A0A060W7T5_ONCMY Loading...

NF-kappa-B inhibitor-interacting Ras-like protein 2

AlphaFold DB , UniProt , Accession A0A060W7T5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110538185, Length 192 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	38	Very low	82	Confident	243 Å²	243	53.5 Å²	53.5	100%	1.197	30%	0.296	S	S	*	.				0	119.6	0	-76.1	166	75.2	0	0	107.5
2	G	53.9	Low	83.2	Confident	76 Å²	76	50.6 Å²	50.6	78%	0.784	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-62.3	147.5	-178.5	0	0	0	0	0	111.6	S4	G2-S4 PolarHBondContact O-N 2.94Å
3	K	63.2	Low	84.1	Confident	160 Å²	160	49.8 Å²	49.8	70%	0.696	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-61.4	121.3	175.2	-172.7	-173.6	173.7	-152.7	0	108.1	C5 D80	K3-C5 PolarHBondContact O-N 3.33Å; K3-D80 IonicContact NZ-OD1 2.6Å; K3-D80 PolarHBondContact NZ-OD1 3Å
4	S	75.4	Confident	84.7	Confident	28 Å²	28	51.7 Å²	51.7	20%	0.196	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-74.6	126.2	174.3	177.5	0	0	0	0	110.4	G2 R58	G2-S4 PolarHBondContact O-N 2.94Å; S4-R58 PolarHBondContact OG-NH1 2.88Å
5	C	90.3	Very high	85.5	Confident	11 Å²	11	48.3 Å²	48.3	7%	0.074	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.1	176.7	-64	0	0	0	0	110.2	K3 R58 M168	K3-C5 PolarHBondContact O-N 3.33Å; C5-R58 PolarHBondContact O-N 2.92Å; C5-M168 HydrophobicContact CB-CE 3.82Å; C5-M168 HydrophobicContact CB-SD 4.18Å
6	K	94.3	Very high	86.1	Confident	70 Å²	70	46.6 Å²	46.6	30%	0.304	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	115.2	175.9	-63.9	159.3	171.6	-175.6	0	109.3	R58 Y60 F78 D80 G81	K6-R58 WeakPolarHBondContact CA-O 3.47Å; K6-Y60 HydrophobicContact CB-CD2 4.39Å; K6-Y60 HydrophobicContact CB-CE2 3.89Å; K6-Y60 HydrophobicContact CG-CE2 3.91Å; K6-F78 HydrophobicContact CB-CE1 4.03Å; K6-F78 HydrophobicContact CB-CZ 4.27Å; K6-F78 HydrophobicContact CD-CD2 4.42Å; K6-F78 HydrophobicContact CD-CE1 4Å; K6-F78 HydrophobicContact CD-CE2 3.75Å; K6-F78 HydrophobicContact CD-CZ 3.48Å; K6-F78 VanDerWaalsContact CD-CZ 3.48Å; K6-F78 HydrophobicContact CG-CE1 4.26Å; K6-F78 HydrophobicContact CG-CZ 3.98Å; K6-D80 PolarHBondContact N-OD2 3.26Å; K6-D80 PolarHBondContact O-N 3.49Å; K6-G81 PolarHBondContact O-N 2.91Å
7	V	96.6	Very high	86.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127.5	177.3	173.2	0	0	0	0	108.9	V57 R58 F59 Y60 G81 V83 L164 M168	V7-V57 HydrophobicContact CB-CG1 4.04Å; V7-V57 HydrophobicContact CG2-CG1 3.54Å; V7-R58 PolarHBondContact N-O 2.97Å; V7-F59 HydrophobicContact CB-CD1 3.78Å; V7-F59 HydrophobicContact CB-CE1 4.05Å; V7-F59 HydrophobicContact CG1-CD1 3.79Å; V7-F59 HydrophobicContact CG1-CE1 4.04Å; V7-F59 HydrophobicContact CG2-CE1 4.38Å; V7-F59 CarbonylContact O-C 3.54Å; V7-F59 WeakPolarHBondContact O-CA 3.43Å; V7-Y60 PolarHBondContact O-N 2.8Å; V7-G81 WeakPolarHBondContact CA-O 3.34Å; V7-V83 HydrophobicContact CG1-CG2 3.75Å; V7-L164 HydrophobicContact CG1-CD2 3.83Å; V7-L164 HydrophobicContact CG2-CD2 3.92Å; V7-M168 HydrophobicContact CG2-CE 3.63Å; V7-M168 HydrophobicContact CG2-SD 3.71Å
8	V	97.5	Very high	87.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.4	173.8	171.6	0	0	0	0	109.3	C10 T62 F71 Y75 F78 A79 G81 F82 V83	V8-C10 HydrophobicContact CG1-CB 4.39Å; V8-T62 HydrophobicContact CG1-CG2 3.89Å; V8-F71 HydrophobicContact CG1-CE1 4.44Å; V8-F71 HydrophobicContact CG1-CZ 3.75Å; V8-Y75 HydrophobicContact CG1-CD1 4.11Å; V8-Y75 HydrophobicContact CG1-CG 4.17Å; V8-Y75 HydrophobicContact CG2-CD1 3.66Å; V8-Y75 HydrophobicContact CG2-CE1 4.38Å; V8-Y75 HydrophobicContact CG2-CG 4.31Å; V8-F78 HydrophobicContact CG2-CD1 4.28Å; V8-A79 HydrophobicContact CB-CB 4.07Å; V8-A79 HydrophobicContact CG2-CB 3.54Å; V8-G81 PolarHBondContact N-O 3.03Å; V8-F82 HydrophobicContact CB-CD1 3.78Å; V8-F82 HydrophobicContact CB-CE1 3.83Å; V8-F82 HydrophobicContact CG1-CD1 4.08Å; V8-F82 HydrophobicContact CG1-CE1 4.06Å; V8-F82 HydrophobicContact CG2-CE1 4.43Å; V8-F82 WeakPolarHBondContact O-CA 3.29Å; V8-V83 PolarHBondContact O-N 2.78Å
9	V	98.2	Very high	87.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	116.6	176.8	-171.4	0	0	0	0	108.4	K17 L21 F59 Y60 T62 V83 V85	V9-K17 HydrophobicContact CG1-CB 3.94Å; V9-K17 HydrophobicContact CG1-CD 4.41Å; V9-K17 HydrophobicContact CG1-CG 4.12Å; V9-L21 HydrophobicContact CB-CD1 4.45Å; V9-L21 HydrophobicContact CG2-CD1 4Å; V9-L21 HydrophobicContact CG2-CD2 4.07Å; V9-L21 HydrophobicContact CG2-CG 4.32Å; V9-F59 HydrophobicContact CG2-CB 4.4Å; V9-F59 HydrophobicContact CG2-CD1 4.28Å; V9-Y60 PolarHBondContact N-O 3.49Å; V9-T62 WeakPolarHBondContact O-CG2 3.35Å; V9-T62 PolarHBondContact O-N 3.47Å; V9-T62 PolarHBondContact O-OG1 3.44Å; V9-V83 WeakPolarHBondContact CA-O 3.47Å; V9-V83 HydrophobicContact CG1-CB 4.33Å; V9-V83 HydrophobicContact CG1-CG1 4.35Å; V9-V83 HydrophobicContact CG2-CB 4.23Å; V9-V85 HydrophobicContact CG1-CG2 3.88Å
10	C	97.3	Very high	88	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	158.8	-172.9	61.5	0	0	0	0	112.9	V8 F71 V83 L84 V85	V8-C10 HydrophobicContact CG1-CB 4.39Å; C10-F71 HydrophobicContact CB-CD2 4.35Å; C10-F71 HydrophobicContact CB-CE2 3.54Å; C10-F71 HydrophobicContact CB-CZ 3.65Å; C10-V83 PolarHBondContact N-O 2.88Å; C10-L84 WeakPolarHBondContact O-CA 3.33Å; C10-L84 WeakPolarHBondContact SG-CD2 3.36Å; C10-V85 PolarHBondContact O-N 3.02Å
11	G	97.3	Very high	88.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.4	173.9	-169.2	0	0	0	0	0	111	L65 V85	G11-L65 PolarHBondContact O-N 3.08Å; G11-L65 VanDerWaalsContact O-N 3.14Å; G11-V85 WeakPolarHBondContact CA-O 3.44Å
12	L	96.7	Very high	91.1	Very high	19 Å²	19	29.1 Å²	29.1	10%	0.099	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-59.7	161.9	178.9	-160.6	70.6	0	0	0	111.3	V15 K17 L65 D67 E92 R96	L12-V15 HydrophobicContact CB-CG1 3.87Å; L12-V15 VanDerWaalsContact O-CG2 3.24Å; L12-V15 WeakPolarHBondContact O-CG2 3.11Å; L12-K17 PolarHBondContact O-NZ 2.9Å; L12-K17 VanDerWaalsContact O-NZ 3.13Å; L12-L65 WeakPolarHBondContact CD1-O 3.41Å; L12-D67 WeakPolarHBondContact CD1-OD1 3.3Å; L12-E92 HydrophobicContact CD2-CG 4.44Å; L12-R96 HydrophobicContact CD1-CB 4.33Å; L12-R96 HydrophobicContact CD1-CG 4.07Å
13	A	94.2	Very high	93	Very high	41 Å²	41	26.5 Å²	26.5	34%	0.339	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	149.8	168.2	0	0	0	0	0	111.8	V15 L65	A13-V15 PolarHBondContact O-N 3.1Å; A13-L65 PolarHBondContact N-O 3.11Å
14	A	93.5	Very high	94.6	Very high	76 Å²	76	19.3 Å²	19.3	63%	0.628	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	9.4	176.9	0	0	0	0	0	117.6	G16	A14-G16 PolarHBondContact O-N 3.01Å
15	V	96	Very high	95.5	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	12%	0.123	C	C	.	.	S	Bend	trans	-74.6	-11.6	174.5	-56.6	0	0	0	0	113.8	L12 A13 K17 V85 N120	L12-V15 HydrophobicContact CB-CG1 3.87Å; L12-V15 VanDerWaalsContact O-CG2 3.24Å; L12-V15 WeakPolarHBondContact O-CG2 3.11Å; A13-V15 PolarHBondContact O-N 3.1Å; V15-K17 HydrophobicContact CG2-CD 4.43Å; V15-K17 HydrophobicContact CG2-CG 3.75Å; V15-V85 HydrophobicContact CB-CG1 4.2Å; V15-V85 HydrophobicContact CG2-CB 3.87Å; V15-V85 HydrophobicContact CG2-CG1 3.73Å; V15-N120 PolarHBondContact O-ND2 3.38Å
16	G	95.1	Very high	95.5	Very high	20 Å²	20	24.4 Å²	24.4	21%	0.206	14%	0.14	C	C	.	.			trans	94.5	31	177.1	0	0	0	0	0	116.2	A14 A19 V20	A14-G16 PolarHBondContact O-N 3.01Å; G16-A19 PolarHBondContact O-N 2.74Å; G16-V20 WeakPolarHBondContact O-CB 3.46Å; G16-V20 VanDerWaalsContact O-CG2 3.26Å; G16-V20 WeakPolarHBondContact O-CG2 3.49Å; G16-V20 PolarHBondContact O-N 2.97Å
17	K	96.5	Very high	95.2	Very high	7 Å²	7	23.3 Å²	23.3	3%	0.03	14%	0.144	C	C	.	.	H	α-helix	trans	-56	-55.4	177.4	-62	-177.6	-58.4	-59.3	0	112.8	V9 L12 V15 V20 L21 D61 T62 G64 V85	V9-K17 HydrophobicContact CG1-CB 3.94Å; V9-K17 HydrophobicContact CG1-CD 4.41Å; V9-K17 HydrophobicContact CG1-CG 4.12Å; L12-K17 PolarHBondContact O-NZ 2.9Å; L12-K17 VanDerWaalsContact O-NZ 3.13Å; V15-K17 HydrophobicContact CG2-CD 4.43Å; V15-K17 HydrophobicContact CG2-CG 3.75Å; K17-V20 WeakPolarHBondContact O-CB 3.17Å; K17-V20 PolarHBondContact O-N 3.06Å; K17-L21 PolarHBondContact O-N 3.35Å; K17-D61 WeakPolarHBondContact CB-OD1 3.25Å; K17-T62 WeakPolarHBondContact CE-O 3.39Å; K17-G64 VanDerWaalsContact NZ-CA 3.25Å; K17-V85 HydrophobicContact CG-CB 4.04Å; K17-V85 HydrophobicContact CG-CG2 4.07Å
18	T	95.3	Very high	94.4	Very high	25 Å²	25	29.2 Å²	29.2	15%	0.153	18%	0.176	C	C	.	.	H	α-helix	trans	-60.6	-47.4	177.3	-46.4	0	0	0	0	111.3	V20 L21 E22 T38 Y43 D61	T18-V20 VanDerWaalsContact C-N 3.31Å; T18-V20 PolarHBondContact O-N 3.04Å; T18-L21 PolarHBondContact O-N 3.29Å; T18-E22 HydrophobicContact CG2-CG 4.29Å; T18-E22 WeakPolarHBondContact O-CG 3.22Å; T18-E22 PolarHBondContact O-N 2.6Å; T18-T38 PolarHBondContact OG1-OG1 3.23Å; T18-Y43 VanDerWaalsContact CG2-OH 3.31Å; T18-Y43 WeakPolarHBondContact CG2-OH 3.48Å; T18-D61 WeakPolarHBondContact CA-OD2 3.36Å; T18-D61 VanDerWaalsContact CB-OD2 3.25Å; T18-D61 WeakPolarHBondContact CB-OD2 3.47Å; T18-D61 WeakPolarHBondContact CG2-OD2 3.43Å; T18-D61 PolarHBondContact OG1-OD2 2.66Å
19	A	94.8	Very high	93.4	Very high	13 Å²	13	31.1 Å²	31.1	11%	0.107	19%	0.185	C	C	.	.	H	α-helix	trans	-58.7	-40.2	178.1	0	0	0	0	0	112.8	G16 Q23 H29 V151	G16-A19 PolarHBondContact O-N 2.74Å; A19-Q23 WeakPolarHBondContact O-CB 3.07Å; A19-Q23 PolarHBondContact O-N 3.09Å; A19-H29 VanDerWaalsContact CB-CE1 3.47Å; A19-H29 WeakPolarHBondContact CB-CE1 3.22Å; A19-V151 HydrophobicContact CB-CG1 3.97Å
20	V	96.6	Very high	92.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-46	173.8	160.6	0	0	0	0	110.9	G16 K17 T18 L24 L118 V151 L157 F161	G16-V20 WeakPolarHBondContact O-CB 3.46Å; G16-V20 VanDerWaalsContact O-CG2 3.26Å; G16-V20 WeakPolarHBondContact O-CG2 3.49Å; G16-V20 PolarHBondContact O-N 2.97Å; K17-V20 WeakPolarHBondContact O-CB 3.17Å; K17-V20 PolarHBondContact O-N 3.06Å; T18-V20 VanDerWaalsContact C-N 3.31Å; T18-V20 PolarHBondContact O-N 3.04Å; V20-L24 WeakPolarHBondContact O-CB 3.24Å; V20-L24 PolarHBondContact O-N 3.45Å; V20-L118 HydrophobicContact CG1-CD1 3.96Å; V20-V151 HydrophobicContact CB-CG1 4.48Å; V20-V151 HydrophobicContact CG2-CG1 3.74Å; V20-L157 HydrophobicContact CG1-CD2 4.15Å; V20-L157 HydrophobicContact CG2-CD2 4.12Å; V20-F161 HydrophobicContact CG1-CE2 3.84Å; V20-F161 HydrophobicContact CG1-CZ 3.63Å
21	L	96.1	Very high	90.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.3	-49	-179.9	-70.5	177.3	0	0	0	112.3	V9 K17 T18 Q23 L24 L25 Y43 F59 D61 F161	V9-L21 HydrophobicContact CB-CD1 4.45Å; V9-L21 HydrophobicContact CG2-CD1 4Å; V9-L21 HydrophobicContact CG2-CD2 4.07Å; V9-L21 HydrophobicContact CG2-CG 4.32Å; K17-L21 PolarHBondContact O-N 3.35Å; T18-L21 PolarHBondContact O-N 3.29Å; L21-Q23 VanDerWaalsContact C-N 3.3Å; L21-Q23 PolarHBondContact O-N 3.02Å; L21-L24 PolarHBondContact O-N 3.28Å; L21-L25 WeakPolarHBondContact O-CB 3.47Å; L21-L25 VanDerWaalsContact O-CG 3.24Å; L21-L25 WeakPolarHBondContact O-CG 3.46Å; L21-L25 PolarHBondContact O-N 3.41Å; L21-Y43 HydrophobicContact CB-CD2 4.42Å; L21-Y43 HydrophobicContact CB-CG 4.4Å; L21-Y43 HydrophobicContact CD1-CD2 3.77Å; L21-Y43 HydrophobicContact CD1-CE2 4.24Å; L21-Y43 HydrophobicContact CD1-CG 4.33Å; L21-F59 HydrophobicContact CD1-CB 4.02Å; L21-F59 HydrophobicContact CD2-CB 3.75Å; L21-F59 HydrophobicContact CD2-CD1 3.87Å; L21-F59 HydrophobicContact CD2-CD2 4.18Å; L21-F59 HydrophobicContact CD2-CG 3.66Å; L21-D61 HydrophobicContact CD1-CB 3.71Å; L21-F161 HydrophobicContact CD2-CE1 4.19Å; L21-F161 HydrophobicContact CD2-CZ 4.49Å
22	E	94.1	Very high	89.4	Confident	65 Å²	65	44.2 Å²	44.2	30%	0.304	28%	0.282	S	S	.	.	H	α-helix	trans	-61.5	-41	179.3	-70.5	180	160.8	0	0	111.7	T18 Y26 A27 Y43	T18-E22 HydrophobicContact CG2-CG 4.29Å; T18-E22 WeakPolarHBondContact O-CG 3.22Å; T18-E22 PolarHBondContact O-N 2.6Å; E22-Y26 WeakPolarHBondContact O-CA 3.48Å; E22-Y26 WeakPolarHBondContact O-CB 3.33Å; E22-Y26 PolarHBondContact O-N 3.2Å; E22-A27 PolarHBondContact O-N 3.26Å; E22-Y43 HydrophobicContact CG-CE1 3.86Å; E22-Y43 PolarHBondContact OE1-OH 2.84Å
23	Q	94.9	Very high	88.2	Confident	20 Å²	20	46.1 Å²	46.1	9%	0.093	30%	0.296	C	S	.	.	H	α-helix	trans	-70.1	-41.9	178.6	-171.6	67.3	-25.5	0	0	112.3	A19 L21 A27 H29 V151 R154 L157	A19-Q23 WeakPolarHBondContact O-CB 3.07Å; A19-Q23 PolarHBondContact O-N 3.09Å; L21-Q23 VanDerWaalsContact C-N 3.3Å; L21-Q23 PolarHBondContact O-N 3.02Å; Q23-A27 WeakPolarHBondContact O-CA 3.37Å; Q23-A27 PolarHBondContact O-N 2.93Å; Q23-H29 HydrophobicContact CB-CB 3.82Å; Q23-H29 HydrophobicContact CG-CB 4.38Å; Q23-H29 PolarHBondContact OE1-O 2.94Å; Q23-V151 VanDerWaalsContact CG-O 3.3Å; Q23-V151 WeakPolarHBondContact CG-O 3.49Å; Q23-V151 PolarHBondContact NE2-O 2.7Å; Q23-R154 HydrophobicContact CG-CB 4.05Å; Q23-R154 HydrophobicContact CG-CG 4.21Å; Q23-R154 VanDerWaalsContact O-CD 3.25Å; Q23-R154 WeakPolarHBondContact O-CD 3.44Å; Q23-R154 PolarHBondContact O-NE 2.86Å; Q23-L157 HydrophobicContact CB-CD1 3.83Å; Q23-L157 HydrophobicContact CG-CD1 3.8Å
24	L	95.5	Very high	87.3	Confident	10 Å²	10	52 Å²	52	5%	0.052	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-51.4	176.2	176.4	69.1	0	0	0	110.9	V20 L21 I47 R154 L157 I158 F161	V20-L24 WeakPolarHBondContact O-CB 3.24Å; V20-L24 PolarHBondContact O-N 3.45Å; L21-L24 PolarHBondContact O-N 3.28Å; L24-I47 HydrophobicContact CD2-CD1 4.4Å; L24-R154 PolarHBondContact O-NE 3.19Å; L24-R154 PolarHBondContact O-NH2 3.44Å; L24-L157 HydrophobicContact CD1-CB 4.13Å; L24-I158 HydrophobicContact CD1-CD1 3.92Å; L24-F161 HydrophobicContact CD1-CB 4.47Å; L24-F161 HydrophobicContact CD1-CD2 4.33Å; L24-F161 HydrophobicContact CD1-CG 4.41Å; L24-F161 HydrophobicContact CD2-CB 3.93Å; L24-F161 HydrophobicContact CD2-CD1 3.32Å; L24-F161 HydrophobicContact CD2-CD2 3.69Å; L24-F161 HydrophobicContact CD2-CE1 3.59Å; L24-F161 HydrophobicContact CD2-CE2 3.91Å; L24-F161 HydrophobicContact CD2-CG 3.36Å; L24-F161 HydrophobicContact CD2-CZ 3.86Å
25	L	93.7	Very high	86.3	Confident	34 Å²	34	53.7 Å²	53.7	18%	0.178	32%	0.321	C	S	.	.	H	α-helix	trans	-84.3	-38.9	-167.6	-62	179.6	0	0	0	113.4	L21 Y43 I47 F59	L21-L25 WeakPolarHBondContact O-CB 3.47Å; L21-L25 VanDerWaalsContact O-CG 3.24Å; L21-L25 WeakPolarHBondContact O-CG 3.46Å; L21-L25 PolarHBondContact O-N 3.41Å; L25-Y43 HydrophobicContact CD1-CD1 4.24Å; L25-Y43 HydrophobicContact CD1-CG 4.3Å; L25-I47 HydrophobicContact CD2-CD1 4.4Å; L25-F59 HydrophobicContact CD1-CD2 4.3Å; L25-F59 HydrophobicContact CD2-CE2 4.28Å
