69-K72 HydrophobicContact CB-CG 4.4Å; D69-K72 PolarHBondContact O-N 3.16Å; D69-K72 PolarHBondContact OD1-N 3.01Å; D69-K72 WeakPolarHBondContact OD2-CE 3.06Å; D69-K72 IonicContact OD2-NZ 3.95Å; D69-H73 WeakPolarHBondContact O-CA 3.39Å; D69-H73 PolarHBondContact O-N 2.78Å; D69-Q74 PolarHBondContact N-O 3.19Å; D69-Q74 PolarHBondContact O-N 3.35Å
70	L	92.5	Very high	92.2	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.042	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-16.1	-177.3	-62	-178.8	0	0	0	112.8	Y38 R47 G48 V50 M68 H73 I301	Y38-L70 HydrophobicContact CD2-CD1 4.14Å; Y38-L70 HydrophobicContact CE2-CD1 3.78Å; R47-L70 HydrophobicContact CB-CB 4.18Å; R47-L70 VanDerWaalsContact CD-O 3.29Å; R47-L70 WeakPolarHBondContact CD-O 3.48Å; G48-L70 WeakPolarHBondContact O-CB 3.4Å; G48-L70 PolarHBondContact O-N 2.64Å; V50-L70 HydrophobicContact CG2-CD1 4.5Å; V50-L70 HydrophobicContact CG2-CD2 4.45Å; M68-L70 HydrophobicContact CE-CD2 3.61Å; M68-L70 HydrophobicContact CG-CD2 4.33Å; M68-L70 PolarHBondContact O-N 3.05Å; M68-L70 HydrophobicContact SD-CD2 4.33Å; L70-H73 PolarHBondContact O-CE1 2.89Å; L70-H73 PolarHBondContact O-NE2 3.26Å; L70-I301 HydrophobicContact CD1-CB 4.05Å; L70-I301 HydrophobicContact CD1-CD1 4.44Å; L70-I301 HydrophobicContact CD1-CG2 4.29Å; L70-I301 HydrophobicContact CD2-CD1 4.25Å
71	G	89.6	Confident	91.8	Very high	35 Å²	35	38.1 Å²	38.1	36%	0.361	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-37.3	176.6	0	0	0	0	0	112.7	D69	D69-G71 PolarHBondContact O-N 2.83Å; D69-G71 WeakPolarHBondContact OD1-CA 3.45Å; D69-G71 PolarHBondContact OD1-N 3.22Å
72	K	90.2	Very high	91.7	Very high	123 Å²	123	40.1 Å²	40.1	54%	0.535	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-15.9	177.5	-62.1	179.1	-170.3	173.3	0	113.5	D69 Q74	D69-K72 HydrophobicContact CB-CB 4.14Å; D69-K72 HydrophobicContact CB-CD 4.35Å; D69-K72 HydrophobicContact CB-CG 4.4Å; D69-K72 PolarHBondContact O-N 3.16Å; D69-K72 PolarHBondContact OD1-N 3.01Å; D69-K72 WeakPolarHBondContact OD2-CE 3.06Å; D69-K72 IonicContact OD2-NZ 3.95Å; K72-Q74 VanDerWaalsContact C-N 3.33Å; K72-Q74 HydrophobicContact CB-CB 4.45Å; K72-Q74 HydrophobicContact CB-CG 3.81Å; K72-Q74 HydrophobicContact CD-CG 4.2Å
73	H	90.7	Very high	91.7	Very high	47 Å²	47	40.7 Å²	40.7	22%	0.218	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	52.8	-169.9	-56.1	-77.1	0	0	0	110.9	P9 V23 P24 D69 L70	P9-H73 HydrophobicContact CG-CB 3.89Å; P9-H73 VanDerWaalsContact CG-CG 3.43Å; P9-H73 WeakPolarHBondContact CG-ND1 3.44Å; V23-H73 VanDerWaalsContact CG1-C 3.48Å; V23-H73 WeakPolarHBondContact CG1-O 3.21Å; P24-H73 VanDerWaalsContact CD-O 3.31Å; P24-H73 WeakPolarHBondContact CD-O 3.12Å; P24-H73 WeakPolarHBondContact CG-O 3.26Å; D69-H73 WeakPolarHBondContact O-CA 3.39Å; D69-H73 PolarHBondContact O-N 2.78Å; L70-H73 PolarHBondContact O-CE1 2.89Å; L70-H73 PolarHBondContact O-NE2 3.26Å
74	Q	93.9	Very high	91.7	Very high	63 Å²	63	41.8 Å²	41.8	29%	0.294	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	150.3	177.7	79.5	-175	23.6	0	0	112.2	V23 P24 M68 D69 K72 D76	V23-Q74 VanDerWaalsContact CG1-C 3.46Å; P24-Q74 CarbonylContact O-C 3.57Å; P24-Q74 VanDerWaalsContact O-CA 3.27Å; P24-Q74 WeakPolarHBondContact O-CA 3.07Å; M68-Q74 WeakPolarHBondContact CA-O 3.2Å; D69-Q74 PolarHBondContact N-O 3.19Å; D69-Q74 PolarHBondContact O-N 3.35Å; K72-Q74 VanDerWaalsContact C-N 3.33Å; K72-Q74 HydrophobicContact CB-CB 4.45Å; K72-Q74 HydrophobicContact CB-CG 3.81Å; K72-Q74 HydrophobicContact CD-CG 4.2Å; Q74-D76 PolarHBondContact NE2-OD1 3.17Å; Q74-D76 PolarHBondContact NE2-OD2 3.37Å
75	W	95.7	Very high	91.8	Very high	9 Å²	9	42.5 Å²	42.5	3%	0.034	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.8	164.7	-76.5	103.8	0	0	0	110.5	V23 P24 G25 D26 P28 I52 H66 T67 M68	V23-W75 HydrophobicContact CG1-CG 4.31Å; P24-W75 PolarHBondContact O-N 3Å; G25-W75 WeakPolarHBondContact CA-O 3.49Å; D26-W75 PolarHBondContact N-O 3.48Å; D26-W75 VanDerWaalsContact N-O 3.1Å; P28-W75 HydrophobicContact CG-CE3 4.45Å; P28-W75 HydrophobicContact CG-CH2 4.16Å; P28-W75 HydrophobicContact CG-CZ3 4.04Å; I52-W75 HydrophobicContact CD1-CH2 4.46Å; I52-W75 HydrophobicContact CG1-CH2 3.58Å; I52-W75 HydrophobicContact CG1-CZ3 3.86Å; H66-W75 HydrophobicContact CB-CE3 3.93Å; H66-W75 HydrophobicContact CB-CZ3 3.88Å; T67-W75 VanDerWaalsContact C-CE3 3.44Å; T67-W75 CarbonylContact O-C 3.55Å; T67-W75 WeakPolarHBondContact O-CA 3.41Å; M68-W75 HydrophobicContact CB-CD2 3.88Å; M68-W75 HydrophobicContact CB-CE3 3.81Å; M68-W75 HydrophobicContact CB-CH2 3.72Å; M68-W75 HydrophobicContact CB-CZ2 3.79Å; M68-W75 HydrophobicContact CB-CZ3 3.73Å; M68-W75 HydrophobicContact CG-CD2 4.43Å; M68-W75 HydrophobicContact CG-CZ2 4.29Å; M68-W75 HydrophobicContact SD-CZ2 4.04Å
76	D	92.6	Very high	91.9	Very high	44 Å²	44	42.5 Å²	42.5	24%	0.235	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.5	169.4	-60.3	-53	0	0	0	108.6	T67 Q74 D78	T67-D76 PolarHBondContact N-O 2.82Å; T67-D76 PolarHBondContact O-N 3.06Å; Q74-D76 PolarHBondContact NE2-OD1 3.17Å; Q74-D76 PolarHBondContact NE2-OD2 3.37Å; D76-D78 PolarHBondContact O-N 3.18Å
77	L	90.9	Very high	92	Very high	74 Å²	74	44.8 Å²	44.8	39%	0.387	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	108.1	165.1	175.2	62.1	0	0	0	108.5	D26 D64 T79	D26-L77 HydrophobicContact CB-CB 3.76Å; D64-L77 HydrophobicContact CB-CD1 4.26Å; L77-T79 PolarHBondContact O-N 3.11Å
78	D	79.4	Confident	92.1	Very high	17 Å²	17	46.4 Å²	46.4	9%	0.091	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	106.1	175.8	-159.2	-12.9	0	0	0	109.1	V65 T67 D76 C80 R124	V65-D78 HydrophobicContact CB-CB 4.42Å; V65-D78 HydrophobicContact CG1-CB 4.4Å; V65-D78 PolarHBondContact O-N 2.86Å; T67-D78 HydrophobicContact CG2-CB 4.13Å; D76-D78 PolarHBondContact O-N 3.18Å; D78-C80 PolarHBondContact O-N 2.85Å; D78-C80 PolarHBondContact OD1-SG 2.82Å; D78-R124 WeakPolarHBondContact OD1-CD 3.37Å; D78-R124 WeakPolarHBondContact OD1-CG 3.48Å; D78-R124 IonicContact OD1-CZ 3.81Å; D78-R124 IonicContact OD1-NE 3.53Å; D78-R124 IonicContact OD1-NH1 3.77Å
79	T	77.1	Confident	92.3	Very high	96 Å²	96	46.8 Å²	46.8	59%	0.589	25%	0.253	S	S	*	.			trans	-72.9	73.6	177.7	-53.5	0	0	0	0	109.8	L77	L77-T79 PolarHBondContact O-N 3.11Å
80	C	85	Confident	92.6	Very high	15 Å²	15	46.1 Å²	46.1	10%	0.101	25%	0.249	C	C	.	.			trans	-84.9	121.6	176.6	-67	0	0	0	0	110	V65 D78 L119 R124	V65-C80 HydrophobicContact CG2-CB 4.21Å; D78-C80 PolarHBondContact O-N 2.85Å; D78-C80 PolarHBondContact OD1-SG 2.82Å; C80-L119 HydrophobicContact CB-CD1 4.01Å; C80-L119 WeakPolarHBondContact SG-CD1 3.32Å; C80-R124 VanDerWaalsContact CA-O 3.28Å; C80-R124 WeakPolarHBondContact CA-O 3.11Å
81	K	89	Confident	92.8	Very high	156 Å²	156	47 Å²	47	68%	0.678	26%	0.256	S	S	*	.	B	Isolated β-bridge	trans	-88	139.4	179.9	-65.6	-175.8	-178.2	179	0	111.1	R124 W126	K81-R124 PolarHBondContact N-O 2.91Å; K81-W126 PolarHBondContact O-N 2.85Å
82	G	94.7	Very high	93.2	Very high	48 Å²	48	45.7 Å²	45.7	50%	0.495	24%	0.24	S	C	.	.			trans	105.7	-8.2	166.9	0	0	0	0	0	116.2	L84 Q117	G82-L84 PolarHBondContact O-N 3.03Å; G82-Q117 PolarHBondContact O-NE2 2.96Å
83	L	97.1	Very high	93.5	Very high	12 Å²	12	42.2 Å²	42.2	6%	0.063	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-63.7	127.7	173.9	-176.2	57.3	0	0	0	109.2	V53 S63 V65 R86 V103 W126	V53-L83 HydrophobicContact CG1-CD2 3.75Å; S63-L83 VanDerWaalsContact CB-O 3.31Å; S63-L83 WeakPolarHBondContact CB-O 3.31Å; V65-L83 HydrophobicContact CG2-CD2 4.4Å; L83-R86 HydrophobicContact CD1-CG 4.49Å; L83-V103 HydrophobicContact CD1-CG2 4.09Å; L83-W126 HydrophobicContact CB-CB 4.48Å; L83-W126 HydrophobicContact CB-CD2 4.01Å; L83-W126 HydrophobicContact CB-CG 3.77Å; L83-W126 HydrophobicContact CD1-CD2 3.91Å; L83-W126 HydrophobicContact CD1-CE3 4.06Å; L83-W126 HydrophobicContact CD1-CG 4.47Å; L83-W126 HydrophobicContact CD1-CH2 4.28Å; L83-W126 HydrophobicContact CD1-CZ2 4.13Å; L83-W126 HydrophobicContact CD1-CZ3 4.25Å; L83-W126 HydrophobicContact CD2-CZ2 3.99Å; L83-W126 HydrophobicContact CG-CD2 4.42Å
84	L	97	Very high	93.8	Very high	69 Å²	69	40 Å²	40	36%	0.361	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-77.2	136	170.6	-61.2	176.7	0	0	0	108.8	G82 R86	G82-L84 PolarHBondContact O-N 3.03Å; L84-R86 WeakPolarHBondContact O-CG 3.48Å; L84-R86 PolarHBondContact O-N 3.4Å; L84-R86 PolarHBondContact O-NE 2.79Å
85	P	97.4	Very high	93.9	Very high	44 Å²	44	40.8 Å²	40.8	29%	0.286	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-51.5	127.6	178.3	-26.8	32.6	0	0	0	111.6	F62 N108 R113	F62-P85 VanDerWaalsContact O-CA 3.31Å; F62-P85 WeakPolarHBondContact O-CA 3.45Å; P85-N108 WeakPolarHBondContact O-CB 3.19Å; P85-R113 PolarHBondContact O-NE 3.44Å; P85-R113 PolarHBondContact O-NH2 3.39Å
86	R	97.9	Very high	93.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.			trans	-157.9	153.2	-175.8	64.1	-179.4	67.9	-144.6	4.7	114.1	G55 F62 L83 L84 G105 A107 C115	G55-R86 PolarHBondContact N-O 3.22Å; G55-R86 VanDerWaalsContact O-O 3.11Å; F62-R86 PolarHBondContact O-N 2.87Å; L83-R86 HydrophobicContact CD1-CG 4.49Å; L84-R86 WeakPolarHBondContact O-CG 3.48Å; L84-R86 PolarHBondContact O-N 3.4Å; L84-R86 PolarHBondContact O-NE 2.79Å; R86-G105 PolarHBondContact NH1-O 3.27Å; R86-A107 CarbonylContact C-O 3.59Å; R86-A107 WeakPolarHBondContact CA-O 3.17Å; R86-C115 PolarHBondContact NH1-O 3.11Å; R86-C115 PolarHBondContact NH2-SG 3.31Å
87	Y	98.2	Very high	93.9	Very high	61 Å²	61	42.3 Å²	42.3	24%	0.239	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-141.6	164.5	167.4	61.1	-81.4	0	0	0	109.9	G33 G55 A56 S61 H89 G106 A107	G33-Y87 CarbonylContact O-C 3.51Å; G33-Y87 WeakPolarHBondContact O-CA 3.26Å; G55-Y87 VanDerWaalsContact C-CB 3.47Å; A56-Y87 HydrophobicContact CB-CD1 3.63Å; A56-Y87 HydrophobicContact CB-CD2 4.37Å; A56-Y87 HydrophobicContact CB-CE1 4.29Å; A56-Y87 HydrophobicContact CB-CG 3.69Å; S61-Y87 WeakPolarHBondContact OG-CD1 3.4Å; S61-Y87 WeakPolarHBondContact OG-CE1 3.36Å; Y87-H89 PolarHBondContact O-N 3.2Å; Y87-G106 CarbonylContact O-C 3.53Å; Y87-G106 WeakPolarHBondContact O-CA 3.25Å; Y87-A107 HydrophobicContact CD1-CB 4.47Å; Y87-A107 WeakPolarHBondContact CD1-O 3.45Å; Y87-A107 VanDerWaalsContact CE1-C 3.47Å; Y87-A107 HydrophobicContact CE1-CB 3.88Å; Y87-A107 VanDerWaalsContact CE1-O 3.29Å; Y87-A107 WeakPolarHBondContact CE1-O 3.46Å; Y87-A107 HydrophobicContact CE2-CB 3.91Å; Y87-A107 PolarHBondContact N-O 3.07Å; Y87-A107 PolarHBondContact O-N 2.65Å
88	E	98.1	Very high	94	Very high	37 Å²	37	42.4 Å²	42.4	17%	0.173	25%	0.248	C	C	.	.	S	Bend	trans	49.6	36.8	-175.1	-61.8	174.3	-154.8	0	0	113.3	G33 G106 T140 F141 H142	G33-E88 PolarHBondContact O-N 3.11Å; E88-G106 WeakPolarHBondContact O-CA 3.28Å; E88-T140 HydrophobicContact CB-CG2 4.09Å; E88-T140 WeakPolarHBondContact OE2-CB 3.3Å; E88-T140 WeakPolarHBondContact OE2-CG2 3.36Å; E88-T140 PolarHBondContact OE2-OG1 3.25Å; E88-F141 CarbonylContact O-C 3.58Å; E88-F141 PolarHBondContact O-N 3.14Å; E88-H142 HydrophobicContact CB-CB 4Å; E88-H142 HydrophobicContact CG-CB 3.8Å
89	H	98.5	Very high	94.5	Very high	10 Å²	10	43.4 Å²	43.4	5%	0.046	25%	0.253	C	S	.	.			trans	-82.6	155.1	172.8	53.9	-86.8	0	0	0	111.2	S35 V53 Y87 F104	S35-H89 WeakPolarHBondContact CB-NE2 3.49Å; S35-H89 PolarHBondContact OG-NE2 3.16Å; V53-H89 PolarHBondContact O-CE1 3.35Å; V53-H89 PolarHBondContact O-NE2 2.72Å; Y87-H89 PolarHBondContact O-N 3.2Å; H89-F104 WeakPolarHBondContact CA-O 3.43Å; H89-F104 WeakPolarHBondContact CB-O 3.49Å
90	A	98.5	Very high	95.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	146.7	163.3	0	0	0	0	0	109.3	V103 F104 F141 S145 L152 V154	A90-V103 CarbonylContact O-C 3.53Å; A90-V103 VanDerWaalsContact O-CA 3.24Å; A90-V103 WeakPolarHBondContact O-CA 3.48Å; A90-F104 HydrophobicContact CB-CB 4.26Å; A90-F104 PolarHBondContact N-O 2.86Å; A90-F104 PolarHBondContact O-N 3.02Å; A90-F141 HydrophobicContact CB-CB 3.93Å; A90-F141 HydrophobicContact CB-CD2 4.27Å; A90-F141 HydrophobicContact CB-CG 4.23Å; A90-S145 VanDerWaalsContact CB-OG 3.25Å; A90-S145 WeakPolarHBondContact CB-OG 3.3Å; A90-L152 HydrophobicContact CB-CD1 4.45Å; A90-L152 HydrophobicContact CB-CD2 4.36Å; A90-V154 HydrophobicContact CB-CG1 4.42Å
91	S	97.9	Very high	95.8	Very high	26 Å²	26	40.8 Å²	40.8	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	140.5	174.7	-176.7	0	0	0	0	110.1	S35 W102	S35-S91 VanDerWaalsContact CB-CB 3.47Å; S91-W102 CarbonylContact C-O 3.53Å; S91-W102 VanDerWaalsContact CA-O 3.27Å; S91-W102 WeakPolarHBondContact CA-O 3.5Å
92	F	97.6	Very high	96.3	Very high	8 Å²	8	34.1 Å²	34.1	4%	0.035	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	164	173.4	75.3	-63.2	0	0	0	112.6	P94 W102 A147 L152 F173 A175	F92-P94 HydrophobicContact CD2-CB 4.24Å; F92-P94 HydrophobicContact CE2-CB 3.83Å; F92-P94 HydrophobicContact CE2-CG 4.05Å; F92-W102 HydrophobicContact CD1-CB 3.53Å; F92-W102 HydrophobicContact CD1-CG 4.46Å; F92-W102 HydrophobicContact CE1-CB 3.19Å; F92-W102 HydrophobicContact CE1-CD2 4.27Å; F92-W102 HydrophobicContact CE1-CE3 4.3Å; F92-W102 AromaticContact CE1-CG 3.87Å; F92-W102 HydrophobicContact CE1-CG 3.87Å; F92-W102 HydrophobicContact CG-CB 4.37Å; F92-W102 HydrophobicContact CZ-CB 3.8Å; F92-W102 HydrophobicContact CZ-CD2 4.05Å; F92-W102 HydrophobicContact CZ-CE3 4.09Å; F92-W102 AromaticContact CZ-CG 3.96Å; F92-W102 HydrophobicContact CZ-CG 3.96Å; F92-W102 PolarHBondContact N-O 2.85Å; F92-W102 PolarHBondContact O-N 2.76Å; F92-A147 HydrophobicContact CB-CB 3.65Å; F92-A147 HydrophobicContact CD2-CB 4.01Å; F92-A147 HydrophobicContact CG-CB 4.23Å; F92-L152 HydrophobicContact CB-CD1 4.08Å; F92-L152 HydrophobicContact CD1-CB 3.92Å; F92-L152 HydrophobicContact CD1-CD1 3.9Å; F92-L152 HydrophobicContact CD1-CD2 3.84Å; F92-L152 HydrophobicContact CD1-CG 4.09Å; F92-L152 HydrophobicContact CD2-CB 3.99Å; F92-L152 HydrophobicContact CE1-CB 3.82Å; F92-L152 HydrophobicContact CE1-CD2 3.76Å; F92-L152 HydrophobicContact CE1-CG 4.24Å; F92-L152 HydrophobicContact CE2-CB 3.88Å; F92-L152 HydrophobicContact CG-CB 4.02Å; F92-L152 HydrophobicContact CG-CD1 3.99Å; F92-L152 HydrophobicContact CG-CG 4.44Å; F92-L152 HydrophobicContact CZ-CB 3.83Å; F92-F173 AromaticContact CZ-CD1 3.88Å; F92-F173 HydrophobicContact CZ-CD1 3.88Å; F92-F173 HydrophobicContact CZ-CE1 4.16Å; F92-A175 HydrophobicContact CE2-CB 4.37Å
93	I	96.8	Very high	96.4	Very high	51 Å²	51	31.8 Å²	31.8	26%	0.262	18%	0.177	S	C	.	.			trans	-124	102.3	175.3	-63.2	149.3	0	0	0	106.5	L39 P98 I101	L39-I93 HydrophobicContact CD2-CD1 3.37Å; L39-I93 HydrophobicContact CD2-CG1 3.83Å; L39-I93 HydrophobicContact CD2-CG2 4.14Å; L39-I93 HydrophobicContact CG-CD1 4.43Å; I93-P98 WeakPolarHBondContact CG2-O 3.44Å; I93-I101 HydrophobicContact CG1-CG1 4.23Å
94	P	96.7	Very high	96.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.174	C	C	.	.			trans	-71	145.2	179.6	28.6	-33	0	0	0	111	F92 C96 T97 W102 G149 N150 A175	F92-P94 HydrophobicContact CD2-CB 4.24Å; F92-P94 HydrophobicContact CE2-CB 3.83Å; F92-P94 HydrophobicContact CE2-CG 4.05Å; P94-C96 PolarHBondContact O-N 2.91Å; P94-C96 VanDerWaalsContact O-N 3.13Å; P94-T97 VanDerWaalsContact CG-OG1 3.32Å; P94-T97 WeakPolarHBondContact CG-OG1 3.22Å; P94-T97 CarbonylContact O-C 3.56Å; P94-T97 PolarHBondContact O-N 3.4Å; P94-W102 HydrophobicContact CG-CD2 4.48Å; P94-W102 HydrophobicContact CG-CG 4.36Å; P94-G149 WeakPolarHBondContact CA-O 3.28Å; P94-N150 HydrophobicContact CB-CB 4.48Å; P94-A175 HydrophobicContact CB-CB 3.64Å; P94-A175 HydrophobicContact CG-CB 3.88Å
95	S	95.4	Very high	96.5	Very high	79 Å²	79	28 Å²	28	55%	0.552	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.9	-179.5	-54	0	0	0	0	114.6	G149 N150	S95-G149 PolarHBondContact N-O 3.31Å; S95-G149 WeakPolarHBondContact OG-CA 3.43Å; S95-G149 PolarHBondContact OG-O 2.97Å; S95-N150 WeakPolarHBondContact CA-OD1 3.35Å; S95-N150 PolarHBondContact N-OD1 2.78Å; S95-N150 VanDerWaalsContact N-OD1 3.12Å
96	C	94.5	Very high	96.6	Very high	52 Å²	52	25.9 Å²	25.9	35%	0.351	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-19.9	178.2	64	0	0	0	0	113.5	P94 N150 N176	P94-C96 PolarHBondContact O-N 2.91Å; P94-C96 VanDerWaalsContact O-N 3.13Å; C96-N150 VanDerWaalsContact CB-OD1 3.3Å; C96-N150 WeakPolarHBondContact CB-OD1 3.46Å; C96-N150 PolarHBondContact N-OD1 2.93Å; C96-N150 PolarHBondContact SG-OD1 2.86Å; C96-N150 VanDerWaalsContact SG-OD1 3.39Å; C96-N176 WeakPolarHBondContact CB-OD1 3.44Å; C96-N176 PolarHBondContact SG-OD1 3.04Å; C96-N176 VanDerWaalsContact SG-OD1 3.33Å
97	T	93.9	Very high	96.6	Very high	34 Å²	34	26 Å²	26	21%	0.209	14%	0.144	C	C	.	.	S	Bend	trans	-137.1	68.7	172.9	51.5	0	0	0	0	109.3	P94 D99 R100 W102	P94-T97 VanDerWaalsContact CG-OG1 3.32Å; P94-T97 WeakPolarHBondContact CG-OG1 3.22Å; P94-T97 CarbonylContact O-C 3.56Å; P94-T97 PolarHBondContact O-N 3.4Å; T97-D99 PolarHBondContact O-N 3.02Å; T97-R100 PolarHBondContact O-N 2.95Å; T97-W102 PolarHBondContact OG1-NE1 2.9Å
98	P	92.8	Very high	96.5	Very high	75 Å²	75	24 Å²	24	49%	0.487	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.3	-171.1	31.1	-36.6	0	0	0	113.4	I93	I93-P98 WeakPolarHBondContact CG2-O 3.44Å
99	D	90.7	Very high	96.2	Very high	38 Å²	38	28.3 Å²	28.3	20%	0.203	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-2.3	174.8	67.4	-56.1	0	0	0	112.9	T97 P121	T97-D99 PolarHBondContact O-N 3.02Å; D99-P121 WeakPolarHBondContact O-CD 3.39Å; D99-P121 WeakPolarHBondContact O-CG 3.47Å
100	R	94.2	Very high	95.9	Very high	56 Å²	56	33 Å²	33	21%	0.211	19%	0.192	C	C	.	.			trans	-117.6	140	-173.8	-59.1	-152.1	-164.9	-56.5	8.7	112.7	T97 V118 L119 N120	T97-R100 PolarHBondContact O-N 2.95Å; R100-V118 HydrophobicContact CB-CG1 3.97Å; R100-L119 WeakPolarHBondContact CA-O 3.47Å; R100-L119 WeakPolarHBondContact CB-O 3.35Å; R100-N120 VanDerWaalsContact CZ-CG 3.4Å; R100-N120 PolarHBondContact NH1-ND2 3.01Å; R100-N120 PolarHBondContact NH1-OD1 3.24Å; R100-N120 PolarHBondContact NH2-ND2 2.97Å; R100-N120 VanDerWaalsContact NH2-ND2 3.15Å
101	I	96	Very high	95.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123.5	176.7	-57.8	176	0	0	0	108.5	L39 F51 I93 L119	L39-I101 HydrophobicContact CD1-CD1 4.14Å; L39-I101 HydrophobicContact CD1-CG1 4.11Å; L39-I101 HydrophobicContact CD2-CG1 4.42Å; L39-I101 HydrophobicContact CG-CD1 4.37Å; L39-I101 HydrophobicContact CG-CG1 4.42Å; F51-I101 HydrophobicContact CB-CD1 3.5Å; F51-I101 HydrophobicContact CD1-CD1 3.57Å; F51-I101 HydrophobicContact CD2-CD1 3.79Å; F51-I101 HydrophobicContact CE1-CD1 4.22Å; F51-I101 HydrophobicContact CE2-CD1 4.4Å; F51-I101 HydrophobicContact CG-CD1 3.33Å; I93-I101 HydrophobicContact CG1-CG1 4.23Å; I101-L119 HydrophobicContact CB-CB 4.38Å; I101-L119 PolarHBondContact N-O 2.97Å; I101-L119 PolarHBondContact O-N 3.18Å
102	W	97.8	Very high	95.8	Very high	16 Å²	16	35.6 Å²	35.6	6%	0.061	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	136	179.2	-67.6	62.3	0	0	0	109.4	S91 F92 P94 T97 L116 Q117 V118 P129 F173 A175 L178	S91-W102 CarbonylContact C-O 3.53Å; S91-W102 VanDerWaalsContact CA-O 3.27Å; S91-W102 WeakPolarHBondContact CA-O 3.5Å; F92-W102 HydrophobicContact CD1-CB 3.53Å; F92-W102 HydrophobicContact CD1-CG 4.46Å; F92-W102 HydrophobicContact CE1-CB 3.19Å; F92-W102 HydrophobicContact CE1-CD2 4.27Å; F92-W102 HydrophobicContact CE1-CE3 4.3Å; F92-W102 AromaticContact CE1-CG 3.87Å; F92-W102 HydrophobicContact CE1-CG 3.87Å; F92-W102 HydrophobicContact CG-CB 4.37Å; F92-W102 HydrophobicContact CZ-CB 3.8Å; F92-W102 HydrophobicContact CZ-CD2 4.05Å; F92-W102 HydrophobicContact CZ-CE3 4.09Å; F92-W102 AromaticContact CZ-CG 3.96Å; F92-W102 HydrophobicContact CZ-CG 3.96Å; F92-W102 PolarHBondContact N-O 2.85Å; F92-W102 PolarHBondContact O-N 2.76Å; P94-W102 HydrophobicContact CG-CD2 4.48Å; P94-W102 HydrophobicContact CG-CG 4.36Å; T97-W102 PolarHBondContact OG1-NE1 2.9Å; W102-L116 HydrophobicContact CE3-CD1 4.02Å; W102-L116 HydrophobicContact CE3-CD2 3.64Å; W102-L116 HydrophobicContact CE3-CG 3.86Å; W102-L116 HydrophobicContact CZ3-CD2 3.52Å; W102-L116 HydrophobicContact CZ3-CG 4.15Å; W102-Q117 CarbonylContact C-O 3.56Å; W102-Q117 WeakPolarHBondContact CA-O 3.31Å; W102-V118 HydrophobicContact CD2-CB 4.23Å; W102-V118 HydrophobicContact CD2-CG1 3.99Å; W102-V118 HydrophobicContact CD2-CG2 3.3Å; W102-V118 HydrophobicContact CE3-CG2 3.28Å; W102-V118 HydrophobicContact CG-CG1 4.1Å; W102-V118 HydrophobicContact CG-CG2 3.94Å; W102-V118 HydrophobicContact CH2-CG2 3.7Å; W102-V118 HydrophobicContact CZ2-CG1 4.08Å; W102-V118 HydrophobicContact CZ2-CG2 3.74Å; W102-V118 HydrophobicContact CZ3-CG2 3.48Å; W102-V118 VanDerWaalsContact CZ3-CG2 3.48Å; W102-P129 HydrophobicContact CH2-CG 4.38Å; W102-P129 HydrophobicContact CZ3-CG 3.89Å; W102-F173 AromaticContact CE3-CE1 3.94Å; W102-F173 HydrophobicContact CE3-CE1 3.94Å; W102-F173 HydrophobicContact CE3-CZ 4.5Å; W102-F173 AromaticContact CZ3-CE1 3.65Å; W102-F173 HydrophobicContact CZ3-CE1 3.65Å; W102-F173 AromaticContact CZ3-CZ 3.85Å; W102-F173 HydrophobicContact CZ3-CZ 3.85Å; W102-A175 HydrophobicContact CH2-CB 4.45Å; W102-A175 HydrophobicContact CZ2-CB 4.42Å; W102-L178 HydrophobicContact CH2-CD2 3.63Å; W102-L178 HydrophobicContact CZ3-CD2 4.05Å
103	V	98.2	Very high	95.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	136.8	175.1	-59.5	0	0	0	0	111.4	V53 L83 A90 L116 Q117 W126	V53-V103 HydrophobicContact CG1-CG1 4.14Å; L83-V103 HydrophobicContact CD1-CG2 4.09Å; A90-V103 CarbonylContact O-C 3.53Å; A90-V103 VanDerWaalsContact O-CA 3.24Å; A90-V103 WeakPolarHBondContact O-CA 3.48Å; V103-L116 CarbonylContact O-C 3.48Å; V103-L116 WeakPolarHBondContact O-CA 3.48Å; V103-Q117 HydrophobicContact CG2-CB 3.9Å; V103-Q117 PolarHBondContact N-O 3.41Å; V103-Q117 PolarHBondContact O-N 3.49Å; V103-W126 HydrophobicContact CB-CZ3 4.41Å; V103-W126 HydrophobicContact CG1-CH2 3.83Å; V103-W126 HydrophobicContact CG1-CZ3 4.05Å; V103-W126 HydrophobicContact CG2-CE3 4.34Å; V103-W126 HydrophobicContact CG2-CH2 4.1Å; V103-W126 HydrophobicContact CG2-CZ3 3.61Å
