YH069_YEAST Loading...

Putative uncharacterized membrane protein YHR069C-A

AlphaFold DB , UniProt , Accession A0A023PZI4, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 120 aa.

						>YH069_YEAST|A0A023PZI4
MDSCSSTPFVTGVLLPSAVFSFLFCTLVSSSFGLDEFNLTTCGIRGTLKMQFLKFLENTLIFLGSGNLTAHIGILVMKNDLSNSRIWRFTGGLYGNTPDILHELINLLNFWNTGSAIFMQ
					

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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	29.6	Very low	25.9	Very low	233 Å²	233	128.7 Å²	128.7	100%	1.148	77%	0.765	S	S	*	*				0	105	0	-76.7	169.2	165.1	0	0	104.9
2	D	21.6	Very low	26.2	Very low	165 Å²	165	122 Å²	122	88%	0.882	74%	0.742	S	S	*	*			trans	-174.7	113	149.4	-87.2	-29.9	0	0	0	107.1	C4	D2-C4 PolarHBondContact O-N 2.91Å
3	S	22.6	Very low	26.6	Very low	109 Å²	109	119.8 Å²	119.8	76%	0.762	73%	0.729	S	S	*	*			trans	-61.9	117	-168.9	33.7	0	0	0	0	112.1	S5	S3-S5 PolarHBondContact O-N 3.23Å
4	C	23.4	Very low	27.1	Very low	138 Å²	138	121.3 Å²	121.3	93%	0.932	73%	0.729	S	S	*	*			trans	-63.1	87.8	154.1	-77.4	0	0	0	0	107.8	D2 S6	D2-C4 PolarHBondContact O-N 2.91Å; C4-S6 PolarHBondContact O-N 3.21Å
5	S	24.6	Very low	27.8	Very low	103 Å²	103	117.1 Å²	117.1	72%	0.72	70%	0.701	S	S	*	*			trans	-66.6	123.7	172.2	57.2	0	0	0	0	108.4	S3 T7	S3-S5 PolarHBondContact O-N 3.23Å; S5-T7 PolarHBondContact O-N 3.19Å; S5-T7 VanDerWaalsContact O-N 3.1Å
6	S	26.4	Very low	28.3	Very low	112 Å²	112	115.1 Å²	115.1	78%	0.783	69%	0.692	S	S	*	*			trans	-49.3	109.5	179.6	47.7	0	0	0	0	111.9	C4	C4-S6 PolarHBondContact O-N 3.21Å
7	T	28.6	Very low	28.9	Very low	85 Å²	85	112.6 Å²	112.6	52%	0.521	68%	0.681	S	S	.	*			trans	-62.3	126.6	162.8	50.5	0	0	0	0	108.5	S5 F9	S5-T7 PolarHBondContact O-N 3.19Å; S5-T7 VanDerWaalsContact O-N 3.1Å; T7-F9 PolarHBondContact O-N 3.34Å; T7-F9 VanDerWaalsContact O-N 3.08Å
8	P	26.1	Very low	29	Very low	108 Å²	108	110.3 Å²	110.3	70%	0.701	68%	0.676	S	S	*	*			trans	-67.9	110.6	178	26.4	-31.6	0	0	0	109.4	V10	P8-V10 PolarHBondContact O-N 2.88Å
9	F	26	Very low	29.4	Very low	148 Å²	148	107.6 Å²	107.6	65%	0.649	66%	0.659	S	S	*	*			trans	-73.3	111.6	163.1	-84.6	-93.6	0	0	0	107.9	T7 T11 F52	T7-F9 PolarHBondContact O-N 3.34Å; T7-F9 VanDerWaalsContact O-N 3.08Å; F9-T11 PolarHBondContact O-N 3.43Å; F9-F52 AromaticContact CD1-CD1 3.88Å; F9-F52 HydrophobicContact CD1-CD1 3.88Å; F9-F52 AromaticContact CD1-CE1 3.91Å; F9-F52 HydrophobicContact CD1-CE1 3.91Å; F9-F52 AromaticContact CE1-CD1 3.54Å; F9-F52 HydrophobicContact CE1-CD1 3.54Å; F9-F52 AromaticContact CE1-CE1 3.52Å; F9-F52 HydrophobicContact CE1-CE1 3.52Å
10	V	28.2	Very low	30	Very low	89 Å²	89	103.6 Å²	103.6	54%	0.539	63%	0.632	S	S	.	*			trans	-84.8	105.4	166.3	-179.3	0	0	0	0	107.5	P8 G12	P8-V10 PolarHBondContact O-N 2.88Å; V10-G12 PolarHBondContact O-N 3.31Å