26	Y	91.4	Very high	85.6	Confident	111 Å²	111	62 Å²	62	44%	0.435	36%	0.362	S	S	.	.	H	α-helix	trans	-117.9	-12.5	-170.1	-49.5	-52.7	0	0	0	113.8	E22 N28 Y43	E22-Y26 WeakPolarHBondContact O-CA 3.48Å; E22-Y26 WeakPolarHBondContact O-CB 3.33Å; E22-Y26 PolarHBondContact O-N 3.2Å; Y26-N28 PolarHBondContact O-N 3.43Å; Y26-N28 PolarHBondContact O-OD1 2.97Å; Y26-N28 VanDerWaalsContact O-OD1 3.11Å; Y26-Y43 AromaticContact CE2-CD1 3.7Å; Y26-Y43 HydrophobicContact CE2-CD1 3.7Å; Y26-Y43 AromaticContact CE2-CE1 3.91Å; Y26-Y43 HydrophobicContact CE2-CE1 3.91Å
27	A	88.6	Confident	85.1	Confident	48 Å²	48	66.1 Å²	66.1	40%	0.397	38%	0.376	S	S	.	.	S	Bend	trans	54.2	31.1	-172.8	0	0	0	0	0	113.3	E22 Q23	E22-A27 PolarHBondContact O-N 3.26Å; Q23-A27 WeakPolarHBondContact O-CA 3.37Å; Q23-A27 PolarHBondContact O-N 2.93Å
28	N	79.4	Confident	84.7	Confident	124 Å²	124	67.2 Å²	67.2	66%	0.663	38%	0.383	S	S	*	.			trans	-110.4	4.4	-171.6	-75.4	-12.8	0	0	0	113.5	Y26 I30	Y26-N28 PolarHBondContact O-N 3.43Å; Y26-N28 PolarHBondContact O-OD1 2.97Å; Y26-N28 VanDerWaalsContact O-OD1 3.11Å; N28-I30 PolarHBondContact O-N 3.16Å
29	H	76	Confident	84.2	Confident	40 Å²	40	71.7 Å²	71.7	19%	0.185	41%	0.406	C	S	.	.			trans	-81.6	123.5	179.1	-172.2	71.9	0	0	0	110.5	A19 Q23 S33	A19-H29 VanDerWaalsContact CB-CE1 3.47Å; A19-H29 WeakPolarHBondContact CB-CE1 3.22Å; Q23-H29 HydrophobicContact CB-CB 3.82Å; Q23-H29 HydrophobicContact CG-CB 4.38Å; Q23-H29 PolarHBondContact OE1-O 2.94Å; H29-S33 PolarHBondContact CE1-OG 3.37Å
30	I	74.2	Confident	83.8	Confident	130 Å²	130	76.6 Å²	76.6	67%	0.667	43%	0.427	S	S	*	.			trans	-92.4	112.7	174.8	-56.9	175.1	0	0	0	107.7	N28 G32 S33	N28-I30 PolarHBondContact O-N 3.16Å; I30-G32 PolarHBondContact O-N 3.24Å; I30-S33 WeakPolarHBondContact O-CB 3.39Å; I30-S33 PolarHBondContact O-N 3.48Å; I30-S33 VanDerWaalsContact O-N 3.11Å; I30-S33 PolarHBondContact O-OG 3.37Å
31	A	68	Low	83.7	Confident	60 Å²	60	81 Å²	81	50%	0.496	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	132	175.1	0	0	0	0	0	110.1	A152	A31-A152 HydrophobicContact CB-CB 4.07Å
32	G	67.1	Low	83.7	Confident	85 Å²	85	85 Å²	85	88%	0.876	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	5.1	-175.9	0	0	0	0	0	115.1	I30	I30-G32 PolarHBondContact O-N 3.24Å
33	S	72.3	Confident	83.7	Confident	58 Å²	58	82.9 Å²	82.9	41%	0.406	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-63.8	147.1	168	53.7	0	0	0	0	111.6	H29 I30	H29-S33 PolarHBondContact CE1-OG 3.37Å; I30-S33 WeakPolarHBondContact O-CB 3.39Å; I30-S33 PolarHBondContact O-N 3.48Å; I30-S33 VanDerWaalsContact O-N 3.11Å; I30-S33 PolarHBondContact O-OG 3.37Å
34	E	73.9	Confident	83.7	Confident	165 Å²	165	85.9 Å²	85.9	77%	0.771	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-57.6	126.5	177.6	-78.3	-68.5	163.1	0	0	110.5	M36	E34-M36 PolarHBondContact O-N 3.49Å
35	P	73.2	Confident	83.6	Confident	111 Å²	111	85.6 Å²	85.6	72%	0.721	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-64	120.4	179.5	-18.2	29.7	0	0	0	110.9
36	M	80.5	Confident	83.5	Confident	175 Å²	175	87.9 Å²	87.9	86%	0.862	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-93.4	139.4	169.5	-69.5	-172.7	-90	0	0	110.4	E34 T38	E34-M36 PolarHBondContact O-N 3.49Å; M36-T38 PolarHBondContact O-N 3Å
37	E	85.9	Confident	83.6	Confident	108 Å²	108	83.3 Å²	83.3	51%	0.505	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-73.1	118	175.2	-173.8	173.5	-158.7	0	0	110.1	R63 R66	E37-R63 IonicContact OE1-CZ 2.72Å; E37-R63 IonicContact OE1-NE 3.55Å; E37-R63 PolarHBondContact OE1-NE 3.09Å; E37-R63 IonicContact OE1-NH2 3.58Å; E37-R63 PolarHBondContact OE1-NH2 3.11Å; E37-R63 IonicContact OE2-NH2 2.76Å; E37-R63 PolarHBondContact OE2-NH2 3.33Å; E37-R63 VanDerWaalsContact OE2-NH2 3.14Å; E37-R66 IonicContact OE1-CZ 2.85Å; E37-R66 IonicContact OE1-NE 3.57Å; E37-R66 IonicContact OE1-NH2 3.91Å; E37-R66 PolarHBondContact OE1-NH2 3.05Å; E37-R66 IonicContact OE2-NH2 3.58Å; E37-R66 PolarHBondContact OE2-NH2 3.29Å
38	T	87.1	Confident	83.8	Confident	29 Å²	29	85.6 Å²	85.6	18%	0.178	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-70.5	132	173.2	-39.2	0	0	0	0	110.4	T18 M36 D61 R63	T18-T38 PolarHBondContact OG1-OG1 3.23Å; M36-T38 PolarHBondContact O-N 3Å; T38-D61 WeakPolarHBondContact CG2-OD2 3.36Å; T38-R63 VanDerWaalsContact O-CG 3.31Å; T38-R63 WeakPolarHBondContact O-CG 3.16Å
39	L	84.1	Confident	84.3	Confident	120 Å²	120	80 Å²	80	63%	0.628	45%	0.449	S	S	*	.			trans	-79.3	-92.8	162	-65.3	177.2	0	0	0	108.3	R63	L39-R63 WeakPolarHBondContact O-CA 3.17Å; L39-R63 WeakPolarHBondContact O-CB 3.44Å; L39-R63 PolarHBondContact O-N 2.9Å
40	E	88.1	Confident	84.9	Confident	116 Å²	116	83.5 Å²	83.5	54%	0.542	47%	0.47	S	S	.	.			trans	-153.3	143.7	169.1	-64.3	-177	168.6	0	0	107.6	D61 Y75	E40-D61 WeakPolarHBondContact CA-O 3.28Å; E40-Y75 VanDerWaalsContact CD-OH 3.26Å; E40-Y75 PolarHBondContact OE1-OH 2.92Å; E40-Y75 PolarHBondContact OE2-OH 3.21Å
41	D	93.4	Very high	85.6	Confident	92 Å²	92	82.5 Å²	82.5	49%	0.492	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	165.2	177.5	-153.8	-8.2	0	0	0	111.9	Y43 D61	D41-Y43 HydrophobicContact CB-CE2 3.96Å; D41-D61 PolarHBondContact N-O 3.41Å; D41-D61 VanDerWaalsContact N-O 3.1Å; D41-D61 PolarHBondContact O-N 3.38Å
42	I	95.6	Very high	86.4	Confident	84 Å²	84	82 Å²	82	43%	0.431	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	113.4	178.3	-56	174	0	0	0	109.8	R58 F59 Y60	I42-R58 HydrophobicContact CG2-CB 4.48Å; I42-F59 CarbonylContact C-O 3.59Å; I42-F59 WeakPolarHBondContact CA-O 3.4Å; I42-Y60 HydrophobicContact CD1-CD1 4.11Å; I42-Y60 HydrophobicContact CD1-CE1 3.51Å; I42-Y60 HydrophobicContact CG1-CD1 3.91Å; I42-Y60 HydrophobicContact CG1-CE1 3.8Å
43	Y	95.5	Very high	87.5	Confident	21 Å²	21	81.1 Å²	81.1	8%	0.082	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	136.6	174.1	-63.9	-99.8	0	0	0	110.5	T18 L21 E22 L25 Y26 D41 F59 D61	T18-Y43 VanDerWaalsContact CG2-OH 3.31Å; T18-Y43 WeakPolarHBondContact CG2-OH 3.48Å; L21-Y43 HydrophobicContact CB-CD2 4.42Å; L21-Y43 HydrophobicContact CB-CG 4.4Å; L21-Y43 HydrophobicContact CD1-CD2 3.77Å; L21-Y43 HydrophobicContact CD1-CE2 4.24Å; L21-Y43 HydrophobicContact CD1-CG 4.33Å; E22-Y43 HydrophobicContact CG-CE1 3.86Å; E22-Y43 PolarHBondContact OE1-OH 2.84Å; L25-Y43 HydrophobicContact CD1-CD1 4.24Å; L25-Y43 HydrophobicContact CD1-CG 4.3Å; Y26-Y43 AromaticContact CE2-CD1 3.7Å; Y26-Y43 HydrophobicContact CE2-CD1 3.7Å; Y26-Y43 AromaticContact CE2-CE1 3.91Å; Y26-Y43 HydrophobicContact CE2-CE1 3.91Å; D41-Y43 HydrophobicContact CB-CE2 3.96Å; Y43-F59 PolarHBondContact N-O 2.99Å; Y43-F59 PolarHBondContact O-N 3.44Å; Y43-D61 HydrophobicContact CD2-CB 3.99Å; Y43-D61 HydrophobicContact CE2-CB 3.81Å
44	I	95.1	Very high	88.4	Confident	83 Å²	83	86.6 Å²	86.6	43%	0.426	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	115.7	176.9	-53.9	-175.2	0	0	0	109	Q56 R58	I44-Q56 HydrophobicContact CG2-CG 3.66Å; I44-R58 HydrophobicContact CG1-CG 4.28Å
45	G	92.2	Very high	89.2	Confident	4 Å²	4	80.7 Å²	80.7	4%	0.041	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	144.8	177.2	0	0	0	0	0	112.6	Q56 V57	G45-Q56 WeakPolarHBondContact O-CA 3.43Å; G45-V57 PolarHBondContact N-O 3.01Å; G45-V57 PolarHBondContact O-N 3.32Å
46	S	92.9	Very high	90.1	Very high	82 Å²	82	80.2 Å²	80.2	57%	0.573	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	106.6	164.2	-172.1	0	0	0	0	108.2	E55	S46-E55 WeakPolarHBondContact CA-O 3.31Å
47	I	93.3	Very high	90.8	Very high	15 Å²	15	72 Å²	72	8%	0.077	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.9	-177.5	-52.6	-57.5	0	0	0	108.6	L24 L25 R54 E55 V57 F59 V162 A165	L24-I47 HydrophobicContact CD2-CD1 4.4Å; L25-I47 HydrophobicContact CD2-CD1 4.4Å; I47-R54 WeakPolarHBondContact O-CA 3.5Å; I47-E55 PolarHBondContact N-O 2.98Å; I47-E55 PolarHBondContact O-N 2.78Å; I47-V57 HydrophobicContact CG1-CG2 4.13Å; I47-F59 HydrophobicContact CG1-CZ 4.32Å; I47-V162 HydrophobicContact CG2-CG2 4.17Å; I47-A165 HydrophobicContact CB-CB 4.06Å; I47-A165 HydrophobicContact CG2-CB 3.81Å
48	E	92.2	Very high	91.3	Very high	95 Å²	95	70.5 Å²	70.5	44%	0.444	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	119.2	172.6	-163.2	164.4	140.9	0	0	109.4	R54 V162	E48-R54 HydrophobicContact CB-CG 4.16Å; E48-R54 HydrophobicContact CG-CG 4.13Å; E48-R54 IonicContact OE2-CZ 2.7Å; E48-R54 IonicContact OE2-NE 2.93Å; E48-R54 PolarHBondContact OE2-NE 3.33Å; E48-R54 VanDerWaalsContact OE2-NE 3.1Å; E48-R54 IonicContact OE2-NH2 3.2Å; E48-R54 PolarHBondContact OE2-NH2 3.22Å; E48-V162 WeakPolarHBondContact O-CG2 3.44Å
49	T	90.8	Very high	91.8	Very high	6 Å²	6	69.2 Å²	69.2	4%	0.037	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-73.7	165.3	178	58.2	0	0	0	0	111.3	R51 G52 T53 E55 A165 S166	T49-R51 PolarHBondContact O-N 3.44Å; T49-G52 PolarHBondContact O-N 3.3Å; T49-T53 WeakPolarHBondContact CB-O 3.44Å; T49-T53 PolarHBondContact N-O 2.85Å; T49-T53 PolarHBondContact OG1-N 2.97Å; T49-T53 PolarHBondContact OG1-O 3.4Å; T49-E55 HydrophobicContact CG2-CG 3.67Å; T49-A165 HydrophobicContact CG2-CB 4.13Å; T49-S166 VanDerWaalsContact CB-OG 3.29Å; T49-S166 WeakPolarHBondContact CB-OG 3.3Å
50	D	87.9	Confident	92.5	Very high	115 Å²	115	65.3 Å²	65.3	62%	0.615	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-21.5	172.7	59.5	-6.8	0	0	0	114	G52 S166	D50-G52 VanDerWaalsContact C-N 3.33Å; D50-S166 PolarHBondContact N-OG 2.88Å; D50-S166 WeakPolarHBondContact OD1-CB 3.32Å; D50-S166 PolarHBondContact OD1-OG 3.33Å
51	R	87.8	Confident	92.8	Very high	109 Å²	109	59.8 Å²	59.8	41%	0.411	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	4	175.9	-66.1	170.9	-69.2	163.2	3.7	113.9	T49 T53 T169 P171	T49-R51 PolarHBondContact O-N 3.44Å; R51-T53 PolarHBondContact O-N 2.85Å; R51-T169 PolarHBondContact NH1-O 3.13Å; R51-T169 PolarHBondContact NH2-O 2.96Å; R51-T169 VanDerWaalsContact NH2-O 3.09Å; R51-T169 PolarHBondContact NH2-OG1 3.2Å; R51-P171 VanDerWaalsContact NH1-CD 3.31Å
52	G	86.4	Confident	92.8	Very high	48 Å²	48	55.5 Å²	55.5	50%	0.495	28%	0.278	S	S	.	.	S	Bend	trans	72.5	10.8	-175.7	0	0	0	0	0	114.3	T49 D50	T49-G52 PolarHBondContact O-N 3.3Å; D50-G52 VanDerWaalsContact C-N 3.33Å
53	T	89.3	Confident	92.7	Very high	68 Å²	68	56.1 Å²	56.1	42%	0.417	28%	0.275	S	S	.	.			trans	-91.9	133.3	175.8	-56.9	0	0	0	0	110	T49 R51	T49-T53 WeakPolarHBondContact CB-O 3.44Å; T49-T53 PolarHBondContact N-O 2.85Å; T49-T53 PolarHBondContact OG1-N 2.97Å; T49-T53 PolarHBondContact OG1-O 3.4Å; R51-T53 PolarHBondContact O-N 2.85Å
54	R	90.6	Very high	92.1	Very high	173 Å²	173	55.6 Å²	55.6	65%	0.653	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	122	175.5	-71.2	-173.3	177.2	-176.7	-0.5	111.6	I47 E48	I47-R54 WeakPolarHBondContact O-CA 3.5Å; E48-R54 HydrophobicContact CB-CG 4.16Å; E48-R54 HydrophobicContact CG-CG 4.13Å; E48-R54 IonicContact OE2-CZ 2.7Å; E48-R54 IonicContact OE2-NE 2.93Å; E48-R54 PolarHBondContact OE2-NE 3.33Å; E48-R54 VanDerWaalsContact OE2-NE 3.1Å; E48-R54 IonicContact OE2-NH2 3.2Å; E48-R54 PolarHBondContact OE2-NH2 3.22Å
55	E	91	Very high	91.6	Very high	41 Å²	41	52.2 Å²	52.2	19%	0.192	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.8	179.9	-61	-67.3	-178.9	0	0	110.3	S46 I47 T49 T169	S46-E55 WeakPolarHBondContact CA-O 3.31Å; I47-E55 PolarHBondContact N-O 2.98Å; I47-E55 PolarHBondContact O-N 2.78Å; T49-E55 HydrophobicContact CG2-CG 3.67Å; E55-T169 HydrophobicContact CB-CG2 4.36Å; E55-T169 VanDerWaalsContact CD-CG2 3.44Å; E55-T169 HydrophobicContact CG-CG2 3.73Å; E55-T169 VanDerWaalsContact OE1-CB 3.25Å; E55-T169 WeakPolarHBondContact OE1-CB 3.31Å; E55-T169 PolarHBondContact OE1-OG1 3.32Å
56	Q	93.3	Very high	91.3	Very high	100 Å²	100	57.9 Å²	57.9	47%	0.467	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.4	172.8	-173.6	-179	83.1	0	0	109.8	I44 G45 R58	I44-Q56 HydrophobicContact CG2-CG 3.66Å; G45-Q56 WeakPolarHBondContact O-CA 3.43Å; Q56-R58 VanDerWaalsContact OE1-NH1 3.14Å
57	V	95.2	Very high	90.7	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.6	179.1	-172.7	0	0	0	0	109.2	V7 G45 I47 F59 A165 M168	V7-V57 HydrophobicContact CB-CG1 4.04Å; V7-V57 HydrophobicContact CG2-CG1 3.54Å; G45-V57 PolarHBondContact N-O 3.01Å; G45-V57 PolarHBondContact O-N 3.32Å; I47-V57 HydrophobicContact CG1-CG2 4.13Å; V57-F59 HydrophobicContact CB-CD2 4.46Å; V57-F59 HydrophobicContact CB-CE1 4.38Å; V57-F59 HydrophobicContact CB-CE2 3.76Å; V57-F59 HydrophobicContact CB-CZ 3.71Å; V57-F59 HydrophobicContact CG1-CD1 4.07Å; V57-F59 HydrophobicContact CG1-CD2 4.24Å; V57-F59 HydrophobicContact CG1-CE1 3.59Å; V57-F59 HydrophobicContact CG1-CE2 3.78Å; V57-F59 HydrophobicContact CG1-CG 4.37Å; V57-F59 HydrophobicContact CG1-CZ 3.43Å; V57-F59 VanDerWaalsContact CG1-CZ 3.43Å; V57-F59 HydrophobicContact CG2-CZ 4.47Å; V57-A165 HydrophobicContact CG2-CB 4.48Å; V57-M168 HydrophobicContact CG1-CE 4.46Å; V57-M168 HydrophobicContact CG2-CE 4.46Å
58	R	96.5	Very high	89.8	Confident	77 Å²	77	62.3 Å²	62.3	29%	0.291	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111.5	170.9	-72.8	177.7	165.3	78.3	1.2	108.2	S4 C5 K6 V7 I42 I44 Q56 Y60	S4-R58 PolarHBondContact OG-NH1 2.88Å; C5-R58 PolarHBondContact O-N 2.92Å; K6-R58 WeakPolarHBondContact CA-O 3.47Å; V7-R58 PolarHBondContact N-O 2.97Å; I42-R58 HydrophobicContact CG2-CB 4.48Å; I44-R58 HydrophobicContact CG1-CG 4.28Å; Q56-R58 VanDerWaalsContact OE1-NH1 3.14Å; R58-Y60 HydrophobicContact CB-CE2 3.84Å
59	F	97.5	Very high	89.4	Confident	3 Å²	3	62.3 Å²	62.3	1%	0.013	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	120.8	176.3	-59.2	-81	0	0	0	109.5	V7 V9 L21 L25 I42 Y43 I47 V57 F161	V7-F59 HydrophobicContact CB-CD1 3.78Å; V7-F59 HydrophobicContact CB-CE1 4.05Å; V7-F59 HydrophobicContact CG1-CD1 3.79Å; V7-F59 HydrophobicContact CG1-CE1 4.04Å; V7-F59 HydrophobicContact CG2-CE1 4.38Å; V7-F59 CarbonylContact O-C 3.54Å; V7-F59 WeakPolarHBondContact O-CA 3.43Å; V9-F59 HydrophobicContact CG2-CB 4.4Å; V9-F59 HydrophobicContact CG2-CD1 4.28Å; L21-F59 HydrophobicContact CD1-CB 4.02Å; L21-F59 HydrophobicContact CD2-CB 3.75Å; L21-F59 HydrophobicContact CD2-CD1 3.87Å; L21-F59 HydrophobicContact CD2-CD2 4.18Å; L21-F59 HydrophobicContact CD2-CG 3.66Å; L25-F59 HydrophobicContact CD1-CD2 4.3Å; L25-F59 HydrophobicContact CD2-CE2 4.28Å; I42-F59 CarbonylContact C-O 3.59Å; I42-F59 WeakPolarHBondContact CA-O 3.4Å; Y43-F59 PolarHBondContact N-O 2.99Å; Y43-F59 PolarHBondContact O-N 3.44Å; I47-F59 HydrophobicContact CG1-CZ 4.32Å; V57-F59 HydrophobicContact CB-CD2 4.46Å; V57-F59 HydrophobicContact CB-CE1 4.38Å; V57-F59 HydrophobicContact CB-CE2 3.76Å; V57-F59 HydrophobicContact CB-CZ 3.71Å; V57-F59 HydrophobicContact CG1-CD1 4.07Å; V57-F59 HydrophobicContact CG1-CD2 4.24Å; V57-F59 HydrophobicContact CG1-CE1 3.59Å; V57-F59 HydrophobicContact CG1-CE2 3.78Å; V57-F59 HydrophobicContact CG1-CG 4.37Å; V57-F59 HydrophobicContact CG1-CZ 3.43Å; V57-F59 VanDerWaalsContact CG1-CZ 3.43Å; V57-F59 HydrophobicContact CG2-CZ 4.47Å; F59-F161 HydrophobicContact CD1-CE1 4.2Å; F59-F161 AromaticContact CE1-CD1 3.58Å; F59-F161 HydrophobicContact CE1-CD1 3.58Å; F59-F161 AromaticContact CE1-CE1 3.61Å; F59-F161 HydrophobicContact CE1-CE1 3.61Å; F59-F161 AromaticContact CZ-CD1 3.74Å; F59-F161 HydrophobicContact CZ-CD1 3.74Å; F59-F161 HydrophobicContact CZ-CE1 4.1Å