104	F	98.5	Very high	95.8	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.2	-178.4	174.8	-111.3	0	0	0	112.1	H89 A90 N114 L116 P135 P136 F141 L152 V154 W180	H89-F104 WeakPolarHBondContact CA-O 3.43Å; H89-F104 WeakPolarHBondContact CB-O 3.49Å; A90-F104 HydrophobicContact CB-CB 4.26Å; A90-F104 PolarHBondContact N-O 2.86Å; A90-F104 PolarHBondContact O-N 3.02Å; F104-N114 HydrophobicContact CE2-CB 4.47Å; F104-N114 WeakPolarHBondContact CE2-O 3.36Å; F104-L116 HydrophobicContact CB-CD1 3.77Å; F104-L116 HydrophobicContact CD2-CB 4.49Å; F104-L116 HydrophobicContact CD2-CD1 4.26Å; F104-L116 HydrophobicContact CG-CD1 4.43Å; F104-P135 HydrophobicContact CE2-CB 4.12Å; F104-P135 HydrophobicContact CZ-CB 4.28Å; F104-P136 HydrophobicContact CE1-CG 4.03Å; F104-P136 HydrophobicContact CZ-CB 4.35Å; F104-P136 HydrophobicContact CZ-CG 3.86Å; F104-F141 HydrophobicContact CD1-CD2 4.04Å; F104-F141 AromaticContact CD1-CE2 3.52Å; F104-F141 HydrophobicContact CD1-CE2 3.52Å; F104-F141 HydrophobicContact CD1-CZ 4.12Å; F104-F141 HydrophobicContact CE1-CD2 4.2Å; F104-F141 AromaticContact CE1-CE2 3.23Å; F104-F141 HydrophobicContact CE1-CE2 3.23Å; F104-F141 AromaticContact CE1-CZ 3.53Å; F104-F141 HydrophobicContact CE1-CZ 3.53Å; F104-F141 HydrophobicContact CZ-CE2 4.21Å; F104-L152 HydrophobicContact CB-CD2 3.93Å; F104-L152 HydrophobicContact CD1-CD2 4.34Å; F104-L152 HydrophobicContact CG-CD2 4.38Å; F104-V154 HydrophobicContact CD1-CG1 4.3Å; F104-V154 HydrophobicContact CE1-CG2 4.43Å; F104-W180 AromaticContact CD1-CH2 3.63Å; F104-W180 HydrophobicContact CD1-CH2 3.63Å; F104-W180 AromaticContact CD1-CZ2 3.84Å; F104-W180 HydrophobicContact CD1-CZ2 3.84Å; F104-W180 HydrophobicContact CD2-CH2 4.21Å; F104-W180 AromaticContact CD2-CZ2 3.53Å; F104-W180 HydrophobicContact CD2-CZ2 3.53Å; F104-W180 AromaticContact CE1-CH2 3.41Å; F104-W180 HydrophobicContact CE1-CH2 3.41Å; F104-W180 VanDerWaalsContact CE1-CH2 3.41Å; F104-W180 AromaticContact CE1-CZ2 3.62Å; F104-W180 HydrophobicContact CE1-CZ2 3.62Å; F104-W180 HydrophobicContact CE1-CZ3 4.38Å; F104-W180 HydrophobicContact CE2-CH2 4.02Å; F104-W180 AromaticContact CE2-CZ2 3.31Å; F104-W180 HydrophobicContact CE2-CZ2 3.31Å; F104-W180 HydrophobicContact CG-CH2 4.02Å; F104-W180 AromaticContact CG-CZ2 3.79Å; F104-W180 HydrophobicContact CG-CZ2 3.79Å; F104-W180 AromaticContact CZ-CH2 3.65Å; F104-W180 HydrophobicContact CZ-CH2 3.65Å; F104-W180 AromaticContact CZ-CZ2 3.38Å; F104-W180 HydrophobicContact CZ-CZ2 3.38Å
105	G	98.1	Very high	95.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.231	C	C	.	.			trans	64.9	-142.5	175.1	0	0	0	0	0	113.4	R86 R113 C115	R86-G105 PolarHBondContact NH1-O 3.27Å; G105-R113 VanDerWaalsContact CA-O 3.29Å; G105-R113 WeakPolarHBondContact CA-O 3.41Å; G105-C115 PolarHBondContact N-O 3.17Å
106	G	98.2	Very high	96	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.206	C	C	.	.			trans	89.2	-170.9	-173	0	0	0	0	0	112.3	Y87 E88 N112 R113 R139	Y87-G106 CarbonylContact O-C 3.53Å; Y87-G106 WeakPolarHBondContact O-CA 3.25Å; E88-G106 WeakPolarHBondContact O-CA 3.28Å; G106-N112 CarbonylContact O-C 3.56Å; G106-N112 WeakPolarHBondContact O-CA 3.47Å; G106-R113 WeakPolarHBondContact O-CB 3.42Å; G106-R113 PolarHBondContact O-N 2.9Å; G106-R139 PolarHBondContact N-O 2.77Å; G106-R139 VanDerWaalsContact N-O 3.12Å
107	A	97.6	Very high	96.1	Very high	2 Å²	2	33.6 Å²	33.6	2%	0.017	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	162	-179.4	0	0	0	0	0	112	R86 Y87 G111 T140	R86-A107 CarbonylContact C-O 3.59Å; R86-A107 WeakPolarHBondContact CA-O 3.17Å; Y87-A107 HydrophobicContact CD1-CB 4.47Å; Y87-A107 WeakPolarHBondContact CD1-O 3.45Å; Y87-A107 VanDerWaalsContact CE1-C 3.47Å; Y87-A107 HydrophobicContact CE1-CB 3.88Å; Y87-A107 VanDerWaalsContact CE1-O 3.29Å; Y87-A107 WeakPolarHBondContact CE1-O 3.46Å; Y87-A107 HydrophobicContact CE2-CB 3.91Å; Y87-A107 PolarHBondContact N-O 3.07Å; Y87-A107 PolarHBondContact O-N 2.65Å; A107-G111 WeakPolarHBondContact CA-O 3.3Å; A107-T140 HydrophobicContact CB-CG2 3.7Å
108	N	96.2	Very high	96.3	Very high	18 Å²	18	32.3 Å²	32.3	10%	0.096	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	-173.3	165.6	74.9	-12.4	0	0	0	109.5	S61 P85 S110 G111 R113	S61-N108 WeakPolarHBondContact OG-CA 3.49Å; P85-N108 WeakPolarHBondContact O-CB 3.19Å; N108-S110 PolarHBondContact ND2-OG 3.45Å; N108-S110 PolarHBondContact O-N 3.35Å; N108-S110 VanDerWaalsContact O-N 3.13Å; N108-S110 WeakPolarHBondContact OD1-CA 3.41Å; N108-S110 PolarHBondContact OD1-N 3.39Å; N108-S110 PolarHBondContact OD1-OG 3.39Å; N108-G111 PolarHBondContact N-O 3.12Å; N108-G111 PolarHBondContact O-N 2.76Å; N108-G111 VanDerWaalsContact O-N 3.12Å; N108-G111 PolarHBondContact OD1-N 2.93Å; N108-G111 PolarHBondContact OD1-O 3.42Å; N108-R113 PolarHBondContact ND2-NH2 2.94Å
109	Q	91.8	Very high	96.5	Very high	128 Å²	128	28.8 Å²	28.8	60%	0.598	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-20.9	179.1	-54.2	95.6	-24	0	0	114.2	R60	R60-Q109 VanDerWaalsContact CA-NE2 3.3Å
110	S	93.4	Very high	96.5	Very high	109 Å²	109	28.2 Å²	28.2	76%	0.762	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-11.6	177.9	58.4	0	0	0	0	114	N108	N108-S110 PolarHBondContact ND2-OG 3.45Å; N108-S110 PolarHBondContact O-N 3.35Å; N108-S110 VanDerWaalsContact O-N 3.13Å; N108-S110 WeakPolarHBondContact OD1-CA 3.41Å; N108-S110 PolarHBondContact OD1-N 3.39Å; N108-S110 PolarHBondContact OD1-OG 3.39Å
111	G	96.1	Very high	96	Very high	31 Å²	31	27 Å²	27	32%	0.32	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	133.9	-167.3	-179.8	0	0	0	0	0	113.6	A107 N108	A107-G111 WeakPolarHBondContact CA-O 3.3Å; N108-G111 PolarHBondContact N-O 3.12Å; N108-G111 PolarHBondContact O-N 2.76Å; N108-G111 VanDerWaalsContact O-N 3.12Å; N108-G111 PolarHBondContact OD1-N 2.93Å; N108-G111 PolarHBondContact OD1-O 3.42Å
112	N	97.9	Very high	95.4	Very high	50 Å²	50	34 Å²	34	27%	0.267	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	157	-177.3	-61.7	-11	0	0	0	112.1	G106 P138 G158 E159	G106-N112 CarbonylContact O-C 3.56Å; G106-N112 WeakPolarHBondContact O-CA 3.47Å; N112-P138 VanDerWaalsContact CB-C 3.46Å; N112-P138 HydrophobicContact CB-CB 3.72Å; N112-P138 PolarHBondContact ND2-O 3.2Å; N112-G158 PolarHBondContact ND2-O 2.75Å; N112-E159 PolarHBondContact ND2-O 3.14Å
113	R	97.5	Very high	95	Very high	43 Å²	43	36.9 Å²	36.9	16%	0.162	21%	0.208	C	C	.	.			trans	-116.7	157.7	177.5	-58.4	-175.6	174.4	-72.7	7	110.3	P85 G105 G106 N108 P138 R139	P85-R113 PolarHBondContact O-NE 3.44Å; P85-R113 PolarHBondContact O-NH2 3.39Å; G105-R113 VanDerWaalsContact CA-O 3.29Å; G105-R113 WeakPolarHBondContact CA-O 3.41Å; G106-R113 WeakPolarHBondContact O-CB 3.42Å; G106-R113 PolarHBondContact O-N 2.9Å; N108-R113 PolarHBondContact ND2-NH2 2.94Å; R113-P138 WeakPolarHBondContact O-CA 3.15Å; R113-R139 PolarHBondContact O-N 3.17Å
114	N	97.2	Very high	94.7	Very high	61 Å²	61	43.3 Å²	43.3	33%	0.326	23%	0.232	S	C	.	.			trans	-136.8	20.5	166.7	62.9	-12.2	0	0	0	111.5	F104 P135 P136 P138	F104-N114 HydrophobicContact CE2-CB 4.47Å; F104-N114 WeakPolarHBondContact CE2-O 3.36Å; N114-P135 HydrophobicContact CB-CG 4.37Å; N114-P136 WeakPolarHBondContact CB-O 3.4Å; N114-P136 PolarHBondContact ND2-O 3.17Å; N114-P138 HydrophobicContact CB-CB 4.47Å; N114-P138 HydrophobicContact CB-CG 4.18Å
115	C	97	Very high	94.5	Very high	32 Å²	32	45.8 Å²	45.8	22%	0.216	25%	0.248	C	C	.	.			trans	-86	145.6	177	60	0	0	0	0	111.1	R86 G105	R86-C115 PolarHBondContact NH1-O 3.11Å; R86-C115 PolarHBondContact NH2-SG 3.31Å; G105-C115 PolarHBondContact N-O 3.17Å
116	L	97.9	Very high	94.5	Very high	7 Å²	7	46.5 Å²	46.5	4%	0.037	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	136.4	171.9	-167.3	63.8	0	0	0	109.4	W102 V103 F104 T128 P129 V131 F173	W102-L116 HydrophobicContact CE3-CD1 4.02Å; W102-L116 HydrophobicContact CE3-CD2 3.64Å; W102-L116 HydrophobicContact CE3-CG 3.86Å; W102-L116 HydrophobicContact CZ3-CD2 3.52Å; W102-L116 HydrophobicContact CZ3-CG 4.15Å; V103-L116 CarbonylContact O-C 3.48Å; V103-L116 WeakPolarHBondContact O-CA 3.48Å; F104-L116 HydrophobicContact CB-CD1 3.77Å; F104-L116 HydrophobicContact CD2-CB 4.49Å; F104-L116 HydrophobicContact CD2-CD1 4.26Å; F104-L116 HydrophobicContact CG-CD1 4.43Å; L116-T128 WeakPolarHBondContact O-CG2 3.49Å; L116-P129 HydrophobicContact CB-CG 4.39Å; L116-P129 HydrophobicContact CD2-CG 3.76Å; L116-P129 HydrophobicContact CG-CG 4.1Å; L116-V131 HydrophobicContact CD2-CG2 4.16Å; L116-F173 HydrophobicContact CD2-CD1 4.22Å; L116-F173 HydrophobicContact CD2-CD2 4.33Å; L116-F173 HydrophobicContact CD2-CE1 3.53Å; L116-F173 HydrophobicContact CD2-CE2 3.66Å; L116-F173 HydrophobicContact CD2-CZ 3.21Å
117	Q	98	Very high	94.4	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	146.9	169.2	-62	-167	-88.8	0	0	110.7	G82 W102 V103 W126 T127	G82-Q117 PolarHBondContact O-NE2 2.96Å; W102-Q117 CarbonylContact C-O 3.56Å; W102-Q117 WeakPolarHBondContact CA-O 3.31Å; V103-Q117 HydrophobicContact CG2-CB 3.9Å; V103-Q117 PolarHBondContact N-O 3.41Å; V103-Q117 PolarHBondContact O-N 3.49Å; Q117-W126 HydrophobicContact CB-CE3 3.73Å; Q117-W126 HydrophobicContact CB-CZ3 4.26Å; Q117-T127 CarbonylContact C-O 3.2Å; Q117-T127 VanDerWaalsContact CA-O 3.22Å; Q117-T127 WeakPolarHBondContact CA-O 3.27Å
118	V	97.3	Very high	94.4	Very high	8 Å²	8	54.2 Å²	54.2	5%	0.048	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126	-177	-171.6	0	0	0	0	109.6	R100 W102 W126 T127 P129	R100-V118 HydrophobicContact CB-CG1 3.97Å; W102-V118 HydrophobicContact CD2-CB 4.23Å; W102-V118 HydrophobicContact CD2-CG1 3.99Å; W102-V118 HydrophobicContact CD2-CG2 3.3Å; W102-V118 HydrophobicContact CE3-CG2 3.28Å; W102-V118 HydrophobicContact CG-CG1 4.1Å; W102-V118 HydrophobicContact CG-CG2 3.94Å; W102-V118 HydrophobicContact CH2-CG2 3.7Å; W102-V118 HydrophobicContact CZ2-CG1 4.08Å; W102-V118 HydrophobicContact CZ2-CG2 3.74Å; W102-V118 HydrophobicContact CZ3-CG2 3.48Å; W102-V118 VanDerWaalsContact CZ3-CG2 3.48Å; V118-W126 VanDerWaalsContact C-CE3 3.4Å; V118-W126 CarbonylContact O-C 3.6Å; V118-W126 VanDerWaalsContact O-CA 3.25Å; V118-W126 WeakPolarHBondContact O-CA 3.47Å; V118-T127 PolarHBondContact N-O 2.82Å; V118-T127 PolarHBondContact O-N 3.11Å; V118-P129 HydrophobicContact CG2-CG 4.08Å
119	L	96.4	Very high	94.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	125.5	169.9	176.9	58.3	0	0	0	109.2	F51 V65 C80 R100 I101 P121 W126	F51-L119 HydrophobicContact CD1-CD2 4.29Å; F51-L119 HydrophobicContact CE1-CD2 4.22Å; V65-L119 HydrophobicContact CG1-CD2 4.4Å; C80-L119 HydrophobicContact CB-CD1 4.01Å; C80-L119 WeakPolarHBondContact SG-CD1 3.32Å; R100-L119 WeakPolarHBondContact CA-O 3.47Å; R100-L119 WeakPolarHBondContact CB-O 3.35Å; I101-L119 HydrophobicContact CB-CB 4.38Å; I101-L119 PolarHBondContact N-O 2.97Å; I101-L119 PolarHBondContact O-N 3.18Å; L119-P121 HydrophobicContact CD2-CG 4.34Å; L119-P121 HydrophobicContact CG-CG 4.15Å; L119-P121 WeakPolarHBondContact O-CD 3.38Å; L119-W126 HydrophobicContact CB-CD2 3.9Å; L119-W126 HydrophobicContact CB-CE3 3.9Å; L119-W126 HydrophobicContact CB-CH2 3.67Å; L119-W126 HydrophobicContact CB-CZ2 3.67Å; L119-W126 HydrophobicContact CB-CZ3 3.77Å; L119-W126 HydrophobicContact CD1-CD2 4.44Å; L119-W126 HydrophobicContact CD2-CZ2 4.05Å; L119-W126 HydrophobicContact CG-CZ2 4.29Å; L119-W126 VanDerWaalsContact N-CE3 3.31Å
120	N	90.8	Very high	94.5	Very high	26 Å²	26	56.9 Å²	56.9	14%	0.139	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	106.8	157.6	176.3	-14	0	0	0	108.1	R100 E122 T123 R124 T125	R100-N120 VanDerWaalsContact CZ-CG 3.4Å; R100-N120 PolarHBondContact NH1-ND2 3.01Å; R100-N120 PolarHBondContact NH1-OD1 3.24Å; R100-N120 PolarHBondContact NH2-ND2 2.97Å; R100-N120 VanDerWaalsContact NH2-ND2 3.15Å; N120-E122 VanDerWaalsContact C-N 3.26Å; N120-E122 PolarHBondContact O-N 3.11Å; N120-E122 WeakPolarHBondContact OD1-CB 3.39Å; N120-E122 PolarHBondContact OD1-N 2.8Å; N120-T123 VanDerWaalsContact CB-OG1 3.29Å; N120-T123 WeakPolarHBondContact CB-OG1 3.46Å; N120-T123 WeakPolarHBondContact ND2-CG2 3.42Å; N120-T123 PolarHBondContact ND2-OG1 2.9Å; N120-T123 PolarHBondContact O-N 3Å; N120-T123 PolarHBondContact OD1-N 2.83Å; N120-R124 WeakPolarHBondContact O-CA 3.24Å; N120-R124 PolarHBondContact O-N 3.17Å; N120-T125 PolarHBondContact N-O 2.96Å; N120-T125 PolarHBondContact O-N 2.68Å
121	P	84.1	Confident	94.6	Very high	31 Å²	31	53.8 Å²	53.8	20%	0.201	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.7	-179	-23.9	36.7	0	0	0	114	L39 D99 L119	L39-P121 HydrophobicContact CD1-CG 4.34Å; D99-P121 WeakPolarHBondContact O-CD 3.39Å; D99-P121 WeakPolarHBondContact O-CG 3.47Å; L119-P121 HydrophobicContact CD2-CG 4.34Å; L119-P121 HydrophobicContact CG-CG 4.15Å; L119-P121 WeakPolarHBondContact O-CD 3.38Å
122	E	84.4	Confident	94.2	Very high	146 Å²	146	58.5 Å²	58.5	68%	0.682	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-44.1	177.5	-56.9	-177.9	149	0	0	111.2	N120	N120-E122 VanDerWaalsContact C-N 3.26Å; N120-E122 PolarHBondContact O-N 3.11Å; N120-E122 WeakPolarHBondContact OD1-CB 3.39Å; N120-E122 PolarHBondContact OD1-N 2.8Å
123	T	89.3	Confident	94	Very high	77 Å²	77	57 Å²	57	47%	0.472	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-10.4	179.5	62.3	0	0	0	0	113.3	N120 T125	N120-T123 VanDerWaalsContact CB-OG1 3.29Å; N120-T123 WeakPolarHBondContact CB-OG1 3.46Å; N120-T123 WeakPolarHBondContact ND2-CG2 3.42Å; N120-T123 PolarHBondContact ND2-OG1 2.9Å; N120-T123 PolarHBondContact O-N 3Å; N120-T123 PolarHBondContact OD1-N 2.83Å; T123-T125 VanDerWaalsContact C-N 3.26Å; T123-T125 PolarHBondContact O-N 2.86Å; T123-T125 PolarHBondContact OG1-OG1 2.92Å
124	R	90.6	Very high	93.9	Very high	136 Å²	136	60.3 Å²	60.3	51%	0.513	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	43.1	-175.5	-57	179.6	-179.8	-161.5	1.6	112.6	D78 C80 K81 N120	D78-R124 WeakPolarHBondContact OD1-CD 3.37Å; D78-R124 WeakPolarHBondContact OD1-CG 3.48Å; D78-R124 IonicContact OD1-CZ 3.81Å; D78-R124 IonicContact OD1-NE 3.53Å; D78-R124 IonicContact OD1-NH1 3.77Å; C80-R124 VanDerWaalsContact CA-O 3.28Å; C80-R124 WeakPolarHBondContact CA-O 3.11Å; K81-R124 PolarHBondContact N-O 2.91Å; N120-R124 WeakPolarHBondContact O-CA 3.24Å; N120-R124 PolarHBondContact O-N 3.17Å
125	T	94.9	Very high	93.9	Very high	53 Å²	53	59.7 Å²	59.7	33%	0.325	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.4	-179.1	54.3	0	0	0	0	111.1	N120 T123	N120-T125 PolarHBondContact N-O 2.96Å; N120-T125 PolarHBondContact O-N 2.68Å; T123-T125 VanDerWaalsContact C-N 3.26Å; T123-T125 PolarHBondContact O-N 2.86Å; T123-T125 PolarHBondContact OG1-OG1 2.92Å
126	W	97.6	Very high	93.9	Very high	14 Å²	14	58.3 Å²	58.3	5%	0.053	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.2	166.2	-69.6	88.3	0	0	0	110.1	V53 V65 K81 L83 V103 Q117 V118 L119	V53-W126 HydrophobicContact CG1-CH2 3.77Å; V53-W126 HydrophobicContact CG1-CZ2 3.64Å; V53-W126 HydrophobicContact CG2-CZ2 4.39Å; V65-W126 HydrophobicContact CG2-CZ2 3.73Å; K81-W126 PolarHBondContact O-N 2.85Å; L83-W126 HydrophobicContact CB-CB 4.48Å; L83-W126 HydrophobicContact CB-CD2 4.01Å; L83-W126 HydrophobicContact CB-CG 3.77Å; L83-W126 HydrophobicContact CD1-CD2 3.91Å; L83-W126 HydrophobicContact CD1-CE3 4.06Å; L83-W126 HydrophobicContact CD1-CG 4.47Å; L83-W126 HydrophobicContact CD1-CH2 4.28Å; L83-W126 HydrophobicContact CD1-CZ2 4.13Å; L83-W126 HydrophobicContact CD1-CZ3 4.25Å; L83-W126 HydrophobicContact CD2-CZ2 3.99Å; L83-W126 HydrophobicContact CG-CD2 4.42Å; V103-W126 HydrophobicContact CB-CZ3 4.41Å; V103-W126 HydrophobicContact CG1-CH2 3.83Å; V103-W126 HydrophobicContact CG1-CZ3 4.05Å; V103-W126 HydrophobicContact CG2-CE3 4.34Å; V103-W126 HydrophobicContact CG2-CH2 4.1Å; V103-W126 HydrophobicContact CG2-CZ3 3.61Å; Q117-W126 HydrophobicContact CB-CE3 3.73Å; Q117-W126 HydrophobicContact CB-CZ3 4.26Å; V118-W126 VanDerWaalsContact C-CE3 3.4Å; V118-W126 CarbonylContact O-C 3.6Å; V118-W126 VanDerWaalsContact O-CA 3.25Å; V118-W126 WeakPolarHBondContact O-CA 3.47Å; L119-W126 HydrophobicContact CB-CD2 3.9Å; L119-W126 HydrophobicContact CB-CE3 3.9Å; L119-W126 HydrophobicContact CB-CH2 3.67Å; L119-W126 HydrophobicContact CB-CZ2 3.67Å; L119-W126 HydrophobicContact CB-CZ3 3.77Å; L119-W126 HydrophobicContact CD1-CD2 4.44Å; L119-W126 HydrophobicContact CD2-CZ2 4.05Å; L119-W126 HydrophobicContact CG-CZ2 4.29Å; L119-W126 VanDerWaalsContact N-CE3 3.31Å
127	T	96.9	Very high	93.9	Very high	78 Å²	78	60.7 Å²	60.7	48%	0.479	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	157.7	173	59.3	0	0	0	0	110.3	Q117 V118	Q117-T127 CarbonylContact C-O 3.2Å; Q117-T127 VanDerWaalsContact CA-O 3.22Å; Q117-T127 WeakPolarHBondContact CA-O 3.27Å; V118-T127 PolarHBondContact N-O 2.82Å; V118-T127 PolarHBondContact O-N 3.11Å
128	T	96.9	Very high	93.9	Very high	86 Å²	86	63.3 Å²	63.3	53%	0.528	36%	0.356	S	S	.	.			trans	-106.2	109.1	170.7	-60.1	0	0	0	0	106.8	L116	L116-T128 WeakPolarHBondContact O-CG2 3.49Å
129	P	95.7	Very high	93.9	Very high	25 Å²	25	63 Å²	63	16%	0.162	35%	0.354	C	S	.	.			trans	-66.6	147.6	177.3	28.6	-34.4	0	0	0	110.1	W102 L116 V118 V131 L178	W102-P129 HydrophobicContact CH2-CG 4.38Å; W102-P129 HydrophobicContact CZ3-CG 3.89Å; L116-P129 HydrophobicContact CB-CG 4.39Å; L116-P129 HydrophobicContact CD2-CG 3.76Å; L116-P129 HydrophobicContact CG-CG 4.1Å; V118-P129 HydrophobicContact CG2-CG 4.08Å; P129-V131 PolarHBondContact O-N 3.27Å; P129-L178 HydrophobicContact CB-CD1 4.33Å; P129-L178 HydrophobicContact CB-CD2 4.3Å
130	E	95.1	Very high	94	Very high	177 Å²	177	63.6 Å²	63.6	83%	0.827	36%	0.357	S	S	*	.			trans	-74.7	113	173.7	-66.2	-170.2	163.1	0	0	109.5
131	V	94.7	Very high	94.3	Very high	44 Å²	44	62.4 Å²	62.4	27%	0.267	35%	0.351	S	S	.	.			trans	-108.9	119.4	179.3	175.1	0	0	0	0	107.8	L116 P129 S133 F173 L178	L116-V131 HydrophobicContact CD2-CG2 4.16Å; P129-V131 PolarHBondContact O-N 3.27Å; V131-S133 WeakPolarHBondContact CG1-O 3.36Å; V131-S133 WeakPolarHBondContact CG1-OG 3.3Å; V131-F173 HydrophobicContact CG1-CE2 4.3Å; V131-F173 HydrophobicContact CG2-CE2 3.87Å; V131-F173 HydrophobicContact CG2-CZ 4.39Å; V131-L178 WeakPolarHBondContact CG1-O 3.3Å
132	T	87.5	Confident	94.8	Very high	130 Å²	130	61.2 Å²	61.2	80%	0.798	34%	0.342	S	S	*	.			trans	-86.6	-21.8	-172.7	51.5	0	0	0	0	113.4
133	S	95.2	Very high	95.3	Very high	19 Å²	19	55.8 Å²	55.8	13%	0.133	32%	0.319	C	S	.	.	S	Bend	trans	-88	151.5	176.8	57.1	0	0	0	0	112.3	V131 T179 W180	V131-S133 WeakPolarHBondContact CG1-O 3.36Å; V131-S133 WeakPolarHBondContact CG1-OG 3.3Å; S133-T179 WeakPolarHBondContact OG-CA 3.17Å; S133-W180 PolarHBondContact OG-N 3.02Å
134	P	95.3	Very high	95.7	Very high	112 Å²	112	52.1 Å²	52.1	73%	0.727	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-68	126.2	175.7	28.1	-33.5	0	0	0	111.7	W180	P134-W180 WeakPolarHBondContact O-CB 3.39Å
135	P	96.9	Very high	96.1	Very high	49 Å²	49	46.4 Å²	46.4	32%	0.318	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-72.7	166.7	170.9	32.3	-35.9	0	0	0	111.4	F104 N114 W180	F104-P135 HydrophobicContact CE2-CB 4.12Å; F104-P135 HydrophobicContact CZ-CB 4.28Å; N114-P135 HydrophobicContact CB-CG 4.37Å; P135-W180 HydrophobicContact CB-CG 4.41Å
136	P	97.2	Very high	96.2	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.013	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-49.4	157.7	163.1	-18.8	21.7	0	0	0	112.7	F104 N114 V154 H171 W180	F104-P136 HydrophobicContact CE1-CG 4.03Å; F104-P136 HydrophobicContact CZ-CB 4.35Å; F104-P136 HydrophobicContact CZ-CG 3.86Å; N114-P136 WeakPolarHBondContact CB-O 3.4Å; N114-P136 PolarHBondContact ND2-O 3.17Å; P136-V154 HydrophobicContact CG-CG2 4.04Å; P136-H171 HydrophobicContact CG-CB 3.73Å; P136-W180 HydrophobicContact CG-CE3 4.06Å; P136-W180 HydrophobicContact CG-CH2 4.24Å; P136-W180 HydrophobicContact CG-CZ3 3.91Å
137	S	97.4	Very high	96.2	Very high	58 Å²	58	45.3 Å²	45.3	41%	0.406	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-59.7	153.1	173.3	67.1	0	0	0	0	111.5	R139	S137-R139 WeakPolarHBondContact O-CG 3.44Å; S137-R139 PolarHBondContact O-N 3.04Å; S137-R139 VanDerWaalsContact O-N 3.17Å; S137-R139 PolarHBondContact O-NE 3.35Å; S137-R139 VanDerWaalsContact O-NE 3.1Å; S137-R139 PolarHBondContact OG-NE 3.48Å; S137-R139 PolarHBondContact OG-NH2 3.34Å
138	P	98	Very high	96.3	Very high	58 Å²	58	43.3 Å²	43.3	38%	0.377	26%	0.263	S	S	.	.	S	Bend	trans	-53.6	120	177.1	-25.6	34.2	0	0	0	112.8	N112 R113 N114	N112-P138 VanDerWaalsContact CB-C 3.46Å; N112-P138 HydrophobicContact CB-CB 3.72Å; N112-P138 PolarHBondContact ND2-O 3.2Å; R113-P138 WeakPolarHBondContact O-CA 3.15Å; N114-P138 HydrophobicContact CB-CB 4.47Å; N114-P138 HydrophobicContact CB-CG 4.18Å
139	R	98.1	Very high	96.3	Very high	3 Å²	3	41 Å²	41	1%	0.011	26%	0.256	C	S	.	.			trans	-157.7	165.5	-176.3	68.5	-173.4	72.9	177.1	0.6	112.4	G106 R113 S137 F141 G156 G158 V165 D167	G106-R139 PolarHBondContact N-O 2.77Å; G106-R139 VanDerWaalsContact N-O 3.12Å; R113-R139 PolarHBondContact O-N 3.17Å; S137-R139 WeakPolarHBondContact O-CG 3.44Å; S137-R139 PolarHBondContact O-N 3.04Å; S137-R139 VanDerWaalsContact O-N 3.17Å; S137-R139 PolarHBondContact O-NE 3.35Å; S137-R139 VanDerWaalsContact O-NE 3.1Å; S137-R139 PolarHBondContact OG-NE 3.48Å; S137-R139 PolarHBondContact OG-NH2 3.34Å; R139-F141 HydrophobicContact CG-CD1 4.44Å; R139-F141 HydrophobicContact CG-CD2 4.28Å; R139-F141 HydrophobicContact CG-CE1 3.69Å; R139-F141 HydrophobicContact CG-CE2 3.52Å; R139-F141 HydrophobicContact CG-CZ 3.19Å; R139-G156 WeakPolarHBondContact CD-O 3.49Å; R139-G156 PolarHBondContact NH1-O 2.83Å; R139-G158 VanDerWaalsContact CA-O 3.29Å; R139-G158 WeakPolarHBondContact CA-O 3.39Å; R139-G158 VanDerWaalsContact CB-O 3.29Å; R139-G158 WeakPolarHBondContact CB-O 3.01Å; R139-V165 HydrophobicContact CB-CG1 3.81Å; R139-V165 VanDerWaalsContact NH1-CG2 3.31Å; R139-D167 IonicContact CZ-OD2 3.34Å; R139-D167 IonicContact NH1-OD2 2.97Å; R139-D167 PolarHBondContact NH1-OD2 3.28Å; R139-D167 IonicContact NH2-OD2 2.79Å; R139-D167 PolarHBondContact NH2-OD2 3.38Å
140	T	98.2	Very high	96.4	Very high	11 Å²	11	41.5 Å²	41.5	7%	0.067	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-93.6	149.5	171.3	73.2	0	0	0	0	111.8	E88 A107 G157 G158	E88-T140 HydrophobicContact CB-CG2 4.09Å; E88-T140 WeakPolarHBondContact OE2-CB 3.3Å; E88-T140 WeakPolarHBondContact OE2-CG2 3.36Å; E88-T140 PolarHBondContact OE2-OG1 3.25Å; A107-T140 HydrophobicContact CB-CG2 3.7Å; T140-G157 CarbonylContact O-C 3.57Å; T140-G157 WeakPolarHBondContact O-CA 3.27Å; T140-G158 PolarHBondContact N-O 2.89Å; T140-G158 VanDerWaalsContact N-O 3.07Å; T140-G158 PolarHBondContact O-N 2.9Å; T140-G158 WeakPolarHBondContact OG1-CA 3.43Å; T140-G158 PolarHBondContact OG1-N 3.16Å