11	T	27.3	Very low	30.5	Very low	126 Å²	126	100.9 Å²	100.9	77%	0.773	62%	0.618	S	S	*	*			trans	-62.1	127	172.9	-30.2	0	0	0	0	109.1	F9 V13	F9-T11 PolarHBondContact O-N 3.43Å; T11-V13 PolarHBondContact O-N 3.32Å; T11-V13 VanDerWaalsContact O-N 3.16Å
12	G	30.3	Very low	30.8	Very low	48 Å²	48	96.6 Å²	96.6	50%	0.495	59%	0.593	S	S	.	*			trans	-50.2	113.8	-167.9	0	0	0	0	0	115.3	V10 M50	V10-G12 PolarHBondContact O-N 3.31Å; G12-M50 VanDerWaalsContact CA-O 3.23Å; G12-M50 WeakPolarHBondContact CA-O 3.18Å
13	V	31.1	Very low	31.8	Very low	94 Å²	94	93.4 Å²	93.4	57%	0.57	58%	0.575	S	S	*	*			trans	-89.5	128.3	167.6	-177.1	0	0	0	0	108.3	T11 L15	T11-V13 PolarHBondContact O-N 3.32Å; T11-V13 VanDerWaalsContact O-N 3.16Å; V13-L15 VanDerWaalsContact C-N 3.3Å; V13-L15 HydrophobicContact CB-CD1 4.34Å; V13-L15 HydrophobicContact CB-CG 4.36Å; V13-L15 HydrophobicContact CG1-CD1 4.46Å; V13-L15 HydrophobicContact CG1-CG 3.99Å; V13-L15 PolarHBondContact O-N 2.99Å
14	L	34.1	Very low	32.8	Very low	140 Å²	140	89.7 Å²	89.7	73%	0.733	55%	0.545	S	S	*	.			trans	-68.4	89.2	167.5	-78.3	161	0	0	0	108.6
15	L	37	Very low	33.6	Very low	59 Å²	59	84.8 Å²	84.8	31%	0.309	51%	0.512	S	S	.	.			trans	-88.3	126.3	172.7	-75.8	148.2	0	0	0	108.6	V13 S17 V19 F20	V13-L15 VanDerWaalsContact C-N 3.3Å; V13-L15 HydrophobicContact CB-CD1 4.34Å; V13-L15 HydrophobicContact CB-CG 4.36Å; V13-L15 HydrophobicContact CG1-CD1 4.46Å; V13-L15 HydrophobicContact CG1-CG 3.99Å; V13-L15 PolarHBondContact O-N 2.99Å; L15-S17 PolarHBondContact O-N 2.94Å; L15-V19 HydrophobicContact CB-CB 4.46Å; L15-V19 HydrophobicContact CD2-CB 3.77Å; L15-V19 HydrophobicContact CD2-CG1 3.33Å; L15-F20 HydrophobicContact CB-CB 4.18Å
16	P	36.2	Very low	34.2	Very low	85 Å²	85	83.5 Å²	83.5	55%	0.552	50%	0.5	S	S	*	.			trans	-51.9	142.8	166.1	-20	29.2	0	0	0	109.3	A18 V19 F20	P16-A18 PolarHBondContact O-N 3.36Å; P16-V19 HydrophobicContact CB-CG2 4.09Å; P16-V19 HydrophobicContact CG-CG2 3.95Å; P16-V19 WeakPolarHBondContact O-CA 3.17Å; P16-V19 PolarHBondContact O-N 3.45Å; P16-F20 PolarHBondContact O-N 3.27Å
17	S	38.9	Very low	34.9	Very low	72 Å²	72	82.3 Å²	82.3	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-50.8	-31	-174.9	57.1	0	0	0	0	113.9	L15 S21	L15-S17 PolarHBondContact O-N 2.94Å; S17-S21 WeakPolarHBondContact O-CB 3.44Å; S17-S21 PolarHBondContact O-N 2.92Å; S17-S21 PolarHBondContact O-OG 3.31Å
18	A	30.8	Very low	35.4	Very low	71 Å²	71	79.2 Å²	79.2	59%	0.587	47%	0.466	S	S	*	.	H	α-helix	trans	-67.6	-41.4	174.2	0	0	0	0	0	113.3	P16 S21 F22	P16-A18 PolarHBondContact O-N 3.36Å; A18-S21 PolarHBondContact O-N 2.83Å; A18-F22 WeakPolarHBondContact O-CB 3.42Å; A18-F22 PolarHBondContact O-N 2.99Å