60	Y	97.1	Very high	89.2	Confident	37 Å²	37	68.7 Å²	68.7	15%	0.145	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	100.2	174.3	-68.9	-99.8	0	0	0	107	K6 V7 V9 I42 R58 F78	K6-Y60 HydrophobicContact CB-CD2 4.39Å; K6-Y60 HydrophobicContact CB-CE2 3.89Å; K6-Y60 HydrophobicContact CG-CE2 3.91Å; V7-Y60 PolarHBondContact O-N 2.8Å; V9-Y60 PolarHBondContact N-O 3.49Å; I42-Y60 HydrophobicContact CD1-CD1 4.11Å; I42-Y60 HydrophobicContact CD1-CE1 3.51Å; I42-Y60 HydrophobicContact CG1-CD1 3.91Å; I42-Y60 HydrophobicContact CG1-CE1 3.8Å; R58-Y60 HydrophobicContact CB-CE2 3.84Å; Y60-F78 AromaticContact CD1-CE1 3.8Å; Y60-F78 HydrophobicContact CD1-CE1 3.8Å; Y60-F78 HydrophobicContact CD1-CZ 4.19Å; Y60-F78 AromaticContact CD2-CE1 3.65Å; Y60-F78 HydrophobicContact CD2-CE1 3.65Å; Y60-F78 HydrophobicContact CD2-CZ 4.27Å; Y60-F78 AromaticContact CE1-CE1 3.6Å; Y60-F78 HydrophobicContact CE1-CE1 3.6Å; Y60-F78 AromaticContact CE1-CZ 3.5Å; Y60-F78 HydrophobicContact CE1-CZ 3.5Å; Y60-F78 AromaticContact CE2-CE1 3.46Å; Y60-F78 HydrophobicContact CE2-CE1 3.46Å; Y60-F78 VanDerWaalsContact CE2-CE1 3.46Å; Y60-F78 AromaticContact CE2-CZ 3.62Å; Y60-F78 HydrophobicContact CE2-CZ 3.62Å; Y60-F78 AromaticContact CG-CE1 3.85Å; Y60-F78 HydrophobicContact CG-CE1 3.85Å; Y60-F78 AromaticContact CZ-CE1 3.47Å; Y60-F78 VanDerWaalsContact CZ-CE1 3.47Å; Y60-F78 AromaticContact CZ-CZ 3.22Å; Y60-F78 WeakPolarHBondContact OH-CZ 3.48Å
61	D	95.6	Very high	89.4	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.5	175.6	-168.9	24	0	0	0	108.9	K17 T18 L21 T38 E40 D41 Y43	K17-D61 WeakPolarHBondContact CB-OD1 3.25Å; T18-D61 WeakPolarHBondContact CA-OD2 3.36Å; T18-D61 VanDerWaalsContact CB-OD2 3.25Å; T18-D61 WeakPolarHBondContact CB-OD2 3.47Å; T18-D61 WeakPolarHBondContact CG2-OD2 3.43Å; T18-D61 PolarHBondContact OG1-OD2 2.66Å; L21-D61 HydrophobicContact CD1-CB 3.71Å; T38-D61 WeakPolarHBondContact CG2-OD2 3.36Å; E40-D61 WeakPolarHBondContact CA-O 3.28Å; D41-D61 PolarHBondContact N-O 3.41Å; D41-D61 VanDerWaalsContact N-O 3.1Å; D41-D61 PolarHBondContact O-N 3.38Å; Y43-D61 HydrophobicContact CD2-CB 3.99Å; Y43-D61 HydrophobicContact CE2-CB 3.81Å
62	T	94.1	Very high	89.6	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.012	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-98.1	151.6	-174.4	61.3	0	0	0	0	110.9	V8 V9 K17 G64 F71 Y75	V8-T62 HydrophobicContact CG1-CG2 3.89Å; V9-T62 WeakPolarHBondContact O-CG2 3.35Å; V9-T62 PolarHBondContact O-N 3.47Å; V9-T62 PolarHBondContact O-OG1 3.44Å; K17-T62 WeakPolarHBondContact CE-O 3.39Å; T62-G64 PolarHBondContact O-N 3.2Å; T62-F71 HydrophobicContact CG2-CE2 4.13Å; T62-F71 HydrophobicContact CG2-CZ 4.26Å; T62-Y75 HydrophobicContact CG2-CD2 4.38Å; T62-Y75 HydrophobicContact CG2-CE1 4.27Å; T62-Y75 HydrophobicContact CG2-CE2 3.83Å
63	R	91.5	Very high	89.8	Confident	97 Å²	97	64.7 Å²	64.7	37%	0.366	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-50.1	138.1	166.1	-171.5	155.8	-173.4	172	4.5	109.5	E37 T38 L39 L65	E37-R63 IonicContact OE1-CZ 2.72Å; E37-R63 IonicContact OE1-NE 3.55Å; E37-R63 PolarHBondContact OE1-NE 3.09Å; E37-R63 IonicContact OE1-NH2 3.58Å; E37-R63 PolarHBondContact OE1-NH2 3.11Å; E37-R63 IonicContact OE2-NH2 2.76Å; E37-R63 PolarHBondContact OE2-NH2 3.33Å; E37-R63 VanDerWaalsContact OE2-NH2 3.14Å; T38-R63 VanDerWaalsContact O-CG 3.31Å; T38-R63 WeakPolarHBondContact O-CG 3.16Å; L39-R63 WeakPolarHBondContact O-CA 3.17Å; L39-R63 WeakPolarHBondContact O-CB 3.44Å; L39-R63 PolarHBondContact O-N 2.9Å; R63-L65 PolarHBondContact O-N 3.03Å
64	G	83.5	Confident	89.8	Confident	9 Å²	9	66.6 Å²	66.6	9%	0.093	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-52.2	123.6	167.6	0	0	0	0	0	112	K17 T62	K17-G64 VanDerWaalsContact NZ-CA 3.25Å; T62-G64 PolarHBondContact O-N 3.2Å
65	L	84.8	Confident	89.9	Confident	12 Å²	12	58.9 Å²	58.9	6%	0.063	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-63.4	141.6	173.2	-71.2	164.1	0	0	0	109.6	G11 L12 A13 R63 F71 L100	G11-L65 PolarHBondContact O-N 3.08Å; G11-L65 VanDerWaalsContact O-N 3.14Å; L12-L65 WeakPolarHBondContact CD1-O 3.41Å; A13-L65 PolarHBondContact N-O 3.11Å; R63-L65 PolarHBondContact O-N 3.03Å; L65-F71 HydrophobicContact CD1-CB 4.33Å; L65-F71 HydrophobicContact CD1-CD2 3.89Å; L65-F71 HydrophobicContact CD1-CG 4.49Å; L65-F71 HydrophobicContact CD2-CB 4.4Å; L65-F71 HydrophobicContact CD2-CD2 4.06Å; L65-F71 HydrophobicContact CG-CD2 4.27Å; L65-L100 HydrophobicContact CD1-CD1 3.83Å; L65-L100 HydrophobicContact CD1-CD2 3.77Å; L65-L100 HydrophobicContact CD1-CG 4.19Å
66	R	86.9	Confident	89.9	Confident	124 Å²	124	57 Å²	57	47%	0.468	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-101.1	154.5	170.1	-55.1	-178.4	174.9	-151.4	-3.8	108.3	E37 G68 L69	E37-R66 IonicContact OE1-CZ 2.85Å; E37-R66 IonicContact OE1-NE 3.57Å; E37-R66 IonicContact OE1-NH2 3.91Å; E37-R66 PolarHBondContact OE1-NH2 3.05Å; E37-R66 IonicContact OE2-NH2 3.58Å; E37-R66 PolarHBondContact OE2-NH2 3.29Å; R66-G68 PolarHBondContact O-N 3.49Å; R66-L69 HydrophobicContact CB-CD1 3.78Å; R66-L69 HydrophobicContact CB-CG 4.13Å; R66-L69 HydrophobicContact CG-CD1 4.21Å; R66-L69 WeakPolarHBondContact O-CB 3.45Å; R66-L69 PolarHBondContact O-N 3.02Å; R66-L69 VanDerWaalsContact O-N 3.11Å
67	D	79.3	Confident	89.7	Confident	103 Å²	103	58.5 Å²	58.5	55%	0.551	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	136.4	179.7	-65.9	-18.9	0	0	0	110.7	L12 L69	L12-D67 WeakPolarHBondContact CD1-OD1 3.3Å; D67-L69 VanDerWaalsContact C-N 3.25Å; D67-L69 PolarHBondContact O-N 3.3Å
68	G	74.5	Confident	89.3	Confident	86 Å²	86	61.5 Å²	61.5	89%	0.887	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-5.9	-177.9	0	0	0	0	0	116	R66	R66-G68 PolarHBondContact O-N 3.49Å
69	L	84.4	Confident	89.1	Confident	96 Å²	96	58.1 Å²	58.1	50%	0.503	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-88.7	133	176.3	-60.1	-172.5	0	0	0	112.1	R66 D67 R96	R66-L69 HydrophobicContact CB-CD1 3.78Å; R66-L69 HydrophobicContact CB-CG 4.13Å; R66-L69 HydrophobicContact CG-CD1 4.21Å; R66-L69 WeakPolarHBondContact O-CB 3.45Å; R66-L69 PolarHBondContact O-N 3.02Å; R66-L69 VanDerWaalsContact O-N 3.11Å; D67-L69 VanDerWaalsContact C-N 3.25Å; D67-L69 PolarHBondContact O-N 3.3Å; L69-R96 PolarHBondContact O-NH2 3.3Å
70	E	87.1	Confident	88.9	Confident	139 Å²	139	60.1 Å²	60.1	65%	0.65	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-68.8	146.7	172.8	-68.5	-166.5	176.9	0	0	111.5	R73	E70-R73 IonicContact OE2-NE 3.1Å; E70-R73 IonicContact OE2-NH2 3.26Å
71	F	91.3	Very high	88.8	Confident	7 Å²	7	58.3 Å²	58.3	3%	0.031	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-76.8	134.9	172.1	-173.3	-115.6	0	0	0	109.8	V8 C10 T62 L65 R73 Y75 F76 L100	V8-F71 HydrophobicContact CG1-CE1 4.44Å; V8-F71 HydrophobicContact CG1-CZ 3.75Å; C10-F71 HydrophobicContact CB-CD2 4.35Å; C10-F71 HydrophobicContact CB-CE2 3.54Å; C10-F71 HydrophobicContact CB-CZ 3.65Å; T62-F71 HydrophobicContact CG2-CE2 4.13Å; T62-F71 HydrophobicContact CG2-CZ 4.26Å; L65-F71 HydrophobicContact CD1-CB 4.33Å; L65-F71 HydrophobicContact CD1-CD2 3.89Å; L65-F71 HydrophobicContact CD1-CG 4.49Å; L65-F71 HydrophobicContact CD2-CB 4.4Å; L65-F71 HydrophobicContact CD2-CD2 4.06Å; L65-F71 HydrophobicContact CG-CD2 4.27Å; F71-R73 PolarHBondContact O-N 3.27Å; F71-R73 VanDerWaalsContact O-N 3.11Å; F71-Y75 AromaticContact CE1-CD2 3.81Å; F71-Y75 HydrophobicContact CE1-CD2 3.81Å; F71-Y75 AromaticContact CE1-CG 3.97Å; F71-Y75 HydrophobicContact CE1-CG 3.97Å; F71-Y75 AromaticContact CE2-CD2 3.88Å; F71-Y75 HydrophobicContact CE2-CD2 3.88Å; F71-Y75 HydrophobicContact CE2-CE2 4.36Å; F71-Y75 AromaticContact CZ-CD2 3.41Å; F71-Y75 HydrophobicContact CZ-CD2 3.41Å; F71-Y75 VanDerWaalsContact CZ-CD2 3.41Å; F71-Y75 HydrophobicContact CZ-CE2 4.23Å; F71-Y75 AromaticContact CZ-CG 3.77Å; F71-Y75 HydrophobicContact CZ-CG 3.77Å; F71-F76 HydrophobicContact CB-CZ 4.09Å; F71-F76 HydrophobicContact CD1-CD1 4.21Å; F71-F76 AromaticContact CD1-CE1 3.51Å; F71-F76 HydrophobicContact CD1-CE1 3.51Å; F71-F76 HydrophobicContact CD1-CE2 4.26Å; F71-F76 AromaticContact CD1-CZ 3.55Å; F71-F76 HydrophobicContact CD1-CZ 3.55Å; F71-F76 HydrophobicContact CE1-CD1 4.43Å; F71-F76 HydrophobicContact CE1-CE1 4.07Å; F71-F76 HydrophobicContact CG-CZ 4.31Å; F71-L100 HydrophobicContact CB-CD2 3.66Å; F71-L100 HydrophobicContact CD1-CD2 4.29Å; F71-L100 HydrophobicContact CD2-CD2 4.27Å; F71-L100 HydrophobicContact CG-CD2 3.83Å
72	P	91.6	Very high	88.8	Confident	49 Å²	49	58.3 Å²	58.3	32%	0.318	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-57.8	119	-176.2	-26.6	35.1	0	0	0	112.5	H74 Y75	P72-H74 WeakPolarHBondContact CB-CE1 3.44Å; P72-H74 WeakPolarHBondContact CB-ND1 3.35Å; P72-H74 PolarHBondContact O-N 2.93Å; P72-Y75 HydrophobicContact CB-CD2 3.86Å; P72-Y75 HydrophobicContact CB-CE2 4.04Å; P72-Y75 HydrophobicContact CG-CD2 4.22Å; P72-Y75 HydrophobicContact CG-CE2 4.08Å; P72-Y75 PolarHBondContact O-N 3.02Å; P72-Y75 VanDerWaalsContact O-N 3.14Å
73	R	90.9	Very high	89	Confident	133 Å²	133	58.2 Å²	58.2	50%	0.502	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.5	-170.1	-64.1	-175.2	-174	-176.7	0.9	114.4	E70 F71 Y75 F76 F77	E70-R73 IonicContact OE2-NE 3.1Å; E70-R73 IonicContact OE2-NH2 3.26Å; F71-R73 PolarHBondContact O-N 3.27Å; F71-R73 VanDerWaalsContact O-N 3.11Å; R73-Y75 PolarHBondContact O-N 3.02Å; R73-F76 HydrophobicContact CB-CD2 4.22Å; R73-F76 HydrophobicContact CG-CD2 4.44Å; R73-F76 HydrophobicContact CG-CE2 4.42Å; R73-F76 WeakPolarHBondContact O-CB 3.24Å; R73-F76 PolarHBondContact O-N 2.93Å; R73-F76 VanDerWaalsContact O-N 3.08Å; R73-F77 WeakPolarHBondContact O-CD2 3.43Å
74	H	90.4	Very high	89.4	Confident	108 Å²	108	53.6 Å²	53.6	50%	0.5	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-31.1	-179.1	67.7	-92.6	0	0	0	112.5	P72 F76 F77 F78	P72-H74 WeakPolarHBondContact CB-CE1 3.44Å; P72-H74 WeakPolarHBondContact CB-ND1 3.35Å; P72-H74 PolarHBondContact O-N 2.93Å; H74-F76 PolarHBondContact O-N 3.42Å; H74-F77 PolarHBondContact O-N 3.44Å; H74-F77 VanDerWaalsContact O-N 3.11Å; H74-F78 WeakPolarHBondContact O-CB 3.34Å; H74-F78 PolarHBondContact O-N 2.98Å
75	Y	92.3	Very high	90.1	Very high	11 Å²	11	53.2 Å²	53.2	4%	0.043	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-30.8	175.5	-71.4	-56.8	0	0	0	112.8	V8 E40 T62 F71 P72 R73 F77 F78 A79 F82 R108	V8-Y75 HydrophobicContact CG1-CD1 4.11Å; V8-Y75 HydrophobicContact CG1-CG 4.17Å; V8-Y75 HydrophobicContact CG2-CD1 3.66Å; V8-Y75 HydrophobicContact CG2-CE1 4.38Å; V8-Y75 HydrophobicContact CG2-CG 4.31Å; E40-Y75 VanDerWaalsContact CD-OH 3.26Å; E40-Y75 PolarHBondContact OE1-OH 2.92Å; E40-Y75 PolarHBondContact OE2-OH 3.21Å; T62-Y75 HydrophobicContact CG2-CD2 4.38Å; T62-Y75 HydrophobicContact CG2-CE1 4.27Å; T62-Y75 HydrophobicContact CG2-CE2 3.83Å; F71-Y75 AromaticContact CE1-CD2 3.81Å; F71-Y75 HydrophobicContact CE1-CD2 3.81Å; F71-Y75 AromaticContact CE1-CG 3.97Å; F71-Y75 HydrophobicContact CE1-CG 3.97Å; F71-Y75 AromaticContact CE2-CD2 3.88Å; F71-Y75 HydrophobicContact CE2-CD2 3.88Å; F71-Y75 HydrophobicContact CE2-CE2 4.36Å; F71-Y75 AromaticContact CZ-CD2 3.41Å; F71-Y75 HydrophobicContact CZ-CD2 3.41Å; F71-Y75 VanDerWaalsContact CZ-CD2 3.41Å; F71-Y75 HydrophobicContact CZ-CE2 4.23Å; F71-Y75 AromaticContact CZ-CG 3.77Å; F71-Y75 HydrophobicContact CZ-CG 3.77Å; P72-Y75 HydrophobicContact CB-CD2 3.86Å; P72-Y75 HydrophobicContact CB-CE2 4.04Å; P72-Y75 HydrophobicContact CG-CD2 4.22Å; P72-Y75 HydrophobicContact CG-CE2 4.08Å; P72-Y75 PolarHBondContact O-N 3.02Å; P72-Y75 VanDerWaalsContact O-N 3.14Å; R73-Y75 PolarHBondContact O-N 3.02Å; Y75-F77 PolarHBondContact O-N 3.17Å; Y75-F78 HydrophobicContact CD1-CD1 4.45Å; Y75-F78 PolarHBondContact O-N 2.76Å; Y75-A79 PolarHBondContact O-N 3.26Å; Y75-F82 WeakPolarHBondContact O-CZ 3.43Å; Y75-R108 PolarHBondContact O-NH2 2.99Å; Y75-R108 VanDerWaalsContact O-NH2 3.17Å
76	F	90.9	Very high	90.8	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.009	27%	0.267	C	S	.	.	H	α-helix	trans	-71.2	-5.7	175.1	-54.8	-51.2	0	0	0	114.5	F71 R73 H74 F82 D103 I104 Y107 R108	F71-F76 HydrophobicContact CB-CZ 4.09Å; F71-F76 HydrophobicContact CD1-CD1 4.21Å; F71-F76 AromaticContact CD1-CE1 3.51Å; F71-F76 HydrophobicContact CD1-CE1 3.51Å; F71-F76 HydrophobicContact CD1-CE2 4.26Å; F71-F76 AromaticContact CD1-CZ 3.55Å; F71-F76 HydrophobicContact CD1-CZ 3.55Å; F71-F76 HydrophobicContact CE1-CD1 4.43Å; F71-F76 HydrophobicContact CE1-CE1 4.07Å; F71-F76 HydrophobicContact CG-CZ 4.31Å; R73-F76 HydrophobicContact CB-CD2 4.22Å; R73-F76 HydrophobicContact CG-CD2 4.44Å; R73-F76 HydrophobicContact CG-CE2 4.42Å; R73-F76 WeakPolarHBondContact O-CB 3.24Å; R73-F76 PolarHBondContact O-N 2.93Å; R73-F76 VanDerWaalsContact O-N 3.08Å; H74-F76 PolarHBondContact O-N 3.42Å; F76-F82 HydrophobicContact CD1-CZ 4.42Å; F76-D103 HydrophobicContact CE1-CB 4.15Å; F76-D103 HydrophobicContact CE2-CB 4.44Å; F76-D103 HydrophobicContact CZ-CB 3.68Å; F76-I104 HydrophobicContact CD1-CG1 3.84Å; F76-I104 HydrophobicContact CE1-CG1 3.7Å; F76-Y107 AromaticContact CD2-CD2 3.46Å; F76-Y107 HydrophobicContact CD2-CD2 3.46Å; F76-Y107 VanDerWaalsContact CD2-CD2 3.46Å; F76-Y107 HydrophobicContact CD2-CE2 4.18Å; F76-Y107 AromaticContact CD2-CG 3.84Å; F76-Y107 HydrophobicContact CD2-CG 3.84Å; F76-Y107 AromaticContact CE2-CD2 3.44Å; F76-Y107 HydrophobicContact CE2-CD2 3.44Å; F76-Y107 VanDerWaalsContact CE2-CD2 3.44Å; F76-Y107 AromaticContact CE2-CE2 3.81Å; F76-Y107 HydrophobicContact CE2-CE2 3.81Å; F76-Y107 HydrophobicContact CE2-CG 4.28Å; F76-Y107 HydrophobicContact CG-CD2 4.19Å; F76-Y107 HydrophobicContact CG-CG 4.38Å; F76-Y107 HydrophobicContact CZ-CD2 4.11Å; F76-R108 WeakPolarHBondContact O-CD 3.32Å; F76-R108 PolarHBondContact O-NE 2.87Å; F76-R108 PolarHBondContact O-NH1 2.8Å; F76-R108 PolarHBondContact O-NH2 3.35Å