141	F	96.5	Very high	96.5	Very high	1 Å²	1	36 Å²	36	0%	0.004	23%	0.232	C	C	.	.			trans	-131.5	40.8	-176	-63.8	-72.6	0	0	0	111.2	E88 A90 F104 R139 T143 S144 V154	E88-F141 CarbonylContact O-C 3.58Å; E88-F141 PolarHBondContact O-N 3.14Å; A90-F141 HydrophobicContact CB-CB 3.93Å; A90-F141 HydrophobicContact CB-CD2 4.27Å; A90-F141 HydrophobicContact CB-CG 4.23Å; F104-F141 HydrophobicContact CD1-CD2 4.04Å; F104-F141 AromaticContact CD1-CE2 3.52Å; F104-F141 HydrophobicContact CD1-CE2 3.52Å; F104-F141 HydrophobicContact CD1-CZ 4.12Å; F104-F141 HydrophobicContact CE1-CD2 4.2Å; F104-F141 AromaticContact CE1-CE2 3.23Å; F104-F141 HydrophobicContact CE1-CE2 3.23Å; F104-F141 AromaticContact CE1-CZ 3.53Å; F104-F141 HydrophobicContact CE1-CZ 3.53Å; F104-F141 HydrophobicContact CZ-CE2 4.21Å; R139-F141 HydrophobicContact CG-CD1 4.44Å; R139-F141 HydrophobicContact CG-CD2 4.28Å; R139-F141 HydrophobicContact CG-CE1 3.69Å; R139-F141 HydrophobicContact CG-CE2 3.52Å; R139-F141 HydrophobicContact CG-CZ 3.19Å; F141-T143 PolarHBondContact O-N 2.95Å; F141-S144 PolarHBondContact O-N 3.2Å; F141-V154 HydrophobicContact CD1-CB 3.88Å; F141-V154 HydrophobicContact CD1-CG1 4.1Å; F141-V154 HydrophobicContact CE1-CB 3.46Å; F141-V154 VanDerWaalsContact CE1-CB 3.46Å; F141-V154 HydrophobicContact CE1-CG1 3.98Å; F141-V154 HydrophobicContact CE1-CG2 3.78Å; F141-V154 HydrophobicContact CZ-CB 4.01Å; F141-V154 HydrophobicContact CZ-CG1 4.28Å; F141-V154 HydrophobicContact CZ-CG2 3.92Å
142	H	94	Very high	96.7	Very high	6 Å²	6	34 Å²	34	3%	0.028	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	100.4	177.6	-173.7	65	0	0	0	110.9	E88 S144 D295 H296	E88-H142 HydrophobicContact CB-CB 4Å; E88-H142 HydrophobicContact CG-CB 3.8Å; H142-S144 PolarHBondContact O-N 2.95Å; H142-S144 PolarHBondContact O-OG 3.47Å; H142-D295 IonicContact CD2-OD1 3.21Å; H142-D295 WeakPolarHBondContact CE1-CA 3.25Å; H142-D295 IonicContact CE1-OD1 2.79Å; H142-D295 IonicContact CG-OD1 3.54Å; H142-D295 IonicContact ND1-OD1 3.6Å; H142-D295 IonicContact NE2-OD1 2.69Å; H142-H296 PolarHBondContact CE1-O 2.79Å; H142-H296 VanDerWaalsContact CE1-O 3.27Å
143	T	96.1	Very high	97.3	Very high	32 Å²	32	28 Å²	28	20%	0.196	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	8.2	-172.2	72.2	0	0	0	0	116.1	F141 S145 H196 V197 M198 H246 S247	F141-T143 PolarHBondContact O-N 2.95Å; T143-S145 PolarHBondContact O-N 3.17Å; T143-S145 VanDerWaalsContact O-N 3.14Å; T143-H196 CarbonylContact C-O 3.47Å; T143-H196 PolarHBondContact OG1-O 3.21Å; T143-V197 CarbonylContact O-C 3.59Å; T143-V197 WeakPolarHBondContact O-CA 3.26Å; T143-V197 WeakPolarHBondContact OG1-CG1 3.36Å; T143-M198 PolarHBondContact O-N 3.22Å; T143-H246 PolarHBondContact OG1-O 3.07Å; T143-H246 VanDerWaalsContact OG1-O 3.04Å; T143-S247 WeakPolarHBondContact CG2-OG 3.46Å
144	S	96.9	Very high	97.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	18%	0.176	C	C	.	.			trans	-88.7	34.5	-176.9	-51.2	0	0	0	0	112.7	F141 H142 H196	F141-S144 PolarHBondContact O-N 3.2Å; H142-S144 PolarHBondContact O-N 2.95Å; H142-S144 PolarHBondContact O-OG 3.47Å; S144-H196 WeakPolarHBondContact CA-O 3.29Å; S144-H196 VanDerWaalsContact CB-CE1 3.43Å; S144-H196 WeakPolarHBondContact CB-CE1 3.38Å; S144-H196 WeakPolarHBondContact CB-NE2 3.29Å; S144-H196 PolarHBondContact N-O 2.78Å; S144-H196 PolarHBondContact OG-CE1 3.17Å; S144-H196 PolarHBondContact OG-ND1 2.74Å; S144-H196 PolarHBondContact OG-O 2.7Å
145	S	98.2	Very high	97.6	Very high	17 Å²	17	21.8 Å²	21.8	12%	0.119	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	145.9	-179.2	66.8	0	0	0	0	111.4	A90 T143 Y153 M198	A90-S145 VanDerWaalsContact CB-OG 3.25Å; A90-S145 WeakPolarHBondContact CB-OG 3.3Å; T143-S145 PolarHBondContact O-N 3.17Å; T143-S145 VanDerWaalsContact O-N 3.14Å; S145-Y153 VanDerWaalsContact CA-O 3.27Å; S145-Y153 WeakPolarHBondContact CA-O 3.48Å; S145-M198 VanDerWaalsContact O-O 3.14Å
146	A	98.3	Very high	97.6	Very high	9 Å²	9	19.5 Å²	19.5	7%	0.074	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.3	175	0	0	0	0	0	110.7	Y153 M198 A200 L205	A146-Y153 PolarHBondContact N-O 2.96Å; A146-Y153 WeakPolarHBondContact O-CB 3.05Å; A146-Y153 PolarHBondContact O-N 2.93Å; A146-M198 HydrophobicContact CB-CB 4.48Å; A146-M198 HydrophobicContact CB-CG 3.92Å; A146-M198 HydrophobicContact CB-SD 4.21Å; A146-A200 HydrophobicContact CB-CB 4.11Å; A146-L205 HydrophobicContact CB-CD2 3.89Å
147	A	97.9	Very high	97.6	Very high	35 Å²	35	19.4 Å²	19.4	29%	0.289	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.5	179.1	0	0	0	0	0	111.8	F92 Q151 A200	F92-A147 HydrophobicContact CB-CB 3.65Å; F92-A147 HydrophobicContact CD2-CB 4.01Å; F92-A147 HydrophobicContact CG-CB 4.23Å; A147-Q151 WeakPolarHBondContact CA-O 3.44Å; A147-A200 WeakPolarHBondContact O-CB 3.39Å
148	I	97.8	Very high	97.7	Very high	36 Å²	36	16.8 Å²	16.8	19%	0.185	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	116.9	170.3	-60.8	171.3	0	0	0	107.5	N150 Q151 Y153 A200 L205 I225	I148-N150 PolarHBondContact O-N 2.82Å; I148-Q151 PolarHBondContact N-O 2.85Å; I148-Q151 PolarHBondContact O-N 3.43Å; I148-Q151 VanDerWaalsContact O-N 3.09Å; I148-Y153 HydrophobicContact CB-CE2 3.99Å; I148-Y153 HydrophobicContact CD1-CE2 4.48Å; I148-Y153 HydrophobicContact CG1-CE2 4.36Å; I148-A200 HydrophobicContact CD1-CB 4.12Å; I148-A200 HydrophobicContact CG1-CB 3.62Å; I148-L205 HydrophobicContact CD1-CD2 3.52Å; I148-L205 HydrophobicContact CD1-CG 4.13Å; I148-L205 HydrophobicContact CG1-CD2 4.05Å; I148-I225 HydrophobicContact CB-CD1 4.15Å; I148-I225 HydrophobicContact CD1-CD1 3.83Å; I148-I225 HydrophobicContact CD1-CG1 4.37Å; I148-I225 HydrophobicContact CD1-CG2 3.85Å; I148-I225 HydrophobicContact CG2-CD1 3.7Å
149	G	97.3	Very high	97.6	Very high	37 Å²	37	19.1 Å²	19.1	38%	0.381	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	-115.3	-176.8	0	0	0	0	0	112.1	P94 S95	P94-G149 WeakPolarHBondContact CA-O 3.28Å; S95-G149 PolarHBondContact N-O 3.31Å; S95-G149 WeakPolarHBondContact OG-CA 3.43Å; S95-G149 PolarHBondContact OG-O 2.97Å
150	N	97.6	Very high	97.4	Very high	36 Å²	36	29.2 Å²	29.2	19%	0.193	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	0.2	179.1	-59.5	-46.1	0	0	0	113.5	P94 S95 C96 I148 A175 N176	P94-N150 HydrophobicContact CB-CB 4.48Å; S95-N150 WeakPolarHBondContact CA-OD1 3.35Å; S95-N150 PolarHBondContact N-OD1 2.78Å; S95-N150 VanDerWaalsContact N-OD1 3.12Å; C96-N150 VanDerWaalsContact CB-OD1 3.3Å; C96-N150 WeakPolarHBondContact CB-OD1 3.46Å; C96-N150 PolarHBondContact N-OD1 2.93Å; C96-N150 PolarHBondContact SG-OD1 2.86Å; C96-N150 VanDerWaalsContact SG-OD1 3.39Å; I148-N150 PolarHBondContact O-N 2.82Å; N150-A175 HydrophobicContact CB-CB 4.47Å; N150-A175 WeakPolarHBondContact O-CB 3.38Å; N150-A175 PolarHBondContact O-N 3.24Å; N150-N176 PolarHBondContact ND2-ND2 2.81Å
151	Q	98.4	Very high	97	Very high	62 Å²	62	32 Å²	32	29%	0.29	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.2	-169.7	-67.9	179.6	19.5	0	0	111.1	A147 I148 Y153 V172 F173 D174	A147-Q151 WeakPolarHBondContact CA-O 3.44Å; I148-Q151 PolarHBondContact N-O 2.85Å; I148-Q151 PolarHBondContact O-N 3.43Å; I148-Q151 VanDerWaalsContact O-N 3.09Å; Q151-Y153 HydrophobicContact CB-CD2 4.36Å; Q151-Y153 HydrophobicContact CB-CE2 3.6Å; Q151-Y153 WeakPolarHBondContact O-CD2 3.25Å; Q151-Y153 PolarHBondContact OE1-OH 3.1Å; Q151-V172 HydrophobicContact CB-CG1 3.85Å; Q151-V172 HydrophobicContact CG-CG1 4.1Å; Q151-F173 CarbonylContact C-O 3.47Å; Q151-F173 WeakPolarHBondContact CA-O 3.35Å; Q151-D174 HydrophobicContact CG-CB 4.16Å; Q151-D174 PolarHBondContact NE2-OD2 3.4Å
152	L	98.6	Very high	96.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	125	168.2	172.6	70.5	0	0	0	108.7	A90 F92 F104 V154 V172 F173 W180	A90-L152 HydrophobicContact CB-CD1 4.45Å; A90-L152 HydrophobicContact CB-CD2 4.36Å; F92-L152 HydrophobicContact CB-CD1 4.08Å; F92-L152 HydrophobicContact CD1-CB 3.92Å; F92-L152 HydrophobicContact CD1-CD1 3.9Å; F92-L152 HydrophobicContact CD1-CD2 3.84Å; F92-L152 HydrophobicContact CD1-CG 4.09Å; F92-L152 HydrophobicContact CD2-CB 3.99Å; F92-L152 HydrophobicContact CE1-CB 3.82Å; F92-L152 HydrophobicContact CE1-CD2 3.76Å; F92-L152 HydrophobicContact CE1-CG 4.24Å; F92-L152 HydrophobicContact CE2-CB 3.88Å; F92-L152 HydrophobicContact CG-CB 4.02Å; F92-L152 HydrophobicContact CG-CD1 3.99Å; F92-L152 HydrophobicContact CG-CG 4.44Å; F92-L152 HydrophobicContact CZ-CB 3.83Å; F104-L152 HydrophobicContact CB-CD2 3.93Å; F104-L152 HydrophobicContact CD1-CD2 4.34Å; F104-L152 HydrophobicContact CG-CD2 4.38Å; L152-V154 HydrophobicContact CD1-CG1 4.4Å; L152-V154 HydrophobicContact CD2-CG1 4.18Å; L152-V154 HydrophobicContact CG-CG1 4.06Å; L152-V172 CarbonylContact O-C 3.39Å; L152-V172 WeakPolarHBondContact O-CA 3.27Å; L152-F173 HydrophobicContact CB-CB 4.29Å; L152-F173 PolarHBondContact N-O 2.83Å; L152-F173 PolarHBondContact O-N 3.39Å; L152-W180 HydrophobicContact CD2-CH2 4.24Å
153	Y	98.6	Very high	96.8	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.7	175.6	-62.9	-98.2	0	0	0	109.2	S145 A146 I148 Q151 L170 V172 L205 I225 M228	S145-Y153 VanDerWaalsContact CA-O 3.27Å; S145-Y153 WeakPolarHBondContact CA-O 3.48Å; A146-Y153 PolarHBondContact N-O 2.96Å; A146-Y153 WeakPolarHBondContact O-CB 3.05Å; A146-Y153 PolarHBondContact O-N 2.93Å; I148-Y153 HydrophobicContact CB-CE2 3.99Å; I148-Y153 HydrophobicContact CD1-CE2 4.48Å; I148-Y153 HydrophobicContact CG1-CE2 4.36Å; Q151-Y153 HydrophobicContact CB-CD2 4.36Å; Q151-Y153 HydrophobicContact CB-CE2 3.6Å; Q151-Y153 WeakPolarHBondContact O-CD2 3.25Å; Q151-Y153 PolarHBondContact OE1-OH 3.1Å; Y153-L170 HydrophobicContact CD1-CD1 4.25Å; Y153-L170 HydrophobicContact CD1-CD2 4.03Å; Y153-L170 HydrophobicContact CD1-CG 4.28Å; Y153-L170 HydrophobicContact CE1-CD2 4.5Å; Y153-V172 HydrophobicContact CD1-CB 4.46Å; Y153-V172 HydrophobicContact CD1-CG1 4.25Å; Y153-V172 HydrophobicContact CD1-CG2 3.53Å; Y153-V172 HydrophobicContact CE1-CB 4.46Å; Y153-V172 HydrophobicContact CE1-CG1 3.97Å; Y153-V172 HydrophobicContact CE1-CG2 3.61Å; Y153-V172 HydrophobicContact CG-CG2 4.47Å; Y153-L205 HydrophobicContact CD1-CD1 3.5Å; Y153-L205 VanDerWaalsContact CD1-CD1 3.5Å; Y153-L205 HydrophobicContact CD2-CD1 4.16Å; Y153-L205 HydrophobicContact CD2-CD2 4.37Å; Y153-L205 HydrophobicContact CE1-CD1 4.13Å; Y153-L205 HydrophobicContact CG-CD1 3.5Å; Y153-L205 HydrophobicContact CG-CD2 4.43Å; Y153-I225 HydrophobicContact CE1-CG2 3.78Å; Y153-I225 HydrophobicContact CE2-CG2 4.5Å; Y153-M228 HydrophobicContact CE1-CE 4.36Å
154	V	98.6	Very high	96.9	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	141.4	173.8	-56.9	0	0	0	0	110.7	A90 F104 P136 F141 L152 H171 W180	A90-V154 HydrophobicContact CB-CG1 4.42Å; F104-V154 HydrophobicContact CD1-CG1 4.3Å; F104-V154 HydrophobicContact CE1-CG2 4.43Å; P136-V154 HydrophobicContact CG-CG2 4.04Å; F141-V154 HydrophobicContact CD1-CB 3.88Å; F141-V154 HydrophobicContact CD1-CG1 4.1Å; F141-V154 HydrophobicContact CE1-CB 3.46Å; F141-V154 VanDerWaalsContact CE1-CB 3.46Å; F141-V154 HydrophobicContact CE1-CG1 3.98Å; F141-V154 HydrophobicContact CE1-CG2 3.78Å; F141-V154 HydrophobicContact CZ-CB 4.01Å; F141-V154 HydrophobicContact CZ-CG1 4.28Å; F141-V154 HydrophobicContact CZ-CG2 3.92Å; L152-V154 HydrophobicContact CD1-CG1 4.4Å; L152-V154 HydrophobicContact CD2-CG1 4.18Å; L152-V154 HydrophobicContact CG-CG1 4.06Å; V154-H171 HydrophobicContact CG2-CB 3.76Å; V154-H171 PolarHBondContact N-O 2.97Å; V154-H171 PolarHBondContact O-N 2.83Å; V154-W180 HydrophobicContact CG2-CH2 4.25Å; V154-W180 HydrophobicContact CG2-CZ3 3.91Å
155	F	98.3	Very high	96.9	Very high	1 Å²	1	37 Å²	37	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	139	-178.4	-178.8	-87.6	0	0	0	110.2	T168 L170 P189 P190 H196 M198 I207 W230	F155-T168 VanDerWaalsContact CE2-O 3.25Å; F155-T168 WeakPolarHBondContact CE2-O 3.4Å; F155-L170 HydrophobicContact CB-CD1 4.26Å; F155-P189 HydrophobicContact CE2-CB 3.89Å; F155-P189 HydrophobicContact CZ-CB 3.94Å; F155-P190 HydrophobicContact CD1-CG 4.48Å; F155-P190 HydrophobicContact CE1-CB 3.84Å; F155-P190 HydrophobicContact CE1-CG 3.74Å; F155-P190 HydrophobicContact CZ-CB 4.14Å; F155-P190 HydrophobicContact CZ-CG 3.95Å; F155-P190 WeakPolarHBondContact CZ-O 3.42Å; F155-H196 PolarHBondContact O-CE1 2.99Å; F155-H196 PolarHBondContact O-NE2 3.07Å; F155-M198 HydrophobicContact CB-CE 3.95Å; F155-I207 HydrophobicContact CB-CD1 4.12Å; F155-I207 HydrophobicContact CD1-CD1 3.7Å; F155-I207 HydrophobicContact CE1-CD1 4.35Å; F155-I207 HydrophobicContact CG-CD1 3.93Å; F155-W230 AromaticContact CD2-CH2 3.88Å; F155-W230 HydrophobicContact CD2-CH2 3.88Å; F155-W230 AromaticContact CD2-CZ2 3.69Å; F155-W230 HydrophobicContact CD2-CZ2 3.69Å; F155-W230 HydrophobicContact CE2-CH2 4.17Å; F155-W230 AromaticContact CE2-CZ2 3.8Å; F155-W230 HydrophobicContact CE2-CZ2 3.8Å; F155-W230 HydrophobicContact CG-CH2 4.26Å
156	G	97.8	Very high	96.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.235	C	C	.	.			trans	59	-138.1	-178.1	0	0	0	0	0	112.6	R139 V165	R139-G156 WeakPolarHBondContact CD-O 3.49Å; R139-G156 PolarHBondContact NH1-O 2.83Å; G156-V165 VanDerWaalsContact C-CG2 3.45Å; G156-V165 WeakPolarHBondContact O-CG2 3.16Å
157	G	98.1	Very high	96.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.242	C	C	.	.			trans	118.3	168.7	177.4	0	0	0	0	0	113.8	T140 P164 V165 R193 H194	T140-G157 CarbonylContact O-C 3.57Å; T140-G157 WeakPolarHBondContact O-CA 3.27Å; G157-P164 VanDerWaalsContact O-CA 3.27Å; G157-P164 WeakPolarHBondContact O-CA 3.4Å; G157-V165 WeakPolarHBondContact O-CG2 3.38Å; G157-V165 PolarHBondContact O-N 3.42Å; G157-R193 PolarHBondContact N-O 3.35Å; G157-R193 VanDerWaalsContact N-O 3.08Å; G157-H194 VanDerWaalsContact C-CB 3.49Å
158	G	97.7	Very high	96.7	Very high	4 Å²	4	44.7 Å²	44.7	4%	0.041	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	132.8	-178.2	0	0	0	0	0	112.6	N112 R139 T140	N112-G158 PolarHBondContact ND2-O 2.75Å; R139-G158 VanDerWaalsContact CA-O 3.29Å; R139-G158 WeakPolarHBondContact CA-O 3.39Å; R139-G158 VanDerWaalsContact CB-O 3.29Å; R139-G158 WeakPolarHBondContact CB-O 3.01Å; T140-G158 PolarHBondContact N-O 2.89Å; T140-G158 VanDerWaalsContact N-O 3.07Å; T140-G158 PolarHBondContact O-N 2.9Å; T140-G158 WeakPolarHBondContact OG1-CA 3.43Å; T140-G158 PolarHBondContact OG1-N 3.16Å
159	E	97.1	Very high	96.7	Very high	107 Å²	107	48.1 Å²	48.1	50%	0.5	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-59.4	170.5	-177.3	173.2	-144.8	0	0	110.5	N112 Q163 V165	N112-E159 PolarHBondContact ND2-O 3.14Å; E159-Q163 WeakPolarHBondContact CB-O 3.38Å; E159-Q163 PolarHBondContact N-O 3.32Å; E159-V165 HydrophobicContact CB-CG1 3.88Å
160	R	93.3	Very high	96.7	Very high	214 Å²	214	46.5 Å²	46.5	81%	0.808	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-160.2	129.3	178.8	-176.3	177	-179.1	-119.1	-0.5	111.4	A162 Q163	R160-A162 PolarHBondContact O-N 2.71Å; R160-Q163 PolarHBondContact N-O 2.81Å; R160-Q163 WeakPolarHBondContact O-CB 3.44Å; R160-Q163 PolarHBondContact O-N 3.21Å
161	G	89.5	Confident	96.7	Very high	69 Å²	69	45.1 Å²	45.1	71%	0.711	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	-128	-179.2	0	0	0	0	0	110.7	Q163 H194	G161-Q163 VanDerWaalsContact C-N 3.28Å; G161-Q163 PolarHBondContact O-N 2.69Å; G161-H194 PolarHBondContact O-CE1 2.98Å
162	A	91	Very high	96.7	Very high	40 Å²	40	42.4 Å²	42.4	33%	0.331	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	7.2	177.3	0	0	0	0	0	114.5	R160 H194 L211 G213	R160-A162 PolarHBondContact O-N 2.71Å; A162-H194 VanDerWaalsContact C-NE2 3.33Å; A162-H194 WeakPolarHBondContact CA-NE2 3.41Å; A162-H194 PolarHBondContact O-NE2 2.79Å; A162-L211 HydrophobicContact CB-CD2 4.1Å; A162-G213 PolarHBondContact O-N 3.2Å
163	Q	95.9	Very high	96.7	Very high	97 Å²	97	42.4 Å²	42.4	45%	0.453	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123.2	-177.8	-62.5	-58.2	-44	0	0	110.9	E159 R160 G161	E159-Q163 WeakPolarHBondContact CB-O 3.38Å; E159-Q163 PolarHBondContact N-O 3.32Å; R160-Q163 PolarHBondContact N-O 2.81Å; R160-Q163 WeakPolarHBondContact O-CB 3.44Å; R160-Q163 PolarHBondContact O-N 3.21Å; G161-Q163 VanDerWaalsContact C-N 3.28Å; G161-Q163 PolarHBondContact O-N 2.69Å
164	P	97.9	Very high	96.7	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.013	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	159	171.4	35	-35.6	0	0	0	111.2	G157 Q166 P192 H194 A212	G157-P164 VanDerWaalsContact O-CA 3.27Å; G157-P164 WeakPolarHBondContact O-CA 3.4Å; P164-Q166 PolarHBondContact O-NE2 3.23Å; P164-Q166 VanDerWaalsContact O-NE2 3.15Å; P164-P192 HydrophobicContact CB-CB 4.47Å; P164-P192 HydrophobicContact CG-CB 3.97Å; P164-H194 HydrophobicContact CB-CB 4.18Å; P164-A212 HydrophobicContact CG-CB 3.87Å
165	V	97.9	Very high	96.6	Very high	5 Å²	5	44 Å²	44	3%	0.03	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-60.3	143.4	163.8	-62.2	0	0	0	0	110.3	R139 G156 G157 E159 D167 P192	R139-V165 HydrophobicContact CB-CG1 3.81Å; R139-V165 VanDerWaalsContact NH1-CG2 3.31Å; G156-V165 VanDerWaalsContact C-CG2 3.45Å; G156-V165 WeakPolarHBondContact O-CG2 3.16Å; G157-V165 WeakPolarHBondContact O-CG2 3.38Å; G157-V165 PolarHBondContact O-N 3.42Å; E159-V165 HydrophobicContact CB-CG1 3.88Å; V165-D167 HydrophobicContact CG2-CB 4.44Å; V165-D167 PolarHBondContact O-N 2.86Å; V165-P192 WeakPolarHBondContact O-CB 3.27Å
166	Q	97.4	Very high	96.5	Very high	130 Å²	130	48.4 Å²	48.4	61%	0.607	25%	0.253	S	S	*	.	S	Bend	trans	-79.9	-5	179.4	-59.2	-55.2	-58.3	0	0	113.8	P164 T168	P164-Q166 PolarHBondContact O-NE2 3.23Å; P164-Q166 VanDerWaalsContact O-NE2 3.15Å; Q166-T168 PolarHBondContact O-N 3.36Å
167	D	95.8	Very high	96.5	Very high	40 Å²	40	52.3 Å²	52.3	21%	0.214	28%	0.277	C	S	.	.			trans	-75.6	113	179.7	170.5	26	0	0	0	111.4	R139 V165 K169 H171	R139-D167 IonicContact CZ-OD2 3.34Å; R139-D167 IonicContact NH1-OD2 2.97Å; R139-D167 PolarHBondContact NH1-OD2 3.28Å; R139-D167 IonicContact NH2-OD2 2.79Å; R139-D167 PolarHBondContact NH2-OD2 3.38Å; V165-D167 HydrophobicContact CG2-CB 4.44Å; V165-D167 PolarHBondContact O-N 2.86Å; D167-K169 WeakPolarHBondContact OD1-CB 3.35Å; D167-K169 PolarHBondContact OD1-N 2.96Å; D167-H171 IonicContact OD1-NE2 3.59Å; D167-H171 IonicContact OD2-CD2 3.75Å; D167-H171 IonicContact OD2-CE1 3.43Å; D167-H171 PolarHBondContact OD2-CE1 2.83Å; D167-H171 IonicContact OD2-NE2 2.68Å; D167-H171 PolarHBondContact OD2-NE2 2.96Å
168	T	95.9	Very high	96.4	Very high	53 Å²	53	54.9 Å²	54.9	33%	0.325	29%	0.29	S	S	.	.			trans	-102.5	19.6	178.9	63.6	0	0	0	0	112.7	F155 Q166 P192	F155-T168 VanDerWaalsContact CE2-O 3.25Å; F155-T168 WeakPolarHBondContact CE2-O 3.4Å; Q166-T168 PolarHBondContact O-N 3.36Å; T168-P192 HydrophobicContact CG2-CG 3.76Å
169	K	97.4	Very high	96.4	Very high	109 Å²	109	56.8 Å²	56.8	47%	0.474	30%	0.301	S	S	.	.			trans	-83.8	146.2	174.2	-62.7	-172.2	179	-172	0	110.6	D167 H171 Q182	D167-K169 WeakPolarHBondContact OD1-CB 3.35Å; D167-K169 PolarHBondContact OD1-N 2.96Å; K169-H171 PolarHBondContact O-CD2 2.9Å; K169-H171 VanDerWaalsContact O-CD2 3.25Å; K169-Q182 HydrophobicContact CD-CG 4.38Å
170	L	98.1	Very high	96.5	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	125.9	164.1	-174.2	62.6	0	0	0	108.3	Y153 F155 V172 P183 T185 M198 I223 M228 W230	Y153-L170 HydrophobicContact CD1-CD1 4.25Å; Y153-L170 HydrophobicContact CD1-CD2 4.03Å; Y153-L170 HydrophobicContact CD1-CG 4.28Å; Y153-L170 HydrophobicContact CE1-CD2 4.5Å; F155-L170 HydrophobicContact CB-CD1 4.26Å; L170-V172 HydrophobicContact CG-CG2 4.25Å; L170-P183 HydrophobicContact CD2-CG 4.32Å; L170-T185 HydrophobicContact CB-CG2 4.16Å; L170-T185 HydrophobicContact CD2-CG2 4.37Å; L170-M198 HydrophobicContact CD1-CE 3.8Å; L170-I223 HydrophobicContact CD2-CD1 4.22Å; L170-M228 HydrophobicContact CD2-SD 4.23Å; L170-W230 HydrophobicContact CB-CZ2 4.28Å; L170-W230 HydrophobicContact CD1-CZ2 4.44Å
171	H	98.4	Very high	96.7	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.037	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.2	173.1	-58.4	-114.6	0	0	0	109.3	P136 V154 D167 K169 W180 Q182	P136-H171 HydrophobicContact CG-CB 3.73Å; V154-H171 HydrophobicContact CG2-CB 3.76Å; V154-H171 PolarHBondContact N-O 2.97Å; V154-H171 PolarHBondContact O-N 2.83Å; D167-H171 IonicContact OD1-NE2 3.59Å; D167-H171 IonicContact OD2-CD2 3.75Å; D167-H171 IonicContact OD2-CE1 3.43Å; D167-H171 PolarHBondContact OD2-CE1 2.83Å; D167-H171 IonicContact OD2-NE2 2.68Å; D167-H171 PolarHBondContact OD2-NE2 2.96Å; K169-H171 PolarHBondContact O-CD2 2.9Å; K169-H171 VanDerWaalsContact O-CD2 3.25Å; H171-W180 HydrophobicContact CB-CE3 3.98Å; H171-W180 HydrophobicContact CB-CZ3 3.98Å; H171-Q182 PolarHBondContact CE1-NE2 3.23Å; H171-Q182 PolarHBondContact ND1-NE2 3.38Å
172	V	98.4	Very high	97.1	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.024	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.5	-175.1	-173.2	0	0	0	0	109.1	Q151 L152 Y153 L170 W180 S181 P183	Q151-V172 HydrophobicContact CB-CG1 3.85Å; Q151-V172 HydrophobicContact CG-CG1 4.1Å; L152-V172 CarbonylContact O-C 3.39Å; L152-V172 WeakPolarHBondContact O-CA 3.27Å; Y153-V172 HydrophobicContact CD1-CB 4.46Å; Y153-V172 HydrophobicContact CD1-CG1 4.25Å; Y153-V172 HydrophobicContact CD1-CG2 3.53Å; Y153-V172 HydrophobicContact CE1-CB 4.46Å; Y153-V172 HydrophobicContact CE1-CG1 3.97Å; Y153-V172 HydrophobicContact CE1-CG2 3.61Å; Y153-V172 HydrophobicContact CG-CG2 4.47Å; L170-V172 HydrophobicContact CG-CG2 4.25Å; V172-W180 CarbonylContact O-C 3.58Å; V172-W180 VanDerWaalsContact O-CA 3.28Å; V172-W180 WeakPolarHBondContact O-CA 3.38Å; V172-S181 PolarHBondContact N-O 3.28Å; V172-S181 PolarHBondContact O-N 3.32Å; V172-S181 PolarHBondContact O-OG 3.01Å; V172-P183 HydrophobicContact CG2-CG 3.79Å
173	F	98.6	Very high	97.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.9	170.3	176.9	-99.6	0	0	0	109.8	F92 W102 L116 V131 Q151 L152 A175 L178 T179 W180	F92-F173 AromaticContact CZ-CD1 3.88Å; F92-F173 HydrophobicContact CZ-CD1 3.88Å; F92-F173 HydrophobicContact CZ-CE1 4.16Å; W102-F173 AromaticContact CE3-CE1 3.94Å; W102-F173 HydrophobicContact CE3-CE1 3.94Å; W102-F173 HydrophobicContact CE3-CZ 4.5Å; W102-F173 AromaticContact CZ3-CE1 3.65Å; W102-F173 HydrophobicContact CZ3-CE1 3.65Å; W102-F173 AromaticContact CZ3-CZ 3.85Å; W102-F173 HydrophobicContact CZ3-CZ 3.85Å; L116-F173 HydrophobicContact CD2-CD1 4.22Å; L116-F173 HydrophobicContact CD2-CD2 4.33Å; L116-F173 HydrophobicContact CD2-CE1 3.53Å; L116-F173 HydrophobicContact CD2-CE2 3.66Å; L116-F173 HydrophobicContact CD2-CZ 3.21Å; V131-F173 HydrophobicContact CG1-CE2 4.3Å; V131-F173 HydrophobicContact CG2-CE2 3.87Å; V131-F173 HydrophobicContact CG2-CZ 4.39Å; Q151-F173 CarbonylContact C-O 3.47Å; Q151-F173 WeakPolarHBondContact CA-O 3.35Å; L152-F173 HydrophobicContact CB-CB 4.29Å; L152-F173 PolarHBondContact N-O 2.83Å; L152-F173 PolarHBondContact O-N 3.39Å; F173-A175 HydrophobicContact CE1-CB 4.15Å; F173-L178 HydrophobicContact CZ-CB 4.5Å; F173-L178 HydrophobicContact CZ-CD2 3.97Å; F173-T179 WeakPolarHBondContact CA-O 3.42Å; F173-W180 HydrophobicContact CB-CD2 3.75Å; F173-W180 HydrophobicContact CB-CE3 3.69Å; F173-W180 HydrophobicContact CB-CH2 3.6Å; F173-W180 HydrophobicContact CB-CZ2 3.64Å; F173-W180 HydrophobicContact CB-CZ3 3.62Å; F173-W180 AromaticContact CD2-CD1 3.83Å; F173-W180 HydrophobicContact CD2-CD2 4.02Å; F173-W180 AromaticContact CD2-CE2 3.67Å; F173-W180 HydrophobicContact CD2-CG 4.1Å; F173-W180 HydrophobicContact CD2-CZ2 4.15Å; F173-W180 AromaticContact CD2-NE1 3.53Å; F173-W180 HydrophobicContact CG-CD2 4.35Å; F173-W180 HydrophobicContact CG-CH2 4.49Å; F173-W180 HydrophobicContact CG-CZ2 4.07Å