19	V	36.7	Very low	35.7	Very low	59 Å²	59	78 Å²	78	36%	0.358	46%	0.459	S	S	.	.	H	α-helix	trans	-74.2	-36.8	180	-166.4	0	0	0	0	110.6	L15 P16 F22 L23	L15-V19 HydrophobicContact CB-CB 4.46Å; L15-V19 HydrophobicContact CD2-CB 3.77Å; L15-V19 HydrophobicContact CD2-CG1 3.33Å; P16-V19 HydrophobicContact CB-CG2 4.09Å; P16-V19 HydrophobicContact CG-CG2 3.95Å; P16-V19 WeakPolarHBondContact O-CA 3.17Å; P16-V19 PolarHBondContact O-N 3.45Å; V19-F22 PolarHBondContact O-N 2.85Å; V19-L23 HydrophobicContact CG1-CD1 3.99Å; V19-L23 PolarHBondContact O-N 2.84Å
20	F	41	Very low	36.1	Very low	27 Å²	27	74.8 Å²	74.8	12%	0.118	46%	0.455	C	S	.	.	H	α-helix	trans	-63.2	-44.8	172.7	-176.6	-99.7	0	0	0	111.4	L15 P16 F22 L23 F24 I44 L48 M50 F62	L15-F20 HydrophobicContact CB-CB 4.18Å; P16-F20 PolarHBondContact O-N 3.27Å; F20-F22 VanDerWaalsContact C-N 3.28Å; F20-F22 PolarHBondContact O-N 3.32Å; F20-L23 PolarHBondContact O-N 3.29Å; F20-F24 HydrophobicContact CE1-CB 4.2Å; F20-F24 HydrophobicContact CE1-CD2 4.36Å; F20-F24 HydrophobicContact CE1-CG 4.38Å; F20-F24 HydrophobicContact CZ-CB 4.24Å; F20-F24 HydrophobicContact CZ-CD2 4.1Å; F20-F24 HydrophobicContact CZ-CG 4.45Å; F20-F24 WeakPolarHBondContact O-CB 3.44Å; F20-F24 PolarHBondContact O-N 3.48Å; F20-I44 HydrophobicContact CD1-CD1 4.16Å; F20-I44 HydrophobicContact CE1-CD1 3.6Å; F20-L48 HydrophobicContact CE1-CD1 4.45Å; F20-M50 HydrophobicContact CD1-CE 4.44Å; F20-M50 HydrophobicContact CD2-CE 3.8Å; F20-M50 HydrophobicContact CD2-SD 4.35Å; F20-M50 HydrophobicContact CE1-CE 3.77Å; F20-M50 HydrophobicContact CE2-CE 3.04Å; F20-M50 HydrophobicContact CE2-SD 3.65Å; F20-M50 HydrophobicContact CG-CE 4.46Å; F20-M50 HydrophobicContact CZ-CE 3.05Å; F20-M50 HydrophobicContact CZ-SD 4.18Å; F20-F62 HydrophobicContact CE2-CE1 4.44Å; F20-F62 HydrophobicContact CZ-CD1 4.29Å; F20-F62 AromaticContact CZ-CE1 3.78Å; F20-F62 HydrophobicContact CZ-CE1 3.78Å; F20-F62 HydrophobicContact CZ-CZ 4.28Å
21	S	39.5	Very low	36.4	Very low	48 Å²	48	74 Å²	74	34%	0.336	45%	0.454	S	S	.	.	H	α-helix	trans	-60.1	-39.4	175.1	-58	0	0	0	0	111.6	S17 A18 C25	S17-S21 WeakPolarHBondContact O-CB 3.44Å; S17-S21 PolarHBondContact O-N 2.92Å; S17-S21 PolarHBondContact O-OG 3.31Å; A18-S21 PolarHBondContact O-N 2.83Å; S21-C25 VanDerWaalsContact O-CB 3.28Å; S21-C25 WeakPolarHBondContact O-CB 3.48Å; S21-C25 PolarHBondContact O-N 3.04Å; S21-C25 PolarHBondContact O-SG 3.28Å
22	F	35.9	Very low	36.6	Very low	143 Å²	143	77.8 Å²	77.8	63%	0.627	46%	0.46	S	S	*	.	H	α-helix	trans	-70.5	-43.6	178.6	-169.7	-92.3	0	0	0	113.6	A18 V19 F20 C25 T26	A18-F22 WeakPolarHBondContact O-CB 3.42Å; A18-F22 PolarHBondContact O-N 2.99Å; V19-F22 PolarHBondContact O-N 2.85Å; F20-F22 VanDerWaalsContact C-N 3.28Å; F20-F22 PolarHBondContact O-N 3.32Å; F22-C25 PolarHBondContact O-N 2.9Å; F22-T26 PolarHBondContact O-N 3.4Å; F22-T26 PolarHBondContact O-OG1 3.46Å