77	F	87.8	Confident	91.3	Very high	130 Å²	130	46.9 Å²	46.9	57%	0.57	25%	0.246	S	C	*	.	H	α-helix	trans	-115.5	-28.9	173	-59.2	-72.4	0	0	0	110.7	R73 H74 Y75 Y107 R108	R73-F77 WeakPolarHBondContact O-CD2 3.43Å; H74-F77 PolarHBondContact O-N 3.44Å; H74-F77 VanDerWaalsContact O-N 3.11Å; Y75-F77 PolarHBondContact O-N 3.17Å; F77-Y107 VanDerWaalsContact CE1-O 3.25Å; F77-Y107 WeakPolarHBondContact CE1-O 3.43Å; F77-R108 PolarHBondContact O-NH1 2.87Å
78	F	87.4	Confident	92.2	Very high	65 Å²	65	42 Å²	42	29%	0.285	22%	0.22	S	C	.	.	H	α-helix	trans	-75.4	-39.6	-175	173.4	-98	0	0	0	115.6	K6 V8 Y60 H74 Y75	K6-F78 HydrophobicContact CB-CE1 4.03Å; K6-F78 HydrophobicContact CB-CZ 4.27Å; K6-F78 HydrophobicContact CD-CD2 4.42Å; K6-F78 HydrophobicContact CD-CE1 4Å; K6-F78 HydrophobicContact CD-CE2 3.75Å; K6-F78 HydrophobicContact CD-CZ 3.48Å; K6-F78 VanDerWaalsContact CD-CZ 3.48Å; K6-F78 HydrophobicContact CG-CE1 4.26Å; K6-F78 HydrophobicContact CG-CZ 3.98Å; V8-F78 HydrophobicContact CG2-CD1 4.28Å; Y60-F78 AromaticContact CD1-CE1 3.8Å; Y60-F78 HydrophobicContact CD1-CE1 3.8Å; Y60-F78 HydrophobicContact CD1-CZ 4.19Å; Y60-F78 AromaticContact CD2-CE1 3.65Å; Y60-F78 HydrophobicContact CD2-CE1 3.65Å; Y60-F78 HydrophobicContact CD2-CZ 4.27Å; Y60-F78 AromaticContact CE1-CE1 3.6Å; Y60-F78 HydrophobicContact CE1-CE1 3.6Å; Y60-F78 AromaticContact CE1-CZ 3.5Å; Y60-F78 HydrophobicContact CE1-CZ 3.5Å; Y60-F78 AromaticContact CE2-CE1 3.46Å; Y60-F78 HydrophobicContact CE2-CE1 3.46Å; Y60-F78 VanDerWaalsContact CE2-CE1 3.46Å; Y60-F78 AromaticContact CE2-CZ 3.62Å; Y60-F78 HydrophobicContact CE2-CZ 3.62Å; Y60-F78 AromaticContact CG-CE1 3.85Å; Y60-F78 HydrophobicContact CG-CE1 3.85Å; Y60-F78 AromaticContact CZ-CE1 3.47Å; Y60-F78 VanDerWaalsContact CZ-CE1 3.47Å; Y60-F78 AromaticContact CZ-CZ 3.22Å; Y60-F78 WeakPolarHBondContact OH-CZ 3.48Å; H74-F78 WeakPolarHBondContact O-CB 3.34Å; H74-F78 PolarHBondContact O-N 2.98Å; Y75-F78 HydrophobicContact CD1-CD1 4.45Å; Y75-F78 PolarHBondContact O-N 2.76Å
79	A	92.6	Very high	93.3	Very high	6 Å²	6	39.6 Å²	39.6	5%	0.05	19%	0.187	C	C	.	.			trans	-76.1	143.6	-170.7	0	0	0	0	0	113.3	V8 Y75 G81 F82 R108	V8-A79 HydrophobicContact CB-CB 4.07Å; V8-A79 HydrophobicContact CG2-CB 3.54Å; Y75-A79 PolarHBondContact O-N 3.26Å; A79-G81 WeakPolarHBondContact CB-O 3.29Å; A79-F82 HydrophobicContact CB-CD2 4.47Å; A79-F82 HydrophobicContact CB-CE1 3.97Å; A79-F82 HydrophobicContact CB-CE2 3.93Å; A79-F82 HydrophobicContact CB-CZ 3.65Å; A79-R108 PolarHBondContact O-NH2 2.92Å
80	D	92.2	Very high	94	Very high	45 Å²	45	36.6 Å²	36.6	24%	0.241	17%	0.174	C	C	.	.	S	Bend	trans	-84.1	-21	165	-62.5	-75	0	0	0	111.5	K3 K6	K3-D80 IonicContact NZ-OD1 2.6Å; K3-D80 PolarHBondContact NZ-OD1 3Å; K6-D80 PolarHBondContact N-OD2 3.26Å; K6-D80 PolarHBondContact O-N 3.49Å
81	G	94.9	Very high	94.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	168.1	176.4	0	0	0	0	0	113	K6 V7 V8 A79 N114	K6-G81 PolarHBondContact O-N 2.91Å; V7-G81 WeakPolarHBondContact CA-O 3.34Å; V8-G81 PolarHBondContact N-O 3.03Å; A79-G81 WeakPolarHBondContact CB-O 3.29Å; G81-N114 CarbonylContact C-O 3.59Å; G81-N114 WeakPolarHBondContact CA-O 3.25Å
82	F	97	Very high	94.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.3	179.9	-66.3	-90.6	0	0	0	112.1	V8 Y75 F76 A79 L84 I104 V113 N114 I115 V116	V8-F82 HydrophobicContact CB-CD1 3.78Å; V8-F82 HydrophobicContact CB-CE1 3.83Å; V8-F82 HydrophobicContact CG1-CD1 4.08Å; V8-F82 HydrophobicContact CG1-CE1 4.06Å; V8-F82 HydrophobicContact CG2-CE1 4.43Å; V8-F82 WeakPolarHBondContact O-CA 3.29Å; Y75-F82 WeakPolarHBondContact O-CZ 3.43Å; F76-F82 HydrophobicContact CD1-CZ 4.42Å; A79-F82 HydrophobicContact CB-CD2 4.47Å; A79-F82 HydrophobicContact CB-CE1 3.97Å; A79-F82 HydrophobicContact CB-CE2 3.93Å; A79-F82 HydrophobicContact CB-CZ 3.65Å; F82-L84 HydrophobicContact CB-CD2 4.26Å; F82-I104 HydrophobicContact CB-CD1 4.19Å; F82-I104 HydrophobicContact CD1-CD1 3.9Å; F82-I104 HydrophobicContact CD2-CD1 4Å; F82-I104 HydrophobicContact CD2-CG1 4.45Å; F82-I104 HydrophobicContact CD2-CG2 4.12Å; F82-I104 HydrophobicContact CE1-CD1 4.26Å; F82-I104 HydrophobicContact CE1-CG1 4.43Å; F82-I104 HydrophobicContact CE2-CD1 4.35Å; F82-I104 HydrophobicContact CE2-CG1 4.33Å; F82-I104 HydrophobicContact CE2-CG2 3.97Å; F82-I104 HydrophobicContact CG-CD1 3.77Å; F82-I104 HydrophobicContact CZ-CD1 4.47Å; F82-I104 HydrophobicContact CZ-CG1 4.32Å; F82-V113 HydrophobicContact CD2-CG1 3.63Å; F82-V113 HydrophobicContact CE2-CG1 3.85Å; F82-N114 PolarHBondContact N-O 3.23Å; F82-I115 HydrophobicContact CB-CG1 4.33Å; F82-I115 HydrophobicContact CB-CG2 4.48Å; F82-I115 HydrophobicContact CD2-CG1 4.45Å; F82-I115 WeakPolarHBondContact O-CA 3.24Å; F82-V116 PolarHBondContact O-N 2.76Å
83	V	98.4	Very high	95	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	113.8	162.2	178	0	0	0	0	107.3	V7 V8 V9 C10 V85 V116 L118 F161 L164	V7-V83 HydrophobicContact CG1-CG2 3.75Å; V8-V83 PolarHBondContact O-N 2.78Å; V9-V83 WeakPolarHBondContact CA-O 3.47Å; V9-V83 HydrophobicContact CG1-CB 4.33Å; V9-V83 HydrophobicContact CG1-CG1 4.35Å; V9-V83 HydrophobicContact CG2-CB 4.23Å; C10-V83 PolarHBondContact N-O 2.88Å; V83-V85 HydrophobicContact CG1-CG2 3.96Å; V83-V116 CarbonylContact C-O 3.37Å; V83-V116 WeakPolarHBondContact CA-O 3Å; V83-L118 HydrophobicContact CG1-CD1 3.53Å; V83-L118 HydrophobicContact CG1-CG 3.84Å; V83-F161 HydrophobicContact CG1-CZ 4.48Å; V83-F161 HydrophobicContact CG2-CE1 4.22Å; V83-L164 HydrophobicContact CG2-CD2 3.55Å
84	L	98.5	Very high	95.4	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.5	175.3	-50.3	-175.5	0	0	0	109.3	C10 F82 M97 L100 K101 I104 I115 V116 V117 L118	C10-L84 WeakPolarHBondContact O-CA 3.33Å; C10-L84 WeakPolarHBondContact SG-CD2 3.36Å; F82-L84 HydrophobicContact CB-CD2 4.26Å; L84-M97 HydrophobicContact CB-CG 3.72Å; L84-M97 HydrophobicContact CB-SD 4.43Å; L84-M97 HydrophobicContact CD1-CG 4.29Å; L84-M97 HydrophobicContact CD1-SD 4.23Å; L84-L100 HydrophobicContact CD2-CB 4.45Å; L84-K101 HydrophobicContact CD1-CB 3.93Å; L84-I104 HydrophobicContact CD1-CD1 4.37Å; L84-I104 HydrophobicContact CD2-CD1 3.74Å; L84-I115 HydrophobicContact CD1-CG2 4.02Å; L84-I115 HydrophobicContact CG-CG2 4.01Å; L84-V116 PolarHBondContact N-O 2.82Å; L84-V117 HydrophobicContact CB-CG2 4.27Å; L84-V117 HydrophobicContact CD1-CG2 4.37Å; L84-V117 CarbonylContact O-C 3.51Å; L84-V117 WeakPolarHBondContact O-CA 3.47Å; L84-L118 PolarHBondContact O-N 3.11Å
85	V	98.7	Very high	95.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.2	-176.8	-168.2	0	0	0	0	109.8	V9 C10 G11 V15 K17 V83 L118 N120	V9-V85 HydrophobicContact CG1-CG2 3.88Å; C10-V85 PolarHBondContact O-N 3.02Å; G11-V85 WeakPolarHBondContact CA-O 3.44Å; V15-V85 HydrophobicContact CB-CG1 4.2Å; V15-V85 HydrophobicContact CG2-CB 3.87Å; V15-V85 HydrophobicContact CG2-CG1 3.73Å; K17-V85 HydrophobicContact CG-CB 4.04Å; K17-V85 HydrophobicContact CG-CG2 4.07Å; V83-V85 HydrophobicContact CG1-CG2 3.96Å; V85-L118 HydrophobicContact CG1-CB 4.45Å; V85-L118 HydrophobicContact CG2-CB 4.44Å; V85-L118 HydrophobicContact CG2-CD1 4.4Å; V85-N120 HydrophobicContact CG1-CB 4.05Å
86	Y	98.8	Very high	95.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	168.8	163.3	78.1	-83.8	0	0	0	108.7	I88 F94 M97 V117 L118 N120 V130 A135 L146	Y86-I88 HydrophobicContact CE2-CG2 4.28Å; Y86-F94 AromaticContact CD1-CD2 4Å; Y86-F94 HydrophobicContact CD1-CD2 4Å; Y86-F94 HydrophobicContact CD2-CB 3.96Å; Y86-F94 AromaticContact CD2-CD2 3.76Å; Y86-F94 HydrophobicContact CD2-CD2 3.76Å; Y86-F94 HydrophobicContact CD2-CG 4.36Å; Y86-F94 AromaticContact CE1-CD2 3.95Å; Y86-F94 HydrophobicContact CE1-CD2 3.95Å; Y86-F94 HydrophobicContact CE1-CE2 4.23Å; Y86-F94 AromaticContact CE2-CD2 3.71Å; Y86-F94 HydrophobicContact CE2-CD2 3.71Å; Y86-F94 HydrophobicContact CE2-CE2 4.49Å; Y86-F94 HydrophobicContact CG-CB 4.33Å; Y86-F94 AromaticContact CG-CD2 3.91Å; Y86-F94 HydrophobicContact CG-CD2 3.91Å; Y86-F94 AromaticContact CZ-CD2 3.8Å; Y86-M97 HydrophobicContact CD1-CE 4.07Å; Y86-M97 HydrophobicContact CD1-CG 4.48Å; Y86-M97 HydrophobicContact CE1-CE 4.45Å; Y86-V117 HydrophobicContact CD1-CG1 4.02Å; Y86-V117 HydrophobicContact CE1-CG1 4.04Å; Y86-L118 VanDerWaalsContact CD1-O 3.27Å; Y86-L118 WeakPolarHBondContact CD1-O 3.47Å; Y86-L118 PolarHBondContact N-O 3.36Å; Y86-L118 VanDerWaalsContact O-O 3.14Å; Y86-N120 PolarHBondContact O-N 3.41Å; Y86-V130 HydrophobicContact CD2-CG2 4.35Å; Y86-V130 HydrophobicContact CE2-CB 4.12Å; Y86-V130 HydrophobicContact CE2-CG1 3.93Å; Y86-V130 HydrophobicContact CE2-CG2 4.18Å; Y86-A135 WeakPolarHBondContact OH-CB 3.5Å; Y86-L146 HydrophobicContact CE1-CD1 3.86Å; Y86-L146 HydrophobicContact CE1-CG 4.38Å
87	S	98.2	Very high	96.2	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.028	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.3	173.7	65.5	0	0	0	0	110.9	D89 S90 S93 N120	S87-D89 WeakPolarHBondContact CB-OD1 2.8Å; S87-D89 PolarHBondContact O-N 2.91Å; S87-D89 VanDerWaalsContact O-N 3.13Å; S87-D89 PolarHBondContact OG-OD1 2.89Å; S87-S90 PolarHBondContact O-N 3.45Å; S87-S90 WeakPolarHBondContact OG-CB 3.27Å; S87-S93 PolarHBondContact N-OG 3.37Å; S87-S93 PolarHBondContact O-OG 3.26Å; S87-N120 WeakPolarHBondContact CA-O 3.4Å
88	I	98.4	Very high	96.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.9	-173.5	65.5	159.1	0	0	0	113	Y86 S90 N120 K121 R128 R129 V130 E148	Y86-I88 HydrophobicContact CE2-CG2 4.28Å; I88-S90 VanDerWaalsContact C-N 3.33Å; I88-N120 PolarHBondContact N-O 2.7Å; I88-K121 VanDerWaalsContact CD1-O 3.26Å; I88-K121 WeakPolarHBondContact CD1-O 3.35Å; I88-K121 VanDerWaalsContact CG1-O 3.29Å; I88-K121 WeakPolarHBondContact CG1-O 3.39Å; I88-R128 HydrophobicContact CD1-CB 4.41Å; I88-R129 PolarHBondContact O-N 3.23Å; I88-V130 PolarHBondContact O-N 3.13Å; I88-E148 HydrophobicContact CG2-CG 4.46Å
89	D	97.9	Very high	97.1	Very high	35 Å²	35	28.1 Å²	28.1	19%	0.187	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.7	177.1	66.2	-18.5	0	0	0	113.4	S87 K121 Q127 R129	S87-D89 WeakPolarHBondContact CB-OD1 2.8Å; S87-D89 PolarHBondContact O-N 2.91Å; S87-D89 VanDerWaalsContact O-N 3.13Å; S87-D89 PolarHBondContact OG-OD1 2.89Å; D89-K121 IonicContact OD1-NZ 3.14Å; D89-K121 WeakPolarHBondContact OD2-CD 3.2Å; D89-K121 IonicContact OD2-NZ 2.79Å; D89-K121 PolarHBondContact OD2-NZ 2.98Å; D89-Q127 WeakPolarHBondContact CA-O 3.38Å; D89-Q127 HydrophobicContact CB-CB 4.22Å; D89-R129 WeakPolarHBondContact O-CG 3.26Å
90	S	97.8	Very high	97.3	Very high	33 Å²	33	27.9 Å²	27.9	23%	0.231	14%	0.138	C	C	.	.			trans	-135.7	103.9	-175.7	177.9	0	0	0	0	112.9	S87 I88 E92 S93 F94	S87-S90 PolarHBondContact O-N 3.45Å; S87-S90 WeakPolarHBondContact OG-CB 3.27Å; I88-S90 VanDerWaalsContact C-N 3.33Å; S90-E92 PolarHBondContact O-N 3.13Å; S90-S93 WeakPolarHBondContact CB-OG 3.34Å; S90-S93 PolarHBondContact O-N 3.41Å; S90-S93 PolarHBondContact O-OG 3.42Å; S90-S93 PolarHBondContact OG-N 3.04Å; S90-S93 VanDerWaalsContact OG-N 3.16Å; S90-F94 PolarHBondContact O-N 3.03Å
91	K	97.5	Very high	97.5	Very high	135 Å²	135	26.2 Å²	26.2	59%	0.587	13%	0.129	S	C	*	.	H	α-helix	trans	-57.3	-35.1	171.4	-78.8	178	-176.9	-173.7	0	112.5	F94 K95 R129 V130	K91-F94 PolarHBondContact O-N 2.95Å; K91-K95 WeakPolarHBondContact O-CG 3.32Å; K91-K95 PolarHBondContact O-N 3.33Å; K91-R129 WeakPolarHBondContact CE-O 3.16Å; K91-R129 HydrophobicContact CG-CB 3.9Å; K91-R129 WeakPolarHBondContact CG-O 3.34Å; K91-V130 HydrophobicContact CG-CG2 4.43Å
92	E	97.1	Very high	97.4	Very high	81 Å²	81	31.7 Å²	31.7	38%	0.379	15%	0.152	S	C	.	.	H	α-helix	trans	-68.5	-40.2	-179.5	-167.3	57.6	-155.6	0	0	111.3	L12 S90 F94 K95 R96	L12-E92 HydrophobicContact CD2-CG 4.44Å; S90-E92 PolarHBondContact O-N 3.13Å; E92-F94 VanDerWaalsContact C-N 3.27Å; E92-F94 PolarHBondContact O-N 3.37Å; E92-K95 PolarHBondContact O-N 3.15Å; E92-R96 WeakPolarHBondContact O-CB 3.24Å; E92-R96 PolarHBondContact O-N 3.01Å
93	S	98	Very high	97.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-36.9	174.5	79.1	0	0	0	0	112.4	S87 S90 R96 M97	S87-S93 PolarHBondContact N-OG 3.37Å; S87-S93 PolarHBondContact O-OG 3.26Å; S90-S93 WeakPolarHBondContact CB-OG 3.34Å; S90-S93 PolarHBondContact O-N 3.41Å; S90-S93 PolarHBondContact O-OG 3.42Å; S90-S93 PolarHBondContact OG-N 3.04Å; S90-S93 VanDerWaalsContact OG-N 3.16Å; S93-R96 PolarHBondContact O-N 3.41Å; S93-M97 WeakPolarHBondContact O-CB 3.42Å; S93-M97 PolarHBondContact O-N 3Å
94	F	98.4	Very high	97	Very high	16 Å²	16	33.2 Å²	33.2	7%	0.07	16%	0.16	C	C	.	.	H	α-helix	trans	-65.9	-50.5	175.6	-175.2	-100.2	0	0	0	111.2	Y86 S90 K91 E92 R96 M97 E98 V130 A135 W138	Y86-F94 AromaticContact CD1-CD2 4Å; Y86-F94 HydrophobicContact CD1-CD2 4Å; Y86-F94 HydrophobicContact CD2-CB 3.96Å; Y86-F94 AromaticContact CD2-CD2 3.76Å; Y86-F94 HydrophobicContact CD2-CD2 3.76Å; Y86-F94 HydrophobicContact CD2-CG 4.36Å; Y86-F94 AromaticContact CE1-CD2 3.95Å; Y86-F94 HydrophobicContact CE1-CD2 3.95Å; Y86-F94 HydrophobicContact CE1-CE2 4.23Å; Y86-F94 AromaticContact CE2-CD2 3.71Å; Y86-F94 HydrophobicContact CE2-CD2 3.71Å; Y86-F94 HydrophobicContact CE2-CE2 4.49Å; Y86-F94 HydrophobicContact CG-CB 4.33Å; Y86-F94 AromaticContact CG-CD2 3.91Å; Y86-F94 HydrophobicContact CG-CD2 3.91Å; Y86-F94 AromaticContact CZ-CD2 3.8Å; S90-F94 PolarHBondContact O-N 3.03Å; K91-F94 PolarHBondContact O-N 2.95Å; E92-F94 VanDerWaalsContact C-N 3.27Å; E92-F94 PolarHBondContact O-N 3.37Å; F94-R96 VanDerWaalsContact C-N 3.26Å; F94-R96 PolarHBondContact O-N 3.3Å; F94-M97 HydrophobicContact CD2-CE 3.49Å; F94-M97 VanDerWaalsContact CD2-CE 3.49Å; F94-M97 HydrophobicContact CE2-CE 3.36Å; F94-M97 HydrophobicContact CG-CE 4.28Å; F94-M97 HydrophobicContact CZ-CE 4.06Å; F94-M97 WeakPolarHBondContact O-CA 3.42Å; F94-M97 VanDerWaalsContact O-CB 3.31Å; F94-M97 WeakPolarHBondContact O-CB 3.49Å; F94-M97 PolarHBondContact O-N 3.43Å; F94-E98 HydrophobicContact CD1-CG 4.16Å; F94-E98 HydrophobicContact CE1-CG 3.88Å; F94-E98 HydrophobicContact CZ-CG 4.29Å; F94-E98 WeakPolarHBondContact O-CG 3.3Å; F94-E98 PolarHBondContact O-N 2.94Å; F94-V130 HydrophobicContact CB-CG1 4.34Å; F94-V130 HydrophobicContact CB-CG2 3.8Å; F94-V130 HydrophobicContact CD1-CG1 4.42Å; F94-V130 HydrophobicContact CD2-CG1 3.87Å; F94-V130 HydrophobicContact CE2-CG1 4.28Å; F94-V130 HydrophobicContact CG-CG1 3.94Å; F94-V130 HydrophobicContact CG-CG2 4.31Å; F94-A135 HydrophobicContact CE2-CB 3.81Å; F94-A135 HydrophobicContact CZ-CB 4.21Å; F94-W138 HydrophobicContact CE2-CE3 4.42Å; F94-W138 HydrophobicContact CZ-CB 4.06Å; F94-W138 HydrophobicContact CZ-CD2 4.12Å; F94-W138 HydrophobicContact CZ-CE3 4.29Å; F94-W138 AromaticContact CZ-CG 4Å; F94-W138 HydrophobicContact CZ-CG 4Å