174	D	97.9	Very high	97.4	Very high	30 Å²	30	50.6 Å²	50.6	16%	0.16	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.1	174.3	-168.6	-44.1	0	0	0	110.4	Q151 N176 T177 L178 T179	Q151-D174 HydrophobicContact CG-CB 4.16Å; Q151-D174 PolarHBondContact NE2-OD2 3.4Å; D174-N176 VanDerWaalsContact C-N 3.26Å; D174-N176 PolarHBondContact O-N 3.3Å; D174-N176 VanDerWaalsContact OD1-CB 3.27Å; D174-N176 WeakPolarHBondContact OD1-CB 3.37Å; D174-N176 PolarHBondContact OD1-N 3.42Å; D174-T177 PolarHBondContact O-N 3.29Å; D174-L178 WeakPolarHBondContact O-CA 3.31Å; D174-L178 PolarHBondContact O-N 2.89Å; D174-T179 PolarHBondContact N-O 3Å; D174-T179 PolarHBondContact O-N 3.44Å
175	A	97.3	Very high	97.4	Very high	9 Å²	9	52.6 Å²	52.6	7%	0.074	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-16.8	-178.5	0	0	0	0	0	114.1	F92 P94 W102 N150 F173	F92-A175 HydrophobicContact CE2-CB 4.37Å; P94-A175 HydrophobicContact CB-CB 3.64Å; P94-A175 HydrophobicContact CG-CB 3.88Å; W102-A175 HydrophobicContact CH2-CB 4.45Å; W102-A175 HydrophobicContact CZ2-CB 4.42Å; N150-A175 HydrophobicContact CB-CB 4.47Å; N150-A175 WeakPolarHBondContact O-CB 3.38Å; N150-A175 PolarHBondContact O-N 3.24Å; F173-A175 HydrophobicContact CE1-CB 4.15Å
176	N	95.7	Very high	97.4	Very high	94 Å²	94	57.5 Å²	57.5	50%	0.503	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-41.7	174.9	-69.5	-33.9	0	0	0	111.9	C96 N150 D174	C96-N176 WeakPolarHBondContact CB-OD1 3.44Å; C96-N176 PolarHBondContact SG-OD1 3.04Å; C96-N176 VanDerWaalsContact SG-OD1 3.33Å; N150-N176 PolarHBondContact ND2-ND2 2.81Å; D174-N176 VanDerWaalsContact C-N 3.26Å; D174-N176 PolarHBondContact O-N 3.3Å; D174-N176 VanDerWaalsContact OD1-CB 3.27Å; D174-N176 WeakPolarHBondContact OD1-CB 3.37Å; D174-N176 PolarHBondContact OD1-N 3.42Å
177	T	96.3	Very high	97.3	Very high	82 Å²	82	53.4 Å²	53.4	50%	0.503	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-12	-176.3	59.4	0	0	0	0	112.7	D174 T179	D174-T177 PolarHBondContact O-N 3.29Å; T177-T179 VanDerWaalsContact C-N 3.29Å; T177-T179 PolarHBondContact O-N 3.14Å; T177-T179 PolarHBondContact OG1-OG1 3.09Å
178	L	97	Very high	97.4	Very high	53 Å²	53	58 Å²	58	28%	0.277	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	42.7	-173.2	-54.8	177.5	0	0	0	112	W102 P129 V131 F173 D174	W102-L178 HydrophobicContact CH2-CD2 3.63Å; W102-L178 HydrophobicContact CZ3-CD2 4.05Å; P129-L178 HydrophobicContact CB-CD1 4.33Å; P129-L178 HydrophobicContact CB-CD2 4.3Å; V131-L178 WeakPolarHBondContact CG1-O 3.3Å; F173-L178 HydrophobicContact CZ-CB 4.5Å; F173-L178 HydrophobicContact CZ-CD2 3.97Å; D174-L178 WeakPolarHBondContact O-CA 3.31Å; D174-L178 PolarHBondContact O-N 2.89Å
179	T	97.8	Very high	97.5	Very high	44 Å²	44	57.5 Å²	57.5	27%	0.27	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.6	-178.6	58.5	0	0	0	0	112.9	S133 F173 D174 T177	S133-T179 WeakPolarHBondContact OG-CA 3.17Å; F173-T179 WeakPolarHBondContact CA-O 3.42Å; D174-T179 PolarHBondContact N-O 3Å; D174-T179 PolarHBondContact O-N 3.44Å; T177-T179 VanDerWaalsContact C-N 3.29Å; T177-T179 PolarHBondContact O-N 3.14Å; T177-T179 PolarHBondContact OG1-OG1 3.09Å
180	W	98.5	Very high	97.5	Very high	19 Å²	19	52.4 Å²	52.4	7%	0.072	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	143.1	162.1	-70.2	97	0	0	0	111.1	F104 S133 P134 P135 P136 L152 V154 H171 V172 F173	F104-W180 AromaticContact CD1-CH2 3.63Å; F104-W180 HydrophobicContact CD1-CH2 3.63Å; F104-W180 AromaticContact CD1-CZ2 3.84Å; F104-W180 HydrophobicContact CD1-CZ2 3.84Å; F104-W180 HydrophobicContact CD2-CH2 4.21Å; F104-W180 AromaticContact CD2-CZ2 3.53Å; F104-W180 HydrophobicContact CD2-CZ2 3.53Å; F104-W180 AromaticContact CE1-CH2 3.41Å; F104-W180 HydrophobicContact CE1-CH2 3.41Å; F104-W180 VanDerWaalsContact CE1-CH2 3.41Å; F104-W180 AromaticContact CE1-CZ2 3.62Å; F104-W180 HydrophobicContact CE1-CZ2 3.62Å; F104-W180 HydrophobicContact CE1-CZ3 4.38Å; F104-W180 HydrophobicContact CE2-CH2 4.02Å; F104-W180 AromaticContact CE2-CZ2 3.31Å; F104-W180 HydrophobicContact CE2-CZ2 3.31Å; F104-W180 HydrophobicContact CG-CH2 4.02Å; F104-W180 AromaticContact CG-CZ2 3.79Å; F104-W180 HydrophobicContact CG-CZ2 3.79Å; F104-W180 AromaticContact CZ-CH2 3.65Å; F104-W180 HydrophobicContact CZ-CH2 3.65Å; F104-W180 AromaticContact CZ-CZ2 3.38Å; F104-W180 HydrophobicContact CZ-CZ2 3.38Å; S133-W180 PolarHBondContact OG-N 3.02Å; P134-W180 WeakPolarHBondContact O-CB 3.39Å; P135-W180 HydrophobicContact CB-CG 4.41Å; P136-W180 HydrophobicContact CG-CE3 4.06Å; P136-W180 HydrophobicContact CG-CH2 4.24Å; P136-W180 HydrophobicContact CG-CZ3 3.91Å; L152-W180 HydrophobicContact CD2-CH2 4.24Å; V154-W180 HydrophobicContact CG2-CH2 4.25Å; V154-W180 HydrophobicContact CG2-CZ3 3.91Å; H171-W180 HydrophobicContact CB-CE3 3.98Å; H171-W180 HydrophobicContact CB-CZ3 3.98Å; V172-W180 CarbonylContact O-C 3.58Å; V172-W180 VanDerWaalsContact O-CA 3.28Å; V172-W180 WeakPolarHBondContact O-CA 3.38Å; F173-W180 HydrophobicContact CB-CD2 3.75Å; F173-W180 HydrophobicContact CB-CE3 3.69Å; F173-W180 HydrophobicContact CB-CH2 3.6Å; F173-W180 HydrophobicContact CB-CZ2 3.64Å; F173-W180 HydrophobicContact CB-CZ3 3.62Å; F173-W180 AromaticContact CD2-CD1 3.83Å; F173-W180 HydrophobicContact CD2-CD2 4.02Å; F173-W180 AromaticContact CD2-CE2 3.67Å; F173-W180 HydrophobicContact CD2-CG 4.1Å; F173-W180 HydrophobicContact CD2-CZ2 4.15Å; F173-W180 AromaticContact CD2-NE1 3.53Å; F173-W180 HydrophobicContact CG-CD2 4.35Å; F173-W180 HydrophobicContact CG-CH2 4.49Å; F173-W180 HydrophobicContact CG-CZ2 4.07Å
181	S	97.8	Very high	97.5	Very high	60 Å²	60	54.3 Å²	54.3	42%	0.42	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	162.3	171.9	64.6	0	0	0	0	110.4	V172	V172-S181 PolarHBondContact N-O 3.28Å; V172-S181 PolarHBondContact O-N 3.32Å; V172-S181 PolarHBondContact O-OG 3.01Å
182	Q	97.4	Very high	97.5	Very high	94 Å²	94	55.3 Å²	55.3	44%	0.439	32%	0.317	S	S	.	.			trans	-122.8	90.6	172.1	-69.7	177.3	-5	0	0	107	K169 H171	K169-Q182 HydrophobicContact CD-CG 4.38Å; H171-Q182 PolarHBondContact CE1-NE2 3.23Å; H171-Q182 PolarHBondContact ND1-NE2 3.38Å
183	P	96.9	Very high	97.5	Very high	37 Å²	37	55.1 Å²	55.1	24%	0.24	32%	0.316	C	S	.	.			trans	-60	145.1	176.5	26.5	-34.4	0	0	0	109.9	L170 V172 T185 M228	L170-P183 HydrophobicContact CD2-CG 4.32Å; V172-P183 HydrophobicContact CG2-CG 3.79Å; P183-T185 PolarHBondContact O-N 2.99Å; P183-M228 HydrophobicContact CB-CE 4.21Å; P183-M228 HydrophobicContact CB-CG 4.43Å; P183-M228 HydrophobicContact CB-SD 4.3Å; P183-M228 HydrophobicContact CG-CE 4.19Å; P183-M228 HydrophobicContact CG-SD 4.21Å
184	E	96.7	Very high	97.5	Very high	188 Å²	188	56.3 Å²	56.3	88%	0.879	32%	0.321	S	S	*	.			trans	-65.6	128.6	167.3	-67.8	-170.8	169	0	0	108.7	M228	E184-M228 WeakPolarHBondContact O-CB 3.49Å
185	T	97.8	Very high	97.5	Very high	43 Å²	43	55.2 Å²	55.2	26%	0.264	32%	0.317	S	S	.	.			trans	-114.2	140.7	178.1	63.2	0	0	0	0	110.6	L170 P183 I223 M228 W230	L170-T185 HydrophobicContact CB-CG2 4.16Å; L170-T185 HydrophobicContact CD2-CG2 4.37Å; P183-T185 PolarHBondContact O-N 2.99Å; T185-I223 HydrophobicContact CG2-CD1 3.87Å; T185-M228 CarbonylContact C-O 3.43Å; T185-M228 VanDerWaalsContact CA-O 3.22Å; T185-M228 WeakPolarHBondContact CA-O 3.38Å; T185-M228 WeakPolarHBondContact CB-O 3.33Å; T185-W230 PolarHBondContact OG1-NE1 3.03Å
186	L	97.8	Very high	97.5	Very high	108 Å²	108	54.8 Å²	54.8	57%	0.565	31%	0.313	S	S	*	.	B	Isolated β-bridge	trans	-95.3	163	175.1	-58.7	175.1	0	0	0	110.9	M228 K229 W230	L186-M228 PolarHBondContact N-O 3.43Å; L186-K229 HydrophobicContact CB-CB 4.16Å; L186-K229 HydrophobicContact CB-CG 4.05Å; L186-W230 PolarHBondContact O-N 3.13Å
187	G	96.8	Very high	97.7	Very high	45 Å²	45	50.4 Å²	50.4	46%	0.464	29%	0.29	S	S	.	.	S	Bend	trans	78.7	-163.7	179.3	0	0	0	0	0	113.3
188	N	96.9	Very high	97.8	Very high	137 Å²	137	46.9 Å²	46.9	73%	0.733	27%	0.268	S	S	*	.			trans	-107.6	111	-177.1	-64.9	-44.8	0	0	0	109.5	W230	N188-W230 WeakPolarHBondContact O-CB 3.34Å
189	P	97.7	Very high	97.8	Very high	42 Å²	42	45 Å²	45	27%	0.273	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-66.6	162.6	174.2	29	-34.7	0	0	0	111.1	F155 W230	F155-P189 HydrophobicContact CE2-CB 3.89Å; F155-P189 HydrophobicContact CZ-CB 3.94Å; P189-W230 HydrophobicContact CB-CD2 4.18Å; P189-W230 HydrophobicContact CB-CG 4.14Å
190	P	98.1	Very high	97.8	Very high	2 Å²	2	44 Å²	44	1%	0.013	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-56.1	149.7	168.8	-13.8	20.4	0	0	0	112	F155 I207 H221 W230	F155-P190 HydrophobicContact CD1-CG 4.48Å; F155-P190 HydrophobicContact CE1-CB 3.84Å; F155-P190 HydrophobicContact CE1-CG 3.74Å; F155-P190 HydrophobicContact CZ-CB 4.14Å; F155-P190 HydrophobicContact CZ-CG 3.95Å; F155-P190 WeakPolarHBondContact CZ-O 3.42Å; P190-I207 HydrophobicContact CG-CD1 4.06Å; P190-I207 HydrophobicContact CG-CG2 4.27Å; P190-H221 HydrophobicContact CG-CB 3.92Å; P190-W230 HydrophobicContact CG-CZ3 4.36Å
191	S	98.1	Very high	97.8	Very high	42 Å²	42	44 Å²	44	29%	0.294	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-61.7	158	170.3	59.1	0	0	0	0	111.7	R193 Y217	S191-R193 WeakPolarHBondContact O-CG 3.42Å; S191-R193 PolarHBondContact O-N 3.42Å; S191-R193 PolarHBondContact O-NE 3.2Å; S191-R193 PolarHBondContact OG-NH2 2.82Å; S191-Y217 VanDerWaalsContact OG-CE1 3.24Å; S191-Y217 WeakPolarHBondContact OG-CE1 3.39Å; S191-Y217 VanDerWaalsContact OG-CZ 3.25Å; S191-Y217 PolarHBondContact OG-OH 2.94Å; S191-Y217 VanDerWaalsContact OG-OH 3.09Å
192	P	98.3	Very high	97.7	Very high	28 Å²	28	44.3 Å²	44.3	18%	0.182	27%	0.272	C	S	.	.	S	Bend	trans	-44.2	128	171.5	-32	38.2	0	0	0	112.3	P164 V165 T168	P164-P192 HydrophobicContact CB-CB 4.47Å; P164-P192 HydrophobicContact CG-CB 3.97Å; V165-P192 WeakPolarHBondContact O-CB 3.27Å; T168-P192 HydrophobicContact CG2-CG 3.76Å
193	R	98.3	Very high	97.6	Very high	1 Å²	1	43 Å²	43	0%	0.004	27%	0.27	C	S	.	.			trans	-161.3	153.6	-174.5	59.7	-176	67.1	-159.5	2.7	111.7	G157 S191 G209 L211 Y217 D219	G157-R193 PolarHBondContact N-O 3.35Å; G157-R193 VanDerWaalsContact N-O 3.08Å; S191-R193 WeakPolarHBondContact O-CG 3.42Å; S191-R193 PolarHBondContact O-N 3.42Å; S191-R193 PolarHBondContact O-NE 3.2Å; S191-R193 PolarHBondContact OG-NH2 2.82Å; R193-G209 WeakPolarHBondContact CD-O 3.29Å; R193-G209 PolarHBondContact NH1-O 2.85Å; R193-L211 WeakPolarHBondContact CA-O 3.41Å; R193-Y217 HydrophobicContact CB-CD2 4.08Å; R193-Y217 HydrophobicContact CB-CE2 3.92Å; R193-D219 IonicContact CZ-OD1 3.8Å; R193-D219 IonicContact NH1-OD1 3.51Å; R193-D219 PolarHBondContact NH1-OD1 2.86Å; R193-D219 IonicContact NH2-OD1 3.65Å; R193-D219 PolarHBondContact NH2-OD1 2.85Å; R193-D219 VanDerWaalsContact NH2-OD1 3.17Å; R193-D219 IonicContact NH2-OD2 3.88Å; R193-D219 PolarHBondContact NH2-OD2 2.98Å
194	H	98	Very high	97.7	Very high	25 Å²	25	45.5 Å²	45.5	12%	0.116	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-132.8	164.9	172.4	78.3	109.2	0	0	0	111	G157 G161 A162 P164 H196 G210 L211	G157-H194 VanDerWaalsContact C-CB 3.49Å; G161-H194 PolarHBondContact O-CE1 2.98Å; A162-H194 VanDerWaalsContact C-NE2 3.33Å; A162-H194 WeakPolarHBondContact CA-NE2 3.41Å; A162-H194 PolarHBondContact O-NE2 2.79Å; P164-H194 HydrophobicContact CB-CB 4.18Å; H194-H196 PolarHBondContact O-N 3.08Å; H194-G210 CarbonylContact O-C 3.46Å; H194-G210 WeakPolarHBondContact O-CA 3.34Å; H194-L211 PolarHBondContact CD2-O 3.14Å; H194-L211 PolarHBondContact N-O 2.74Å; H194-L211 PolarHBondContact O-N 3.2Å
195	G	97.7	Very high	97.8	Very high	7 Å²	7	36.5 Å²	36.5	7%	0.072	24%	0.235	C	C	.	.	S	Bend	trans	62.6	23	-177.7	0	0	0	0	0	113.8	A244 A245	G195-A244 CarbonylContact O-C 3.56Å; G195-A244 VanDerWaalsContact O-CA 3.3Å; G195-A244 WeakPolarHBondContact O-CA 3.45Å; G195-A245 PolarHBondContact O-N 2.72Å
196	H	98.5	Very high	97.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.224	C	C	.	.			trans	-90.4	154.4	171.5	62.4	-81.6	0	0	0	109.1	T143 S144 F155 H194 I207 H208 G209	T143-H196 CarbonylContact C-O 3.47Å; T143-H196 PolarHBondContact OG1-O 3.21Å; S144-H196 WeakPolarHBondContact CA-O 3.29Å; S144-H196 VanDerWaalsContact CB-CE1 3.43Å; S144-H196 WeakPolarHBondContact CB-CE1 3.38Å; S144-H196 WeakPolarHBondContact CB-NE2 3.29Å; S144-H196 PolarHBondContact N-O 2.78Å; S144-H196 PolarHBondContact OG-CE1 3.17Å; S144-H196 PolarHBondContact OG-ND1 2.74Å; S144-H196 PolarHBondContact OG-O 2.7Å; F155-H196 PolarHBondContact O-CE1 2.99Å; F155-H196 PolarHBondContact O-NE2 3.07Å; H194-H196 PolarHBondContact O-N 3.08Å; H196-I207 HydrophobicContact CB-CG2 4.47Å; H196-H208 WeakPolarHBondContact CB-O 3.38Å; H196-G209 VanDerWaalsContact CB-O 3.27Å; H196-G209 WeakPolarHBondContact CB-O 3.03Å
197	V	98.6	Very high	97.9	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	143	169.1	-61.7	0	0	0	0	109.8	T143 I207 H208 H246 A248 I257	T143-V197 CarbonylContact O-C 3.59Å; T143-V197 WeakPolarHBondContact O-CA 3.26Å; T143-V197 WeakPolarHBondContact OG1-CG1 3.36Å; V197-I207 VanDerWaalsContact O-CA 3.29Å; V197-I207 WeakPolarHBondContact O-CA 3.43Å; V197-H208 HydrophobicContact CG2-CB 3.76Å; V197-H208 PolarHBondContact N-O 3.45Å; V197-H208 VanDerWaalsContact N-O 3.16Å; V197-H208 PolarHBondContact O-N 2.86Å; V197-H208 VanDerWaalsContact O-N 3.15Å; V197-H246 WeakPolarHBondContact CG1-CD2 3.08Å; V197-H246 WeakPolarHBondContact CG1-NE2 3.44Å; V197-H246 VanDerWaalsContact CG1-O 3.27Å; V197-H246 WeakPolarHBondContact CG1-O 3.44Å; V197-H246 WeakPolarHBondContact CG2-NE2 3.5Å; V197-A248 HydrophobicContact CB-CB 3.71Å; V197-A248 HydrophobicContact CG1-CB 3.79Å; V197-A248 HydrophobicContact CG2-CB 3.96Å; V197-I257 HydrophobicContact CG2-CG2 4.3Å
198	M	98.6	Very high	98	Very high	7 Å²	7	27.6 Å²	27.6	3%	0.034	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.1	161	-170.8	-173.2	-135	0	0	107.5	T143 S145 A146 F155 L170 L205 F206 I207 W230	T143-M198 PolarHBondContact O-N 3.22Å; S145-M198 VanDerWaalsContact O-O 3.14Å; A146-M198 HydrophobicContact CB-CB 4.48Å; A146-M198 HydrophobicContact CB-CG 3.92Å; A146-M198 HydrophobicContact CB-SD 4.21Å; F155-M198 HydrophobicContact CB-CE 3.95Å; L170-M198 HydrophobicContact CD1-CE 3.8Å; M198-L205 HydrophobicContact CE-CB 4.03Å; M198-L205 HydrophobicContact CE-CD1 3.75Å; M198-L205 HydrophobicContact CE-CG 4.46Å; M198-F206 CarbonylContact C-O 3.59Å; M198-F206 VanDerWaalsContact CA-O 3.26Å; M198-F206 WeakPolarHBondContact CA-O 3.46Å; M198-I207 HydrophobicContact CB-CG1 4.22Å; M198-I207 HydrophobicContact CE-CD1 3.87Å; M198-I207 HydrophobicContact CE-CG1 4.15Å; M198-I207 HydrophobicContact CG-CG1 3.91Å; M198-W230 HydrophobicContact CE-CH2 4.42Å
199	V	98.3	Very high	98	Very high	14 Å²	14	21.1 Å²	21.1	9%	0.085	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.3	-178.8	67.1	0	0	0	0	111	L205 F206 A248 A250 V255	V199-L205 WeakPolarHBondContact O-CA 3.36Å; V199-F206 HydrophobicContact CG1-CB 4.04Å; V199-F206 PolarHBondContact N-O 3.15Å; V199-F206 PolarHBondContact O-N 3.25Å; V199-A248 HydrophobicContact CB-CB 4.2Å; V199-A248 HydrophobicContact CG1-CB 4.4Å; V199-A250 HydrophobicContact CG2-CB 3.68Å; V199-V255 HydrophobicContact CG1-CB 4.37Å; V199-V255 HydrophobicContact CG1-CG1 3.65Å; V199-V255 HydrophobicContact CG1-CG2 3.77Å
200	A	98.1	Very high	98.1	Very high	24 Å²	24	19.1 Å²	19.1	20%	0.198	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	132.5	177.2	0	0	0	0	0	111.2	A146 A147 I148 K204 L205 A250	A146-A200 HydrophobicContact CB-CB 4.11Å; A147-A200 WeakPolarHBondContact O-CB 3.39Å; I148-A200 HydrophobicContact CD1-CB 4.12Å; I148-A200 HydrophobicContact CG1-CB 3.62Å; A200-K204 CarbonylContact C-O 3.51Å; A200-K204 WeakPolarHBondContact CA-O 3.39Å; A200-L205 HydrophobicContact CB-CD2 3.88Å; A200-A250 WeakPolarHBondContact O-CB 3.41Å
201	A	96.8	Very high	98	Very high	17 Å²	17	19.8 Å²	19.8	14%	0.14	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	110.5	166.2	0	0	0	0	0	109.2	T203 K204 F206 A250 T275	A201-T203 PolarHBondContact O-N 3.16Å; A201-K204 PolarHBondContact N-O 3.35Å; A201-K204 PolarHBondContact O-N 3.37Å; A201-K204 VanDerWaalsContact O-N 3.11Å; A201-F206 HydrophobicContact CB-CD2 4.34Å; A201-F206 HydrophobicContact CB-CE2 4Å; A201-A250 HydrophobicContact CB-CB 4.19Å; A201-T275 HydrophobicContact CB-CG2 4.28Å
202	G	95.8	Very high	98	Very high	68 Å²	68	18.9 Å²	18.9	70%	0.701	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.6	-123.6	-169.4	0	0	0	0	0	111.4
203	T	96.6	Very high	97.9	Very high	67 Å²	67	18.7 Å²	18.7	41%	0.411	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-0.7	176.2	57.4	0	0	0	0	113.2	A201 D224 I225	A201-T203 PolarHBondContact O-N 3.16Å; T203-D224 WeakPolarHBondContact CB-OD1 3.49Å; T203-D224 PolarHBondContact OG1-OD1 2.88Å; T203-D224 PolarHBondContact OG1-OD2 2.78Å; T203-I225 WeakPolarHBondContact O-CG1 3.48Å; T203-I225 PolarHBondContact O-N 2.76Å
204	K	98.1	Very high	97.7	Very high	88 Å²	88	25.7 Å²	25.7	38%	0.383	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.9	-172.7	-68.7	176.8	-179.2	174	0	111.2	A200 A201 F206 I223 D224	A200-K204 CarbonylContact C-O 3.51Å; A200-K204 WeakPolarHBondContact CA-O 3.39Å; A201-K204 PolarHBondContact N-O 3.35Å; A201-K204 PolarHBondContact O-N 3.37Å; A201-K204 VanDerWaalsContact O-N 3.11Å; K204-F206 HydrophobicContact CB-CD2 4.33Å; K204-F206 HydrophobicContact CB-CE2 3.61Å; K204-F206 HydrophobicContact CB-CZ 4.01Å; K204-F206 HydrophobicContact CD-CZ 4.13Å; K204-I223 WeakPolarHBondContact CA-O 3.49Å; K204-D224 WeakPolarHBondContact CE-OD2 3.29Å; K204-D224 HydrophobicContact CG-CB 4.07Å; K204-D224 WeakPolarHBondContact CG-OD2 3.26Å
205	L	98.6	Very high	97.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.3	169.2	-53	174.2	0	0	0	108.3	A146 I148 Y153 M198 V199 A200 C222 I223 I225	A146-L205 HydrophobicContact CB-CD2 3.89Å; I148-L205 HydrophobicContact CD1-CD2 3.52Å; I148-L205 HydrophobicContact CD1-CG 4.13Å; I148-L205 HydrophobicContact CG1-CD2 4.05Å; Y153-L205 HydrophobicContact CD1-CD1 3.5Å; Y153-L205 VanDerWaalsContact CD1-CD1 3.5Å; Y153-L205 HydrophobicContact CD2-CD1 4.16Å; Y153-L205 HydrophobicContact CD2-CD2 4.37Å; Y153-L205 HydrophobicContact CE1-CD1 4.13Å; Y153-L205 HydrophobicContact CG-CD1 3.5Å; Y153-L205 HydrophobicContact CG-CD2 4.43Å; M198-L205 HydrophobicContact CE-CB 4.03Å; M198-L205 HydrophobicContact CE-CD1 3.75Å; M198-L205 HydrophobicContact CE-CG 4.46Å; V199-L205 WeakPolarHBondContact O-CA 3.36Å; A200-L205 HydrophobicContact CB-CD2 3.88Å; L205-C222 CarbonylContact O-C 3.47Å; L205-C222 VanDerWaalsContact O-CA 3.29Å; L205-C222 WeakPolarHBondContact O-CA 3.45Å; L205-I223 HydrophobicContact CB-CG2 3.79Å; L205-I223 HydrophobicContact CD1-CG2 4.1Å; L205-I223 HydrophobicContact CG-CG2 4.32Å; L205-I223 PolarHBondContact N-O 2.88Å; L205-I223 PolarHBondContact O-N 3Å; L205-I225 HydrophobicContact CD1-CG2 4.15Å; L205-I225 HydrophobicContact CG-CG2 4.22Å
206	F	98.6	Very high	97.7	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.026	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.8	176.3	-66.2	-89.3	0	0	0	109.8	M198 V199 A201 K204 L220 H221 C222 L233 V255 Y273 T275	M198-F206 CarbonylContact C-O 3.59Å; M198-F206 VanDerWaalsContact CA-O 3.26Å; M198-F206 WeakPolarHBondContact CA-O 3.46Å; V199-F206 HydrophobicContact CG1-CB 4.04Å; V199-F206 PolarHBondContact N-O 3.15Å; V199-F206 PolarHBondContact O-N 3.25Å; A201-F206 HydrophobicContact CB-CD2 4.34Å; A201-F206 HydrophobicContact CB-CE2 4Å; K204-F206 HydrophobicContact CB-CD2 4.33Å; K204-F206 HydrophobicContact CB-CE2 3.61Å; K204-F206 HydrophobicContact CB-CZ 4.01Å; K204-F206 HydrophobicContact CD-CZ 4.13Å; F206-L220 HydrophobicContact CB-CD1 4.36Å; F206-L220 HydrophobicContact CD1-CD1 4.39Å; F206-H221 CarbonylContact C-O 3.59Å; F206-H221 WeakPolarHBondContact CA-O 3.36Å; F206-C222 HydrophobicContact CD1-CB 4.03Å; F206-C222 HydrophobicContact CE1-CB 3.99Å; F206-L233 HydrophobicContact CD1-CD1 4.23Å; F206-L233 HydrophobicContact CE1-CD1 3.9Å; F206-V255 HydrophobicContact CD2-CG2 4.34Å; F206-Y273 HydrophobicContact CD1-CE1 4.05Å; F206-Y273 AromaticContact CE1-CE1 3.71Å; F206-Y273 HydrophobicContact CE1-CE1 3.71Å; F206-Y273 HydrophobicContact CZ-CE1 4.38Å; F206-T275 HydrophobicContact CE2-CG2 3.87Å; F206-T275 HydrophobicContact CZ-CG2 3.82Å
207	I	98.7	Very high	97.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.9	175.8	-67.2	176.3	0	0	0	109.2	F155 P190 H196 V197 M198 L220 H221 W230	F155-I207 HydrophobicContact CB-CD1 4.12Å; F155-I207 HydrophobicContact CD1-CD1 3.7Å; F155-I207 HydrophobicContact CE1-CD1 4.35Å; F155-I207 HydrophobicContact CG-CD1 3.93Å; P190-I207 HydrophobicContact CG-CD1 4.06Å; P190-I207 HydrophobicContact CG-CG2 4.27Å; H196-I207 HydrophobicContact CB-CG2 4.47Å; V197-I207 VanDerWaalsContact O-CA 3.29Å; V197-I207 WeakPolarHBondContact O-CA 3.43Å; M198-I207 HydrophobicContact CB-CG1 4.22Å; M198-I207 HydrophobicContact CE-CD1 3.87Å; M198-I207 HydrophobicContact CE-CG1 4.15Å; M198-I207 HydrophobicContact CG-CG1 3.91Å; I207-L220 WeakPolarHBondContact O-CA 3.42Å; I207-H221 HydrophobicContact CB-CB 4.36Å; I207-H221 PolarHBondContact N-O 3.01Å; I207-H221 PolarHBondContact O-N 2.95Å; I207-W230 HydrophobicContact CD1-CH2 3.64Å; I207-W230 HydrophobicContact CD1-CZ3 3.65Å
208	H	98.7	Very high	97.6	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137	176.6	174.6	-93.1	0	0	0	111.9	H196 V197 L220 H246	H196-H208 WeakPolarHBondContact CB-O 3.38Å; V197-H208 HydrophobicContact CG2-CB 3.76Å; V197-H208 PolarHBondContact N-O 3.45Å; V197-H208 VanDerWaalsContact N-O 3.16Å; V197-H208 PolarHBondContact O-N 2.86Å; V197-H208 VanDerWaalsContact O-N 3.15Å; H208-L220 HydrophobicContact CB-CD1 4Å; H208-H246 AromaticContact CE1-NE2 3.92Å; H208-H246 AromaticContact ND1-CE1 3.58Å; H208-H246 AromaticContact ND1-NE2 3.02Å; H208-H246 PolarHBondContact ND1-NE2 2.9Å; H208-H246 PolarHBondContact O-CE1 3.01Å; H208-H246 PolarHBondContact O-NE2 3.07Å