23	L	42.5	Very low	36.6	Very low	97 Å²	97	78.5 Å²	78.5	51%	0.508	47%	0.468	S	S	.	.	H	α-helix	trans	-67.1	-40.9	175	-105.1	89.4	0	0	0	111.2	V19 F20 T26 L27	V19-L23 HydrophobicContact CG1-CD1 3.99Å; V19-L23 PolarHBondContact O-N 2.84Å; F20-L23 PolarHBondContact O-N 3.29Å; L23-T26 PolarHBondContact O-N 3.46Å; L23-L27 VanDerWaalsContact O-CB 3.27Å; L23-L27 WeakPolarHBondContact O-CB 3.34Å; L23-L27 PolarHBondContact O-N 3.45Å
24	F	45.3	Very low	36.6	Very low	31 Å²	31	76.6 Å²	76.6	14%	0.136	45%	0.454	C	S	.	.	H	α-helix	trans	-61.6	-44.8	175.1	-177.5	-99.6	0	0	0	110.9	F20 T26 L27 V28 L60 F62	F20-F24 HydrophobicContact CE1-CB 4.2Å; F20-F24 HydrophobicContact CE1-CD2 4.36Å; F20-F24 HydrophobicContact CE1-CG 4.38Å; F20-F24 HydrophobicContact CZ-CB 4.24Å; F20-F24 HydrophobicContact CZ-CD2 4.1Å; F20-F24 HydrophobicContact CZ-CG 4.45Å; F20-F24 WeakPolarHBondContact O-CB 3.44Å; F20-F24 PolarHBondContact O-N 3.48Å; F24-T26 PolarHBondContact O-N 3.4Å; F24-L27 PolarHBondContact O-N 3.32Å; F24-V28 HydrophobicContact CD1-CG2 4.28Å; F24-V28 HydrophobicContact CD2-CG2 4.2Å; F24-V28 HydrophobicContact CE1-CG2 4.04Å; F24-V28 HydrophobicContact CE2-CG2 3.93Å; F24-V28 HydrophobicContact CG-CG2 4.36Å; F24-V28 HydrophobicContact CZ-CG2 3.87Å; F24-V28 VanDerWaalsContact O-CB 3.24Å; F24-V28 WeakPolarHBondContact O-CB 3.36Å; F24-V28 WeakPolarHBondContact O-CG2 3.43Å; F24-V28 PolarHBondContact O-N 3.22Å; F24-L60 HydrophobicContact CE2-CD2 3.82Å; F24-F62 HydrophobicContact CD2-CE2 4.31Å; F24-F62 AromaticContact CD2-CZ 3.71Å; F24-F62 HydrophobicContact CD2-CZ 3.71Å; F24-F62 AromaticContact CE2-CE2 3.58Å; F24-F62 HydrophobicContact CE2-CE2 3.58Å; F24-F62 AromaticContact CE2-CZ 3.4Å; F24-F62 HydrophobicContact CE2-CZ 3.4Å; F24-F62 HydrophobicContact CZ-CE2 4.39Å
25	C	38.2	Very low	36.5	Very low	36 Å²	36	78.3 Å²	78.3	24%	0.243	46%	0.464	C	S	.	.	H	α-helix	trans	-56.7	-50.5	171.9	-78.6	0	0	0	0	111.3	S21 F22 L27 V28 S29 L39	S21-C25 VanDerWaalsContact O-CB 3.28Å; S21-C25 WeakPolarHBondContact O-CB 3.48Å; S21-C25 PolarHBondContact O-N 3.04Å; S21-C25 PolarHBondContact O-SG 3.28Å; F22-C25 PolarHBondContact O-N 2.9Å; C25-L27 VanDerWaalsContact C-N 3.35Å; C25-L27 PolarHBondContact O-N 2.92Å; C25-V28 PolarHBondContact O-N 3.39Å; C25-S29 WeakPolarHBondContact O-CB 3.27Å; C25-S29 PolarHBondContact O-N 3.1Å; C25-S29 PolarHBondContact O-OG 2.87Å; C25-L39 WeakPolarHBondContact SG-CD2 3.23Å
26	T	38	Very low	36.3	Very low	76 Å²	76	83.8 Å²	83.8	47%	0.466	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-37.6	-177.4	-47.5	0	0	0	0	112.5	F22 L23 F24 S30	F22-T26 PolarHBondContact O-N 3.4Å; F22-T26 PolarHBondContact O-OG1 3.46Å; L23-T26 PolarHBondContact O-N 3.46Å; F24-T26 PolarHBondContact O-N 3.4Å; T26-S30 VanDerWaalsContact O-CB 3.32Å; T26-S30 WeakPolarHBondContact O-CB 3.35Å; T26-S30 PolarHBondContact O-N 2.86Å; T26-S30 PolarHBondContact O-OG 2.93Å