95	K	97.4	Very high	96.7	Very high	119 Å²	119	37 Å²	37	52%	0.517	18%	0.18	S	C	.	.	H	α-helix	trans	-56.5	-40.8	175.4	-71.5	178.6	-178	175.6	0	112.5	K91 E92 M97 E98 A99	K91-K95 WeakPolarHBondContact O-CG 3.32Å; K91-K95 PolarHBondContact O-N 3.33Å; E92-K95 PolarHBondContact O-N 3.15Å; K95-M97 VanDerWaalsContact C-N 3.32Å; K95-M97 PolarHBondContact O-N 2.94Å; K95-E98 WeakPolarHBondContact CA-OE2 3.24Å; K95-E98 PolarHBondContact O-N 3.48Å; K95-A99 PolarHBondContact O-N 2.91Å
96	R	96.6	Very high	96.4	Very high	30 Å²	30	45.2 Å²	45.2	11%	0.113	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-39.7	177	-172.8	66.3	-174.8	110.7	-10.2	111.5	L12 L69 E92 S93 F94 A99 L100	L12-R96 HydrophobicContact CD1-CB 4.33Å; L12-R96 HydrophobicContact CD1-CG 4.07Å; L69-R96 PolarHBondContact O-NH2 3.3Å; E92-R96 WeakPolarHBondContact O-CB 3.24Å; E92-R96 PolarHBondContact O-N 3.01Å; S93-R96 PolarHBondContact O-N 3.41Å; F94-R96 VanDerWaalsContact C-N 3.26Å; F94-R96 PolarHBondContact O-N 3.3Å; R96-A99 PolarHBondContact O-N 2.67Å; R96-L100 WeakPolarHBondContact O-CG 3.1Å; R96-L100 PolarHBondContact O-N 3.32Å
97	M	97.5	Very high	95.9	Very high	1 Å²	1	48 Å²	48	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-43	174.3	178.8	-76.6	-59.5	0	0	111.7	L84 Y86 S93 F94 K95 A99 L100 K101 V117 W138	L84-M97 HydrophobicContact CB-CG 3.72Å; L84-M97 HydrophobicContact CB-SD 4.43Å; L84-M97 HydrophobicContact CD1-CG 4.29Å; L84-M97 HydrophobicContact CD1-SD 4.23Å; Y86-M97 HydrophobicContact CD1-CE 4.07Å; Y86-M97 HydrophobicContact CD1-CG 4.48Å; Y86-M97 HydrophobicContact CE1-CE 4.45Å; S93-M97 WeakPolarHBondContact O-CB 3.42Å; S93-M97 PolarHBondContact O-N 3Å; F94-M97 HydrophobicContact CD2-CE 3.49Å; F94-M97 VanDerWaalsContact CD2-CE 3.49Å; F94-M97 HydrophobicContact CE2-CE 3.36Å; F94-M97 HydrophobicContact CG-CE 4.28Å; F94-M97 HydrophobicContact CZ-CE 4.06Å; F94-M97 WeakPolarHBondContact O-CA 3.42Å; F94-M97 VanDerWaalsContact O-CB 3.31Å; F94-M97 WeakPolarHBondContact O-CB 3.49Å; F94-M97 PolarHBondContact O-N 3.43Å; K95-M97 VanDerWaalsContact C-N 3.32Å; K95-M97 PolarHBondContact O-N 2.94Å; M97-A99 VanDerWaalsContact C-N 3.33Å; M97-A99 PolarHBondContact O-N 3.15Å; M97-L100 WeakPolarHBondContact O-CB 3.35Å; M97-L100 PolarHBondContact O-N 2.8Å; M97-K101 PolarHBondContact O-N 3.23Å; M97-V117 HydrophobicContact CE-CG1 3.96Å; M97-V117 HydrophobicContact CG-CG1 4.11Å; M97-V117 HydrophobicContact SD-CG1 3.69Å; M97-V117 HydrophobicContact SD-CG2 4.22Å; M97-W138 HydrophobicContact CE-CD2 4.4Å; M97-W138 HydrophobicContact CE-CE3 3.92Å; M97-W138 HydrophobicContact CE-CH2 3.63Å; M97-W138 HydrophobicContact CE-CZ2 4.08Å; M97-W138 HydrophobicContact CE-CZ3 3.53Å; M97-W138 HydrophobicContact SD-CH2 3.17Å; M97-W138 WeakPolarHBondContact SD-CH2 3.36Å; M97-W138 HydrophobicContact SD-CZ2 3.81Å; M97-W138 HydrophobicContact SD-CZ3 3.6Å; M97-W138 VanDerWaalsContact SD-CZ3 3.6Å
98	E	97.6	Very high	95.2	Very high	48 Å²	48	50 Å²	50	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-43	174.5	-60.3	-179	96.7	0	0	111.8	F94 K95 K101 K102 W138	F94-E98 HydrophobicContact CD1-CG 4.16Å; F94-E98 HydrophobicContact CE1-CG 3.88Å; F94-E98 HydrophobicContact CZ-CG 4.29Å; F94-E98 WeakPolarHBondContact O-CG 3.3Å; F94-E98 PolarHBondContact O-N 2.94Å; K95-E98 WeakPolarHBondContact CA-OE2 3.24Å; K95-E98 PolarHBondContact O-N 3.48Å; E98-K101 PolarHBondContact O-N 2.88Å; E98-K102 WeakPolarHBondContact O-CG 3.37Å; E98-K102 PolarHBondContact O-N 3.06Å; E98-K102 VanDerWaalsContact O-N 3.16Å; E98-W138 HydrophobicContact CB-CZ2 4.31Å; E98-W138 HydrophobicContact CG-CD2 4.38Å; E98-W138 HydrophobicContact CG-CZ2 4.08Å; E98-W138 PolarHBondContact OE1-NE1 3.31Å
99	A	96.1	Very high	93.7	Very high	36 Å²	36	57 Å²	57	30%	0.298	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-42.3	176.1	0	0	0	0	0	112	K95 R96 M97 K101 K102 D103	K95-A99 PolarHBondContact O-N 2.91Å; R96-A99 PolarHBondContact O-N 2.67Å; M97-A99 VanDerWaalsContact C-N 3.33Å; M97-A99 PolarHBondContact O-N 3.15Å; A99-K101 VanDerWaalsContact C-N 3.33Å; A99-K101 PolarHBondContact O-N 2.92Å; A99-K102 PolarHBondContact O-N 3.34Å; A99-D103 PolarHBondContact O-N 2.76Å
100	L	95.8	Very high	91.7	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-42	175.5	-77.4	169	0	0	0	112.1	L65 F71 L84 R96 M97 K102 D103 I104	L65-L100 HydrophobicContact CD1-CD1 3.83Å; L65-L100 HydrophobicContact CD1-CD2 3.77Å; L65-L100 HydrophobicContact CD1-CG 4.19Å; F71-L100 HydrophobicContact CB-CD2 3.66Å; F71-L100 HydrophobicContact CD1-CD2 4.29Å; F71-L100 HydrophobicContact CD2-CD2 4.27Å; F71-L100 HydrophobicContact CG-CD2 3.83Å; L84-L100 HydrophobicContact CD2-CB 4.45Å; R96-L100 WeakPolarHBondContact O-CG 3.1Å; R96-L100 PolarHBondContact O-N 3.32Å; M97-L100 WeakPolarHBondContact O-CB 3.35Å; M97-L100 PolarHBondContact O-N 2.8Å; L100-K102 VanDerWaalsContact C-N 3.34Å; L100-K102 PolarHBondContact O-N 3.41Å; L100-D103 PolarHBondContact O-N 3.3Å; L100-I104 VanDerWaalsContact O-CG1 3.28Å; L100-I104 WeakPolarHBondContact O-CG1 3.37Å; L100-I104 PolarHBondContact O-N 3.47Å
101	K	96	Very high	90.1	Very high	11 Å²	11	73 Å²	73	5%	0.048	33%	0.33	C	S	.	.	H	α-helix	trans	-59.2	-46.5	175.8	177.2	54.9	170.3	71.8	0	111.3	L84 M97 E98 A99 D103 I104 D105 I115 W138 E142 V144	L84-K101 HydrophobicContact CD1-CB 3.93Å; M97-K101 PolarHBondContact O-N 3.23Å; E98-K101 PolarHBondContact O-N 2.88Å; A99-K101 VanDerWaalsContact C-N 3.33Å; A99-K101 PolarHBondContact O-N 2.92Å; K101-D103 VanDerWaalsContact C-N 3.32Å; K101-D103 PolarHBondContact O-N 3.11Å; K101-I104 PolarHBondContact O-N 2.9Å; K101-D105 IonicContact NZ-OD1 3.65Å; K101-D105 PolarHBondContact NZ-OD1 3Å; K101-D105 IonicContact NZ-OD2 3.45Å; K101-D105 PolarHBondContact NZ-OD2 3.16Å; K101-D105 PolarHBondContact O-N 3.34Å; K101-I115 HydrophobicContact CD-CD1 3.7Å; K101-W138 HydrophobicContact CB-CH2 4.28Å; K101-W138 HydrophobicContact CB-CZ2 4.06Å; K101-W138 HydrophobicContact CG-CH2 4.33Å; K101-W138 HydrophobicContact CG-CZ2 4.16Å; K101-E142 IonicContact NZ-OE2 3.56Å; K101-V144 HydrophobicContact CD-CG1 4.21Å
102	K	94.8	Very high	89	Confident	115 Å²	115	75.6 Å²	75.6	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-39.4	176.6	-69.5	173.7	-177.9	173.2	0	112.4	E98 A99 L100 D105 R106	E98-K102 WeakPolarHBondContact O-CG 3.37Å; E98-K102 PolarHBondContact O-N 3.06Å; E98-K102 VanDerWaalsContact O-N 3.16Å; A99-K102 PolarHBondContact O-N 3.34Å; L100-K102 VanDerWaalsContact C-N 3.34Å; L100-K102 PolarHBondContact O-N 3.41Å; K102-D105 PolarHBondContact O-N 3.27Å; K102-R106 WeakPolarHBondContact O-CB 3.33Å; K102-R106 PolarHBondContact O-N 3.22Å
103	D	93.5	Very high	88.5	Confident	31 Å²	31	73.4 Å²	73.4	17%	0.166	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-43.4	176.1	-70	-26.8	0	0	0	110.9	F76 A99 L100 K101 D105 R106 Y107	F76-D103 HydrophobicContact CE1-CB 4.15Å; F76-D103 HydrophobicContact CE2-CB 4.44Å; F76-D103 HydrophobicContact CZ-CB 3.68Å; A99-D103 PolarHBondContact O-N 2.76Å; L100-D103 PolarHBondContact O-N 3.3Å; K101-D103 VanDerWaalsContact C-N 3.32Å; K101-D103 PolarHBondContact O-N 3.11Å; D103-D105 PolarHBondContact O-N 3.14Å; D103-R106 PolarHBondContact O-N 3.29Å; D103-Y107 HydrophobicContact CB-CD2 4.32Å; D103-Y107 HydrophobicContact CB-CE2 4.37Å; D103-Y107 WeakPolarHBondContact O-CD2 3.44Å; D103-Y107 PolarHBondContact O-N 3.33Å
104	I	93.7	Very high	88.2	Confident	1 Å²	1	75.7 Å²	75.7	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-58.5	-47.7	176	-68.3	163.9	0	0	0	110.6	F76 F82 L84 L100 K101 R106 Y107 R108 I115	F76-I104 HydrophobicContact CD1-CG1 3.84Å; F76-I104 HydrophobicContact CE1-CG1 3.7Å; F82-I104 HydrophobicContact CB-CD1 4.19Å; F82-I104 HydrophobicContact CD1-CD1 3.9Å; F82-I104 HydrophobicContact CD2-CD1 4Å; F82-I104 HydrophobicContact CD2-CG1 4.45Å; F82-I104 HydrophobicContact CD2-CG2 4.12Å; F82-I104 HydrophobicContact CE1-CD1 4.26Å; F82-I104 HydrophobicContact CE1-CG1 4.43Å; F82-I104 HydrophobicContact CE2-CD1 4.35Å; F82-I104 HydrophobicContact CE2-CG1 4.33Å; F82-I104 HydrophobicContact CE2-CG2 3.97Å; F82-I104 HydrophobicContact CG-CD1 3.77Å; F82-I104 HydrophobicContact CZ-CD1 4.47Å; F82-I104 HydrophobicContact CZ-CG1 4.32Å; L84-I104 HydrophobicContact CD1-CD1 4.37Å; L84-I104 HydrophobicContact CD2-CD1 3.74Å; L100-I104 VanDerWaalsContact O-CG1 3.28Å; L100-I104 WeakPolarHBondContact O-CG1 3.37Å; L100-I104 PolarHBondContact O-N 3.47Å; K101-I104 PolarHBondContact O-N 2.9Å; I104-R106 VanDerWaalsContact C-N 3.28Å; I104-R106 PolarHBondContact O-N 2.95Å; I104-Y107 PolarHBondContact O-N 2.74Å; I104-R108 HydrophobicContact CG2-CG 3.92Å; I104-R108 WeakPolarHBondContact O-CB 3.46Å; I104-R108 WeakPolarHBondContact O-CG 3.49Å; I104-R108 PolarHBondContact O-N 2.95Å; I104-I115 HydrophobicContact CB-CD1 4.49Å; I104-I115 HydrophobicContact CG2-CD1 3.74Å
105	D	91.8	Very high	88.1	Confident	79 Å²	79	75.9 Å²	75.9	42%	0.422	35%	0.351	S	S	.	.	H	α-helix	trans	-63.9	-34.5	178.8	-65.7	-22.8	0	0	0	112.7	K101 K102 D103	K101-D105 IonicContact NZ-OD1 3.65Å; K101-D105 PolarHBondContact NZ-OD1 3Å; K101-D105 IonicContact NZ-OD2 3.45Å; K101-D105 PolarHBondContact NZ-OD2 3.16Å; K101-D105 PolarHBondContact O-N 3.34Å; K102-D105 PolarHBondContact O-N 3.27Å; D103-D105 PolarHBondContact O-N 3.14Å
106	R	90.9	Very high	88.1	Confident	174 Å²	174	70.4 Å²	70.4	66%	0.657	33%	0.327	S	S	*	.	H	α-helix	trans	-69.2	-42.9	178.4	-176.6	-172.4	-61.5	167.5	4.5	112	K102 D103 I104	K102-R106 WeakPolarHBondContact O-CB 3.33Å; K102-R106 PolarHBondContact O-N 3.22Å; D103-R106 PolarHBondContact O-N 3.29Å; I104-R106 VanDerWaalsContact C-N 3.28Å; I104-R106 PolarHBondContact O-N 2.95Å
107	Y	89.1	Confident	88.2	Confident	57 Å²	57	69 Å²	69	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-92.3	-17	-172.4	-69	-65.5	0	0	0	113.7	F76 F77 D103 I104	F76-Y107 AromaticContact CD2-CD2 3.46Å; F76-Y107 HydrophobicContact CD2-CD2 3.46Å; F76-Y107 VanDerWaalsContact CD2-CD2 3.46Å; F76-Y107 HydrophobicContact CD2-CE2 4.18Å; F76-Y107 AromaticContact CD2-CG 3.84Å; F76-Y107 HydrophobicContact CD2-CG 3.84Å; F76-Y107 AromaticContact CE2-CD2 3.44Å; F76-Y107 HydrophobicContact CE2-CD2 3.44Å; F76-Y107 VanDerWaalsContact CE2-CD2 3.44Å; F76-Y107 AromaticContact CE2-CE2 3.81Å; F76-Y107 HydrophobicContact CE2-CE2 3.81Å; F76-Y107 HydrophobicContact CE2-CG 4.28Å; F76-Y107 HydrophobicContact CG-CD2 4.19Å; F76-Y107 HydrophobicContact CG-CG 4.38Å; F76-Y107 HydrophobicContact CZ-CD2 4.11Å; F77-Y107 VanDerWaalsContact CE1-O 3.25Å; F77-Y107 WeakPolarHBondContact CE1-O 3.43Å; D103-Y107 HydrophobicContact CB-CD2 4.32Å; D103-Y107 HydrophobicContact CB-CE2 4.37Å; D103-Y107 WeakPolarHBondContact O-CD2 3.44Å; D103-Y107 PolarHBondContact O-N 3.33Å; I104-Y107 PolarHBondContact O-N 2.74Å
108	R	82.9	Confident	88.3	Confident	47 Å²	47	68.9 Å²	68.9	18%	0.177	32%	0.321	C	S	.	.	S	Bend	trans	-87.6	124.1	174.6	-69.6	-68.7	-170	-172.3	-1.9	111	Y75 F76 F77 A79 I104 V113	Y75-R108 PolarHBondContact O-NH2 2.99Å; Y75-R108 VanDerWaalsContact O-NH2 3.17Å; F76-R108 WeakPolarHBondContact O-CD 3.32Å; F76-R108 PolarHBondContact O-NE 2.87Å; F76-R108 PolarHBondContact O-NH1 2.8Å; F76-R108 PolarHBondContact O-NH2 3.35Å; F77-R108 PolarHBondContact O-NH1 2.87Å; A79-R108 PolarHBondContact O-NH2 2.92Å; I104-R108 HydrophobicContact CG2-CG 3.92Å; I104-R108 WeakPolarHBondContact O-CB 3.46Å; I104-R108 WeakPolarHBondContact O-CG 3.49Å; I104-R108 PolarHBondContact O-N 2.95Å; R108-V113 HydrophobicContact CB-CG2 4.21Å; R108-V113 HydrophobicContact CG-CG2 3.79Å
109	D	67.4	Low	88.3	Confident	146 Å²	146	66.6 Å²	66.6	78%	0.781	31%	0.311	S	S	*	.			trans	-59.3	166.4	167.4	-75.6	-36.9	0	0	0	111.8	K111	D109-K111 PolarHBondContact O-N 2.94Å
110	K	56.9	Low	88.5	Confident	223 Å²	223	65 Å²	65	97%	0.97	30%	0.297	S	S	*	.	S	Bend	trans	-49.1	2.5	-173.7	-64.1	-177.1	179.6	178	0	118.4	E112	K110-E112 PolarHBondContact O-N 2.83Å
111	K	63.6	Low	88.5	Confident	181 Å²	181	67 Å²	67	79%	0.787	31%	0.306	S	S	*	.	S	Bend	trans	-75.8	119.4	166.4	-72.1	-174.7	179.2	177.9	0	108.7	D109 V113	D109-K111 PolarHBondContact O-N 2.94Å; K111-V113 PolarHBondContact O-N 2.79Å; K111-V113 VanDerWaalsContact O-N 3.09Å
112	E	73.1	Confident	88.6	Confident	191 Å²	191	69 Å²	69	89%	0.893	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-54.7	116.7	170.9	-69.2	-175.7	162	0	0	109.6	K110	K110-E112 PolarHBondContact O-N 2.83Å
113	V	87.4	Confident	88.6	Confident	35 Å²	35	67.5 Å²	67.5	21%	0.212	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-90.7	136.1	171.2	176.7	0	0	0	0	108.3	F82 R108 K111 I115	F82-V113 HydrophobicContact CD2-CG1 3.63Å; F82-V113 HydrophobicContact CE2-CG1 3.85Å; R108-V113 HydrophobicContact CB-CG2 4.21Å; R108-V113 HydrophobicContact CG-CG2 3.79Å; K111-V113 PolarHBondContact O-N 2.79Å; K111-V113 VanDerWaalsContact O-N 3.09Å; V113-I115 HydrophobicContact CG1-CG1 4.36Å; V113-I115 PolarHBondContact O-N 2.89Å
114	N	92.3	Very high	88.6	Confident	48 Å²	48	69 Å²	69	26%	0.257	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	120.8	177.1	-66	-62.2	0	0	0	109.9	G81 F82 L164 M168	G81-N114 CarbonylContact C-O 3.59Å; G81-N114 WeakPolarHBondContact CA-O 3.25Å; F82-N114 PolarHBondContact N-O 3.23Å; N114-L164 HydrophobicContact CB-CD1 3.76Å; N114-M168 HydrophobicContact CB-CG 3.96Å; N114-M168 WeakPolarHBondContact ND2-CG 3.19Å
115	I	95.8	Very high	88.7	Confident	21 Å²	21	73 Å²	73	11%	0.108	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.4	-179.2	-56.4	172.7	0	0	0	108.8	F82 L84 K101 I104 V113 V144	F82-I115 HydrophobicContact CB-CG1 4.33Å; F82-I115 HydrophobicContact CB-CG2 4.48Å; F82-I115 HydrophobicContact CD2-CG1 4.45Å; F82-I115 WeakPolarHBondContact O-CA 3.24Å; L84-I115 HydrophobicContact CD1-CG2 4.02Å; L84-I115 HydrophobicContact CG-CG2 4.01Å; K101-I115 HydrophobicContact CD-CD1 3.7Å; I104-I115 HydrophobicContact CB-CD1 4.49Å; I104-I115 HydrophobicContact CG2-CD1 3.74Å; V113-I115 HydrophobicContact CG1-CG1 4.36Å; V113-I115 PolarHBondContact O-N 2.89Å; I115-V144 HydrophobicContact CB-CG1 4.07Å; I115-V144 HydrophobicContact CG2-CG1 4.11Å