209	G	98.5	Very high	97.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.223	C	C	.	.			trans	67	-146.7	170.6	0	0	0	0	0	115.2	R193 H196 Y217 D219	R193-G209 WeakPolarHBondContact CD-O 3.29Å; R193-G209 PolarHBondContact NH1-O 2.85Å; H196-G209 VanDerWaalsContact CB-O 3.27Å; H196-G209 WeakPolarHBondContact CB-O 3.03Å; G209-Y217 WeakPolarHBondContact CA-O 3.49Å; G209-D219 PolarHBondContact N-O 2.85Å
210	G	98.3	Very high	97.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.221	C	C	.	.			trans	107.9	-179.9	-174.6	0	0	0	0	0	113.7	H194 F216 Y217 C243	H194-G210 CarbonylContact O-C 3.46Å; H194-G210 WeakPolarHBondContact O-CA 3.34Å; G210-F216 WeakPolarHBondContact O-CA 3.3Å; G210-Y217 WeakPolarHBondContact O-CD2 3.43Å; G210-Y217 PolarHBondContact O-N 3.14Å; G210-C243 PolarHBondContact N-O 2.95Å
211	L	97.5	Very high	97.7	Very high	17 Å²	17	37.9 Å²	37.9	9%	0.089	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145.8	-178.6	-179.1	62.7	0	0	0	110.6	A162 R193 H194 G213 R215 F216 A244	A162-L211 HydrophobicContact CB-CD2 4.1Å; R193-L211 WeakPolarHBondContact CA-O 3.41Å; H194-L211 PolarHBondContact CD2-O 3.14Å; H194-L211 PolarHBondContact N-O 2.74Å; H194-L211 PolarHBondContact O-N 3.2Å; L211-G213 WeakPolarHBondContact CD1-O 3.29Å; L211-R215 WeakPolarHBondContact CA-O 3.05Å; L211-R215 WeakPolarHBondContact CD1-O 3.35Å; L211-F216 HydrophobicContact CD1-CD1 4.17Å; L211-F216 HydrophobicContact CD1-CD2 3.82Å; L211-F216 HydrophobicContact CD1-CE1 4.06Å; L211-F216 HydrophobicContact CD1-CE2 3.71Å; L211-F216 HydrophobicContact CD1-CG 4.06Å; L211-F216 HydrophobicContact CD1-CZ 3.83Å; L211-F216 HydrophobicContact CD2-CE1 4.48Å; L211-F216 HydrophobicContact CD2-CZ 4.28Å; L211-A244 HydrophobicContact CB-CB 3.8Å
212	A	97.4	Very high	97.8	Very high	22 Å²	22	37.5 Å²	37.5	18%	0.182	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	109.7	161.4	0	0	0	0	0	110	P164 D214 R215 Y217	P164-A212 HydrophobicContact CG-CB 3.87Å; A212-D214 PolarHBondContact O-N 3.5Å; A212-R215 PolarHBondContact N-O 3Å; A212-R215 PolarHBondContact O-N 2.77Å; A212-R215 VanDerWaalsContact O-N 3.11Å; A212-Y217 HydrophobicContact CB-CE2 3.72Å
213	G	95.8	Very high	97.9	Very high	25 Å²	25	34.3 Å²	34.3	26%	0.258	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	-112.6	-172.6	0	0	0	0	0	111	A162 L211	A162-G213 PolarHBondContact O-N 3.2Å; L211-G213 WeakPolarHBondContact CD1-O 3.29Å
214	D	94.4	Very high	97.9	Very high	147 Å²	147	32.4 Å²	32.4	79%	0.786	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-7.6	176.8	59.9	-8.8	0	0	0	113.2	A212 F216	A212-D214 PolarHBondContact O-N 3.5Å; D214-F216 PolarHBondContact O-N 3.12Å
215	R	97.4	Very high	97.9	Very high	146 Å²	146	30.1 Å²	30.1	55%	0.551	16%	0.155	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	111.5	-175.7	-177.4	178.6	179.2	-179.5	-0	111.7	L211 A212 Y217	L211-R215 WeakPolarHBondContact CA-O 3.05Å; L211-R215 WeakPolarHBondContact CD1-O 3.35Å; A212-R215 PolarHBondContact N-O 3Å; A212-R215 PolarHBondContact O-N 2.77Å; A212-R215 VanDerWaalsContact O-N 3.11Å; R215-Y217 HydrophobicContact CG-CE1 4.32Å
216	F	98.2	Very high	97.8	Very high	38 Å²	38	34.7 Å²	34.7	17%	0.167	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	133.8	163.8	-67.7	-95.6	0	0	0	110.1	G210 L211 D214 G242 A244 M261 P263	G210-F216 WeakPolarHBondContact O-CA 3.3Å; L211-F216 HydrophobicContact CD1-CD1 4.17Å; L211-F216 HydrophobicContact CD1-CD2 3.82Å; L211-F216 HydrophobicContact CD1-CE1 4.06Å; L211-F216 HydrophobicContact CD1-CE2 3.71Å; L211-F216 HydrophobicContact CD1-CG 4.06Å; L211-F216 HydrophobicContact CD1-CZ 3.83Å; L211-F216 HydrophobicContact CD2-CE1 4.48Å; L211-F216 HydrophobicContact CD2-CZ 4.28Å; D214-F216 PolarHBondContact O-N 3.12Å; F216-G242 WeakPolarHBondContact CB-O 3.34Å; F216-A244 HydrophobicContact CD1-CB 3.98Å; F216-A244 HydrophobicContact CE1-CB 3.89Å; F216-M261 HydrophobicContact CE1-CE 4.19Å; F216-M261 HydrophobicContact CE1-CG 3.98Å; F216-M261 WeakPolarHBondContact CE1-O 3.39Å; F216-M261 HydrophobicContact CE1-SD 4.42Å; F216-M261 HydrophobicContact CZ-CE 3.73Å; F216-M261 HydrophobicContact CZ-CG 4.48Å; F216-M261 HydrophobicContact CZ-SD 4.47Å; F216-P263 VanDerWaalsContact CD2-CD 3.49Å; F216-P263 HydrophobicContact CD2-CG 3.55Å; F216-P263 HydrophobicContact CE2-CG 3.69Å; F216-P263 HydrophobicContact CG-CG 4.48Å
217	Y	98.4	Very high	97.7	Very high	16 Å²	16	38 Å²	38	6%	0.063	21%	0.206	C	C	.	.			trans	-95.1	145.3	177.2	-64.1	-81.9	0	0	0	110.5	S191 R193 G209 G210 A212 R215 G242 C243	S191-Y217 VanDerWaalsContact OG-CE1 3.24Å; S191-Y217 WeakPolarHBondContact OG-CE1 3.39Å; S191-Y217 VanDerWaalsContact OG-CZ 3.25Å; S191-Y217 PolarHBondContact OG-OH 2.94Å; S191-Y217 VanDerWaalsContact OG-OH 3.09Å; R193-Y217 HydrophobicContact CB-CD2 4.08Å; R193-Y217 HydrophobicContact CB-CE2 3.92Å; G209-Y217 WeakPolarHBondContact CA-O 3.49Å; G210-Y217 WeakPolarHBondContact O-CD2 3.43Å; G210-Y217 PolarHBondContact O-N 3.14Å; A212-Y217 HydrophobicContact CB-CE2 3.72Å; R215-Y217 HydrophobicContact CG-CE1 4.32Å; Y217-G242 CarbonylContact O-C 3.56Å; Y217-G242 WeakPolarHBondContact O-CA 3.02Å; Y217-C243 PolarHBondContact O-N 2.91Å; Y217-C243 VanDerWaalsContact O-N 3.11Å
218	D	98	Very high	97.7	Very high	100 Å²	100	39.7 Å²	39.7	54%	0.535	21%	0.214	S	C	.	.			trans	-120.8	3.3	177.9	61.1	-10.9	0	0	0	112.3
219	D	98.4	Very high	97.7	Very high	18 Å²	18	44 Å²	44	10%	0.096	23%	0.233	C	C	.	.			trans	-82.1	146.9	-175.2	57.5	-6.3	0	0	0	112.5	R193 G209 H221 K232	R193-D219 IonicContact CZ-OD1 3.8Å; R193-D219 IonicContact NH1-OD1 3.51Å; R193-D219 PolarHBondContact NH1-OD1 2.86Å; R193-D219 IonicContact NH2-OD1 3.65Å; R193-D219 PolarHBondContact NH2-OD1 2.85Å; R193-D219 VanDerWaalsContact NH2-OD1 3.17Å; R193-D219 IonicContact NH2-OD2 3.88Å; R193-D219 PolarHBondContact NH2-OD2 2.98Å; G209-D219 PolarHBondContact N-O 2.85Å; D219-H221 VanDerWaalsContact CG-NE2 3.34Å; D219-H221 IonicContact OD1-NE2 3.61Å; D219-H221 IonicContact OD2-CD2 3.2Å; D219-H221 IonicContact OD2-CE1 2.74Å; D219-H221 IonicContact OD2-NE2 2.78Å; D219-H221 PolarHBondContact OD2-NE2 2.86Å; D219-K232 IonicContact OD2-NZ 3.68Å
220	L	98.6	Very high	97.7	Very high	8 Å²	8	44.3 Å²	44.3	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.1	171.3	-176.8	67.1	0	0	0	109.2	F206 I207 H208 L233 P235 Y273 W280	F206-L220 HydrophobicContact CB-CD1 4.36Å; F206-L220 HydrophobicContact CD1-CD1 4.39Å; I207-L220 WeakPolarHBondContact O-CA 3.42Å; H208-L220 HydrophobicContact CB-CD1 4Å; L220-L233 HydrophobicContact CB-CB 4.46Å; L220-L233 HydrophobicContact CD2-CB 4.26Å; L220-L233 HydrophobicContact CD2-CD1 3.94Å; L220-L233 HydrophobicContact CG-CB 4.35Å; L220-L233 HydrophobicContact CG-CD1 4.22Å; L220-L233 PolarHBondContact O-N 3.39Å; L220-P235 HydrophobicContact CB-CG 4.37Å; L220-P235 HydrophobicContact CD2-CG 3.55Å; L220-Y273 HydrophobicContact CD2-CD1 4.25Å; L220-Y273 HydrophobicContact CD2-CD2 4.11Å; L220-Y273 HydrophobicContact CD2-CE1 3.8Å; L220-Y273 HydrophobicContact CD2-CE2 3.65Å; L220-Y273 HydrophobicContact CD2-CG 4.38Å; L220-Y273 VanDerWaalsContact CD2-CZ 3.47Å; L220-W280 HydrophobicContact CD1-CZ2 4.36Å; L220-W280 HydrophobicContact CD2-CZ2 4.3Å
221	H	98.6	Very high	97.6	Very high	10 Å²	10	48.6 Å²	48.6	5%	0.046	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	153.5	172.2	-67.7	-106.8	0	0	0	110.2	P190 F206 I207 D219 Q231	P190-H221 HydrophobicContact CG-CB 3.92Å; F206-H221 CarbonylContact C-O 3.59Å; F206-H221 WeakPolarHBondContact CA-O 3.36Å; I207-H221 HydrophobicContact CB-CB 4.36Å; I207-H221 PolarHBondContact N-O 3.01Å; I207-H221 PolarHBondContact O-N 2.95Å; D219-H221 VanDerWaalsContact CG-NE2 3.34Å; D219-H221 IonicContact OD1-NE2 3.61Å; D219-H221 IonicContact OD2-CD2 3.2Å; D219-H221 IonicContact OD2-CE1 2.74Å; D219-H221 IonicContact OD2-NE2 2.78Å; D219-H221 PolarHBondContact OD2-NE2 2.86Å; H221-Q231 CarbonylContact C-O 3.56Å; H221-Q231 WeakPolarHBondContact CA-O 3.29Å
222	C	98.5	Very high	97.7	Very high	9 Å²	9	53.3 Å²	53.3	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	143.1	174.7	178.5	0	0	0	0	109.6	L205 F206 W230 Q231 L233	L205-C222 CarbonylContact O-C 3.47Å; L205-C222 VanDerWaalsContact O-CA 3.29Å; L205-C222 WeakPolarHBondContact O-CA 3.45Å; F206-C222 HydrophobicContact CD1-CB 4.03Å; F206-C222 HydrophobicContact CE1-CB 3.99Å; C222-W230 CarbonylContact O-C 3.6Å; C222-W230 WeakPolarHBondContact O-CA 3.21Å; C222-Q231 PolarHBondContact N-O 2.81Å; C222-Q231 PolarHBondContact O-N 3.12Å; C222-L233 HydrophobicContact CB-CD1 3.69Å; C222-L233 HydrophobicContact CB-CD2 4.23Å; C222-L233 HydrophobicContact CB-CG 3.97Å
223	I	98.5	Very high	97.7	Very high	1 Å²	1	53 Å²	53	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131	164.8	-178.8	160	0	0	0	108.5	L170 T185 K204 L205 M228 W230	L170-I223 HydrophobicContact CD2-CD1 4.22Å; T185-I223 HydrophobicContact CG2-CD1 3.87Å; K204-I223 WeakPolarHBondContact CA-O 3.49Å; L205-I223 HydrophobicContact CB-CG2 3.79Å; L205-I223 HydrophobicContact CD1-CG2 4.1Å; L205-I223 HydrophobicContact CG-CG2 4.32Å; L205-I223 PolarHBondContact N-O 2.88Å; L205-I223 PolarHBondContact O-N 3Å; I223-M228 HydrophobicContact CD1-CB 4.48Å; I223-M228 HydrophobicContact CD1-SD 4.38Å; I223-W230 HydrophobicContact CB-CD2 3.9Å; I223-W230 HydrophobicContact CB-CE3 3.66Å; I223-W230 HydrophobicContact CB-CH2 4.24Å; I223-W230 HydrophobicContact CB-CZ2 4.46Å; I223-W230 HydrophobicContact CB-CZ3 3.83Å; I223-W230 HydrophobicContact CD1-CD2 3.81Å; I223-W230 HydrophobicContact CD1-CE3 4.43Å; I223-W230 HydrophobicContact CD1-CG 4.05Å; I223-W230 HydrophobicContact CD1-CZ2 3.95Å; I223-W230 HydrophobicContact CG1-CD2 4.39Å; I223-W230 HydrophobicContact CG2-CD2 4.35Å; I223-W230 HydrophobicContact CG2-CE3 3.9Å; I223-W230 HydrophobicContact CG2-CH2 3.61Å; I223-W230 HydrophobicContact CG2-CZ2 4.1Å; I223-W230 HydrophobicContact CG2-CZ3 3.5Å; I223-W230 VanDerWaalsContact CG2-CZ3 3.5Å
224	D	97.4	Very high	97.8	Very high	26 Å²	26	58.2 Å²	58.2	14%	0.139	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.5	172.1	-161.5	-50	0	0	0	108.5	T203 K204 S226 D227 M228	T203-D224 WeakPolarHBondContact CB-OD1 3.49Å; T203-D224 PolarHBondContact OG1-OD1 2.88Å; T203-D224 PolarHBondContact OG1-OD2 2.78Å; K204-D224 WeakPolarHBondContact CE-OD2 3.29Å; K204-D224 HydrophobicContact CG-CB 4.07Å; K204-D224 WeakPolarHBondContact CG-OD2 3.26Å; D224-S226 VanDerWaalsContact CG-OG 3.24Å; D224-S226 PolarHBondContact O-N 3.31Å; D224-S226 WeakPolarHBondContact OD1-CB 3.35Å; D224-S226 PolarHBondContact OD1-N 3.14Å; D224-S226 PolarHBondContact OD1-OG 2.94Å; D224-D227 PolarHBondContact O-N 3.25Å; D224-M228 WeakPolarHBondContact O-CA 3.39Å; D224-M228 PolarHBondContact O-N 2.89Å
225	I	97.1	Very high	98	Very high	40 Å²	40	52.7 Å²	52.7	21%	0.205	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.7	-177.7	69.4	172.3	0	0	0	112.6	I148 Y153 T203 L205 M228	I148-I225 HydrophobicContact CB-CD1 4.15Å; I148-I225 HydrophobicContact CD1-CD1 3.83Å; I148-I225 HydrophobicContact CD1-CG1 4.37Å; I148-I225 HydrophobicContact CD1-CG2 3.85Å; I148-I225 HydrophobicContact CG2-CD1 3.7Å; Y153-I225 HydrophobicContact CE1-CG2 3.78Å; Y153-I225 HydrophobicContact CE2-CG2 4.5Å; T203-I225 WeakPolarHBondContact O-CG1 3.48Å; T203-I225 PolarHBondContact O-N 2.76Å; L205-I225 HydrophobicContact CD1-CG2 4.15Å; L205-I225 HydrophobicContact CG-CG2 4.22Å; I225-M228 HydrophobicContact CB-CE 4.06Å; I225-M228 HydrophobicContact CG2-CE 4.48Å
226	S	96.6	Very high	98	Very high	96 Å²	96	49.7 Å²	49.7	67%	0.671	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-30.9	177.7	61.5	0	0	0	0	113.4	D224	D224-S226 VanDerWaalsContact CG-OG 3.24Å; D224-S226 PolarHBondContact O-N 3.31Å; D224-S226 WeakPolarHBondContact OD1-CB 3.35Å; D224-S226 PolarHBondContact OD1-N 3.14Å; D224-S226 PolarHBondContact OD1-OG 2.94Å
227	D	97.3	Very high	98	Very high	77 Å²	77	50.2 Å²	50.2	41%	0.412	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-5.5	-179.6	75.2	-1	0	0	0	114.1	D224 K229	D224-D227 PolarHBondContact O-N 3.25Å; D227-K229 PolarHBondContact O-N 3.15Å; D227-K229 WeakPolarHBondContact OD1-CB 3.32Å; D227-K229 PolarHBondContact OD1-N 2.94Å
228	M	97.8	Very high	97.9	Very high	34 Å²	34	51.7 Å²	51.7	17%	0.167	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	35.1	-178.7	-66.9	-67.8	-179.3	0	0	113.5	Y153 L170 P183 E184 T185 L186 I223 D224 I225	Y153-M228 HydrophobicContact CE1-CE 4.36Å; L170-M228 HydrophobicContact CD2-SD 4.23Å; P183-M228 HydrophobicContact CB-CE 4.21Å; P183-M228 HydrophobicContact CB-CG 4.43Å; P183-M228 HydrophobicContact CB-SD 4.3Å; P183-M228 HydrophobicContact CG-CE 4.19Å; P183-M228 HydrophobicContact CG-SD 4.21Å; E184-M228 WeakPolarHBondContact O-CB 3.49Å; T185-M228 CarbonylContact C-O 3.43Å; T185-M228 VanDerWaalsContact CA-O 3.22Å; T185-M228 WeakPolarHBondContact CA-O 3.38Å; T185-M228 WeakPolarHBondContact CB-O 3.33Å; L186-M228 PolarHBondContact N-O 3.43Å; I223-M228 HydrophobicContact CD1-CB 4.48Å; I223-M228 HydrophobicContact CD1-SD 4.38Å; D224-M228 WeakPolarHBondContact O-CA 3.39Å; D224-M228 PolarHBondContact O-N 2.89Å; I225-M228 HydrophobicContact CB-CE 4.06Å; I225-M228 HydrophobicContact CG2-CE 4.48Å
229	K	98.3	Very high	97.8	Very high	94 Å²	94	49.8 Å²	49.8	41%	0.409	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.4	-178.2	-173.4	176.3	177.3	-178.2	0	112.8	L186 D227	L186-K229 HydrophobicContact CB-CB 4.16Å; L186-K229 HydrophobicContact CB-CG 4.05Å; D227-K229 PolarHBondContact O-N 3.15Å; D227-K229 WeakPolarHBondContact OD1-CB 3.32Å; D227-K229 PolarHBondContact OD1-N 2.94Å
230	W	98.4	Very high	97.8	Very high	6 Å²	6	49.3 Å²	49.3	2%	0.023	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136.6	170.7	-67.4	104.3	0	0	0	112	F155 L170 T185 L186 N188 P189 P190 M198 I207 C222 I223	F155-W230 AromaticContact CD2-CH2 3.88Å; F155-W230 HydrophobicContact CD2-CH2 3.88Å; F155-W230 AromaticContact CD2-CZ2 3.69Å; F155-W230 HydrophobicContact CD2-CZ2 3.69Å; F155-W230 HydrophobicContact CE2-CH2 4.17Å; F155-W230 AromaticContact CE2-CZ2 3.8Å; F155-W230 HydrophobicContact CE2-CZ2 3.8Å; F155-W230 HydrophobicContact CG-CH2 4.26Å; L170-W230 HydrophobicContact CB-CZ2 4.28Å; L170-W230 HydrophobicContact CD1-CZ2 4.44Å; T185-W230 PolarHBondContact OG1-NE1 3.03Å; L186-W230 PolarHBondContact O-N 3.13Å; N188-W230 WeakPolarHBondContact O-CB 3.34Å; P189-W230 HydrophobicContact CB-CD2 4.18Å; P189-W230 HydrophobicContact CB-CG 4.14Å; P190-W230 HydrophobicContact CG-CZ3 4.36Å; M198-W230 HydrophobicContact CE-CH2 4.42Å; I207-W230 HydrophobicContact CD1-CH2 3.64Å; I207-W230 HydrophobicContact CD1-CZ3 3.65Å; C222-W230 CarbonylContact O-C 3.6Å; C222-W230 WeakPolarHBondContact O-CA 3.21Å; I223-W230 HydrophobicContact CB-CD2 3.9Å; I223-W230 HydrophobicContact CB-CE3 3.66Å; I223-W230 HydrophobicContact CB-CH2 4.24Å; I223-W230 HydrophobicContact CB-CZ2 4.46Å; I223-W230 HydrophobicContact CB-CZ3 3.83Å; I223-W230 HydrophobicContact CD1-CD2 3.81Å; I223-W230 HydrophobicContact CD1-CE3 4.43Å; I223-W230 HydrophobicContact CD1-CG 4.05Å; I223-W230 HydrophobicContact CD1-CZ2 3.95Å; I223-W230 HydrophobicContact CG1-CD2 4.39Å; I223-W230 HydrophobicContact CG2-CD2 4.35Å; I223-W230 HydrophobicContact CG2-CE3 3.9Å; I223-W230 HydrophobicContact CG2-CH2 3.61Å; I223-W230 HydrophobicContact CG2-CZ2 4.1Å; I223-W230 HydrophobicContact CG2-CZ3 3.5Å; I223-W230 VanDerWaalsContact CG2-CZ3 3.5Å
231	Q	98	Very high	97.7	Very high	91 Å²	91	52 Å²	52	43%	0.425	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	123.9	174.4	-58.2	-176	15.6	0	0	109.2	H221 C222 L233	H221-Q231 CarbonylContact C-O 3.56Å; H221-Q231 WeakPolarHBondContact CA-O 3.29Å; C222-Q231 PolarHBondContact N-O 2.81Å; C222-Q231 PolarHBondContact O-N 3.12Å; Q231-L233 HydrophobicContact CB-CD2 4.2Å; Q231-L233 PolarHBondContact O-N 3.31Å
232	K	98.3	Very high	97.7	Very high	116 Å²	116	52.2 Å²	52.2	50%	0.504	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119	164.1	-176.9	172.7	176.8	165.7	0	108.1	D219	D219-K232 IonicContact OD2-NZ 3.68Å
233	L	98.1	Very high	97.7	Very high	14 Å²	14	52 Å²	52	7%	0.073	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	151.2	179.1	-56.2	-173.4	0	0	0	109.8	F206 L220 C222 Q231 P235 Y273	F206-L233 HydrophobicContact CD1-CD1 4.23Å; F206-L233 HydrophobicContact CE1-CD1 3.9Å; L220-L233 HydrophobicContact CB-CB 4.46Å; L220-L233 HydrophobicContact CD2-CB 4.26Å; L220-L233 HydrophobicContact CD2-CD1 3.94Å; L220-L233 HydrophobicContact CG-CB 4.35Å; L220-L233 HydrophobicContact CG-CD1 4.22Å; L220-L233 PolarHBondContact O-N 3.39Å; C222-L233 HydrophobicContact CB-CD1 3.69Å; C222-L233 HydrophobicContact CB-CD2 4.23Å; C222-L233 HydrophobicContact CB-CG 3.97Å; Q231-L233 HydrophobicContact CB-CD2 4.2Å; Q231-L233 PolarHBondContact O-N 3.31Å; L233-P235 VanDerWaalsContact C-CD 3.43Å; L233-P235 HydrophobicContact CB-CG 4.36Å; L233-P235 WeakPolarHBondContact O-CD 3.24Å; L233-Y273 WeakPolarHBondContact CD1-OH 3.27Å
234	N	97.5	Very high	97.6	Very high	136 Å²	136	52.1 Å²	52.1	73%	0.727	32%	0.316	S	S	*	.			trans	-123.2	74.5	170	-60.2	-68.9	0	0	0	108.7
235	P	97.6	Very high	97.7	Very high	31 Å²	31	51.2 Å²	51.2	20%	0.201	31%	0.313	C	S	.	.			trans	-57.5	153.1	179.9	-28.5	39.1	0	0	0	113	L220 L233 Y273 Q278 W280	L220-P235 HydrophobicContact CB-CG 4.37Å; L220-P235 HydrophobicContact CD2-CG 3.55Å; L233-P235 VanDerWaalsContact C-CD 3.43Å; L233-P235 HydrophobicContact CB-CG 4.36Å; L233-P235 WeakPolarHBondContact O-CD 3.24Å; P235-Y273 HydrophobicContact CB-CD2 4.41Å; P235-Y273 HydrophobicContact CB-CE2 3.77Å; P235-Y273 HydrophobicContact CG-CD2 4.39Å; P235-Y273 HydrophobicContact CG-CE2 3.6Å; P235-Q278 CarbonylContact C-O 3.57Å; P235-Q278 VanDerWaalsContact CA-O 3.22Å; P235-Q278 WeakPolarHBondContact CA-O 3.21Å; P235-Q278 WeakPolarHBondContact CB-O 3.49Å; P235-W280 VanDerWaalsContact CB-CD1 3.46Å; P235-W280 HydrophobicContact CB-CG 4.43Å
236	T	98.3	Very high	97.7	Very high	83 Å²	83	49.4 Å²	49.4	51%	0.509	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	172.2	167.1	57.3	0	0	0	0	110.7	Q278 H279 W280	T236-Q278 PolarHBondContact N-O 3.43Å; T236-Q278 PolarHBondContact OG1-O 3.25Å; T236-H279 WeakPolarHBondContact O-CA 3.47Å; T236-H279 PolarHBondContact OG1-ND1 3.38Å; T236-W280 PolarHBondContact O-N 3.23Å
237	G	97.9	Very high	97.8	Very high	48 Å²	48	44.9 Å²	44.9	50%	0.495	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	90.9	-156.6	174.6	0	0	0	0	0	114.4	A239 H279 W280	G237-A239 PolarHBondContact O-N 2.95Å; G237-H279 WeakPolarHBondContact CA-CE1 3.43Å; G237-W280 CarbonylContact C-O 3.48Å; G237-W280 WeakPolarHBondContact CA-O 3.39Å
238	A	97.1	Very high	97.9	Very high	48 Å²	48	42.2 Å²	42.2	40%	0.397	26%	0.26	S	S	.	.	S	Bend	trans	-89.6	79.1	-175.3	0	0	0	0	0	110.3	Y271 W280 L282	A238-Y271 WeakPolarHBondContact O-CD1 3.48Å; A238-Y271 VanDerWaalsContact O-CE1 3.22Å; A238-Y271 WeakPolarHBondContact O-CE1 3.49Å; A238-W280 PolarHBondContact N-O 3.45Å; A238-W280 WeakPolarHBondContact O-CB 3.45Å; A238-L282 HydrophobicContact CB-CB 4.17Å
239	A	96.3	Very high	97.9	Very high	59 Å²	59	41.1 Å²	41.1	49%	0.488	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-61	143.2	179.4	0	0	0	0	0	111.9	G237	G237-A239 PolarHBondContact O-N 2.95Å
240	P	97.3	Very high	97.9	Very high	9 Å²	9	38 Å²	38	6%	0.058	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-61.6	151.1	172.7	-17	28.9	0	0	0	111.9	I257 Y271 W280	P240-I257 HydrophobicContact CB-CD1 4.06Å; P240-I257 HydrophobicContact CG-CD1 3.5Å; P240-Y271 HydrophobicContact CB-CD1 4.46Å; P240-Y271 HydrophobicContact CB-CD2 4.19Å; P240-Y271 HydrophobicContact CB-CE1 4.3Å; P240-Y271 HydrophobicContact CB-CE2 4.03Å; P240-Y271 HydrophobicContact CB-CG 4.41Å; P240-Y271 HydrophobicContact CG-CD1 3.89Å; P240-Y271 HydrophobicContact CG-CD2 4.06Å; P240-Y271 HydrophobicContact CG-CE1 4.18Å; P240-Y271 HydrophobicContact CG-CE2 4.34Å; P240-Y271 HydrophobicContact CG-CG 3.83Å; P240-W280 HydrophobicContact CG-CD2 4.27Å; P240-W280 HydrophobicContact CG-CE3 4.27Å; P240-W280 HydrophobicContact CG-CH2 4.36Å; P240-W280 HydrophobicContact CG-CZ2 4.35Å; P240-W280 HydrophobicContact CG-CZ3 4.31Å
241	A	96.6	Very high	97.7	Very high	63 Å²	63	40.3 Å²	40.3	52%	0.521	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-69.8	163.2	167	0	0	0	0	0	110.6	C243	A241-C243 PolarHBondContact O-N 2.92Å
242	G	98.1	Very high	97.5	Very high	16 Å²	16	39.1 Å²	39.1	17%	0.165	27%	0.271	C	S	.	.	S	Bend	trans	-61.7	121.5	177.6	0	0	0	0	0	111.7	F216 Y217 T262	F216-G242 WeakPolarHBondContact CB-O 3.34Å; Y217-G242 CarbonylContact O-C 3.56Å; Y217-G242 WeakPolarHBondContact O-CA 3.02Å; G242-T262 WeakPolarHBondContact O-CG2 3.1Å
243	C	98.3	Very high	97.4	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.02	27%	0.267	C	S	.	.			trans	-145.4	160.1	-173.3	72	0	0	0	0	112.9	G210 Y217 A241 H246 M261 T262 L267	G210-C243 PolarHBondContact N-O 2.95Å; Y217-C243 PolarHBondContact O-N 2.91Å; Y217-C243 VanDerWaalsContact O-N 3.11Å; A241-C243 PolarHBondContact O-N 2.92Å; C243-H246 VanDerWaalsContact SG-CE1 3.56Å; C243-H246 PolarHBondContact SG-ND1 3.12Å; C243-H246 VanDerWaalsContact SG-ND1 3.39Å; C243-M261 WeakPolarHBondContact CA-O 3.47Å; C243-M261 WeakPolarHBondContact CB-O 3.38Å; C243-T262 HydrophobicContact CB-CG2 4.19Å; C243-L267 HydrophobicContact CB-CD1 3.69Å
244	A	98.2	Very high	97.3	Very high	4 Å²	4	39.2 Å²	39.2	3%	0.033	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-136.1	169.1	174.6	0	0	0	0	0	110.8	G195 L211 F216 H246 G260 M261	G195-A244 CarbonylContact O-C 3.56Å; G195-A244 VanDerWaalsContact O-CA 3.3Å; G195-A244 WeakPolarHBondContact O-CA 3.45Å; L211-A244 HydrophobicContact CB-CB 3.8Å; F216-A244 HydrophobicContact CD1-CB 3.98Å; F216-A244 HydrophobicContact CE1-CB 3.89Å; A244-H246 PolarHBondContact O-N 2.8Å; A244-H246 VanDerWaalsContact O-N 3.17Å; A244-G260 CarbonylContact O-C 3.5Å; A244-G260 WeakPolarHBondContact O-CA 3.27Å; A244-M261 PolarHBondContact N-O 3.11Å; A244-M261 PolarHBondContact O-N 2.99Å
245	A	98.1	Very high	97.4	Very high	8 Å²	8	33 Å²	33	7%	0.066	24%	0.238	C	C	.	.	S	Bend	trans	57	28.4	178.2	0	0	0	0	0	114.3	G195 G260 L294 D295	G195-A245 PolarHBondContact O-N 2.72Å; A245-G260 WeakPolarHBondContact O-CA 3.08Å; A245-L294 HydrophobicContact CB-CB 3.8Å; A245-L294 HydrophobicContact CB-CD1 4.14Å; A245-L294 CarbonylContact O-C 3.59Å; A245-L294 VanDerWaalsContact O-CA 3.32Å; A245-L294 WeakPolarHBondContact O-CA 3.34Å; A245-D295 WeakPolarHBondContact CB-OD1 3.01Å; A245-D295 PolarHBondContact O-N 3.19Å
246	H	98.5	Very high	97.4	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	23%	0.229	C	C	.	.			trans	-92.1	168.1	172.6	60.3	-74.3	0	0	0	110.1	T143 V197 H208 C243 A244 F258 G259	T143-H246 PolarHBondContact OG1-O 3.07Å; T143-H246 VanDerWaalsContact OG1-O 3.04Å; V197-H246 WeakPolarHBondContact CG1-CD2 3.08Å; V197-H246 WeakPolarHBondContact CG1-NE2 3.44Å; V197-H246 VanDerWaalsContact CG1-O 3.27Å; V197-H246 WeakPolarHBondContact CG1-O 3.44Å; V197-H246 WeakPolarHBondContact CG2-NE2 3.5Å; H208-H246 AromaticContact CE1-NE2 3.92Å; H208-H246 AromaticContact ND1-CE1 3.58Å; H208-H246 AromaticContact ND1-NE2 3.02Å; H208-H246 PolarHBondContact ND1-NE2 2.9Å; H208-H246 PolarHBondContact O-CE1 3.01Å; H208-H246 PolarHBondContact O-NE2 3.07Å; C243-H246 VanDerWaalsContact SG-CE1 3.56Å; C243-H246 PolarHBondContact SG-ND1 3.12Å; C243-H246 VanDerWaalsContact SG-ND1 3.39Å; A244-H246 PolarHBondContact O-N 2.8Å; A244-H246 VanDerWaalsContact O-N 3.17Å; H246-F258 WeakPolarHBondContact CB-O 3.49Å; H246-G259 VanDerWaalsContact CB-O 3.26Å; H246-G259 WeakPolarHBondContact CB-O 3.29Å
247	S	98.6	Very high	97.4	Very high	2 Å²	2	28 Å²	28	1%	0.014	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	159.5	175.8	-76.5	0	0	0	0	112.3	T143 I257 F258 H296 M298	T143-S247 WeakPolarHBondContact CG2-OG 3.46Å; S247-I257 VanDerWaalsContact O-CA 3.28Å; S247-I257 WeakPolarHBondContact O-CA 3.49Å; S247-F258 PolarHBondContact N-O 2.75Å; S247-F258 VanDerWaalsContact N-O 3.16Å; S247-F258 PolarHBondContact O-N 2.98Å; S247-H296 WeakPolarHBondContact CB-NE2 3.48Å; S247-H296 PolarHBondContact OG-O 3.36Å; S247-M298 WeakPolarHBondContact CB-SD 3.27Å
248	A	98.4	Very high	97.5	Very high	20 Å²	20	25.8 Å²	25.8	17%	0.165	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	151	179.6	0	0	0	0	0	112.6	V197 V199 Y256 I257	V197-A248 HydrophobicContact CB-CB 3.71Å; V197-A248 HydrophobicContact CG1-CB 3.79Å; V197-A248 HydrophobicContact CG2-CB 3.96Å; V199-A248 HydrophobicContact CB-CB 4.2Å; V199-A248 HydrophobicContact CG1-CB 4.4Å; A248-Y256 CarbonylContact C-O 3.5Å; A248-Y256 WeakPolarHBondContact CA-O 3.39Å; A248-I257 HydrophobicContact CB-CG2 3.9Å
249	V	98.1	Very high	97.5	Very high	12 Å²	12	23.7 Å²	23.7	7%	0.073	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150	169	-68.5	0	0	0	0	109.2	Y256 M298 I300	V249-Y256 HydrophobicContact CG2-CD2 4.35Å; V249-Y256 PolarHBondContact N-O 2.97Å; V249-Y256 PolarHBondContact O-N 2.92Å; V249-M298 HydrophobicContact CG1-CB 3.67Å; V249-M298 HydrophobicContact CG2-CE 4.05Å; V249-I300 HydrophobicContact CB-CD1 3.96Å; V249-I300 HydrophobicContact CB-CG1 4.07Å; V249-I300 HydrophobicContact CG1-CD1 4.35Å; V249-I300 HydrophobicContact CG1-CG1 4.44Å; V249-I300 HydrophobicContact CG2-CD1 3.56Å; V249-I300 HydrophobicContact CG2-CG1 4.22Å
250	A	97.5	Very high	97.6	Very high	27 Å²	27	20.9 Å²	20.9	22%	0.223	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.3	172.6	0	0	0	0	0	110.5	V199 A200 A201 H254 V255	V199-A250 HydrophobicContact CG2-CB 3.68Å; A200-A250 WeakPolarHBondContact O-CB 3.41Å; A201-A250 HydrophobicContact CB-CB 4.19Å; A250-H254 CarbonylContact C-O 3.51Å; A250-H254 WeakPolarHBondContact CA-O 3.2Å; A250-V255 HydrophobicContact CB-CG2 4.23Å
251	M	95.2	Very high	97.7	Very high	56 Å²	56	22.8 Å²	22.8	28%	0.276	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	127.2	172.5	-174.6	49.8	62.3	0	0	109.9	K253 H254 Y256 I300 L348	M251-K253 PolarHBondContact O-N 2.91Å; M251-K253 VanDerWaalsContact O-N 3.14Å; M251-H254 PolarHBondContact N-O 2.88Å; M251-H254 PolarHBondContact O-N 3.02Å; M251-Y256 HydrophobicContact CB-CE2 4.31Å; M251-I300 HydrophobicContact CE-CB 4.13Å; M251-I300 HydrophobicContact CE-CG1 4.14Å; M251-I300 HydrophobicContact CE-CG2 3.76Å; M251-L348 HydrophobicContact CE-CD1 3.91Å; M251-L348 HydrophobicContact CG-CD1 3.76Å; M251-L348 HydrophobicContact SD-CD1 3.67Å
252	G	93.5	Very high	97.7	Very high	66 Å²	66	20.6 Å²	20.6	68%	0.68	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	-119.2	-176	0	0	0	0	0	111.9
253	K	95.5	Very high	97.6	Very high	98 Å²	98	25.2 Å²	25.2	43%	0.426	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	3.2	179.2	-61.6	179.8	178	-162.6	0	113.3	M251 T275 E276	M251-K253 PolarHBondContact O-N 2.91Å; M251-K253 VanDerWaalsContact O-N 3.14Å; K253-T275 WeakPolarHBondContact O-CB 3.46Å; K253-T275 WeakPolarHBondContact O-CG2 3.45Å; K253-T275 PolarHBondContact O-N 3.37Å; K253-T275 PolarHBondContact O-OG1 2.97Å; K253-E276 VanDerWaalsContact CD-CD 3.48Å; K253-E276 HydrophobicContact CD-CG 4.28Å; K253-E276 WeakPolarHBondContact CD-OE1 3.21Å; K253-E276 WeakPolarHBondContact CD-OE2 3.37Å; K253-E276 VanDerWaalsContact CE-CD 3.44Å; K253-E276 WeakPolarHBondContact CE-OE1 3.36Å; K253-E276 WeakPolarHBondContact CE-OE2 3.18Å; K253-E276 VanDerWaalsContact NZ-CD 3.27Å; K253-E276 IonicContact NZ-OE1 3.94Å; K253-E276 PolarHBondContact NZ-OE1 3.1Å; K253-E276 VanDerWaalsContact NZ-OE1 3.14Å; K253-E276 IonicContact NZ-OE2 3.58Å; K253-E276 PolarHBondContact NZ-OE2 3.17Å
254	H	97.5	Very high	97.6	Very high	33 Å²	33	29.9 Å²	29.9	15%	0.153	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.9	-171.3	-58.2	112.3	0	0	0	112.1	A250 M251 Y256 Q272 Y273 H274 D372	A250-H254 CarbonylContact C-O 3.51Å; A250-H254 WeakPolarHBondContact CA-O 3.2Å; M251-H254 PolarHBondContact N-O 2.88Å; M251-H254 PolarHBondContact O-N 3.02Å; H254-Y256 HydrophobicContact CB-CD2 4.3Å; H254-Y256 HydrophobicContact CB-CE2 3.6Å; H254-Q272 HydrophobicContact CB-CG 4.02Å; H254-Q272 PolarHBondContact CD2-NE2 2.9Å; H254-Q272 VanDerWaalsContact CD2-NE2 3.35Å; H254-Y273 VanDerWaalsContact CA-O 3.31Å; H254-Y273 WeakPolarHBondContact CA-O 3.25Å; H254-H274 AromaticContact CD2-CD2 3.95Å; H254-H274 AromaticContact NE2-CD2 3.39Å; H254-H274 PolarHBondContact NE2-CD2 3.18Å; H254-D372 PolarHBondContact ND1-O 3.25Å
255	V	98.2	Very high	97.5	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.03	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.3	161.3	167	0	0	0	0	107.6	V199 F206 A250 I257 Q272 Y273 T275	V199-V255 HydrophobicContact CG1-CB 4.37Å; V199-V255 HydrophobicContact CG1-CG1 3.65Å; V199-V255 HydrophobicContact CG1-CG2 3.77Å; F206-V255 HydrophobicContact CD2-CG2 4.34Å; A250-V255 HydrophobicContact CB-CG2 4.23Å; V255-I257 HydrophobicContact CG1-CG2 4.27Å; V255-Q272 CarbonylContact O-C 3.54Å; V255-Q272 WeakPolarHBondContact O-CA 3.31Å; V255-Y273 HydrophobicContact CB-CD1 4.48Å; V255-Y273 PolarHBondContact N-O 2.75Å; V255-Y273 PolarHBondContact O-N 2.81Å; V255-T275 HydrophobicContact CG2-CG2 4.03Å
256	Y	98.5	Very high	97.5	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134	174.4	-59.8	-87.7	0	0	0	109.1	A248 V249 M251 H254 M270 Y271 Q272 L283 V371 D372	A248-Y256 CarbonylContact C-O 3.5Å; A248-Y256 WeakPolarHBondContact CA-O 3.39Å; V249-Y256 HydrophobicContact CG2-CD2 4.35Å; V249-Y256 PolarHBondContact N-O 2.97Å; V249-Y256 PolarHBondContact O-N 2.92Å; M251-Y256 HydrophobicContact CB-CE2 4.31Å; H254-Y256 HydrophobicContact CB-CD2 4.3Å; H254-Y256 HydrophobicContact CB-CE2 3.6Å; Y256-M270 HydrophobicContact CD1-CE 3.7Å; Y256-M270 HydrophobicContact CG-CE 3.93Å; Y256-Y271 VanDerWaalsContact CA-O 3.3Å; Y256-Y271 WeakPolarHBondContact CA-O 3.43Å; Y256-Q272 HydrophobicContact CD1-CB 3.93Å; Y256-Q272 HydrophobicContact CD1-CG 3.99Å; Y256-Q272 HydrophobicContact CE1-CB 3.89Å; Y256-Q272 HydrophobicContact CE1-CG 3.58Å; Y256-Q272 PolarHBondContact OH-NE2 2.78Å; Y256-L283 HydrophobicContact CD1-CD1 4.08Å; Y256-L283 HydrophobicContact CE1-CD1 4.18Å; Y256-V371 HydrophobicContact CD1-CG1 4.18Å; Y256-V371 HydrophobicContact CD2-CB 4.42Å; Y256-V371 HydrophobicContact CD2-CG1 4.2Å; Y256-V371 HydrophobicContact CE1-CB 4.3Å; Y256-V371 HydrophobicContact CE1-CG1 4.06Å; Y256-V371 HydrophobicContact CE2-CB 3.87Å; Y256-V371 HydrophobicContact CE2-CG1 4.1Å; Y256-V371 HydrophobicContact CG-CG1 4.23Å; Y256-D372 PolarHBondContact OH-N 3.03Å; Y256-D372 PolarHBondContact OH-O 2.85Å
257	I	98.5	Very high	97.5	Very high	5 Å²	5	33 Å²	33	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.9	170.6	66.3	169	0	0	0	110.1	V197 P240 S247 A248 V255 M270 Y271 W280	V197-I257 HydrophobicContact CG2-CG2 4.3Å; P240-I257 HydrophobicContact CB-CD1 4.06Å; P240-I257 HydrophobicContact CG-CD1 3.5Å; S247-I257 VanDerWaalsContact O-CA 3.28Å; S247-I257 WeakPolarHBondContact O-CA 3.49Å; A248-I257 HydrophobicContact CB-CG2 3.9Å; V255-I257 HydrophobicContact CG1-CG2 4.27Å; I257-M270 CarbonylContact O-C 3.41Å; I257-M270 VanDerWaalsContact O-CA 3.32Å; I257-M270 WeakPolarHBondContact O-CA 3.36Å; I257-M270 WeakPolarHBondContact O-CG 3.47Å; I257-Y271 HydrophobicContact CD1-CD2 4.4Å; I257-Y271 HydrophobicContact CG1-CD2 4.36Å; I257-Y271 HydrophobicContact CG1-CG 4.46Å; I257-Y271 PolarHBondContact N-O 3.5Å; I257-Y271 PolarHBondContact O-N 3.44Å; I257-W280 HydrophobicContact CD1-CH2 3.87Å; I257-W280 HydrophobicContact CD1-CZ3 4.07Å; I257-W280 HydrophobicContact CG1-CH2 4.08Å; I257-W280 HydrophobicContact CG1-CZ3 3.97Å; I257-W280 HydrophobicContact CG2-CH2 4.18Å
258	F	98.6	Very high	97.5	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	144.2	-179.9	174.8	-105.4	0	0	0	111.9	W18 H246 S247 D268 T269 M270 P290 R293 H296 M298 V352 I367	W18-F258 HydrophobicContact CH2-CD2 4.3Å; W18-F258 HydrophobicContact CH2-CE2 4.24Å; W18-F258 HydrophobicContact CH2-CG 4.45Å; W18-F258 HydrophobicContact CH2-CZ 4.37Å; W18-F258 AromaticContact CZ2-CD2 3.86Å; W18-F258 HydrophobicContact CZ2-CD2 3.86Å; W18-F258 AromaticContact CZ2-CE2 3.74Å; W18-F258 HydrophobicContact CZ2-CE2 3.74Å; W18-F258 HydrophobicContact CZ2-CG 4.43Å; W18-F258 HydrophobicContact CZ2-CZ 4.26Å; H246-F258 WeakPolarHBondContact CB-O 3.49Å; S247-F258 PolarHBondContact N-O 2.75Å; S247-F258 VanDerWaalsContact N-O 3.16Å; S247-F258 PolarHBondContact O-N 2.98Å; F258-D268 VanDerWaalsContact CE2-O 3.31Å; F258-D268 WeakPolarHBondContact CE2-O 3.29Å; F258-T269 WeakPolarHBondContact CD2-O 3.31Å; F258-M270 HydrophobicContact CB-CG 4.24Å; F258-M270 HydrophobicContact CD2-CB 3.91Å; F258-M270 HydrophobicContact CD2-CG 4.38Å; F258-P290 HydrophobicContact CE2-CG 3.88Å; F258-P290 HydrophobicContact CZ-CB 4.42Å; F258-P290 HydrophobicContact CZ-CG 3.46Å; F258-P290 VanDerWaalsContact CZ-CG 3.46Å; F258-R293 HydrophobicContact CE1-CG 3.94Å; F258-R293 HydrophobicContact CZ-CG 4.46Å; F258-H296 AromaticContact CD1-NE2 3.49Å; F258-H296 WeakPolarHBondContact CD1-NE2 3.36Å; F258-H296 PolarHBondContact O-CE1 3.19Å; F258-H296 PolarHBondContact O-NE2 3.06Å; F258-M298 HydrophobicContact CB-CE 3.78Å; F258-M298 HydrophobicContact CB-SD 3.79Å; F258-M298 HydrophobicContact CD1-SD 4.48Å; F258-V352 HydrophobicContact CD1-CG1 4.38Å; F258-V352 HydrophobicContact CD1-CG2 3.77Å; F258-V352 HydrophobicContact CE1-CG1 4.17Å; F258-V352 HydrophobicContact CE1-CG2 4.05Å; F258-I367 HydrophobicContact CE1-CD1 4.29Å; F258-I367 HydrophobicContact CZ-CD1 4.32Å
259	G	98.5	Very high	97.5	Very high	4 Å²	4	36.4 Å²	36.4	4%	0.041	24%	0.236	C	C	.	.			trans	65.9	-146.6	174.4	0	0	0	0	0	114.4	H246 L267 T269 R293	H246-G259 VanDerWaalsContact CB-O 3.26Å; H246-G259 WeakPolarHBondContact CB-O 3.29Å; G259-L267 VanDerWaalsContact CA-O 3.3Å; G259-L267 WeakPolarHBondContact CA-O 3.43Å; G259-T269 PolarHBondContact N-O 3.38Å; G259-R293 CarbonylContact C-O 3.6Å; G259-R293 WeakPolarHBondContact CA-O 3.37Å
260	G	98.4	Very high	97.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.233	C	C	.	.			trans	97.3	-164.2	-171.8	0	0	0	0	0	113.2	A244 A245 A266 L267 R293	A244-G260 CarbonylContact O-C 3.5Å; A244-G260 WeakPolarHBondContact O-CA 3.27Å; A245-G260 WeakPolarHBondContact O-CA 3.08Å; G260-A266 CarbonylContact O-C 3.55Å; G260-A266 WeakPolarHBondContact O-CA 3.25Å; G260-L267 PolarHBondContact O-N 3.31Å; G260-R293 PolarHBondContact N-O 2.77Å
261	M	97.9	Very high	97.5	Very high	49 Å²	49	36.1 Å²	36.1	24%	0.241	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.4	177.9	63.6	168	-61	0	0	111.6	F216 C243 A244 G265 L294 T358	F216-M261 HydrophobicContact CE1-CE 4.19Å; F216-M261 HydrophobicContact CE1-CG 3.98Å; F216-M261 WeakPolarHBondContact CE1-O 3.39Å; F216-M261 HydrophobicContact CE1-SD 4.42Å; F216-M261 HydrophobicContact CZ-CE 3.73Å; F216-M261 HydrophobicContact CZ-CG 4.48Å; F216-M261 HydrophobicContact CZ-SD 4.47Å; C243-M261 WeakPolarHBondContact CA-O 3.47Å; C243-M261 WeakPolarHBondContact CB-O 3.38Å; A244-M261 PolarHBondContact N-O 3.11Å; A244-M261 PolarHBondContact O-N 2.99Å; M261-G265 WeakPolarHBondContact CA-O 3.44Å; M261-L294 HydrophobicContact CB-CB 4.43Å; M261-L294 HydrophobicContact CB-CD1 4.3Å; M261-L294 HydrophobicContact CB-CD2 4.35Å; M261-L294 HydrophobicContact CG-CD1 4.12Å; M261-L294 HydrophobicContact SD-CD1 3.79Å; M261-T358 HydrophobicContact CB-CG2 4.5Å
262	T	97.9	Very high	97.7	Very high	18 Å²	18	34.9 Å²	34.9	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	177.4	169.5	70.9	0	0	0	0	108.4	G242 C243 A264 G265 L267	G242-T262 WeakPolarHBondContact O-CG2 3.1Å; C243-T262 HydrophobicContact CB-CG2 4.19Å; T262-A264 PolarHBondContact O-N 3.21Å; T262-A264 VanDerWaalsContact O-N 3.08Å; T262-A264 PolarHBondContact OG1-N 3.49Å; T262-A264 VanDerWaalsContact OG1-N 3.1Å; T262-G265 PolarHBondContact N-O 3.35Å; T262-G265 PolarHBondContact O-N 2.93Å; T262-G265 VanDerWaalsContact O-N 3.17Å; T262-L267 HydrophobicContact CG2-CD1 3.74Å; T262-L267 HydrophobicContact CG2-CD2 3.8Å; T262-L267 HydrophobicContact CG2-CG 3.91Å
263	P	96.3	Very high	97.9	Very high	112 Å²	112	31.8 Å²	31.8	73%	0.727	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.2	169.7	-25.3	35.9	0	0	0	114.2	F216	F216-P263 VanDerWaalsContact CD2-CD 3.49Å; F216-P263 HydrophobicContact CD2-CG 3.55Å; F216-P263 HydrophobicContact CE2-CG 3.69Å; F216-P263 HydrophobicContact CG-CG 4.48Å
264	A	96.8	Very high	98	Very high	102 Å²	102	28.5 Å²	28.5	84%	0.843	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-11.2	-178.6	0	0	0	0	0	114.2	T262	T262-A264 PolarHBondContact O-N 3.21Å; T262-A264 VanDerWaalsContact O-N 3.08Å; T262-A264 PolarHBondContact OG1-N 3.49Å; T262-A264 VanDerWaalsContact OG1-N 3.1Å
265	G	97.7	Very high	98	Very high	14 Å²	14	28.1 Å²	28.1	14%	0.144	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.9	-174.2	-177.7	0	0	0	0	0	114.1	M261 T262	M261-G265 WeakPolarHBondContact CA-O 3.44Å; T262-G265 PolarHBondContact N-O 3.35Å; T262-G265 PolarHBondContact O-N 2.93Å; T262-G265 VanDerWaalsContact O-N 3.17Å
266	A	98.3	Very high	97.9	Very high	27 Å²	27	33.7 Å²	33.7	22%	0.223	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	144.7	173	0	0	0	0	0	111.8	G260 L294 N357 T358	G260-A266 CarbonylContact O-C 3.55Å; G260-A266 WeakPolarHBondContact O-CA 3.25Å; A266-L294 HydrophobicContact CB-CD2 4.01Å; A266-N357 HydrophobicContact CB-CB 4.42Å; A266-T358 HydrophobicContact CB-CG2 4.21Å; A266-T358 PolarHBondContact N-OG1 3.09Å
267	L	98.4	Very high	97.8	Very high	37 Å²	37	39.8 Å²	39.8	19%	0.194	23%	0.23	C	C	.	.			trans	-100.1	145.7	-179.8	-63.7	176.9	0	0	0	111.2	C243 G259 G260 T262 G292 R293	C243-L267 HydrophobicContact CB-CD1 3.69Å; G259-L267 VanDerWaalsContact CA-O 3.3Å; G259-L267 WeakPolarHBondContact CA-O 3.43Å; G260-L267 PolarHBondContact O-N 3.31Å; T262-L267 HydrophobicContact CG2-CD1 3.74Å; T262-L267 HydrophobicContact CG2-CD2 3.8Å; T262-L267 HydrophobicContact CG2-CG 3.91Å; L267-G292 VanDerWaalsContact C-CA 3.49Å; L267-G292 CarbonylContact O-C 3.45Å; L267-G292 WeakPolarHBondContact O-CA 3.39Å; L267-R293 PolarHBondContact O-N 2.86Å
268	D	97.5	Very high	97.8	Very high	60 Å²	60	43.3 Å²	43.3	32%	0.321	25%	0.246	S	C	.	.			trans	-119.1	6.8	174.8	59.8	-0.1	0	0	0	112.7	F258 L289 P290	F258-D268 VanDerWaalsContact CE2-O 3.31Å; F258-D268 WeakPolarHBondContact CE2-O 3.29Å; D268-L289 HydrophobicContact CB-CB 4.29Å; D268-L289 HydrophobicContact CB-CD1 4.45Å; D268-P290 VanDerWaalsContact CB-O 3.3Å; D268-P290 WeakPolarHBondContact CB-O 3.22Å
269	T	98.1	Very high	97.8	Very high	34 Å²	34	46.3 Å²	46.3	21%	0.209	26%	0.26	C	S	.	.			trans	-85	142.1	-175.4	51.1	0	0	0	0	112	F258 G259 Y271 L282	F258-T269 WeakPolarHBondContact CD2-O 3.31Å; G259-T269 PolarHBondContact N-O 3.38Å; T269-Y271 WeakPolarHBondContact OG1-CE2 3.5Å; T269-L282 HydrophobicContact CG2-CD1 4.3Å
270	M	98.3	Very high	97.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131	170.6	-165.7	174.6	-179.5	0	0	110.3	W18 Y256 I257 F258 L283 F285 C350 T369 V371	W18-M270 HydrophobicContact CH2-SD 4.38Å; W18-M270 HydrophobicContact CZ2-SD 3.84Å; Y256-M270 HydrophobicContact CD1-CE 3.7Å; Y256-M270 HydrophobicContact CG-CE 3.93Å; I257-M270 CarbonylContact O-C 3.41Å; I257-M270 VanDerWaalsContact O-CA 3.32Å; I257-M270 WeakPolarHBondContact O-CA 3.36Å; I257-M270 WeakPolarHBondContact O-CG 3.47Å; F258-M270 HydrophobicContact CB-CG 4.24Å; F258-M270 HydrophobicContact CD2-CB 3.91Å; F258-M270 HydrophobicContact CD2-CG 4.38Å; M270-L283 HydrophobicContact CB-CB 4.47Å; M270-L283 HydrophobicContact CB-CD1 4.4Å; M270-L283 HydrophobicContact CE-CD1 4.32Å; M270-L283 HydrophobicContact CG-CD1 3.92Å; M270-L283 WeakPolarHBondContact O-CB 3.29Å; M270-L283 PolarHBondContact O-N 2.86Å; M270-L283 HydrophobicContact SD-CD1 3.93Å; M270-F285 HydrophobicContact CB-CE2 3.97Å; M270-F285 HydrophobicContact CB-CZ 4.08Å; M270-F285 HydrophobicContact SD-CZ 3.86Å; M270-C350 HydrophobicContact CE-CB 4.4Å; M270-T369 HydrophobicContact CE-CG2 4.13Å; M270-T369 HydrophobicContact SD-CG2 3.79Å; M270-V371 HydrophobicContact CE-CG1 3.9Å
271	Y	98.4	Very high	97.8	Very high	32 Å²	32	49 Å²	49	13%	0.125	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	149.6	175.6	-65.8	-103.9	0	0	0	110.4	A238 P240 Y256 I257 T269 T281 L282	A238-Y271 WeakPolarHBondContact O-CD1 3.48Å; A238-Y271 VanDerWaalsContact O-CE1 3.22Å; A238-Y271 WeakPolarHBondContact O-CE1 3.49Å; P240-Y271 HydrophobicContact CB-CD1 4.46Å; P240-Y271 HydrophobicContact CB-CD2 4.19Å; P240-Y271 HydrophobicContact CB-CE1 4.3Å; P240-Y271 HydrophobicContact CB-CE2 4.03Å; P240-Y271 HydrophobicContact CB-CG 4.41Å; P240-Y271 HydrophobicContact CG-CD1 3.89Å; P240-Y271 HydrophobicContact CG-CD2 4.06Å; P240-Y271 HydrophobicContact CG-CE1 4.18Å; P240-Y271 HydrophobicContact CG-CE2 4.34Å; P240-Y271 HydrophobicContact CG-CG 3.83Å; Y256-Y271 VanDerWaalsContact CA-O 3.3Å; Y256-Y271 WeakPolarHBondContact CA-O 3.43Å; I257-Y271 HydrophobicContact CD1-CD2 4.4Å; I257-Y271 HydrophobicContact CG1-CD2 4.36Å; I257-Y271 HydrophobicContact CG1-CG 4.46Å; I257-Y271 PolarHBondContact N-O 3.5Å; I257-Y271 PolarHBondContact O-N 3.44Å; T269-Y271 WeakPolarHBondContact OG1-CE2 3.5Å; Y271-T281 WeakPolarHBondContact CA-O 3.08Å; Y271-L282 HydrophobicContact CD1-CB 4.05Å; Y271-L282 HydrophobicContact CD1-CD1 4.18Å; Y271-L282 HydrophobicContact CD2-CD1 4.32Å; Y271-L282 HydrophobicContact CE1-CB 3.85Å; Y271-L282 HydrophobicContact CE1-CD1 3.85Å; Y271-L282 HydrophobicContact CE1-CG 4.34Å; Y271-L282 HydrophobicContact CE2-CD1 3.99Å; Y271-L282 HydrophobicContact CG-CD1 4.4Å
272	Q	98.2	Very high	97.8	Very high	30 Å²	30	50 Å²	50	14%	0.14	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.3	172.8	-178.8	-170.2	49.7	0	0	108.8	H254 V255 Y256 W280 T281 L283	H254-Q272 HydrophobicContact CB-CG 4.02Å; H254-Q272 PolarHBondContact CD2-NE2 2.9Å; H254-Q272 VanDerWaalsContact CD2-NE2 3.35Å; V255-Q272 CarbonylContact O-C 3.54Å; V255-Q272 WeakPolarHBondContact O-CA 3.31Å; Y256-Q272 HydrophobicContact CD1-CB 3.93Å; Y256-Q272 HydrophobicContact CD1-CG 3.99Å; Y256-Q272 HydrophobicContact CE1-CB 3.89Å; Y256-Q272 HydrophobicContact CE1-CG 3.58Å; Y256-Q272 PolarHBondContact OH-NE2 2.78Å; Q272-W280 CarbonylContact O-C 3.57Å; Q272-W280 WeakPolarHBondContact O-CA 3.5Å; Q272-T281 PolarHBondContact N-O 3.22Å; Q272-T281 PolarHBondContact O-N 2.99Å; Q272-L283 HydrophobicContact CB-CD1 4.29Å; Q272-L283 HydrophobicContact CB-CD2 3.87Å; Q272-L283 HydrophobicContact CB-CG 4.13Å
273	Y	98.5	Very high	97.8	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.4	172.7	178.4	-113.4	0	0	0	109.9	F206 L220 L233 P235 H254 V255 T275 Q278 H279 W280	F206-Y273 HydrophobicContact CD1-CE1 4.05Å; F206-Y273 AromaticContact CE1-CE1 3.71Å; F206-Y273 HydrophobicContact CE1-CE1 3.71Å; F206-Y273 HydrophobicContact CZ-CE1 4.38Å; L220-Y273 HydrophobicContact CD2-CD1 4.25Å; L220-Y273 HydrophobicContact CD2-CD2 4.11Å; L220-Y273 HydrophobicContact CD2-CE1 3.8Å; L220-Y273 HydrophobicContact CD2-CE2 3.65Å; L220-Y273 HydrophobicContact CD2-CG 4.38Å; L220-Y273 VanDerWaalsContact CD2-CZ 3.47Å; L233-Y273 WeakPolarHBondContact CD1-OH 3.27Å; P235-Y273 HydrophobicContact CB-CD2 4.41Å; P235-Y273 HydrophobicContact CB-CE2 3.77Å; P235-Y273 HydrophobicContact CG-CD2 4.39Å; P235-Y273 HydrophobicContact CG-CE2 3.6Å; H254-Y273 VanDerWaalsContact CA-O 3.31Å; H254-Y273 WeakPolarHBondContact CA-O 3.25Å; V255-Y273 HydrophobicContact CB-CD1 4.48Å; V255-Y273 PolarHBondContact N-O 2.75Å; V255-Y273 PolarHBondContact O-N 2.81Å; Y273-T275 HydrophobicContact CD1-CG2 4Å; Y273-T275 HydrophobicContact CE1-CG2 4.14Å; Y273-T275 PolarHBondContact O-N 2.67Å; Y273-Q278 HydrophobicContact CE2-CB 4.28Å; Y273-Q278 WeakPolarHBondContact OH-CA 3.45Å; Y273-Q278 WeakPolarHBondContact OH-CB 3.27Å; Y273-Q278 WeakPolarHBondContact OH-CG 3.41Å; Y273-H279 WeakPolarHBondContact CA-O 3.24Å; Y273-W280 VanDerWaalsContact CB-CZ3 3.45Å; Y273-W280 AromaticContact CD2-CD2 3.81Å; Y273-W280 HydrophobicContact CD2-CD2 3.81Å; Y273-W280 AromaticContact CD2-CE2 3.71Å; Y273-W280 HydrophobicContact CD2-CE3 4.41Å; Y273-W280 HydrophobicContact CD2-CG 4.01Å; Y273-W280 HydrophobicContact CD2-CZ2 4.21Å; Y273-W280 AromaticContact CD2-NE1 3.85Å; Y273-W280 HydrophobicContact CG-CD2 4.23Å; Y273-W280 HydrophobicContact CG-CE3 4.44Å; Y273-W280 HydrophobicContact CG-CH2 4.36Å; Y273-W280 HydrophobicContact CG-CZ2 4.13Å
274	H	98	Very high	97.8	Very high	29 Å²	29	54.2 Å²	54.2	13%	0.134	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	111.5	171.3	-168	-56	0	0	0	109.5	H254 E276 E277 Q278 H279	H254-H274 AromaticContact CD2-CD2 3.95Å; H254-H274 AromaticContact NE2-CD2 3.39Å; H254-H274 PolarHBondContact NE2-CD2 3.18Å; H274-E276 PolarHBondContact ND1-N 3.28Å; H274-E276 PolarHBondContact O-N 2.8Å; H274-E277 HydrophobicContact CB-CB 4.17Å; H274-E277 IonicContact CD2-OE2 3.96Å; H274-E277 IonicContact CG-OE2 3.78Å; H274-E277 PolarHBondContact ND1-N 2.79Å; H274-Q278 VanDerWaalsContact O-CA 3.3Å; H274-Q278 WeakPolarHBondContact O-CA 3.4Å; H274-Q278 PolarHBondContact O-N 2.97Å; H274-H279 PolarHBondContact N-O 3.48Å; H274-H279 PolarHBondContact O-N 3Å