116	V	97.9	Very high	89	Confident	3 Å²	3	78.8 Å²	78.8	2%	0.018	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.2	169.3	165.4	0	0	0	0	109	F82 V83 L84 L118 W147 P160 L164	F82-V116 PolarHBondContact O-N 2.76Å; V83-V116 CarbonylContact C-O 3.37Å; V83-V116 WeakPolarHBondContact CA-O 3Å; L84-V116 PolarHBondContact N-O 2.82Å; V116-L118 HydrophobicContact CG1-CD2 3.97Å; V116-L118 HydrophobicContact CG1-CG 4.48Å; V116-W147 HydrophobicContact CB-CZ3 4.27Å; V116-W147 HydrophobicContact CG1-CE3 3.72Å; V116-W147 HydrophobicContact CG1-CZ3 3.55Å; V116-W147 HydrophobicContact CG2-CZ3 3.86Å; V116-P160 HydrophobicContact CG1-CB 3.96Å; V116-L164 HydrophobicContact CG2-CB 4Å; V116-L164 HydrophobicContact CG2-CD1 4.24Å
117	V	98.8	Very high	89.3	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.9	176.7	-175	0	0	0	0	109.9	L84 Y86 M97 W138 V144 R145 L146 W147	L84-V117 HydrophobicContact CB-CG2 4.27Å; L84-V117 HydrophobicContact CD1-CG2 4.37Å; L84-V117 CarbonylContact O-C 3.51Å; L84-V117 WeakPolarHBondContact O-CA 3.47Å; Y86-V117 HydrophobicContact CD1-CG1 4.02Å; Y86-V117 HydrophobicContact CE1-CG1 4.04Å; M97-V117 HydrophobicContact CE-CG1 3.96Å; M97-V117 HydrophobicContact CG-CG1 4.11Å; M97-V117 HydrophobicContact SD-CG1 3.69Å; M97-V117 HydrophobicContact SD-CG2 4.22Å; V117-W138 HydrophobicContact CG1-CZ3 4.3Å; V117-W138 HydrophobicContact CG2-CH2 4.18Å; V117-W138 HydrophobicContact CG2-CZ3 3.98Å; V117-V144 HydrophobicContact CG2-CB 4.28Å; V117-V144 HydrophobicContact CG2-CG2 3.83Å; V117-R145 PolarHBondContact N-O 2.98Å; V117-L146 HydrophobicContact CB-CB 4.19Å; V117-L146 HydrophobicContact CB-CD1 4.31Å; V117-L146 HydrophobicContact CB-CG 4.14Å; V117-L146 HydrophobicContact CG1-CD1 3.84Å; V117-L146 HydrophobicContact CG1-CG 4.03Å; V117-L146 VanDerWaalsContact O-CA 3.3Å; V117-L146 WeakPolarHBondContact O-CA 3.5Å; V117-W147 PolarHBondContact O-N 2.85Å
118	L	98.9	Very high	89.7	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.1	177.6	-57.2	-177.9	0	0	0	110	V20 V83 L84 V85 Y86 V116 W147 V149 P160 F161	V20-L118 HydrophobicContact CG1-CD1 3.96Å; V83-L118 HydrophobicContact CG1-CD1 3.53Å; V83-L118 HydrophobicContact CG1-CG 3.84Å; L84-L118 PolarHBondContact O-N 3.11Å; V85-L118 HydrophobicContact CG1-CB 4.45Å; V85-L118 HydrophobicContact CG2-CB 4.44Å; V85-L118 HydrophobicContact CG2-CD1 4.4Å; Y86-L118 VanDerWaalsContact CD1-O 3.27Å; Y86-L118 WeakPolarHBondContact CD1-O 3.47Å; Y86-L118 PolarHBondContact N-O 3.36Å; Y86-L118 VanDerWaalsContact O-O 3.14Å; V116-L118 HydrophobicContact CG1-CD2 3.97Å; V116-L118 HydrophobicContact CG1-CG 4.48Å; L118-W147 CarbonylContact C-O 3.51Å; L118-W147 WeakPolarHBondContact CA-O 3.39Å; L118-W147 HydrophobicContact CD2-CB 4.4Å; L118-V149 HydrophobicContact CB-CG2 4.14Å; L118-V149 HydrophobicContact CD2-CG1 4.12Å; L118-P160 HydrophobicContact CD2-CB 3.61Å; L118-P160 HydrophobicContact CD2-CG 3.83Å; L118-F161 HydrophobicContact CD1-CE2 3.83Å; L118-F161 HydrophobicContact CD1-CZ 4.11Å
119	G	98.7	Very high	90.4	Very high	0 Å²	0	81.5 Å²	81.5	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	89.3	164.8	0	0	0	0	0	109.5	W147 E148 V149	G119-W147 PolarHBondContact N-O 3.02Å; G119-E148 CarbonylContact O-C 3.53Å; G119-E148 VanDerWaalsContact O-CA 3.23Å; G119-E148 WeakPolarHBondContact O-CA 3.46Å; G119-V149 PolarHBondContact O-N 2.87Å
120	N	98.3	Very high	91.9	Very high	2 Å²	2	75 Å²	75	1%	0.011	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	168.2	-175.1	-168.5	30.5	0	0	0	112.4	V15 V85 Y86 S87 I88 V149	V15-N120 PolarHBondContact O-ND2 3.38Å; V85-N120 HydrophobicContact CG1-CB 4.05Å; Y86-N120 PolarHBondContact O-N 3.41Å; S87-N120 WeakPolarHBondContact CA-O 3.4Å; I88-N120 PolarHBondContact N-O 2.7Å; N120-V149 CarbonylContact C-O 3.17Å; N120-V149 WeakPolarHBondContact CA-O 3.07Å; N120-V149 HydrophobicContact CB-CG2 4.25Å; N120-V149 PolarHBondContact OD1-O 3.25Å
121	K	96.6	Very high	93.9	Very high	42 Å²	42	68.3 Å²	68.3	18%	0.183	32%	0.319	C	S	.	.			trans	67.8	36.6	-178	-44	-171	-165	173.7	0	113.4	I88 D89 D123 M124 V149	I88-K121 VanDerWaalsContact CD1-O 3.26Å; I88-K121 WeakPolarHBondContact CD1-O 3.35Å; I88-K121 VanDerWaalsContact CG1-O 3.29Å; I88-K121 WeakPolarHBondContact CG1-O 3.39Å; D89-K121 IonicContact OD1-NZ 3.14Å; D89-K121 WeakPolarHBondContact OD2-CD 3.2Å; D89-K121 IonicContact OD2-NZ 2.79Å; D89-K121 PolarHBondContact OD2-NZ 2.98Å; K121-D123 WeakPolarHBondContact CA-OD1 3.46Å; K121-D123 PolarHBondContact O-N 3.45Å; K121-M124 HydrophobicContact CB-CB 4.39Å; K121-M124 HydrophobicContact CB-CG 4.16Å; K121-M124 HydrophobicContact CB-SD 4.06Å; K121-M124 HydrophobicContact CD-CE 4.26Å; K121-M124 HydrophobicContact CD-SD 3.65Å; K121-M124 HydrophobicContact CG-SD 4.43Å; K121-M124 WeakPolarHBondContact O-CB 3.49Å; K121-M124 PolarHBondContact O-N 3.25Å; K121-V149 PolarHBondContact N-O 2.72Å; K121-V149 VanDerWaalsContact N-O 3.07Å
122	L	97.3	Very high	95.5	Very high	52 Å²	52	61.6 Å²	61.6	27%	0.272	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-23.8	176.5	-179.1	70.1	0	0	0	113	M124 Q125 E148 V149	L122-M124 PolarHBondContact O-N 3.3Å; L122-Q125 WeakPolarHBondContact O-CG 2.99Å; L122-Q125 PolarHBondContact O-NE2 3.02Å; L122-E148 HydrophobicContact CD1-CB 3.72Å; L122-E148 VanDerWaalsContact CD1-OE2 3.24Å; L122-E148 WeakPolarHBondContact CD1-OE2 3.44Å; L122-E148 HydrophobicContact CD2-CB 4.44Å; L122-E148 HydrophobicContact CG-CB 4.46Å; L122-V149 VanDerWaalsContact CB-O 3.23Å; L122-V149 WeakPolarHBondContact CB-O 3.31Å; L122-V149 PolarHBondContact N-O 3.02Å
123	D	94.9	Very high	96.7	Very high	85 Å²	85	60.1 Å²	60.1	46%	0.455	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.5	172.3	52.9	-69.5	0	0	0	113.8	K121 Q125 S150	K121-D123 WeakPolarHBondContact CA-OD1 3.46Å; K121-D123 PolarHBondContact O-N 3.45Å; D123-Q125 VanDerWaalsContact C-N 3.32Å; D123-Q125 PolarHBondContact O-N 3.39Å; D123-S150 VanDerWaalsContact OD1-CB 3.32Å; D123-S150 WeakPolarHBondContact OD1-CB 3.19Å; D123-S150 PolarHBondContact OD1-OG 2.77Å
124	M	94.8	Very high	97.2	Very high	61 Å²	61	62.5 Å²	62.5	30%	0.3	30%	0.302	S	S	.	.			trans	-90.8	46	-177.6	-59.8	-173.8	175	0	0	113.1	K121 L122 E126 Q127 R128	K121-M124 HydrophobicContact CB-CB 4.39Å; K121-M124 HydrophobicContact CB-CG 4.16Å; K121-M124 HydrophobicContact CB-SD 4.06Å; K121-M124 HydrophobicContact CD-CE 4.26Å; K121-M124 HydrophobicContact CD-SD 3.65Å; K121-M124 HydrophobicContact CG-SD 4.43Å; K121-M124 WeakPolarHBondContact O-CB 3.49Å; K121-M124 PolarHBondContact O-N 3.25Å; L122-M124 PolarHBondContact O-N 3.3Å; M124-E126 VanDerWaalsContact C-N 3.29Å; M124-E126 PolarHBondContact O-N 2.9Å; M124-Q127 HydrophobicContact CB-CB 4.34Å; M124-Q127 PolarHBondContact O-N 2.81Å; M124-R128 PolarHBondContact O-N 2.86Å
125	Q	95.8	Very high	97.5	Very high	87 Å²	87	60.2 Å²	60.2	41%	0.407	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-57.4	-38.2	-176.3	-71.3	-55.8	-50.1	0	0	113.6	L122 D123 Q127 R128	L122-Q125 WeakPolarHBondContact O-CG 2.99Å; L122-Q125 PolarHBondContact O-NE2 3.02Å; D123-Q125 VanDerWaalsContact C-N 3.32Å; D123-Q125 PolarHBondContact O-N 3.39Å; Q125-Q127 PolarHBondContact O-N 2.86Å; Q125-R128 WeakPolarHBondContact O-CB 3.45Å; Q125-R128 PolarHBondContact O-N 3.2Å; Q125-R128 VanDerWaalsContact O-N 3.12Å
126	E	96.9	Very high	97.6	Very high	200 Å²	200	63 Å²	63	94%	0.935	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-65.5	-23.2	179.1	-62.2	-175.3	170.5	0	0	113	M124	M124-E126 VanDerWaalsContact C-N 3.29Å; M124-E126 PolarHBondContact O-N 2.9Å
127	Q	96.9	Very high	97.6	Very high	108 Å²	108	70.9 Å²	70.9	51%	0.505	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-98.9	3.1	179.9	-58.4	170.7	27.7	0	0	111.8	D89 M124 Q125 R129	D89-Q127 WeakPolarHBondContact CA-O 3.38Å; D89-Q127 HydrophobicContact CB-CB 4.22Å; M124-Q127 HydrophobicContact CB-CB 4.34Å; M124-Q127 PolarHBondContact O-N 2.81Å; Q125-Q127 PolarHBondContact O-N 2.86Å; Q127-R129 WeakPolarHBondContact O-CG 3.29Å; Q127-R129 PolarHBondContact O-N 3.32Å
128	R	98.3	Very high	97.6	Very high	58 Å²	58	71.9 Å²	71.9	22%	0.219	34%	0.337	C	S	.	.			trans	-54.1	126.5	-176.8	-179.8	-179	-76.1	-89.6	9.9	110.7	I88 M124 Q125 V130 E148	I88-R128 HydrophobicContact CD1-CB 4.41Å; M124-R128 PolarHBondContact O-N 2.86Å; Q125-R128 WeakPolarHBondContact O-CB 3.45Å; Q125-R128 PolarHBondContact O-N 3.2Å; Q125-R128 VanDerWaalsContact O-N 3.12Å; R128-V130 VanDerWaalsContact CD-O 3.24Å; R128-V130 WeakPolarHBondContact CD-O 3.48Å; R128-V130 WeakPolarHBondContact CG-O 3.41Å; R128-V130 PolarHBondContact NH1-O 3.35Å; R128-E148 IonicContact CZ-OE1 2.77Å; R128-E148 IonicContact CZ-OE2 3.68Å; R128-E148 IonicContact NH1-OE1 2.74Å; R128-E148 PolarHBondContact NH1-OE1 3.14Å; R128-E148 IonicContact NH1-OE2 3.69Å; R128-E148 IonicContact NH2-OE1 3.75Å; R128-E148 PolarHBondContact NH2-OE1 3.23Å; R128-E148 IonicContact NH2-OE2 3.36Å; R128-E148 PolarHBondContact NH2-OE2 3.25Å
129	R	98.4	Very high	97.6	Very high	169 Å²	169	72 Å²	72	64%	0.638	34%	0.338	S	S	*	.			trans	-114.5	-17.6	172.3	-55.3	-63.3	-171.8	152	1.3	112.1	I88 D89 K91 Q127	I88-R129 PolarHBondContact O-N 3.23Å; D89-R129 WeakPolarHBondContact O-CG 3.26Å; K91-R129 WeakPolarHBondContact CE-O 3.16Å; K91-R129 HydrophobicContact CG-CB 3.9Å; K91-R129 WeakPolarHBondContact CG-O 3.34Å; Q127-R129 WeakPolarHBondContact O-CG 3.29Å; Q127-R129 PolarHBondContact O-N 3.32Å
130	V	98.4	Very high	97.6	Very high	8 Å²	8	80.2 Å²	80.2	5%	0.048	37%	0.374	C	S	.	.	S	Bend	trans	-106.4	117.5	177.2	-174.2	0	0	0	0	108.9	Y86 I88 K91 F94 R128 A135	Y86-V130 HydrophobicContact CD2-CG2 4.35Å; Y86-V130 HydrophobicContact CE2-CB 4.12Å; Y86-V130 HydrophobicContact CE2-CG1 3.93Å; Y86-V130 HydrophobicContact CE2-CG2 4.18Å; I88-V130 PolarHBondContact O-N 3.13Å; K91-V130 HydrophobicContact CG-CG2 4.43Å; F94-V130 HydrophobicContact CB-CG1 4.34Å; F94-V130 HydrophobicContact CB-CG2 3.8Å; F94-V130 HydrophobicContact CD1-CG1 4.42Å; F94-V130 HydrophobicContact CD2-CG1 3.87Å; F94-V130 HydrophobicContact CE2-CG1 4.28Å; F94-V130 HydrophobicContact CG-CG1 3.94Å; F94-V130 HydrophobicContact CG-CG2 4.31Å; R128-V130 VanDerWaalsContact CD-O 3.24Å; R128-V130 WeakPolarHBondContact CD-O 3.48Å; R128-V130 WeakPolarHBondContact CG-O 3.41Å; R128-V130 PolarHBondContact NH1-O 3.35Å; V130-A135 HydrophobicContact CG1-CB 4.11Å
131	D	98.3	Very high	97.5	Very high	83 Å²	83	84 Å²	84	44%	0.444	40%	0.396	S	S	.	.			trans	-68.3	135.2	176.6	-176.6	-80	0	0	0	110.7	E133 V134 A135	D131-E133 WeakPolarHBondContact OD1-CA 3.46Å; D131-E133 VanDerWaalsContact OD1-CB 3.3Å; D131-E133 WeakPolarHBondContact OD1-CB 3.23Å; D131-E133 PolarHBondContact OD1-N 2.67Å; D131-V134 HydrophobicContact CB-CB 4.07Å; D131-V134 HydrophobicContact CB-CG2 3.83Å; D131-V134 PolarHBondContact O-N 3.27Å; D131-V134 PolarHBondContact OD1-N 3.4Å; D131-V134 VanDerWaalsContact OD1-N 3.11Å; D131-A135 PolarHBondContact O-N 2.86Å
132	S	97.9	Very high	97.5	Very high	41 Å²	41	84.3 Å²	84.3	29%	0.287	40%	0.399	S	S	.	.	H	α-helix	trans	-67.3	-39.1	-174.7	-160.4	0	0	0	0	112	A135 Q136 E148	S132-A135 PolarHBondContact O-N 2.87Å; S132-Q136 WeakPolarHBondContact O-CB 3.46Å; S132-Q136 VanDerWaalsContact O-CG 3.24Å; S132-Q136 WeakPolarHBondContact O-CG 3.26Å; S132-Q136 PolarHBondContact O-N 2.88Å; S132-E148 WeakPolarHBondContact CB-OE1 3.32Å; S132-E148 VanDerWaalsContact OG-CD 3.31Å; S132-E148 PolarHBondContact OG-OE1 3.1Å; S132-E148 PolarHBondContact OG-OE2 3.02Å
133	E	98.1	Very high	97.4	Very high	159 Å²	159	91 Å²	91	74%	0.743	43%	0.426	S	S	*	.	H	α-helix	trans	-66.7	-40.7	178.7	-57.5	-174.7	172.3	0	0	110.7	D131 Q136 Y137	D131-E133 WeakPolarHBondContact OD1-CA 3.46Å; D131-E133 VanDerWaalsContact OD1-CB 3.3Å; D131-E133 WeakPolarHBondContact OD1-CB 3.23Å; D131-E133 PolarHBondContact OD1-N 2.67Å; E133-Q136 PolarHBondContact O-N 2.54Å; E133-Y137 VanDerWaalsContact O-CB 3.24Å; E133-Y137 WeakPolarHBondContact O-CB 3.28Å; E133-Y137 PolarHBondContact O-N 3.13Å
134	V	97.9	Very high	97.4	Very high	85 Å²	85	87.8 Å²	87.8	52%	0.515	41%	0.409	S	S	.	.	H	α-helix	trans	-61.6	-47.3	175	175.1	0	0	0	0	111	D131 Y137 W138	D131-V134 HydrophobicContact CB-CB 4.07Å; D131-V134 HydrophobicContact CB-CG2 3.83Å; D131-V134 PolarHBondContact O-N 3.27Å; D131-V134 PolarHBondContact OD1-N 3.4Å; D131-V134 VanDerWaalsContact OD1-N 3.11Å; V134-Y137 PolarHBondContact O-N 2.97Å; V134-W138 WeakPolarHBondContact O-CB 3.12Å; V134-W138 PolarHBondContact O-N 2.81Å
135	A	98.5	Very high	97.5	Very high	0 Å²	0	91.4 Å²	91.4	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-63.9	-42.1	179.3	0	0	0	0	0	112.2	Y86 F94 V130 D131 S132 W138 A139 L146	Y86-A135 WeakPolarHBondContact OH-CB 3.5Å; F94-A135 HydrophobicContact CE2-CB 3.81Å; F94-A135 HydrophobicContact CZ-CB 4.21Å; V130-A135 HydrophobicContact CG1-CB 4.11Å; D131-A135 PolarHBondContact O-N 2.86Å; S132-A135 PolarHBondContact O-N 2.87Å; A135-W138 PolarHBondContact O-N 3.12Å; A135-A139 WeakPolarHBondContact O-CB 3.4Å; A135-A139 PolarHBondContact O-N 3.07Å; A135-L146 HydrophobicContact CB-CD1 4.04Å
136	Q	98.5	Very high	97.7	Very high	81 Å²	81	87.7 Å²	87.7	38%	0.379	40%	0.403	S	S	.	.	H	α-helix	trans	-67.9	-39.5	177.2	-71.8	-65.3	-15.1	0	0	112.3	S132 E133 A139 K140 L146	S132-Q136 WeakPolarHBondContact O-CB 3.46Å; S132-Q136 VanDerWaalsContact O-CG 3.24Å; S132-Q136 WeakPolarHBondContact O-CG 3.26Å; S132-Q136 PolarHBondContact O-N 2.88Å; E133-Q136 PolarHBondContact O-N 2.54Å; Q136-A139 PolarHBondContact O-N 2.87Å; Q136-K140 WeakPolarHBondContact O-CB 3.23Å; Q136-K140 PolarHBondContact O-N 3.07Å; Q136-L146 PolarHBondContact NE2-O 3.25Å; Q136-L146 VanDerWaalsContact NE2-O 3.13Å
137	Y	98.5	Very high	97.8	Very high	167 Å²	167	79.9 Å²	79.9	66%	0.655	36%	0.364	S	S	*	.	H	α-helix	trans	-62.3	-43.4	174.5	177.2	-97.3	0	0	0	111.9	E133 V134 K140 T141	E133-Y137 VanDerWaalsContact O-CB 3.24Å; E133-Y137 WeakPolarHBondContact O-CB 3.28Å; E133-Y137 PolarHBondContact O-N 3.13Å; V134-Y137 PolarHBondContact O-N 2.97Å; Y137-K140 PolarHBondContact O-N 2.79Å; Y137-T141 PolarHBondContact O-N 2.86Å; Y137-T141 PolarHBondContact O-OG1 2.79Å