275	T	97	Very high	97.8	Very high	24 Å²	24	50.9 Å²	50.9	15%	0.147	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-34.2	-170.1	55.4	0	0	0	0	114.3	A201 F206 K253 V255 Y273	A201-T275 HydrophobicContact CB-CG2 4.28Å; F206-T275 HydrophobicContact CE2-CG2 3.87Å; F206-T275 HydrophobicContact CZ-CG2 3.82Å; K253-T275 WeakPolarHBondContact O-CB 3.46Å; K253-T275 WeakPolarHBondContact O-CG2 3.45Å; K253-T275 PolarHBondContact O-N 3.37Å; K253-T275 PolarHBondContact O-OG1 2.97Å; V255-T275 HydrophobicContact CG2-CG2 4.03Å; Y273-T275 HydrophobicContact CD1-CG2 4Å; Y273-T275 HydrophobicContact CE1-CG2 4.14Å; Y273-T275 PolarHBondContact O-N 2.67Å
276	E	96.1	Very high	97.6	Very high	122 Å²	122	57.1 Å²	57.1	57%	0.57	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-47.4	178.1	-55.1	177.7	171.1	0	0	112.5	K253 H274 Q278	K253-E276 VanDerWaalsContact CD-CD 3.48Å; K253-E276 HydrophobicContact CD-CG 4.28Å; K253-E276 WeakPolarHBondContact CD-OE1 3.21Å; K253-E276 WeakPolarHBondContact CD-OE2 3.37Å; K253-E276 VanDerWaalsContact CE-CD 3.44Å; K253-E276 WeakPolarHBondContact CE-OE1 3.36Å; K253-E276 WeakPolarHBondContact CE-OE2 3.18Å; K253-E276 VanDerWaalsContact NZ-CD 3.27Å; K253-E276 IonicContact NZ-OE1 3.94Å; K253-E276 PolarHBondContact NZ-OE1 3.1Å; K253-E276 VanDerWaalsContact NZ-OE1 3.14Å; K253-E276 IonicContact NZ-OE2 3.58Å; K253-E276 PolarHBondContact NZ-OE2 3.17Å; H274-E276 PolarHBondContact ND1-N 3.28Å; H274-E276 PolarHBondContact O-N 2.8Å; E276-Q278 VanDerWaalsContact C-N 3.26Å; E276-Q278 PolarHBondContact O-N 2.68Å
277	E	97.3	Very high	97.3	Very high	133 Å²	133	57.6 Å²	57.6	62%	0.621	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.9	177.7	-62.7	-179.3	174.7	0	0	113.9	H274 H279	H274-E277 HydrophobicContact CB-CB 4.17Å; H274-E277 IonicContact CD2-OE2 3.96Å; H274-E277 IonicContact CG-OE2 3.78Å; H274-E277 PolarHBondContact ND1-N 2.79Å; E277-H279 HydrophobicContact CB-CB 4.28Å; E277-H279 PolarHBondContact O-N 3.28Å
278	Q	97.8	Very high	97	Very high	78 Å²	78	59.7 Å²	59.7	36%	0.364	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	53.1	-172.1	-52.4	-168.6	19.4	0	0	112.3	P235 T236 Y273 H274 E276	P235-Q278 CarbonylContact C-O 3.57Å; P235-Q278 VanDerWaalsContact CA-O 3.22Å; P235-Q278 WeakPolarHBondContact CA-O 3.21Å; P235-Q278 WeakPolarHBondContact CB-O 3.49Å; T236-Q278 PolarHBondContact N-O 3.43Å; T236-Q278 PolarHBondContact OG1-O 3.25Å; Y273-Q278 HydrophobicContact CE2-CB 4.28Å; Y273-Q278 WeakPolarHBondContact OH-CA 3.45Å; Y273-Q278 WeakPolarHBondContact OH-CB 3.27Å; Y273-Q278 WeakPolarHBondContact OH-CG 3.41Å; H274-Q278 VanDerWaalsContact O-CA 3.3Å; H274-Q278 WeakPolarHBondContact O-CA 3.4Å; H274-Q278 PolarHBondContact O-N 2.97Å; E276-Q278 VanDerWaalsContact C-N 3.26Å; E276-Q278 PolarHBondContact O-N 2.68Å
279	H	98.5	Very high	96.9	Very high	65 Å²	65	60 Å²	60	30%	0.301	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.8	-176.1	-162.6	83.9	0	0	0	111.2	T236 G237 Y273 H274 E277	T236-H279 WeakPolarHBondContact O-CA 3.47Å; T236-H279 PolarHBondContact OG1-ND1 3.38Å; G237-H279 WeakPolarHBondContact CA-CE1 3.43Å; Y273-H279 WeakPolarHBondContact CA-O 3.24Å; H274-H279 PolarHBondContact N-O 3.48Å; H274-H279 PolarHBondContact O-N 3Å; E277-H279 HydrophobicContact CB-CB 4.28Å; E277-H279 PolarHBondContact O-N 3.28Å
280	W	98.6	Very high	96.8	Very high	6 Å²	6	58.5 Å²	58.5	2%	0.023	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132.9	170.9	-80.1	117.2	0	0	0	111.4	L220 P235 T236 G237 A238 P240 I257 Q272 Y273	L220-W280 HydrophobicContact CD1-CZ2 4.36Å; L220-W280 HydrophobicContact CD2-CZ2 4.3Å; P235-W280 VanDerWaalsContact CB-CD1 3.46Å; P235-W280 HydrophobicContact CB-CG 4.43Å; T236-W280 PolarHBondContact O-N 3.23Å; G237-W280 CarbonylContact C-O 3.48Å; G237-W280 WeakPolarHBondContact CA-O 3.39Å; A238-W280 PolarHBondContact N-O 3.45Å; A238-W280 WeakPolarHBondContact O-CB 3.45Å; P240-W280 HydrophobicContact CG-CD2 4.27Å; P240-W280 HydrophobicContact CG-CE3 4.27Å; P240-W280 HydrophobicContact CG-CH2 4.36Å; P240-W280 HydrophobicContact CG-CZ2 4.35Å; P240-W280 HydrophobicContact CG-CZ3 4.31Å; I257-W280 HydrophobicContact CD1-CH2 3.87Å; I257-W280 HydrophobicContact CD1-CZ3 4.07Å; I257-W280 HydrophobicContact CG1-CH2 4.08Å; I257-W280 HydrophobicContact CG1-CZ3 3.97Å; I257-W280 HydrophobicContact CG2-CH2 4.18Å; Q272-W280 CarbonylContact O-C 3.57Å; Q272-W280 WeakPolarHBondContact O-CA 3.5Å; Y273-W280 VanDerWaalsContact CB-CZ3 3.45Å; Y273-W280 AromaticContact CD2-CD2 3.81Å; Y273-W280 HydrophobicContact CD2-CD2 3.81Å; Y273-W280 AromaticContact CD2-CE2 3.71Å; Y273-W280 HydrophobicContact CD2-CE3 4.41Å; Y273-W280 HydrophobicContact CD2-CG 4.01Å; Y273-W280 HydrophobicContact CD2-CZ2 4.21Å; Y273-W280 AromaticContact CD2-NE1 3.85Å; Y273-W280 HydrophobicContact CG-CD2 4.23Å; Y273-W280 HydrophobicContact CG-CE3 4.44Å; Y273-W280 HydrophobicContact CG-CH2 4.36Å; Y273-W280 HydrophobicContact CG-CZ2 4.13Å
281	T	98.4	Very high	96.7	Very high	56 Å²	56	61.7 Å²	61.7	34%	0.344	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.7	173.3	-57.6	0	0	0	0	109	Y271 Q272 L283	Y271-T281 WeakPolarHBondContact CA-O 3.08Å; Q272-T281 PolarHBondContact N-O 3.22Å; Q272-T281 PolarHBondContact O-N 2.99Å; T281-L283 HydrophobicContact CG2-CD2 4.28Å; T281-L283 PolarHBondContact O-N 3Å
282	L	98.2	Very high	96.7	Very high	68 Å²	68	60.9 Å²	60.9	36%	0.356	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	115.9	165.3	173.3	60.3	0	0	0	108.4	A238 T269 Y271	A238-L282 HydrophobicContact CB-CB 4.17Å; T269-L282 HydrophobicContact CG2-CD1 4.3Å; Y271-L282 HydrophobicContact CD1-CB 4.05Å; Y271-L282 HydrophobicContact CD1-CD1 4.18Å; Y271-L282 HydrophobicContact CD2-CD1 4.32Å; Y271-L282 HydrophobicContact CE1-CB 3.85Å; Y271-L282 HydrophobicContact CE1-CD1 3.85Å; Y271-L282 HydrophobicContact CE1-CG 4.34Å; Y271-L282 HydrophobicContact CE2-CD1 3.99Å; Y271-L282 HydrophobicContact CG-CD1 4.4Å
283	L	97.6	Very high	96.7	Very high	43 Å²	43	59.5 Å²	59.5	23%	0.225	30%	0.304	C	S	.	.			trans	-73.1	135.3	-179.9	-61.1	-175.7	0	0	0	110.3	Y256 M270 Q272 T281 F285	Y256-L283 HydrophobicContact CD1-CD1 4.08Å; Y256-L283 HydrophobicContact CE1-CD1 4.18Å; M270-L283 HydrophobicContact CB-CB 4.47Å; M270-L283 HydrophobicContact CB-CD1 4.4Å; M270-L283 HydrophobicContact CE-CD1 4.32Å; M270-L283 HydrophobicContact CG-CD1 3.92Å; M270-L283 WeakPolarHBondContact O-CB 3.29Å; M270-L283 PolarHBondContact O-N 2.86Å; M270-L283 HydrophobicContact SD-CD1 3.93Å; Q272-L283 HydrophobicContact CB-CD1 4.29Å; Q272-L283 HydrophobicContact CB-CD2 3.87Å; Q272-L283 HydrophobicContact CB-CG 4.13Å; T281-L283 HydrophobicContact CG2-CD2 4.28Å; T281-L283 PolarHBondContact O-N 3Å; L283-F285 HydrophobicContact CB-CE2 3.84Å; L283-F285 HydrophobicContact CB-CZ 4.05Å; L283-F285 HydrophobicContact CD1-CZ 4.46Å
284	K	96.9	Very high	96.7	Very high	177 Å²	177	60 Å²	60	77%	0.77	31%	0.307	S	S	*	.			trans	-107.1	140.8	176.1	-64.1	-176.5	179.9	178.8	0	109.2
285	F	96.6	Very high	96.7	Very high	32 Å²	32	59.8 Å²	59.8	14%	0.14	31%	0.307	C	S	.	.			trans	-120.3	144.6	-177.5	-63.5	-90.8	0	0	0	110.4	A16 W18 M270 L283 T287 L289 T369	A16-F285 VanDerWaalsContact C-CD1 3.49Å; A16-F285 CarbonylContact O-C 3.5Å; A16-F285 VanDerWaalsContact O-CA 3.3Å; A16-F285 WeakPolarHBondContact O-CA 3.45Å; W18-F285 AromaticContact CD1-CD1 3.43Å; W18-F285 VanDerWaalsContact CD1-CD1 3.43Å; W18-F285 AromaticContact CD1-CE1 3.68Å; W18-F285 AromaticContact CD1-CG 3.64Å; W18-F285 HydrophobicContact CG-CD1 4.33Å; W18-F285 HydrophobicContact CG-CE1 4.46Å; W18-F285 HydrophobicContact CZ2-CZ 4.38Å; W18-F285 AromaticContact NE1-CD1 3.61Å; W18-F285 AromaticContact NE1-CD2 3.75Å; W18-F285 AromaticContact NE1-CE1 3.38Å; W18-F285 AromaticContact NE1-CE2 3.51Å; W18-F285 AromaticContact NE1-CG 3.8Å; W18-F285 AromaticContact NE1-CZ 3.33Å; W18-F285 VanDerWaalsContact NE1-CZ 3.33Å; M270-F285 HydrophobicContact CB-CE2 3.97Å; M270-F285 HydrophobicContact CB-CZ 4.08Å; M270-F285 HydrophobicContact SD-CZ 3.86Å; L283-F285 HydrophobicContact CB-CE2 3.84Å; L283-F285 HydrophobicContact CB-CZ 4.05Å; L283-F285 HydrophobicContact CD1-CZ 4.46Å; F285-T287 VanDerWaalsContact C-N 3.28Å; F285-L289 HydrophobicContact CB-CD2 4.06Å; F285-L289 HydrophobicContact CD2-CD2 3.58Å; F285-L289 HydrophobicContact CE2-CD2 4.39Å; F285-L289 HydrophobicContact CG-CD2 4.05Å; F285-T369 HydrophobicContact CE1-CG2 4.38Å; F285-T369 WeakPolarHBondContact CE1-OG1 3.33Å
286	D	93.9	Very high	96.8	Very high	144 Å²	144	58.6 Å²	58.6	77%	0.77	30%	0.3	S	S	*	.	S	Bend	trans	-83.8	-9.5	178.5	-64.1	-31	0	0	0	112.2	A16	A16-D286 PolarHBondContact O-N 3.31Å
287	T	90.1	Very high	96.9	Very high	37 Å²	37	53.2 Å²	53.2	23%	0.227	28%	0.275	C	S	.	.	S	Bend	trans	-108.7	177	176.4	58.4	0	0	0	0	111.9	P5 T17 W18 F285	P5-T287 HydrophobicContact CG-CG2 4.45Å; T17-T287 HydrophobicContact CG2-CG2 3.5Å; W18-T287 PolarHBondContact N-OG1 2.82Å; W18-T287 VanDerWaalsContact N-OG1 3.12Å; F285-T287 VanDerWaalsContact C-N 3.28Å
288	L	92.9	Very high	97	Very high	82 Å²	82	47.6 Å²	47.6	43%	0.429	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-58.1	148.7	165.8	-64	164.9	0	0	0	109.9	K2 L4	K2-L288 HydrophobicContact CB-CD1 3.18Å; K2-L288 HydrophobicContact CD-CD1 4.07Å; K2-L288 HydrophobicContact CG-CD1 4.27Å; K2-L288 WeakPolarHBondContact O-CD1 3.47Å; L4-L288 HydrophobicContact CD2-CB 4.21Å; L4-L288 WeakPolarHBondContact CD2-O 3.41Å
289	L	96.2	Very high	97	Very high	67 Å²	67	44.3 Å²	44.3	35%	0.351	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-78.5	147.5	168.3	-59.7	179.3	0	0	0	109.1	D268 F285	D268-L289 HydrophobicContact CB-CB 4.29Å; D268-L289 HydrophobicContact CB-CD1 4.45Å; F285-L289 HydrophobicContact CB-CD2 4.06Å; F285-L289 HydrophobicContact CD2-CD2 3.58Å; F285-L289 HydrophobicContact CE2-CD2 4.39Å; F285-L289 HydrophobicContact CG-CD2 4.05Å
290	P	96.3	Very high	96.9	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-56.6	155.2	163.8	28.9	-38.9	0	0	0	110.6	L4 W18 F258 D268 I367	L4-P290 HydrophobicContact CD1-CB 4.27Å; W18-P290 HydrophobicContact CD2-CG 4.11Å; W18-P290 HydrophobicContact CE3-CG 4.49Å; W18-P290 HydrophobicContact CG-CG 4.39Å; W18-P290 HydrophobicContact CZ2-CG 4.49Å; F258-P290 HydrophobicContact CE2-CG 3.88Å; F258-P290 HydrophobicContact CZ-CB 4.42Å; F258-P290 HydrophobicContact CZ-CG 3.46Å; F258-P290 VanDerWaalsContact CZ-CG 3.46Å; D268-P290 VanDerWaalsContact CB-O 3.3Å; D268-P290 WeakPolarHBondContact CB-O 3.22Å; P290-I367 HydrophobicContact CB-CD1 3.29Å; P290-I367 HydrophobicContact CG-CD1 3.61Å
291	P	96.2	Very high	96.8	Very high	69 Å²	69	42.1 Å²	42.1	45%	0.448	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-54.5	143.8	171.7	-25.3	34.3	0	0	0	111.9	R293 Y363	P291-R293 PolarHBondContact O-N 3.3Å; P291-R293 PolarHBondContact O-NE 2.83Å; P291-Y363 HydrophobicContact CB-CE1 4.36Å; P291-Y363 WeakPolarHBondContact CB-OH 3.3Å
292	G	97.6	Very high	96.6	Very high	15 Å²	15	41.2 Å²	41.2	16%	0.155	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-57.3	135.5	176.4	0	0	0	0	0	111.2	L267 Y363	L267-G292 VanDerWaalsContact C-CA 3.49Å; L267-G292 CarbonylContact O-C 3.45Å; L267-G292 WeakPolarHBondContact O-CA 3.39Å; G292-Y363 PolarHBondContact O-OH 2.95Å
293	R	98.4	Very high	96.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.204	C	C	.	.			trans	-150.4	145.2	-172.3	64.1	-178.5	71.2	-161.2	3.8	114.3	F258 G259 G260 L267 P291 H296 G354 M356 Y363 D365	F258-R293 HydrophobicContact CE1-CG 3.94Å; F258-R293 HydrophobicContact CZ-CG 4.46Å; G259-R293 CarbonylContact C-O 3.6Å; G259-R293 WeakPolarHBondContact CA-O 3.37Å; G260-R293 PolarHBondContact N-O 2.77Å; L267-R293 PolarHBondContact O-N 2.86Å; P291-R293 PolarHBondContact O-N 3.3Å; P291-R293 PolarHBondContact O-NE 2.83Å; R293-H296 PolarHBondContact O-ND1 2.88Å; R293-G354 PolarHBondContact NH1-O 2.95Å; R293-M356 CarbonylContact C-O 3.58Å; R293-M356 WeakPolarHBondContact CA-O 3.33Å; R293-Y363 HydrophobicContact CB-CD2 4.01Å; R293-Y363 HydrophobicContact CB-CE2 3.74Å; R293-D365 IonicContact CZ-OD1 3.93Å; R293-D365 IonicContact CZ-OD2 3.48Å; R293-D365 IonicContact NH1-OD1 3.17Å; R293-D365 PolarHBondContact NH1-OD1 2.86Å; R293-D365 IonicContact NH1-OD2 2.72Å; R293-D365 IonicContact NH2-OD1 3.97Å; R293-D365 PolarHBondContact NH2-OD1 2.74Å; R293-D365 IonicContact NH2-OD2 3.35Å; R293-D365 PolarHBondContact NH2-OD2 2.87Å
294	L	98.4	Very high	95.5	Very high	12 Å²	12	37.2 Å²	37.2	6%	0.063	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-124.5	167	173.1	61.9	148.8	0	0	0	110.4	A245 M261 A266 H296 G355 M356 T358	A245-L294 HydrophobicContact CB-CB 3.8Å; A245-L294 HydrophobicContact CB-CD1 4.14Å; A245-L294 CarbonylContact O-C 3.59Å; A245-L294 VanDerWaalsContact O-CA 3.32Å; A245-L294 WeakPolarHBondContact O-CA 3.34Å; M261-L294 HydrophobicContact CB-CB 4.43Å; M261-L294 HydrophobicContact CB-CD1 4.3Å; M261-L294 HydrophobicContact CB-CD2 4.35Å; M261-L294 HydrophobicContact CG-CD1 4.12Å; M261-L294 HydrophobicContact SD-CD1 3.79Å; A266-L294 HydrophobicContact CB-CD2 4.01Å; L294-H296 PolarHBondContact O-N 2.98Å; L294-G355 CarbonylContact O-C 3.57Å; L294-G355 WeakPolarHBondContact O-CA 3.19Å; L294-M356 HydrophobicContact CD1-CG 4.49Å; L294-M356 HydrophobicContact CD2-CG 4.18Å; L294-M356 WeakPolarHBondContact CD2-O 3.28Å; L294-M356 HydrophobicContact CG-CG 3.96Å; L294-M356 PolarHBondContact N-O 3.4Å; L294-M356 PolarHBondContact O-N 2.8Å; L294-T358 HydrophobicContact CD2-CG2 4.27Å
295	D	98.2	Very high	94.6	Very high	24 Å²	24	30.3 Å²	30.3	13%	0.128	17%	0.174	C	C	.	.	S	Bend	trans	55.3	23.1	178.6	-63.2	-44.2	0	0	0	115.4	V32 G33 H142 A245	V32-D295 CarbonylContact C-O 3.5Å; V32-D295 WeakPolarHBondContact CA-O 3.43Å; V32-D295 HydrophobicContact CB-CB 3.74Å; V32-D295 HydrophobicContact CG1-CB 4.24Å; G33-D295 PolarHBondContact N-O 2.84Å; H142-D295 IonicContact CD2-OD1 3.21Å; H142-D295 WeakPolarHBondContact CE1-CA 3.25Å; H142-D295 IonicContact CE1-OD1 2.79Å; H142-D295 IonicContact CG-OD1 3.54Å; H142-D295 IonicContact ND1-OD1 3.6Å; H142-D295 IonicContact NE2-OD1 2.69Å; A245-D295 WeakPolarHBondContact CB-OD1 3.01Å; A245-D295 PolarHBondContact O-N 3.19Å
296	H	98.7	Very high	93.2	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.187	C	C	.	.			trans	-82.5	179.4	171.2	62	-82.6	0	0	0	110.3	H142 S247 F258 R293 L294 V352 F353 G354	H142-H296 PolarHBondContact CE1-O 2.79Å; H142-H296 VanDerWaalsContact CE1-O 3.27Å; S247-H296 WeakPolarHBondContact CB-NE2 3.48Å; S247-H296 PolarHBondContact OG-O 3.36Å; F258-H296 AromaticContact CD1-NE2 3.49Å; F258-H296 WeakPolarHBondContact CD1-NE2 3.36Å; F258-H296 PolarHBondContact O-CE1 3.19Å; F258-H296 PolarHBondContact O-NE2 3.06Å; R293-H296 PolarHBondContact O-ND1 2.88Å; L294-H296 PolarHBondContact O-N 2.98Å; H296-V352 HydrophobicContact CB-CG1 4.13Å; H296-V352 VanDerWaalsContact CD2-CG1 3.5Å; H296-V352 WeakPolarHBondContact CD2-CG1 3.44Å; H296-F353 WeakPolarHBondContact CB-O 3.36Å; H296-G354 WeakPolarHBondContact CB-O 3.34Å
297	S	98.5	Very high	91.4	Very high	9 Å²	9	27.7 Å²	27.7	6%	0.063	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158	169.3	68.5	0	0	0	0	112	H34 C36 V352 F353	H34-S297 PolarHBondContact CD2-OG 2.82Å; H34-S297 PolarHBondContact NE2-OG 2.84Å; H34-S297 WeakPolarHBondContact O-CB 3.39Å; C36-S297 WeakPolarHBondContact CB-OG 3.4Å; C36-S297 PolarHBondContact N-OG 2.9Å; C36-S297 VanDerWaalsContact N-OG 3.17Å; S297-V352 WeakPolarHBondContact O-CA 3.48Å; S297-F353 PolarHBondContact N-O 3.22Å; S297-F353 PolarHBondContact O-N 2.95Å
298	M	98.3	Very high	89.5	Confident	15 Å²	15	30.1 Å²	30.1	7%	0.074	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147.8	-174.3	-69.4	164.4	73.7	0	0	111.7	S247 V249 F258 C350 L351 V352	S247-M298 WeakPolarHBondContact CB-SD 3.27Å; V249-M298 HydrophobicContact CG1-CB 3.67Å; V249-M298 HydrophobicContact CG2-CE 4.05Å; F258-M298 HydrophobicContact CB-CE 3.78Å; F258-M298 HydrophobicContact CB-SD 3.79Å; F258-M298 HydrophobicContact CD1-SD 4.48Å; M298-C350 WeakPolarHBondContact CE-SG 3.46Å; M298-L351 CarbonylContact C-O 3.59Å; M298-L351 WeakPolarHBondContact CA-O 3.47Å; M298-V352 HydrophobicContact CE-CG2 4.48Å; M298-V352 HydrophobicContact CG-CB 4.38Å; M298-V352 HydrophobicContact CG-CG2 3.65Å; M298-V352 HydrophobicContact SD-CG2 4.34Å
299	C	98	Very high	87.2	Confident	9 Å²	9	30.4 Å²	30.4	6%	0.061	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	162.9	163.5	75.1	0	0	0	0	111.2	C36 L351	C36-C299 PolarHBondContact SG-SG 2.9Å; C299-L351 PolarHBondContact N-O 3.21Å; C299-L351 PolarHBondContact O-N 3.19Å
300	I	97.2	Very high	84.7	Confident	25 Å²	25	33.3 Å²	33.3	13%	0.128	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133.2	170.9	-55.8	-54.9	0	0	0	109.6	V249 M251 L348 L349 C350 V371	V249-I300 HydrophobicContact CB-CD1 3.96Å; V249-I300 HydrophobicContact CB-CG1 4.07Å; V249-I300 HydrophobicContact CG1-CD1 4.35Å; V249-I300 HydrophobicContact CG1-CG1 4.44Å; V249-I300 HydrophobicContact CG2-CD1 3.56Å; V249-I300 HydrophobicContact CG2-CG1 4.22Å; M251-I300 HydrophobicContact CE-CB 4.13Å; M251-I300 HydrophobicContact CE-CG1 4.14Å; M251-I300 HydrophobicContact CE-CG2 3.76Å; I300-L348 HydrophobicContact CG2-CB 4.03Å; I300-L348 HydrophobicContact CG2-CD1 4.45Å; I300-L348 HydrophobicContact CG2-CD2 4.13Å; I300-L348 HydrophobicContact CG2-CG 4.43Å; I300-L349 WeakPolarHBondContact CA-O 3.35Å; I300-C350 HydrophobicContact CD1-CB 3.85Å; I300-V371 HydrophobicContact CD1-CG2 3.8Å
301	I	96	Very high	82.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142	174.9	63.5	175.5	0	0	0	111	Y38 V50 L70 L349 L351	Y38-I301 HydrophobicContact CD2-CG2 4Å; Y38-I301 HydrophobicContact CG-CG2 4.29Å; V50-I301 HydrophobicContact CG2-CG2 3.47Å; V50-I301 VanDerWaalsContact CG2-CG2 3.47Å; L70-I301 HydrophobicContact CD1-CB 4.05Å; L70-I301 HydrophobicContact CD1-CD1 4.44Å; L70-I301 HydrophobicContact CD1-CG2 4.29Å; L70-I301 HydrophobicContact CD2-CD1 4.25Å; I301-L349 HydrophobicContact CD1-CB 4.4Å; I301-L349 HydrophobicContact CG1-CB 3.83Å; I301-L349 PolarHBondContact N-O 3.12Å; I301-L349 PolarHBondContact O-N 3.24Å; I301-L351 HydrophobicContact CD1-CB 4.28Å; I301-L351 HydrophobicContact CD1-CD1 3.93Å
302	P	94.2	Very high	79.4	Confident	37 Å²	37	45.2 Å²	45.2	24%	0.24	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.1	167.2	30.6	-31.5	0	0	0	110	Y38 A346 L348	Y38-P302 HydrophobicContact CE1-CG 4.11Å; Y38-P302 HydrophobicContact CE2-CG 4.21Å; Y38-P302 VanDerWaalsContact CZ-CD 3.43Å; Y38-P302 VanDerWaalsContact OH-CG 3.26Å; Y38-P302 WeakPolarHBondContact OH-CG 3.41Å; P302-A346 HydrophobicContact CB-CB 4.03Å; P302-L348 HydrophobicContact CB-CD2 4.44Å
303	W	91.9	Very high	76.8	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.011	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.2	176.7	-169.2	-99.7	0	0	0	110.6	L7 E8 D11 L21 T347 L349	L7-W303 HydrophobicContact CD2-CD2 4.26Å; L7-W303 HydrophobicContact CD2-CH2 4.36Å; L7-W303 HydrophobicContact CD2-CZ2 3.87Å; L7-W303 HydrophobicContact CG-CZ2 3.88Å; E8-W303 WeakPolarHBondContact O-CZ2 3.3Å; D11-W303 PolarHBondContact O-NE1 3.01Å; L21-W303 HydrophobicContact CD1-CH2 3.77Å; L21-W303 HydrophobicContact CD1-CZ3 4.04Å; W303-T347 WeakPolarHBondContact CA-O 3.06Å; W303-T347 WeakPolarHBondContact CB-O 3.14Å; W303-T347 PolarHBondContact N-O 3.03Å; W303-T347 PolarHBondContact O-N 2.87Å; W303-L349 HydrophobicContact CB-CD1 3.61Å; W303-L349 HydrophobicContact CB-CG 3.74Å; W303-L349 HydrophobicContact CD2-CD1 3.64Å; W303-L349 HydrophobicContact CE3-CD1 3.75Å; W303-L349 HydrophobicContact CG-CD1 3.6Å; W303-L349 HydrophobicContact CG-CG 4.22Å
304	P	80.3	Confident	74.1	Confident	24 Å²	24	55.8 Å²	55.8	16%	0.156	32%	0.319	C	S	.	.			trans	-70.8	141.8	172.7	33.2	-38.4	0	0	0	111.2	R47	R47-P304 VanDerWaalsContact NH1-CB 3.27Å; R47-P304 VanDerWaalsContact NH1-CG 3.3Å; R47-P304 VanDerWaalsContact NH2-CG 3.31Å
305	V	77.9	Confident	71.4	Confident	32 Å²	32	62.5 Å²	62.5	19%	0.194	36%	0.355	C	S	.	.			trans	-110.1	123.8	167.7	-179.1	0	0	0	0	106.8	K12 C307	K12-V305 HydrophobicContact CB-CG1 3.56Å; K12-V305 HydrophobicContact CB-CG2 4.43Å; K12-V305 HydrophobicContact CD-CG1 4.13Å; K12-V305 HydrophobicContact CG-CG1 3.79Å; K12-V305 HydrophobicContact CG-CG2 4.22Å; V305-C307 PolarHBondContact O-N 2.88Å
306	T	67.4	Low	68.4	Low	68 Å²	68	65.4 Å²	65.4	42%	0.417	38%	0.377	S	S	.	.			trans	-72.4	118.6	167.6	35.2	0	0	0	0	108.6	G10	G10-T306 WeakPolarHBondContact CA-OG1 3.3Å; G10-T306 PolarHBondContact O-N 2.63Å; G10-T306 PolarHBondContact O-OG1 3.02Å
307	C	57.1	Low	65.4	Low	53 Å²	53	73.5 Å²	73.5	36%	0.358	42%	0.42	S	S	.	.			trans	-65.3	137.2	169.7	-79.5	0	0	0	0	109.3	V305 S309 E310	V305-C307 PolarHBondContact O-N 2.88Å; C307-S309 PolarHBondContact O-N 2.86Å; C307-E310 PolarHBondContact O-N 3.02Å
308	A	50.6	Low	62.3	Low	88 Å²	88	79.6 Å²	79.6	73%	0.727	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-58.6	-18.7	-176.6	0	0	0	0	0	113.9	E310 K311	A308-E310 VanDerWaalsContact C-N 3.31Å; A308-E310 PolarHBondContact O-N 3.37Å; A308-K311 PolarHBondContact O-N 3.41Å
309	S	43	Very low	59.3	Low	87 Å²	87	86.5 Å²	86.5	61%	0.608	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-68.3	-22	178.7	52.8	0	0	0	0	114.4	C307 K311	C307-S309 PolarHBondContact O-N 2.86Å; S309-K311 VanDerWaalsContact C-N 3.31Å; S309-K311 PolarHBondContact O-N 3.4Å
310	E	43.7	Very low	56.5	Low	129 Å²	129	92.7 Å²	92.7	60%	0.603	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-80.4	-10.7	-179.6	-68.2	-176.6	170	0	0	113.6	C307 A308	C307-E310 PolarHBondContact O-N 3.02Å; A308-E310 VanDerWaalsContact C-N 3.31Å; A308-E310 PolarHBondContact O-N 3.37Å
311	K	43	Very low	53.8	Low	159 Å²	159	98.1 Å²	98.1	69%	0.691	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-83.4	-12.8	-179.8	-75.5	-172	177.7	179.1	0	114.1	A308 S309	A308-K311 PolarHBondContact O-N 3.41Å; S309-K311 VanDerWaalsContact C-N 3.31Å; S309-K311 PolarHBondContact O-N 3.4Å
312	E	40.1	Very low	51	Low	161 Å²	161	106 Å²	106	75%	0.752	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-24.6	-176.8	-70.8	-171.8	160.1	0	0	114.2	S314	E312-S314 PolarHBondContact O-N 3.35Å
313	D	42.8	Very low	48.3	Very low	140 Å²	140	108.4 Å²	108.4	75%	0.749	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	0.8	-173.9	-78.2	-19.9	0	0	0	115.5
314	S	41.9	Very low	45.7	Very low	97 Å²	97	116.6 Å²	116.6	68%	0.678	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	1.4	179	64.6	0	0	0	0	115.3	E312	E312-S314 PolarHBondContact O-N 3.35Å
315	N	40	Very low	43.7	Very low	152 Å²	152	123.2 Å²	123.2	81%	0.813	68%	0.675	S	S	*	*	S	Bend	trans	-117.8	11.1	-174.5	-89.9	-16.4	0	0	0	115.9
316	S	36.4	Very low	41.8	Very low	86 Å²	86	129.5 Å²	129.5	60%	0.601	70%	0.702	S	S	*	*			trans	-123	97.3	171.9	63.1	0	0	0	0	110.1