138	W	98.5	Very high	97.8	Very high	21 Å²	21	76.3 Å²	76.3	8%	0.08	35%	0.348	C	S	.	.	H	α-helix	trans	-59.3	-49.3	173.4	172.4	87.7	0	0	0	111.2	F94 M97 E98 K101 V117 V134 A135 K140 T141 E142 V144 L146	F94-W138 HydrophobicContact CE2-CE3 4.42Å; F94-W138 HydrophobicContact CZ-CB 4.06Å; F94-W138 HydrophobicContact CZ-CD2 4.12Å; F94-W138 HydrophobicContact CZ-CE3 4.29Å; F94-W138 AromaticContact CZ-CG 4Å; F94-W138 HydrophobicContact CZ-CG 4Å; M97-W138 HydrophobicContact CE-CD2 4.4Å; M97-W138 HydrophobicContact CE-CE3 3.92Å; M97-W138 HydrophobicContact CE-CH2 3.63Å; M97-W138 HydrophobicContact CE-CZ2 4.08Å; M97-W138 HydrophobicContact CE-CZ3 3.53Å; M97-W138 HydrophobicContact SD-CH2 3.17Å; M97-W138 WeakPolarHBondContact SD-CH2 3.36Å; M97-W138 HydrophobicContact SD-CZ2 3.81Å; M97-W138 HydrophobicContact SD-CZ3 3.6Å; M97-W138 VanDerWaalsContact SD-CZ3 3.6Å; E98-W138 HydrophobicContact CB-CZ2 4.31Å; E98-W138 HydrophobicContact CG-CD2 4.38Å; E98-W138 HydrophobicContact CG-CZ2 4.08Å; E98-W138 PolarHBondContact OE1-NE1 3.31Å; K101-W138 HydrophobicContact CB-CH2 4.28Å; K101-W138 HydrophobicContact CB-CZ2 4.06Å; K101-W138 HydrophobicContact CG-CH2 4.33Å; K101-W138 HydrophobicContact CG-CZ2 4.16Å; V117-W138 HydrophobicContact CG1-CZ3 4.3Å; V117-W138 HydrophobicContact CG2-CH2 4.18Å; V117-W138 HydrophobicContact CG2-CZ3 3.98Å; V134-W138 WeakPolarHBondContact O-CB 3.12Å; V134-W138 PolarHBondContact O-N 2.81Å; A135-W138 PolarHBondContact O-N 3.12Å; W138-K140 VanDerWaalsContact C-N 3.3Å; W138-K140 PolarHBondContact O-N 2.97Å; W138-T141 WeakPolarHBondContact O-CB 3.45Å; W138-T141 PolarHBondContact O-N 3.47Å; W138-E142 HydrophobicContact CD2-CG 4.12Å; W138-E142 VanDerWaalsContact CE2-CG 3.49Å; W138-E142 HydrophobicContact CG-CG 4.49Å; W138-E142 HydrophobicContact CH2-CB 4.47Å; W138-E142 HydrophobicContact CH2-CG 4.35Å; W138-E142 HydrophobicContact CZ2-CB 4.24Å; W138-E142 HydrophobicContact CZ2-CG 3.65Å; W138-E142 PolarHBondContact O-N 2.94Å; W138-V144 HydrophobicContact CH2-CG2 4.06Å; W138-V144 HydrophobicContact CZ3-CG2 3.82Å; W138-L146 HydrophobicContact CE3-CD1 4.43Å
139	A	98.2	Very high	97.8	Very high	2 Å²	2	73.5 Å²	73.5	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-59.5	-41.3	-178.7	0	0	0	0	0	112.1	A135 Q136 E142 K143 V144 L146	A135-A139 WeakPolarHBondContact O-CB 3.4Å; A135-A139 PolarHBondContact O-N 3.07Å; Q136-A139 PolarHBondContact O-N 2.87Å; A139-E142 PolarHBondContact O-N 2.72Å; A139-K143 PolarHBondContact O-N 2.92Å; A139-V144 CarbonylContact C-O 3.52Å; A139-V144 HydrophobicContact CB-CG2 4.12Å; A139-V144 PolarHBondContact O-N 2.7Å; A139-V144 VanDerWaalsContact O-O 3.09Å; A139-L146 HydrophobicContact CB-CB 3.55Å; A139-L146 HydrophobicContact CB-CD1 4.09Å; A139-L146 HydrophobicContact CB-CG 4.49Å
140	K	97.8	Very high	97.7	Very high	174 Å²	174	65.7 Å²	65.7	76%	0.757	31%	0.308	S	S	*	.	H	α-helix	trans	-61.2	-43.4	174.2	-175.6	-179.9	178.9	-178.9	0	112.1	Q136 Y137 W138 K143	Q136-K140 WeakPolarHBondContact O-CB 3.23Å; Q136-K140 PolarHBondContact O-N 3.07Å; Y137-K140 PolarHBondContact O-N 2.79Å; W138-K140 VanDerWaalsContact C-N 3.3Å; W138-K140 PolarHBondContact O-N 2.97Å; K140-K143 PolarHBondContact O-N 2.97Å
141	T	97.3	Very high	97.6	Very high	80 Å²	80	66.1 Å²	66.1	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-42.5	178.8	-59.5	0	0	0	0	111.5	Y137 W138 K143	Y137-T141 PolarHBondContact O-N 2.86Å; Y137-T141 PolarHBondContact O-OG1 2.79Å; W138-T141 WeakPolarHBondContact O-CB 3.45Å; W138-T141 PolarHBondContact O-N 3.47Å; T141-K143 PolarHBondContact O-N 2.87Å
142	E	95.8	Very high	97.3	Very high	49 Å²	49	64.9 Å²	64.9	23%	0.229	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	0.1	178.6	-67.5	-64.2	156.2	0	0	113.8	K101 W138 A139 V144	K101-E142 IonicContact NZ-OE2 3.56Å; W138-E142 HydrophobicContact CD2-CG 4.12Å; W138-E142 VanDerWaalsContact CE2-CG 3.49Å; W138-E142 HydrophobicContact CG-CG 4.49Å; W138-E142 HydrophobicContact CH2-CB 4.47Å; W138-E142 HydrophobicContact CH2-CG 4.35Å; W138-E142 HydrophobicContact CZ2-CB 4.24Å; W138-E142 HydrophobicContact CZ2-CG 3.65Å; W138-E142 PolarHBondContact O-N 2.94Å; A139-E142 PolarHBondContact O-N 2.72Å; E142-V144 HydrophobicContact CB-CG2 4.08Å; E142-V144 PolarHBondContact O-N 3.37Å
143	K	94.8	Very high	97.1	Very high	193 Å²	193	65.2 Å²	65.2	84%	0.839	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	35.9	-179	-56.1	176.1	-177.2	173.9	0	113.3	A139 K140 T141	A139-K143 PolarHBondContact O-N 2.92Å; K140-K143 PolarHBondContact O-N 2.97Å; T141-K143 PolarHBondContact O-N 2.87Å
144	V	96	Very high	96.9	Very high	18 Å²	18	62.5 Å²	62.5	11%	0.109	29%	0.294	C	S	.	.			trans	-112.3	157	174	-65.5	0	0	0	0	110.2	K101 I115 V117 W138 A139 E142	K101-V144 HydrophobicContact CD-CG1 4.21Å; I115-V144 HydrophobicContact CB-CG1 4.07Å; I115-V144 HydrophobicContact CG2-CG1 4.11Å; V117-V144 HydrophobicContact CG2-CB 4.28Å; V117-V144 HydrophobicContact CG2-CG2 3.83Å; W138-V144 HydrophobicContact CH2-CG2 4.06Å; W138-V144 HydrophobicContact CZ3-CG2 3.82Å; A139-V144 CarbonylContact C-O 3.52Å; A139-V144 HydrophobicContact CB-CG2 4.12Å; A139-V144 PolarHBondContact O-N 2.7Å; A139-V144 VanDerWaalsContact O-O 3.09Å; E142-V144 HydrophobicContact CB-CG2 4.08Å; E142-V144 PolarHBondContact O-N 3.37Å
145	R	97.5	Very high	96.8	Very high	136 Å²	136	67.6 Å²	67.6	51%	0.513	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.9	170.8	-68.3	-157.9	178.7	-158.5	1.3	110.5	V117 W147 H163	V117-R145 PolarHBondContact N-O 2.98Å; R145-W147 HydrophobicContact CB-CE3 4.06Å; R145-W147 HydrophobicContact CB-CH2 3.38Å; R145-W147 HydrophobicContact CB-CZ2 4.25Å; R145-W147 HydrophobicContact CB-CZ3 3.26Å; R145-W147 VanDerWaalsContact CD-CH2 3.45Å; R145-W147 HydrophobicContact CG-CH2 4.06Å; R145-W147 HydrophobicContact CG-CZ3 4.39Å; R145-H163 PolarHBondContact NE-CE1 3.4Å
146	L	98.6	Very high	96.7	Very high	10 Å²	10	69.4 Å²	69.4	5%	0.052	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.8	178.4	-173	156.5	0	0	0	109.8	Y86 V117 A135 Q136 W138 A139 E148	Y86-L146 HydrophobicContact CE1-CD1 3.86Å; Y86-L146 HydrophobicContact CE1-CG 4.38Å; V117-L146 HydrophobicContact CB-CB 4.19Å; V117-L146 HydrophobicContact CB-CD1 4.31Å; V117-L146 HydrophobicContact CB-CG 4.14Å; V117-L146 HydrophobicContact CG1-CD1 3.84Å; V117-L146 HydrophobicContact CG1-CG 4.03Å; V117-L146 VanDerWaalsContact O-CA 3.3Å; V117-L146 WeakPolarHBondContact O-CA 3.5Å; A135-L146 HydrophobicContact CB-CD1 4.04Å; Q136-L146 PolarHBondContact NE2-O 3.25Å; Q136-L146 VanDerWaalsContact NE2-O 3.13Å; W138-L146 HydrophobicContact CE3-CD1 4.43Å; A139-L146 HydrophobicContact CB-CB 3.55Å; A139-L146 HydrophobicContact CB-CD1 4.09Å; A139-L146 HydrophobicContact CB-CG 4.49Å; L146-E148 HydrophobicContact CD2-CG 4.16Å
147	W	98.8	Very high	96.6	Very high	36 Å²	36	65.5 Å²	65.5	14%	0.136	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.1	168.4	-68.2	-100.2	0	0	0	109.4	V116 V117 L118 G119 R145 V149 E159 P160 H163	V116-W147 HydrophobicContact CB-CZ3 4.27Å; V116-W147 HydrophobicContact CG1-CE3 3.72Å; V116-W147 HydrophobicContact CG1-CZ3 3.55Å; V116-W147 HydrophobicContact CG2-CZ3 3.86Å; V117-W147 PolarHBondContact O-N 2.85Å; L118-W147 CarbonylContact C-O 3.51Å; L118-W147 WeakPolarHBondContact CA-O 3.39Å; L118-W147 HydrophobicContact CD2-CB 4.4Å; G119-W147 PolarHBondContact N-O 3.02Å; R145-W147 HydrophobicContact CB-CE3 4.06Å; R145-W147 HydrophobicContact CB-CH2 3.38Å; R145-W147 HydrophobicContact CB-CZ2 4.25Å; R145-W147 HydrophobicContact CB-CZ3 3.26Å; R145-W147 VanDerWaalsContact CD-CH2 3.45Å; R145-W147 HydrophobicContact CG-CH2 4.06Å; R145-W147 HydrophobicContact CG-CZ3 4.39Å; W147-V149 HydrophobicContact CB-CG1 3.95Å; W147-E159 PolarHBondContact NE1-OE1 3.29Å; W147-P160 HydrophobicContact CB-CG 3.76Å; W147-P160 HydrophobicContact CD2-CB 3.95Å; W147-P160 HydrophobicContact CD2-CG 3.79Å; W147-P160 HydrophobicContact CE3-CB 3.77Å; W147-P160 HydrophobicContact CE3-CG 4.1Å; W147-P160 HydrophobicContact CG-CB 4.32Å; W147-P160 HydrophobicContact CG-CG 3.65Å; W147-P160 HydrophobicContact CZ3-CB 4.2Å; W147-H163 HydrophobicContact CH2-CB 3.82Å; W147-H163 AromaticContact CH2-CD2 3.67Å; W147-H163 AromaticContact CH2-CG 3.64Å; W147-H163 HydrophobicContact CZ2-CB 4.19Å
148	E	98.6	Very high	96.5	Very high	32 Å²	32	61 Å²	61	15%	0.15	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	130.5	162.6	-63.5	-172.6	164.6	0	0	108.5	I88 G119 L122 R128 S132 L146	I88-E148 HydrophobicContact CG2-CG 4.46Å; G119-E148 CarbonylContact O-C 3.53Å; G119-E148 VanDerWaalsContact O-CA 3.23Å; G119-E148 WeakPolarHBondContact O-CA 3.46Å; L122-E148 HydrophobicContact CD1-CB 3.72Å; L122-E148 VanDerWaalsContact CD1-OE2 3.24Å; L122-E148 WeakPolarHBondContact CD1-OE2 3.44Å; L122-E148 HydrophobicContact CD2-CB 4.44Å; L122-E148 HydrophobicContact CG-CB 4.46Å; R128-E148 IonicContact CZ-OE1 2.77Å; R128-E148 IonicContact CZ-OE2 3.68Å; R128-E148 IonicContact NH1-OE1 2.74Å; R128-E148 PolarHBondContact NH1-OE1 3.14Å; R128-E148 IonicContact NH1-OE2 3.69Å; R128-E148 IonicContact NH2-OE1 3.75Å; R128-E148 PolarHBondContact NH2-OE1 3.23Å; R128-E148 IonicContact NH2-OE2 3.36Å; R128-E148 PolarHBondContact NH2-OE2 3.25Å; S132-E148 WeakPolarHBondContact CB-OE1 3.32Å; S132-E148 VanDerWaalsContact OG-CD 3.31Å; S132-E148 PolarHBondContact OG-OE1 3.1Å; S132-E148 PolarHBondContact OG-OE2 3.02Å; L146-E148 HydrophobicContact CD2-CG 4.16Å
149	V	98.4	Very high	96.4	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.305	C	S	.	.			trans	-136	160.2	-170.4	-58.3	0	0	0	0	110.6	L118 G119 N120 K121 L122 W147 T156 L157 P160	L118-V149 HydrophobicContact CB-CG2 4.14Å; L118-V149 HydrophobicContact CD2-CG1 4.12Å; G119-V149 PolarHBondContact O-N 2.87Å; N120-V149 CarbonylContact C-O 3.17Å; N120-V149 WeakPolarHBondContact CA-O 3.07Å; N120-V149 HydrophobicContact CB-CG2 4.25Å; N120-V149 PolarHBondContact OD1-O 3.25Å; K121-V149 PolarHBondContact N-O 2.72Å; K121-V149 VanDerWaalsContact N-O 3.07Å; L122-V149 VanDerWaalsContact CB-O 3.23Å; L122-V149 WeakPolarHBondContact CB-O 3.31Å; L122-V149 PolarHBondContact N-O 3.02Å; W147-V149 HydrophobicContact CB-CG1 3.95Å; V149-T156 VanDerWaalsContact CG1-O 3.28Å; V149-T156 WeakPolarHBondContact CG1-O 3.18Å; V149-L157 HydrophobicContact CB-CD2 3.73Å; V149-L157 HydrophobicContact CG1-CD2 4.28Å; V149-L157 HydrophobicContact CG2-CD2 3.7Å; V149-P160 HydrophobicContact CG1-CG 4.18Å
150	S	96.4	Very high	96.4	Very high	5 Å²	5	65.5 Å²	65.5	4%	0.035	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-132.2	132.5	170.5	174.7	0	0	0	0	109.6	D123 A152 D153 T156	D123-S150 VanDerWaalsContact OD1-CB 3.32Å; D123-S150 WeakPolarHBondContact OD1-CB 3.19Å; D123-S150 PolarHBondContact OD1-OG 2.77Å; S150-A152 PolarHBondContact O-N 3.03Å; S150-A152 WeakPolarHBondContact OG-CB 3.4Å; S150-A152 PolarHBondContact OG-N 3.14Å; S150-D153 CarbonylContact O-C 3.58Å; S150-D153 PolarHBondContact O-N 3.1Å; S150-T156 PolarHBondContact N-OG1 3.26Å; S150-T156 PolarHBondContact O-OG1 3.36Å
151	V	94.4	Very high	96.4	Very high	16 Å²	16	57.5 Å²	57.5	10%	0.097	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.9	168.7	-61.3	0	0	0	0	112	A19 V20 Q23 D153	A19-V151 HydrophobicContact CB-CG1 3.97Å; V20-V151 HydrophobicContact CB-CG1 4.48Å; V20-V151 HydrophobicContact CG2-CG1 3.74Å; Q23-V151 VanDerWaalsContact CG-O 3.3Å; Q23-V151 WeakPolarHBondContact CG-O 3.49Å; Q23-V151 PolarHBondContact NE2-O 2.7Å; V151-D153 VanDerWaalsContact C-N 3.28Å; V151-D153 PolarHBondContact O-N 2.93Å
152	A	92.3	Very high	96.3	Very high	57 Å²	57	55.3 Å²	55.3	47%	0.471	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-23.9	173.1	0	0	0	0	0	112.3	A31 S150	A31-A152 HydrophobicContact CB-CB 4.07Å; S150-A152 PolarHBondContact O-N 3.03Å; S150-A152 WeakPolarHBondContact OG-CB 3.4Å; S150-A152 PolarHBondContact OG-N 3.14Å
153	D	94	Very high	96.3	Very high	49 Å²	49	54.9 Å²	54.9	26%	0.262	25%	0.254	S	S	.	.	B	Isolated β-bridge	trans	-119.3	87.9	172.2	-171.1	-7.8	0	0	0	111.3	S150 V151 R155 T156	S150-D153 CarbonylContact O-C 3.58Å; S150-D153 PolarHBondContact O-N 3.1Å; V151-D153 VanDerWaalsContact C-N 3.28Å; V151-D153 PolarHBondContact O-N 2.93Å; D153-R155 PolarHBondContact O-N 3.06Å; D153-R155 VanDerWaalsContact OD1-CB 3.31Å; D153-R155 WeakPolarHBondContact OD1-CB 3.25Å; D153-R155 IonicContact OD1-CZ 3.63Å; D153-R155 PolarHBondContact OD1-N 2.76Å; D153-R155 VanDerWaalsContact OD1-N 3.13Å; D153-R155 IonicContact OD1-NE 2.86Å; D153-R155 PolarHBondContact OD1-NE 2.79Å; D153-R155 IonicContact OD1-NH2 3.52Å; D153-R155 IonicContact OD2-CZ 3.52Å; D153-R155 IonicContact OD2-NE 3.45Å; D153-R155 PolarHBondContact OD2-NE 3.38Å; D153-R155 IonicContact OD2-NH2 2.75Å; D153-R155 PolarHBondContact OD2-NH2 2.55Å; D153-T156 HydrophobicContact CB-CG2 4.04Å; D153-T156 WeakPolarHBondContact O-CB 3.39Å; D153-T156 PolarHBondContact O-N 3.24Å; D153-T156 PolarHBondContact O-OG1 3.26Å
154	R	93.9	Very high	96.3	Very high	102 Å²	102	45.9 Å²	45.9	39%	0.385	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-50.4	-28.8	179.9	-176.5	177.8	178.1	-134.9	-1.4	113.6	Q23 L24 T156 L157	Q23-R154 HydrophobicContact CG-CB 4.05Å; Q23-R154 HydrophobicContact CG-CG 4.21Å; Q23-R154 VanDerWaalsContact O-CD 3.25Å; Q23-R154 WeakPolarHBondContact O-CD 3.44Å; Q23-R154 PolarHBondContact O-NE 2.86Å; L24-R154 PolarHBondContact O-NE 3.19Å; L24-R154 PolarHBondContact O-NH2 3.44Å; R154-T156 PolarHBondContact O-N 3.02Å; R154-L157 WeakPolarHBondContact O-CB 3.44Å; R154-L157 PolarHBondContact O-N 3.04Å
155	R	95.4	Very high	96.2	Very high	192 Å²	192	45.1 Å²	45.1	73%	0.725	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-61.9	-34.1	-179	-60	171.5	-64.8	178.5	4.8	111.6	D153 L157 I158	D153-R155 PolarHBondContact O-N 3.06Å; D153-R155 VanDerWaalsContact OD1-CB 3.31Å; D153-R155 WeakPolarHBondContact OD1-CB 3.25Å; D153-R155 IonicContact OD1-CZ 3.63Å; D153-R155 PolarHBondContact OD1-N 2.76Å; D153-R155 VanDerWaalsContact OD1-N 3.13Å; D153-R155 IonicContact OD1-NE 2.86Å; D153-R155 PolarHBondContact OD1-NE 2.79Å; D153-R155 IonicContact OD1-NH2 3.52Å; D153-R155 IonicContact OD2-CZ 3.52Å; D153-R155 IonicContact OD2-NE 3.45Å; D153-R155 PolarHBondContact OD2-NE 3.38Å; D153-R155 IonicContact OD2-NH2 2.75Å; D153-R155 PolarHBondContact OD2-NH2 2.55Å; R155-L157 PolarHBondContact O-N 3.18Å; R155-I158 PolarHBondContact O-N 2.96Å
156	T	96.9	Very high	95.9	Very high	37 Å²	37	38.8 Å²	38.8	23%	0.227	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-64.6	-22.8	176.9	68.2	0	0	0	0	112.7	V149 S150 D153 R154 P160	V149-T156 VanDerWaalsContact CG1-O 3.28Å; V149-T156 WeakPolarHBondContact CG1-O 3.18Å; S150-T156 PolarHBondContact N-OG1 3.26Å; S150-T156 PolarHBondContact O-OG1 3.36Å; D153-T156 HydrophobicContact CB-CG2 4.04Å; D153-T156 WeakPolarHBondContact O-CB 3.39Å; D153-T156 PolarHBondContact O-N 3.24Å; D153-T156 PolarHBondContact O-OG1 3.26Å; R154-T156 PolarHBondContact O-N 3.02Å; T156-P160 WeakPolarHBondContact O-CD 3.45Å