317	L	34.8	Very low	40.3	Very low	169 Å²	169	133.3 Å²	133.3	89%	0.885	72%	0.72	S	S	*	*			trans	-178.4	87.5	154	-96.8	167.2	0	0	0	108.4
318	T	32.7	Very low	39.6	Very low	137 Å²	137	135.6 Å²	135.6	84%	0.84	74%	0.737	S	S	*	*			trans	179.2	104.7	148	18.3	0	0	0	0	107.8
319	L	37.3	Very low	38.9	Very low	160 Å²	160	135.4 Å²	135.4	84%	0.838	74%	0.735	S	S	*	*			trans	175.3	137.4	141.7	-94.1	154.2	0	0	0	110.5
320	N	37.7	Very low	38.6	Very low	139 Å²	139	138.5 Å²	138.5	74%	0.743	75%	0.745	S	S	*	*			trans	84.9	139.9	165.8	-52.1	-15.9	0	0	0	116.6
321	H	41.1	Very low	38.3	Very low	140 Å²	140	141.7 Å²	141.7	65%	0.648	76%	0.757	S	S	*	*			cis	-173.8	136.9	-27	-133.4	-92.2	0	0	0	102.4
322	E	38	Very low	38	Very low	165 Å²	165	140.1 Å²	140.1	77%	0.771	76%	0.76	S	S	*	*			trans	52.9	119.9	147.6	-73.8	169.1	167.6	0	0	122.8
323	A	35.9	Very low	37.5	Very low	88 Å²	88	141 Å²	141	73%	0.727	77%	0.766	S	S	*	*				95.2	116.5	119.2	0	0	0	0	0	120.8
324	E	37.8	Very low	36.9	Very low	174 Å²	174	138.8 Å²	138.8	81%	0.813	76%	0.762	S	S	*	*			trans	89.4	101.2	136.2	-69.3	-175.6	176.9	0	0	121.5
325	K	38.8	Very low	36.7	Very low	163 Å²	163	142.9 Å²	142.9	71%	0.709	77%	0.77	S	S	*	*				80.7	131	118	-84.8	-173.4	167.7	-158.6	0	122.4
326	E	37.2	Very low	36.3	Very low	164 Å²	164	141.5 Å²	141.5	77%	0.766	77%	0.772	S	S	*	*			trans	70.3	145.6	144.9	-68.5	169.4	-160.7	0	0	117.1
327	D	37.3	Very low	36.2	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	78%	0.78	S	S	*	*			cis	-167.1	155.1	-27.7	-168.7	6	0	0	0	104.5
328	S	40.6	Very low	36	Very low	101 Å²	101	141 Å²	141	71%	0.706	78%	0.781	S	S	*	*			trans	73.8	117.1	157.1	76.1	0	0	0	0	122.6
329	A	37.7	Very low	35.9	Very low	84 Å²	84	139.5 Å²	139.5	69%	0.694	78%	0.776	S	S	*	*				83.8	117.4	123.6	0	0	0	0	0	122.1
330	D	34.9	Very low	35.8	Very low	152 Å²	152	140.9 Å²	140.9	81%	0.813	78%	0.778	S	S	*	*			trans	60	110.3	139.6	-65.3	-21.7	0	0	0	120.1
331	K	37.3	Very low	35.5	Very low	196 Å²	196	143.3 Å²	143.3	85%	0.852	79%	0.785	S	S	*	*				178.1	129.6	114.3	-99.4	-179.5	174.3	172.4	0	114.4
332	V	36.6	Very low	35	Very low	126 Å²	126	145.3 Å²	145.3	76%	0.764	80%	0.795	S	S	*	*			trans	79.8	113.1	131.9	-178.7	0	0	0	0	119.2
333	M	30.3	Very low	34.9	Very low	179 Å²	179	142.7 Å²	142.7	88%	0.882	79%	0.794	S	S	*	*			trans	-62.6	133.2	157.8	-68	-174.8	-73.5	0	0	111.9
334	S	30.9	Very low	35.7	Very low	94 Å²	94	144.5 Å²	144.5	66%	0.657	79%	0.788	S	S	*	*				169.5	128.4	119.6	55.8	0	0	0	0	108.8
335	H	36.7	Very low	37.1	Very low	182 Å²	182	142.5 Å²	142.5	84%	0.843	79%	0.787	S	S	*	*			trans	-176.5	119.1	131.2	-87.5	-38.9	0	0	0	110.4
336	S	31.9	Very low	39.2	Very low	123 Å²	123	137.1 Å²	137.1	86%	0.86	77%	0.774	S	S	*	*			trans	-51.1	132.4	159	47.1	0	0	0	0	111.7
337	G	33.8	Very low	41.8	Very low	74 Å²	74	131.2 Å²	131.2	76%	0.763	75%	0.749	S	S	*	*			trans	-134.1	112.6	167.2	0	0	0	0	0	109.4
338	D	30.4	Very low	44.6	Very low	170 Å²	170	126.4 Å²	126.4	91%	0.909	72%	0.723	S	S	*	*			trans	-55.1	128.1	172	-113.8	-28.5	0	0	0	110.9
339	S	32	Very low	47.2	Very low	106 Å²	106	121.6 Å²	121.6	74%	0.741	69%	0.689	S	S	*	*			trans	-99.3	108.7	169.7	56.5	0	0	0	0	109.7	E341	S339-E341 PolarHBondContact O-N 3.47Å
340	H	34	Very low	50.1	Low	190 Å²	190	117.6 Å²	117.6	88%	0.88	66%	0.656	S	S	*	*			trans	-67.7	111.1	164.1	-89.5	-73.6	0	0	0	109.7
341	E	31.8	Very low	53.1	Low	189 Å²	189	110.4 Å²	110.4	88%	0.883	62%	0.618	S	S	*	*			trans	-84	104.2	162.9	-82.9	-174.7	152.8	0	0	109.4	S339 S343	S339-E341 PolarHBondContact O-N 3.47Å; E341-S343 PolarHBondContact O-N 2.95Å
342	E	30.6	Very low	56	Low	183 Å²	183	101 Å²	101	86%	0.855	58%	0.577	S	S	*	*			trans	-69.1	105.1	161.4	-97.7	-178	162.1	0	0	109	Q344	E342-Q344 PolarHBondContact O-N 3.05Å
343	S	36.4	Very low	59	Low	109 Å²	109	95.1 Å²	95.1	76%	0.762	54%	0.541	S	S	*	.			trans	-66.5	95.3	170.7	178.8	0	0	0	0	109.9	E341 T345	E341-S343 PolarHBondContact O-N 2.95Å; S343-T345 PolarHBondContact O-N 3.06Å
344	Q	51.7	Low	62.2	Low	126 Å²	126	86.6 Å²	86.6	59%	0.589	50%	0.499	S	S	*	.			trans	-64.6	111.1	168.6	-78.1	179.7	2.5	0	0	109.2	E342 A346	E342-Q344 PolarHBondContact O-N 3.05Å; Q344-A346 PolarHBondContact O-N 3.13Å; Q344-A346 VanDerWaalsContact O-N 3.17Å
345	T	68.6	Low	65.4	Low	132 Å²	132	82.1 Å²	82.1	81%	0.81	47%	0.467	S	S	*	.			trans	-65.4	113.3	173.4	40.9	0	0	0	0	109.8	S343	S343-T345 PolarHBondContact O-N 3.06Å
346	A	81.4	Confident	68.3	Low	51 Å²	51	75.5 Å²	75.5	42%	0.421	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-60.7	141.4	176.9	0	0	0	0	0	110.7	P302 Q344	P302-A346 HydrophobicContact CB-CB 4.03Å; Q344-A346 PolarHBondContact O-N 3.13Å; Q344-A346 VanDerWaalsContact O-N 3.17Å
347	T	92.4	Very high	71.5	Confident	40 Å²	40	70.4 Å²	70.4	25%	0.245	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	136.6	171.4	-60.4	0	0	0	0	108.7	P13 W303 V370	P13-T347 HydrophobicContact CG-CG2 3.86Å; W303-T347 WeakPolarHBondContact CA-O 3.06Å; W303-T347 WeakPolarHBondContact CB-O 3.14Å; W303-T347 PolarHBondContact N-O 3.03Å; W303-T347 PolarHBondContact O-N 2.87Å; T347-V370 HydrophobicContact CG2-CG1 3.9Å; T347-V370 HydrophobicContact CG2-CG2 4.13Å
348	L	95.5	Very high	74.5	Confident	47 Å²	47	69.7 Å²	69.7	25%	0.246	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.4	178.4	-62.4	177.3	0	0	0	110.2	M251 I300 P302 V371	M251-L348 HydrophobicContact CE-CD1 3.91Å; M251-L348 HydrophobicContact CG-CD1 3.76Å; M251-L348 HydrophobicContact SD-CD1 3.67Å; I300-L348 HydrophobicContact CG2-CB 4.03Å; I300-L348 HydrophobicContact CG2-CD1 4.45Å; I300-L348 HydrophobicContact CG2-CD2 4.13Å; I300-L348 HydrophobicContact CG2-CG 4.43Å; P302-L348 HydrophobicContact CB-CD2 4.44Å; L348-V371 HydrophobicContact CB-CG2 4.07Å; L348-V371 PolarHBondContact O-N 3.36Å; L348-V371 VanDerWaalsContact O-N 3.12Å
349	L	97.1	Very high	77.6	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	136.3	173.1	-61.2	179.6	0	0	0	109.6	L7 P13 I300 I301 W303 V368 T369 V370	L7-L349 HydrophobicContact CD2-CD1 3.67Å; P13-L349 HydrophobicContact CB-CD2 4.13Å; P13-L349 HydrophobicContact CG-CD2 3.98Å; I300-L349 WeakPolarHBondContact CA-O 3.35Å; I301-L349 HydrophobicContact CD1-CB 4.4Å; I301-L349 HydrophobicContact CG1-CB 3.83Å; I301-L349 PolarHBondContact N-O 3.12Å; I301-L349 PolarHBondContact O-N 3.24Å; W303-L349 HydrophobicContact CB-CD1 3.61Å; W303-L349 HydrophobicContact CB-CG 3.74Å; W303-L349 HydrophobicContact CD2-CD1 3.64Å; W303-L349 HydrophobicContact CE3-CD1 3.75Å; W303-L349 HydrophobicContact CG-CD1 3.6Å; W303-L349 HydrophobicContact CG-CG 4.22Å; L349-V368 HydrophobicContact CB-CB 4.41Å; L349-V368 HydrophobicContact CD1-CB 4.26Å; L349-V368 HydrophobicContact CD1-CG2 4.19Å; L349-T369 CarbonylContact C-O 3.5Å; L349-T369 WeakPolarHBondContact CA-O 3.36Å; L349-V370 HydrophobicContact CD2-CB 4.47Å; L349-V370 HydrophobicContact CD2-CG2 3.84Å
350	C	98.1	Very high	80.6	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	113	160.4	179.9	0	0	0	0	108.4	M270 M298 I300 V368 T369 V371	M270-C350 HydrophobicContact CE-CB 4.4Å; M298-C350 WeakPolarHBondContact CE-SG 3.46Å; I300-C350 HydrophobicContact CD1-CB 3.85Å; C350-V368 VanDerWaalsContact O-CA 3.31Å; C350-V368 WeakPolarHBondContact O-CA 3.45Å; C350-T369 HydrophobicContact CB-CG2 4.34Å; C350-T369 PolarHBondContact N-O 2.88Å; C350-T369 PolarHBondContact O-N 2.93Å; C350-T369 VanDerWaalsContact O-N 3.16Å; C350-V371 HydrophobicContact CB-CG1 3.59Å; C350-V371 HydrophobicContact CB-CG2 4.43Å
351	L	98.1	Very high	83.7	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.6	174.1	-179	150.7	0	0	0	109.9	L21 V50 M68 M298 C299 I301 F353 V368	L21-L351 HydrophobicContact CD2-CD1 4.13Å; V50-L351 HydrophobicContact CG1-CD2 4.49Å; V50-L351 HydrophobicContact CG2-CD1 4.49Å; M68-L351 HydrophobicContact CE-CD1 3.35Å; M298-L351 CarbonylContact C-O 3.59Å; M298-L351 WeakPolarHBondContact CA-O 3.47Å; C299-L351 PolarHBondContact N-O 3.21Å; C299-L351 PolarHBondContact O-N 3.19Å; I301-L351 HydrophobicContact CD1-CB 4.28Å; I301-L351 HydrophobicContact CD1-CD1 3.93Å; L351-F353 HydrophobicContact CD2-CB 4.26Å; L351-V368 HydrophobicContact CB-CG1 4.05Å; L351-V368 HydrophobicContact CD1-CG1 4.27Å; L351-V368 HydrophobicContact CG-CG1 4.13Å
352	V	98.5	Very high	86.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.4	170.4	175.1	0	0	0	0	108	W18 F258 H296 S297 M298 I367	W18-V352 HydrophobicContact CH2-CG2 3.99Å; W18-V352 HydrophobicContact CZ3-CG2 4.19Å; F258-V352 HydrophobicContact CD1-CG1 4.38Å; F258-V352 HydrophobicContact CD1-CG2 3.77Å; F258-V352 HydrophobicContact CE1-CG1 4.17Å; F258-V352 HydrophobicContact CE1-CG2 4.05Å; H296-V352 HydrophobicContact CB-CG1 4.13Å; H296-V352 VanDerWaalsContact CD2-CG1 3.5Å; H296-V352 WeakPolarHBondContact CD2-CG1 3.44Å; S297-V352 WeakPolarHBondContact O-CA 3.48Å; M298-V352 HydrophobicContact CE-CG2 4.48Å; M298-V352 HydrophobicContact CG-CB 4.38Å; M298-V352 HydrophobicContact CG-CG2 3.65Å; M298-V352 HydrophobicContact SD-CG2 4.34Å; V352-I367 HydrophobicContact CB-CD1 4.08Å; V352-I367 HydrophobicContact CB-CG1 3.61Å; V352-I367 HydrophobicContact CG1-CD1 4.18Å; V352-I367 HydrophobicContact CG1-CG1 4.1Å; V352-I367 HydrophobicContact CG2-CD1 4.47Å; V352-I367 HydrophobicContact CG2-CG1 4.27Å; V352-I367 PolarHBondContact N-O 3.43Å; V352-I367 PolarHBondContact O-N 3.47Å
353	F	98.2	Very high	90	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	137.6	173.4	-176	-105.3	0	0	0	111.7	P28 R31 H34 I52 H296 S297 L351 D364 D365 C366	P28-F353 HydrophobicContact CB-CE1 3.76Å; P28-F353 HydrophobicContact CB-CZ 3.57Å; P28-F353 HydrophobicContact CG-CE1 3.65Å; P28-F353 HydrophobicContact CG-CE2 4.07Å; P28-F353 HydrophobicContact CG-CZ 3.36Å; R31-F353 HydrophobicContact CG-CE1 3.95Å; H34-F353 AromaticContact CD2-CD1 3.87Å; H34-F353 AromaticContact CE1-CD1 3.75Å; H34-F353 PolarHBondContact CE1-O 3.43Å; H34-F353 AromaticContact NE2-CD1 3.38Å; H34-F353 WeakPolarHBondContact NE2-CD1 3.45Å; H34-F353 PolarHBondContact NE2-O 2.95Å; H34-F353 VanDerWaalsContact NE2-O 3.11Å; I52-F353 HydrophobicContact CD1-CB 3.89Å; I52-F353 HydrophobicContact CD1-CD1 3.75Å; I52-F353 HydrophobicContact CD1-CG 3.89Å; I52-F353 HydrophobicContact CG1-CD1 3.96Å; I52-F353 HydrophobicContact CG1-CE1 4.37Å; I52-F353 HydrophobicContact CG1-CG 4.29Å; I52-F353 HydrophobicContact CG2-CD1 3.88Å; I52-F353 HydrophobicContact CG2-CE1 3.89Å; H296-F353 WeakPolarHBondContact CB-O 3.36Å; S297-F353 PolarHBondContact N-O 3.22Å; S297-F353 PolarHBondContact O-N 2.95Å; L351-F353 HydrophobicContact CD2-CB 4.26Å; F353-D364 VanDerWaalsContact CE2-O 3.28Å; F353-D364 WeakPolarHBondContact CE2-O 3.48Å; F353-D365 VanDerWaalsContact CD2-O 3.25Å; F353-D365 WeakPolarHBondContact CD2-O 3.42Å; F353-C366 WeakPolarHBondContact CD2-SG 3.32Å
354	G	98.1	Very high	92.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.257	C	S	.	.			trans	60.9	-144.4	169.3	0	0	0	0	0	114.9	R293 H296 Y363 D365	R293-G354 PolarHBondContact NH1-O 2.95Å; H296-G354 WeakPolarHBondContact CB-O 3.34Å; G354-Y363 VanDerWaalsContact CA-O 3.3Å; G354-Y363 WeakPolarHBondContact CA-O 3.19Å; G354-D365 PolarHBondContact N-O 2.93Å
355	G	98.4	Very high	95	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.			trans	95.4	-170.2	-172	0	0	0	0	0	112.6	R31 L294 I362 Y363	R31-G355 PolarHBondContact O-N 3.38Å; R31-G355 VanDerWaalsContact O-N 3.11Å; L294-G355 CarbonylContact O-C 3.57Å; L294-G355 WeakPolarHBondContact O-CA 3.19Å; G355-I362 WeakPolarHBondContact O-CA 3.29Å; G355-I362 WeakPolarHBondContact O-CG2 3.32Å; G355-Y363 PolarHBondContact O-N 3.39Å
356	M	98.3	Very high	96.4	Very high	44 Å²	44	36.1 Å²	36.1	22%	0.217	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-147.3	162.9	178.7	65.3	-178.5	-72.6	0	0	112.2	V32 R293 L294 E361 I362	V32-M356 HydrophobicContact CG1-CB 3.79Å; V32-M356 HydrophobicContact CG1-CG 3.76Å; V32-M356 HydrophobicContact CG1-SD 3.88Å; R293-M356 CarbonylContact C-O 3.58Å; R293-M356 WeakPolarHBondContact CA-O 3.33Å; L294-M356 HydrophobicContact CD1-CG 4.49Å; L294-M356 HydrophobicContact CD2-CG 4.18Å; L294-M356 WeakPolarHBondContact CD2-O 3.28Å; L294-M356 HydrophobicContact CG-CG 3.96Å; L294-M356 PolarHBondContact N-O 3.4Å; L294-M356 PolarHBondContact O-N 2.8Å; M356-E361 CarbonylContact C-O 3.54Å; M356-E361 WeakPolarHBondContact CA-O 3.35Å; M356-E361 WeakPolarHBondContact CB-O 3.22Å; M356-I362 HydrophobicContact CB-CB 4.5Å; M356-I362 HydrophobicContact CB-CG1 4.07Å
357	N	97.7	Very high	97.1	Very high	15 Å²	15	33.7 Å²	33.7	8%	0.08	18%	0.183	C	C	.	.			trans	-90.6	178.6	165.4	63.8	21.2	0	0	0	112.1	A266 E359 G360 E361 Y363	A266-N357 HydrophobicContact CB-CB 4.42Å; N357-E359 WeakPolarHBondContact CB-OE2 3.28Å; N357-E359 PolarHBondContact ND2-OE2 3.06Å; N357-E359 PolarHBondContact O-N 3.27Å; N357-E359 WeakPolarHBondContact OD1-CA 3.47Å; N357-E359 PolarHBondContact OD1-N 2.97Å; N357-E359 VanDerWaalsContact OD1-N 3.08Å; N357-E359 PolarHBondContact OD1-OE2 2.73Å; N357-G360 PolarHBondContact O-N 3.26Å; N357-G360 PolarHBondContact OD1-N 3.15Å; N357-E361 PolarHBondContact N-O 3.33Å; N357-E361 WeakPolarHBondContact ND2-CB 3.22Å; N357-E361 PolarHBondContact ND2-OE2 2.89Å; N357-E361 WeakPolarHBondContact OD1-CB 3.46Å; N357-E361 PolarHBondContact OD1-N 3.28Å; N357-Y363 HydrophobicContact CB-CE2 4.49Å; N357-Y363 WeakPolarHBondContact CB-OH 3.48Å; N357-Y363 PolarHBondContact ND2-OH 2.98Å
358	T	96.5	Very high	97.4	Very high	60 Å²	60	31.8 Å²	31.8	37%	0.368	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.6	178.8	37.7	0	0	0	0	113.9	M261 A266 L294	M261-T358 HydrophobicContact CB-CG2 4.5Å; A266-T358 HydrophobicContact CB-CG2 4.21Å; A266-T358 PolarHBondContact N-OG1 3.09Å; L294-T358 HydrophobicContact CD2-CG2 4.27Å
359	E	96.4	Very high	97.5	Very high	146 Å²	146	29.6 Å²	29.6	68%	0.682	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	-6.1	178.5	-61.2	66	-132.1	0	0	112.6	N357	N357-E359 WeakPolarHBondContact CB-OE2 3.28Å; N357-E359 PolarHBondContact ND2-OE2 3.06Å; N357-E359 PolarHBondContact O-N 3.27Å; N357-E359 WeakPolarHBondContact OD1-CA 3.47Å; N357-E359 PolarHBondContact OD1-N 2.97Å; N357-E359 VanDerWaalsContact OD1-N 3.08Å; N357-E359 PolarHBondContact OD1-OE2 2.73Å
360	G	95.6	Very high	97.5	Very high	42 Å²	42	30.6 Å²	30.6	43%	0.433	17%	0.166	S	C	.	.	S	Bend	trans	96.5	3.4	177.4	0	0	0	0	0	115.2	N357 I362	N357-G360 PolarHBondContact O-N 3.26Å; N357-G360 PolarHBondContact OD1-N 3.15Å; G360-I362 PolarHBondContact O-N 3.29Å
361	E	97.6	Very high	97.3	Very high	118 Å²	118	30.9 Å²	30.9	55%	0.551	17%	0.168	S	C	*	.			trans	-73.3	125.6	172.4	-171.3	-179.5	-179.2	0	0	109.3	M356 N357 Y363	M356-E361 CarbonylContact C-O 3.54Å; M356-E361 WeakPolarHBondContact CA-O 3.35Å; M356-E361 WeakPolarHBondContact CB-O 3.22Å; N357-E361 PolarHBondContact N-O 3.33Å; N357-E361 WeakPolarHBondContact ND2-CB 3.22Å; N357-E361 PolarHBondContact ND2-OE2 2.89Å; N357-E361 WeakPolarHBondContact OD1-CB 3.46Å; N357-E361 PolarHBondContact OD1-N 3.28Å; E361-Y363 HydrophobicContact CG-CE1 4.17Å
362	I	98.1	Very high	96.6	Very high	35 Å²	35	36.1 Å²	36.1	18%	0.179	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-106.7	132.1	-178.4	-52.8	179.4	0	0	0	108.4	A30 V32 N57 P58 G355 M356 G360	A30-I362 HydrophobicContact CB-CB 4.02Å; A30-I362 HydrophobicContact CB-CG2 3.79Å; A30-I362 WeakPolarHBondContact CB-O 3.48Å; V32-I362 HydrophobicContact CG1-CG2 3.98Å; N57-I362 HydrophobicContact CB-CD1 4.3Å; P58-I362 VanDerWaalsContact CD-CD1 3.45Å; P58-I362 HydrophobicContact CG-CD1 4.04Å; G355-I362 WeakPolarHBondContact O-CA 3.29Å; G355-I362 WeakPolarHBondContact O-CG2 3.32Å; M356-I362 HydrophobicContact CB-CB 4.5Å; M356-I362 HydrophobicContact CB-CG1 4.07Å; G360-I362 PolarHBondContact O-N 3.29Å
363	Y	97.7	Very high	96.6	Very high	22 Å²	22	38 Å²	38	9%	0.086	21%	0.205	C	C	.	.			trans	-94.6	151.7	-178	-48.5	-63.1	0	0	0	111.9	A30 R31 P291 G292 R293 G354 G355 N357 E361 D365	A30-Y363 WeakPolarHBondContact CA-O 3.46Å; R31-Y363 PolarHBondContact N-O 2.72Å; P291-Y363 HydrophobicContact CB-CE1 4.36Å; P291-Y363 WeakPolarHBondContact CB-OH 3.3Å; G292-Y363 PolarHBondContact O-OH 2.95Å; R293-Y363 HydrophobicContact CB-CD2 4.01Å; R293-Y363 HydrophobicContact CB-CE2 3.74Å; G354-Y363 VanDerWaalsContact CA-O 3.3Å; G354-Y363 WeakPolarHBondContact CA-O 3.19Å; G355-Y363 PolarHBondContact O-N 3.39Å; N357-Y363 HydrophobicContact CB-CE2 4.49Å; N357-Y363 WeakPolarHBondContact CB-OH 3.48Å; N357-Y363 PolarHBondContact ND2-OH 2.98Å; E361-Y363 HydrophobicContact CG-CE1 4.17Å; Y363-D365 VanDerWaalsContact CB-OD1 3.32Å; Y363-D365 WeakPolarHBondContact CB-OD1 3.34Å
364	D	96.8	Very high	96.5	Very high	89 Å²	89	39.9 Å²	39.9	48%	0.476	22%	0.216	S	C	.	.			trans	-128.7	17.8	172.7	56.5	1.3	0	0	0	112.4	A30 F353	A30-D364 HydrophobicContact CB-CB 4.16Å; F353-D364 VanDerWaalsContact CE2-O 3.28Å; F353-D364 WeakPolarHBondContact CE2-O 3.48Å
365	D	96.5	Very high	96.4	Very high	41 Å²	41	42.1 Å²	42.1	22%	0.219	23%	0.228	C	C	.	.			trans	-86	153.5	-178	64.3	-22.5	0	0	0	112.5	R293 F353 G354 Y363 I367	R293-D365 IonicContact CZ-OD1 3.93Å; R293-D365 IonicContact CZ-OD2 3.48Å; R293-D365 IonicContact NH1-OD1 3.17Å; R293-D365 PolarHBondContact NH1-OD1 2.86Å; R293-D365 IonicContact NH1-OD2 2.72Å; R293-D365 IonicContact NH2-OD1 3.97Å; R293-D365 PolarHBondContact NH2-OD1 2.74Å; R293-D365 IonicContact NH2-OD2 3.35Å; R293-D365 PolarHBondContact NH2-OD2 2.87Å; F353-D365 VanDerWaalsContact CD2-O 3.25Å; F353-D365 WeakPolarHBondContact CD2-O 3.42Å; G354-D365 PolarHBondContact N-O 2.93Å; Y363-D365 VanDerWaalsContact CB-OD1 3.32Å; Y363-D365 WeakPolarHBondContact CB-OD1 3.34Å; D365-I367 WeakPolarHBondContact OD2-CG2 3.5Å
366	C	97	Very high	96.3	Very high	7 Å²	7	44.6 Å²	44.6	5%	0.047	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.3	163	-67.3	0	0	0	0	109	L21 F353	L21-C366 HydrophobicContact CB-CB 4.01Å; L21-C366 PolarHBondContact N-O 3.28Å; L21-C366 WeakPolarHBondContact O-CB 3.43Å; F353-C366 WeakPolarHBondContact CD2-SG 3.32Å
367	I	97.6	Very high	96.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.9	170.9	62.3	176.5	0	0	0	109.7	L4 W18 Y19 F258 P290 V352 D365	L4-I367 HydrophobicContact CD1-CB 4.45Å; L4-I367 HydrophobicContact CD1-CG2 3.83Å; W18-I367 HydrophobicContact CE3-CB 4.1Å; W18-I367 HydrophobicContact CE3-CD1 4.11Å; W18-I367 HydrophobicContact CE3-CG1 4.12Å; W18-I367 HydrophobicContact CH2-CD1 4.45Å; W18-I367 HydrophobicContact CZ3-CB 4.24Å; W18-I367 HydrophobicContact CZ3-CD1 3.87Å; W18-I367 HydrophobicContact CZ3-CG1 3.81Å; Y19-I367 CarbonylContact O-C 3.49Å; Y19-I367 VanDerWaalsContact O-CA 3.23Å; Y19-I367 WeakPolarHBondContact O-CA 3.44Å; F258-I367 HydrophobicContact CE1-CD1 4.29Å; F258-I367 HydrophobicContact CZ-CD1 4.32Å; P290-I367 HydrophobicContact CB-CD1 3.29Å; P290-I367 HydrophobicContact CG-CD1 3.61Å; V352-I367 HydrophobicContact CB-CD1 4.08Å; V352-I367 HydrophobicContact CB-CG1 3.61Å; V352-I367 HydrophobicContact CG1-CD1 4.18Å; V352-I367 HydrophobicContact CG1-CG1 4.1Å; V352-I367 HydrophobicContact CG2-CD1 4.47Å; V352-I367 HydrophobicContact CG2-CG1 4.27Å; V352-I367 PolarHBondContact N-O 3.43Å; V352-I367 PolarHBondContact O-N 3.47Å; D365-I367 WeakPolarHBondContact OD2-CG2 3.5Å
368	V	97.8	Very high	96	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	149.4	-176.3	-60.1	0	0	0	0	111.5	L7 W18 Y19 L21 L349 C350 L351	L7-V368 HydrophobicContact CD2-CG2 3.85Å; W18-V368 WeakPolarHBondContact CA-O 3.49Å; Y19-V368 PolarHBondContact N-O 2.87Å; Y19-V368 PolarHBondContact O-N 2.71Å; L21-V368 HydrophobicContact CB-CG1 4.12Å; L21-V368 HydrophobicContact CB-CG2 4.45Å; L21-V368 HydrophobicContact CD2-CG1 4.13Å; L349-V368 HydrophobicContact CB-CB 4.41Å; L349-V368 HydrophobicContact CD1-CB 4.26Å; L349-V368 HydrophobicContact CD1-CG2 4.19Å; C350-V368 VanDerWaalsContact O-CA 3.31Å; C350-V368 WeakPolarHBondContact O-CA 3.45Å; L351-V368 HydrophobicContact CB-CG1 4.05Å; L351-V368 HydrophobicContact CD1-CG1 4.27Å; L351-V368 HydrophobicContact CG-CG1 4.13Å
369	T	97.9	Very high	96	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	153.7	167	179.8	0	0	0	0	110.2	T17 W18 M270 F285 L349 C350	T17-T369 PolarHBondContact O-OG1 3.44Å; W18-T369 HydrophobicContact CD2-CG2 4.26Å; W18-T369 HydrophobicContact CE3-CG2 4.14Å; W18-T369 HydrophobicContact CH2-CG2 3.63Å; W18-T369 HydrophobicContact CZ2-CG2 3.74Å; W18-T369 HydrophobicContact CZ3-CG2 3.83Å; M270-T369 HydrophobicContact CE-CG2 4.13Å; M270-T369 HydrophobicContact SD-CG2 3.79Å; F285-T369 HydrophobicContact CE1-CG2 4.38Å; F285-T369 WeakPolarHBondContact CE1-OG1 3.33Å; L349-T369 CarbonylContact C-O 3.5Å; L349-T369 WeakPolarHBondContact CA-O 3.36Å; C350-T369 HydrophobicContact CB-CG2 4.34Å; C350-T369 PolarHBondContact N-O 2.88Å; C350-T369 PolarHBondContact O-N 2.93Å; C350-T369 VanDerWaalsContact O-N 3.16Å
370	V	97	Very high	96	Very high	20 Å²	20	37.9 Å²	37.9	12%	0.121	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	137.8	171.7	-177.8	0	0	0	0	110	P13 K15 T347 L349	P13-V370 HydrophobicContact CB-CG2 3.68Å; P13-V370 HydrophobicContact CG-CG2 3.86Å; K15-V370 HydrophobicContact CG-CG1 4.12Å; T347-V370 HydrophobicContact CG2-CG1 3.9Å; T347-V370 HydrophobicContact CG2-CG2 4.13Å; L349-V370 HydrophobicContact CD2-CB 4.47Å; L349-V370 HydrophobicContact CD2-CG2 3.84Å
371	V	94.7	Very high	96	Very high	7 Å²	7	37.6 Å²	37.6	4%	0.042	19%	0.194	C	C	.	.			trans	-123.5	152.5	168.8	-68	0	0	0	0	110.2	Y256 M270 I300 L348 C350	Y256-V371 HydrophobicContact CD1-CG1 4.18Å; Y256-V371 HydrophobicContact CD2-CB 4.42Å; Y256-V371 HydrophobicContact CD2-CG1 4.2Å; Y256-V371 HydrophobicContact CE1-CB 4.3Å; Y256-V371 HydrophobicContact CE1-CG1 4.06Å; Y256-V371 HydrophobicContact CE2-CB 3.87Å; Y256-V371 HydrophobicContact CE2-CG1 4.1Å; Y256-V371 HydrophobicContact CG-CG1 4.23Å; M270-V371 HydrophobicContact CE-CG1 3.9Å; I300-V371 HydrophobicContact CD1-CG2 3.8Å; L348-V371 HydrophobicContact CB-CG2 4.07Å; L348-V371 PolarHBondContact O-N 3.36Å; L348-V371 VanDerWaalsContact O-N 3.12Å; C350-V371 HydrophobicContact CB-CG1 3.59Å; C350-V371 HydrophobicContact CB-CG2 4.43Å
372	D	83.6	Confident	95.9	Very high	111 Å²	111	30.3 Å²	30.3	59%	0.594	16%	0.161	S	C	*	.			trans	-102.8	0	179.8	-73.4	-34.6	0	0	0	112.9	K15 H254 Y256	K15-D372 WeakPolarHBondContact CE-OD1 3.27Å; K15-D372 IonicContact NZ-OD1 2.68Å; K15-D372 PolarHBondContact NZ-OD1 3.45Å; K15-D372 IonicContact NZ-OD2 3.38Å; K15-D372 PolarHBondContact NZ-OD2 2.81Å; H254-D372 PolarHBondContact ND1-O 3.25Å; Y256-D372 PolarHBondContact OH-N 3.03Å; Y256-D372 PolarHBondContact OH-O 2.85Å

Retrieved 372 of 372 residues in 885.6 ms (Link to these results)

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