157	L	97.1	Very high	95.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-84.5	-15.2	179.8	-55.1	176.3	0	0	0	113.3	V20 Q23 L24 V149 R154 R155 F161	V20-L157 HydrophobicContact CG1-CD2 4.15Å; V20-L157 HydrophobicContact CG2-CD2 4.12Å; Q23-L157 HydrophobicContact CB-CD1 3.83Å; Q23-L157 HydrophobicContact CG-CD1 3.8Å; L24-L157 HydrophobicContact CD1-CB 4.13Å; V149-L157 HydrophobicContact CB-CD2 3.73Å; V149-L157 HydrophobicContact CG1-CD2 4.28Å; V149-L157 HydrophobicContact CG2-CD2 3.7Å; R154-L157 WeakPolarHBondContact O-CB 3.44Å; R154-L157 PolarHBondContact O-N 3.04Å; R155-L157 PolarHBondContact O-N 3.18Å; L157-F161 WeakPolarHBondContact O-CD2 3.1Å
158	I	95.9	Very high	95	Very high	72 Å²	72	42.4 Å²	42.4	37%	0.369	21%	0.205	S	C	.	.	H	α-helix	trans	-72.7	-55	-171.9	-56.7	-56.6	0	0	0	111.1	L24 R155 P160 F161 V162	L24-I158 HydrophobicContact CD1-CD1 3.92Å; R155-I158 PolarHBondContact O-N 2.96Å; I158-P160 VanDerWaalsContact C-CD 3.49Å; I158-F161 PolarHBondContact O-N 3.31Å; I158-V162 HydrophobicContact CG2-CG2 3.92Å; I158-V162 WeakPolarHBondContact O-CG2 3.24Å; I158-V162 PolarHBondContact O-N 2.94Å
159	E	97	Very high	94.3	Very high	116 Å²	116	42.2 Å²	42.2	54%	0.542	21%	0.206	S	C	.	.	H	α-helix	trans	-57.6	-44.5	-173.7	-168.6	-170.4	155.9	0	0	114.2	W147 F161 V162 H163	W147-E159 PolarHBondContact NE1-OE1 3.29Å; E159-F161 VanDerWaalsContact C-N 3.29Å; E159-F161 PolarHBondContact O-N 2.89Å; E159-V162 PolarHBondContact O-N 3.32Å; E159-H163 WeakPolarHBondContact O-CB 3.32Å; E159-H163 PolarHBondContact O-N 2.86Å
160	P	97.8	Very high	93.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-59.7	-39.1	-179.7	-20.9	30.6	0	0	0	113	V116 L118 W147 V149 T156 I158 L164	V116-P160 HydrophobicContact CG1-CB 3.96Å; L118-P160 HydrophobicContact CD2-CB 3.61Å; L118-P160 HydrophobicContact CD2-CG 3.83Å; W147-P160 HydrophobicContact CB-CG 3.76Å; W147-P160 HydrophobicContact CD2-CB 3.95Å; W147-P160 HydrophobicContact CD2-CG 3.79Å; W147-P160 HydrophobicContact CE3-CB 3.77Å; W147-P160 HydrophobicContact CE3-CG 4.1Å; W147-P160 HydrophobicContact CG-CB 4.32Å; W147-P160 HydrophobicContact CG-CG 3.65Å; W147-P160 HydrophobicContact CZ3-CB 4.2Å; V149-P160 HydrophobicContact CG1-CG 4.18Å; T156-P160 WeakPolarHBondContact O-CD 3.45Å; I158-P160 VanDerWaalsContact C-CD 3.49Å; P160-L164 WeakPolarHBondContact O-CB 3.32Å; P160-L164 PolarHBondContact O-N 3.19Å
161	F	96.8	Very high	91.5	Very high	6 Å²	6	51.5 Å²	51.5	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-81	-35	-177.2	-73.4	-99.2	0	0	0	112.2	V20 L21 L24 F59 V83 L118 L157 I158 E159 H163 L164 A165	V20-F161 HydrophobicContact CG1-CE2 3.84Å; V20-F161 HydrophobicContact CG1-CZ 3.63Å; L21-F161 HydrophobicContact CD2-CE1 4.19Å; L21-F161 HydrophobicContact CD2-CZ 4.49Å; L24-F161 HydrophobicContact CD1-CB 4.47Å; L24-F161 HydrophobicContact CD1-CD2 4.33Å; L24-F161 HydrophobicContact CD1-CG 4.41Å; L24-F161 HydrophobicContact CD2-CB 3.93Å; L24-F161 HydrophobicContact CD2-CD1 3.32Å; L24-F161 HydrophobicContact CD2-CD2 3.69Å; L24-F161 HydrophobicContact CD2-CE1 3.59Å; L24-F161 HydrophobicContact CD2-CE2 3.91Å; L24-F161 HydrophobicContact CD2-CG 3.36Å; L24-F161 HydrophobicContact CD2-CZ 3.86Å; F59-F161 HydrophobicContact CD1-CE1 4.2Å; F59-F161 AromaticContact CE1-CD1 3.58Å; F59-F161 HydrophobicContact CE1-CD1 3.58Å; F59-F161 AromaticContact CE1-CE1 3.61Å; F59-F161 HydrophobicContact CE1-CE1 3.61Å; F59-F161 AromaticContact CZ-CD1 3.74Å; F59-F161 HydrophobicContact CZ-CD1 3.74Å; F59-F161 HydrophobicContact CZ-CE1 4.1Å; V83-F161 HydrophobicContact CG1-CZ 4.48Å; V83-F161 HydrophobicContact CG2-CE1 4.22Å; L118-F161 HydrophobicContact CD1-CE2 3.83Å; L118-F161 HydrophobicContact CD1-CZ 4.11Å; L157-F161 WeakPolarHBondContact O-CD2 3.1Å; I158-F161 PolarHBondContact O-N 3.31Å; E159-F161 VanDerWaalsContact C-N 3.29Å; E159-F161 PolarHBondContact O-N 2.89Å; F161-H163 VanDerWaalsContact C-N 3.32Å; F161-L164 PolarHBondContact O-N 2.56Å; F161-A165 WeakPolarHBondContact O-CB 3.17Å; F161-A165 PolarHBondContact O-N 2.99Å
162	V	95.8	Very high	89.5	Confident	34 Å²	34	59.4 Å²	59.4	21%	0.206	29%	0.293	C	S	.	.	H	α-helix	trans	-60.5	-44.9	169	172.7	0	0	0	0	110.1	I47 E48 I158 E159 A165 S166	I47-V162 HydrophobicContact CG2-CG2 4.17Å; E48-V162 WeakPolarHBondContact O-CG2 3.44Å; I158-V162 HydrophobicContact CG2-CG2 3.92Å; I158-V162 WeakPolarHBondContact O-CG2 3.24Å; I158-V162 PolarHBondContact O-N 2.94Å; E159-V162 PolarHBondContact O-N 3.32Å; V162-A165 PolarHBondContact O-N 3.32Å; V162-S166 VanDerWaalsContact O-CB 3.29Å; V162-S166 WeakPolarHBondContact O-CB 3.47Å; V162-S166 PolarHBondContact O-N 3.05Å; V162-S166 PolarHBondContact O-OG 3.45Å
163	H	95.6	Very high	87.4	Confident	41 Å²	41	61.9 Å²	61.9	19%	0.19	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-49.7	176.3	-179.7	83.1	0	0	0	111.8	R145 W147 E159 F161 S166 K167	R145-H163 PolarHBondContact NE-CE1 3.4Å; W147-H163 HydrophobicContact CH2-CB 3.82Å; W147-H163 AromaticContact CH2-CD2 3.67Å; W147-H163 AromaticContact CH2-CG 3.64Å; W147-H163 HydrophobicContact CZ2-CB 4.19Å; E159-H163 WeakPolarHBondContact O-CB 3.32Å; E159-H163 PolarHBondContact O-N 2.86Å; F161-H163 VanDerWaalsContact C-N 3.32Å; H163-S166 PolarHBondContact O-N 2.92Å; H163-K167 WeakPolarHBondContact O-CB 3.43Å; H163-K167 WeakPolarHBondContact O-CG 3.25Å; H163-K167 PolarHBondContact O-N 3.33Å
164	L	94.9	Very high	85	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-60.1	-49.9	179.9	-179.1	59.8	0	0	0	111.6	V7 V83 N114 V116 P160 F161 S166 K167 M168	V7-L164 HydrophobicContact CG1-CD2 3.83Å; V7-L164 HydrophobicContact CG2-CD2 3.92Å; V83-L164 HydrophobicContact CG2-CD2 3.55Å; N114-L164 HydrophobicContact CB-CD1 3.76Å; V116-L164 HydrophobicContact CG2-CB 4Å; V116-L164 HydrophobicContact CG2-CD1 4.24Å; P160-L164 WeakPolarHBondContact O-CB 3.32Å; P160-L164 PolarHBondContact O-N 3.19Å; F161-L164 PolarHBondContact O-N 2.56Å; L164-S166 VanDerWaalsContact C-N 3.34Å; L164-S166 PolarHBondContact O-N 3.19Å; L164-K167 PolarHBondContact O-N 3.2Å; L164-M168 HydrophobicContact CD1-CE 4.42Å; L164-M168 HydrophobicContact CD1-CG 4.26Å; L164-M168 HydrophobicContact CD1-SD 4.06Å; L164-M168 HydrophobicContact CG-CE 3.88Å; L164-M168 HydrophobicContact CG-SD 4.15Å; L164-M168 WeakPolarHBondContact O-CG 3.31Å; L164-M168 PolarHBondContact O-N 3.45Å
165	A	93.1	Very high	82.8	Confident	2 Å²	2	68.5 Å²	68.5	2%	0.017	35%	0.349	C	S	.	.	H	α-helix	trans	-58.4	-46.6	178.2	0	0	0	0	0	111.5	I47 T49 V57 F161 V162 K167 M168 T169	I47-A165 HydrophobicContact CB-CB 4.06Å; I47-A165 HydrophobicContact CG2-CB 3.81Å; T49-A165 HydrophobicContact CG2-CB 4.13Å; V57-A165 HydrophobicContact CG2-CB 4.48Å; F161-A165 WeakPolarHBondContact O-CB 3.17Å; F161-A165 PolarHBondContact O-N 2.99Å; V162-A165 PolarHBondContact O-N 3.32Å; A165-K167 VanDerWaalsContact C-N 3.32Å; A165-K167 PolarHBondContact O-N 3.02Å; A165-M168 PolarHBondContact O-N 2.86Å; A165-T169 PolarHBondContact O-N 3.49Å; A165-T169 VanDerWaalsContact O-N 3.15Å; A165-T169 PolarHBondContact O-OG1 2.93Å
166	S	92.2	Very high	80.4	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-62.1	-40	-179	-54.1	0	0	0	0	111.8	T49 D50 V162 H163 L164 Q170	T49-S166 VanDerWaalsContact CB-OG 3.29Å; T49-S166 WeakPolarHBondContact CB-OG 3.3Å; D50-S166 PolarHBondContact N-OG 2.88Å; D50-S166 WeakPolarHBondContact OD1-CB 3.32Å; D50-S166 PolarHBondContact OD1-OG 3.33Å; V162-S166 VanDerWaalsContact O-CB 3.29Å; V162-S166 WeakPolarHBondContact O-CB 3.47Å; V162-S166 PolarHBondContact O-N 3.05Å; V162-S166 PolarHBondContact O-OG 3.45Å; H163-S166 PolarHBondContact O-N 2.92Å; L164-S166 VanDerWaalsContact C-N 3.34Å; L164-S166 PolarHBondContact O-N 3.19Å; S166-Q170 WeakPolarHBondContact O-CG 3.43Å; S166-Q170 PolarHBondContact O-N 3.27Å
167	K	90.9	Very high	78.3	Confident	89 Å²	89	71.2 Å²	71.2	39%	0.387	38%	0.376	S	S	.	.	H	α-helix	trans	-69.1	-38.1	177.1	-78.5	-71.7	-176.6	178.1	0	113.4	H163 L164 A165 T169	H163-K167 WeakPolarHBondContact O-CB 3.43Å; H163-K167 WeakPolarHBondContact O-CG 3.25Å; H163-K167 PolarHBondContact O-N 3.33Å; L164-K167 PolarHBondContact O-N 3.2Å; A165-K167 VanDerWaalsContact C-N 3.32Å; A165-K167 PolarHBondContact O-N 3.02Å; K167-T169 VanDerWaalsContact C-N 3.31Å; K167-T169 PolarHBondContact O-N 2.75Å
168	M	88.4	Confident	76.1	Confident	33 Å²	33	77 Å²	77	16%	0.163	41%	0.414	C	S	.	.	H	α-helix	trans	-71	-26.1	179.1	-69.3	-176.7	-52.6	0	0	113.3	C5 V7 V57 N114 L164 A165	C5-M168 HydrophobicContact CB-CE 3.82Å; C5-M168 HydrophobicContact CB-SD 4.18Å; V7-M168 HydrophobicContact CG2-CE 3.63Å; V7-M168 HydrophobicContact CG2-SD 3.71Å; V57-M168 HydrophobicContact CG1-CE 4.46Å; V57-M168 HydrophobicContact CG2-CE 4.46Å; N114-M168 HydrophobicContact CB-CG 3.96Å; N114-M168 WeakPolarHBondContact ND2-CG 3.19Å; L164-M168 HydrophobicContact CD1-CE 4.42Å; L164-M168 HydrophobicContact CD1-CG 4.26Å; L164-M168 HydrophobicContact CD1-SD 4.06Å; L164-M168 HydrophobicContact CG-CE 3.88Å; L164-M168 HydrophobicContact CG-SD 4.15Å; L164-M168 WeakPolarHBondContact O-CG 3.31Å; L164-M168 PolarHBondContact O-N 3.45Å; A165-M168 PolarHBondContact O-N 2.86Å
169	T	82.7	Confident	73.9	Confident	28 Å²	28	81.8 Å²	81.8	17%	0.172	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	16.8	-176.5	76.2	0	0	0	0	113.8	R51 E55 A165 K167 P171	R51-T169 PolarHBondContact NH1-O 3.13Å; R51-T169 PolarHBondContact NH2-O 2.96Å; R51-T169 VanDerWaalsContact NH2-O 3.09Å; R51-T169 PolarHBondContact NH2-OG1 3.2Å; E55-T169 HydrophobicContact CB-CG2 4.36Å; E55-T169 VanDerWaalsContact CD-CG2 3.44Å; E55-T169 HydrophobicContact CG-CG2 3.73Å; E55-T169 VanDerWaalsContact OE1-CB 3.25Å; E55-T169 WeakPolarHBondContact OE1-CB 3.31Å; E55-T169 PolarHBondContact OE1-OG1 3.32Å; A165-T169 PolarHBondContact O-N 3.49Å; A165-T169 VanDerWaalsContact O-N 3.15Å; A165-T169 PolarHBondContact O-OG1 2.93Å; K167-T169 VanDerWaalsContact C-N 3.31Å; K167-T169 PolarHBondContact O-N 2.75Å; T169-P171 WeakPolarHBondContact O-CD 3.45Å
170	Q	74.4	Confident	71.7	Confident	96 Å²	96	81.8 Å²	81.8	45%	0.449	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-64.4	123.4	167.4	-92.5	168.1	29.2	0	0	109.1	S166 Q172	S166-Q170 WeakPolarHBondContact O-CG 3.43Å; S166-Q170 PolarHBondContact O-N 3.27Å; Q170-Q172 PolarHBondContact O-N 3.42Å
171	P	61.3	Low	69.6	Low	103 Å²	103	92.2 Å²	92.2	67%	0.669	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-56.8	126.2	170.6	-17.9	27.6	0	0	0	107.6	R51 T169 S173	R51-P171 VanDerWaalsContact NH1-CD 3.31Å; T169-P171 WeakPolarHBondContact O-CD 3.45Å; P171-S173 PolarHBondContact O-N 3.23Å; P171-S173 VanDerWaalsContact O-N 3.1Å
172	Q	53.5	Low	67.2	Low	182 Å²	182	98.7 Å²	98.7	85%	0.85	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-54	125.5	164.3	-67.3	-155.4	-23.2	0	0	106.4	Q170 K174	Q170-Q172 PolarHBondContact O-N 3.42Å; Q172-K174 PolarHBondContact O-N 3.48Å
173	S	46.7	Very low	64.9	Low	110 Å²	110	105.3 Å²	105.3	77%	0.769	55%	0.552	S	S	*	*			trans	-52.4	113.9	174.8	54.9	0	0	0	0	106.1	P171 S175	P171-S173 PolarHBondContact O-N 3.23Å; P171-S173 VanDerWaalsContact O-N 3.1Å; S173-S175 PolarHBondContact O-N 3.3Å
174	K	43.9	Very low	62.5	Low	195 Å²	195	111.5 Å²	111.5	85%	0.848	59%	0.587	S	S	*	*			trans	-55.7	113.4	166.7	-69.8	-176.4	179.9	179.9	0	103.3	Q172 S176	Q172-K174 PolarHBondContact O-N 3.48Å; K174-S176 VanDerWaalsContact C-N 3.31Å; K174-S176 PolarHBondContact O-N 3.11Å
175	S	47.6	Very low	60.3	Low	95 Å²	95	121 Å²	121	66%	0.664	63%	0.628	S	S	*	*			trans	-48.8	108.7	166.5	57	0	0	0	0	105.2	S173 F177	S173-S175 PolarHBondContact O-N 3.3Å; S175-F177 PolarHBondContact O-N 2.88Å
176	S	45	Very low	58	Low	107 Å²	107	124.1 Å²	124.1	75%	0.748	66%	0.66	S	S	*	*			trans	-60.4	110.7	175.1	54.9	0	0	0	0	104.8	K174 P178	K174-S176 VanDerWaalsContact C-N 3.31Å; K174-S176 PolarHBondContact O-N 3.11Å; S176-P178 WeakPolarHBondContact O-CD 3.32Å; S176-P178 VanDerWaalsContact O-N 3.14Å
177	F	53.9	Low	55.8	Low	179 Å²	179	130 Å²	130	79%	0.785	70%	0.701	S	S	*	*			trans	-51.1	124.6	163.7	-77.9	-86.3	0	0	0	106.1	S175 L179	S175-F177 PolarHBondContact O-N 2.88Å; F177-L179 PolarHBondContact O-N 3.4Å
178	P	50.5	Low	53.3	Low	122 Å²	122	129.5 Å²	129.5	79%	0.792	72%	0.721	S	S	*	*			trans	-62.9	107.2	174.4	23.7	-29.1	0	0	0	106.7	S176 S180	S176-P178 WeakPolarHBondContact O-CD 3.32Å; S176-P178 VanDerWaalsContact O-N 3.14Å; P178-S180 PolarHBondContact O-N 2.82Å
179	L	49.8	Very low	51.1	Low	172 Å²	172	133.9 Å²	133.9	90%	0.901	76%	0.755	S	S	*	*			trans	-61.6	103.3	168.4	-81.6	158.1	0	0	0	106.5	F177 R181	F177-L179 PolarHBondContact O-N 3.4Å; L179-R181 PolarHBondContact O-N 3.11Å
180	S	51.5	Low	49.7	Very low	116 Å²	116	138.3 Å²	138.3	81%	0.811	78%	0.782	S	S	*	*			trans	-61.6	107.2	170.6	-176	0	0	0	0	108.2	P178	P178-S180 PolarHBondContact O-N 2.82Å
181	R	53.6	Low	48.3	Very low	219 Å²	219	140.8 Å²	140.8	83%	0.826	80%	0.798	S	S	*	*			trans	-89.9	105.4	171.4	-177.3	179.1	171.9	178	-1.9	107.6	L179	L179-R181 PolarHBondContact O-N 3.11Å
182	N	45.9	Very low	47.4	Very low	143 Å²	143	145 Å²	145	77%	0.765	83%	0.83	S	S	*	*			trans	-136.6	94.3	157.9	-104	-6.2	0	0	0	108.5
183	K	47.6	Very low	47.1	Very low	172 Å²	172	143.1 Å²	143.1	75%	0.748	83%	0.829	S	S	*	*				63.5	90.1	94.6	-87.4	-172.4	177.1	176.3	0	112.6	K185	K183-K185 PolarHBondContact O-N 3.48Å
184	N	45.4	Very low	47.2	Very low	172 Å²	172	144.8 Å²	144.8	92%	0.92	83%	0.832	S	S	*	*			trans	-48.7	122.7	147.7	-96.7	-2.5	0	0	0	109.6
185	K	48.9	Very low	47.3	Very low	203 Å²	203	142.1 Å²	142.1	88%	0.883	83%	0.831	S	S	*	*			trans	-113.3	110.1	146.5	-85.4	-173	173.4	-176.3	0	106.1	K183	K183-K185 PolarHBondContact O-N 3.48Å
186	G	44.3	Very low	47.3	Very low	67 Å²	67	144.8 Å²	144.8	69%	0.691	84%	0.841	S	S	*	*			trans	-79.7	155.1	163.8	0	0	0	0	0	110.6
187	S	45.2	Very low	47.5	Very low	127 Å²	127	147.2 Å²	147.2	89%	0.888	85%	0.847	S	S	*	*				152.2	131.7	126.9	64.5	0	0	0	0	112.4
188	G	39.6	Very low	47.1	Very low	78 Å²	78	145.1 Å²	145.1	80%	0.804	85%	0.851	S	S	*	*			trans	94.2	128.3	164.1	0	0	0	0	0	113.1
189	S	42	Very low	46.8	Very low	126 Å²	126	146.7 Å²	146.7	88%	0.881	86%	0.855	S	S	*	*			cis	-158.5	159.3	25.4	39.2	0	0	0	0	111.1
190	V	52.2	Low	46.6	Very low	121 Å²	121	144.8 Å²	144.8	73%	0.733	85%	0.852	S	S	*	*			trans	-91.9	155.8	-171.5	162.8	0	0	0	0	111.1
191	D	45.6	Very low	46.2	Very low	147 Å²	147	147.2 Å²	147.2	79%	0.786	86%	0.855	S	S	*	*			trans	82.1	136	151.7	-78.7	-15.1	0	0	0	123.4
192	S	43.7	Very low	45.5	Very low	191 Å²	191	140.6 Å²	140.6	100%	1.336	86%	0.858	S	S	*	*			trans	79.8	0	153.6	-49	0	0	0	0	119

Retrieved 192 of 192 residues in 1343.9 ms (Link to these results)

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