27	L	40.5	Very low	36	Very low	87 Å²	87	83 Å²	83	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-73.2	-38.8	-179.4	-155.2	82.4	0	0	0	112.4	L23 F24 C25 S30 S31 F55	L23-L27 VanDerWaalsContact O-CB 3.27Å; L23-L27 WeakPolarHBondContact O-CB 3.34Å; L23-L27 PolarHBondContact O-N 3.45Å; F24-L27 PolarHBondContact O-N 3.32Å; C25-L27 VanDerWaalsContact C-N 3.35Å; C25-L27 PolarHBondContact O-N 2.92Å; L27-S30 WeakPolarHBondContact CA-OG 3.42Å; L27-S30 PolarHBondContact O-OG 3.45Å; L27-S30 VanDerWaalsContact O-OG 3.1Å; L27-S31 PolarHBondContact O-N 3.15Å; L27-S31 PolarHBondContact O-OG 3.06Å; L27-F55 HydrophobicContact CD2-CZ 3.92Å
28	V	39	Very low	35.6	Very low	20 Å²	20	84.1 Å²	84.1	12%	0.121	48%	0.476	C	S	.	.	H	α-helix	trans	-69.1	-52.9	174.2	174.9	0	0	0	0	107.8	F24 C25 S30 S31 L34	F24-V28 HydrophobicContact CD1-CG2 4.28Å; F24-V28 HydrophobicContact CD2-CG2 4.2Å; F24-V28 HydrophobicContact CE1-CG2 4.04Å; F24-V28 HydrophobicContact CE2-CG2 3.93Å; F24-V28 HydrophobicContact CG-CG2 4.36Å; F24-V28 HydrophobicContact CZ-CG2 3.87Å; F24-V28 VanDerWaalsContact O-CB 3.24Å; F24-V28 WeakPolarHBondContact O-CB 3.36Å; F24-V28 WeakPolarHBondContact O-CG2 3.43Å; F24-V28 PolarHBondContact O-N 3.22Å; C25-V28 PolarHBondContact O-N 3.39Å; V28-S30 PolarHBondContact O-N 3.37Å; V28-S30 VanDerWaalsContact O-N 3.11Å; V28-S31 WeakPolarHBondContact O-CA 3.21Å; V28-S31 PolarHBondContact O-N 3.49Å; V28-L34 HydrophobicContact CB-CD1 4.22Å; V28-L34 HydrophobicContact CG1-CD1 3.41Å; V28-L34 VanDerWaalsContact CG1-CD1 3.41Å; V28-L34 HydrophobicContact CG1-CD2 3.75Å; V28-L34 HydrophobicContact CG1-CG 4.25Å; V28-L34 WeakPolarHBondContact O-CD1 3.43Å
29	S	33	Very low	35.5	Very low	81 Å²	81	85 Å²	85	57%	0.566	47%	0.47	S	S	*	.	H	α-helix	trans	-57	-27.5	178	-63.3	0	0	0	0	115.4	C25 L34	C25-S29 WeakPolarHBondContact O-CB 3.27Å; C25-S29 PolarHBondContact O-N 3.1Å; C25-S29 PolarHBondContact O-OG 2.87Å; S29-L34 VanDerWaalsContact CA-CD1 3.4Å
30	S	33.9	Very low	35	Very low	81 Å²	81	87.9 Å²	87.9	57%	0.566	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-12	175.8	49	0	0	0	0	113.8	T26 L27 V28	T26-S30 VanDerWaalsContact O-CB 3.32Å; T26-S30 WeakPolarHBondContact O-CB 3.35Å; T26-S30 PolarHBondContact O-N 2.86Å; T26-S30 PolarHBondContact O-OG 2.93Å; L27-S30 WeakPolarHBondContact CA-OG 3.42Å; L27-S30 PolarHBondContact O-OG 3.45Å; L27-S30 VanDerWaalsContact O-OG 3.1Å; V28-S30 PolarHBondContact O-N 3.37Å; V28-S30 VanDerWaalsContact O-N 3.11Å
31	S	34.4	Very low	34.4	Very low	73 Å²	73	91.9 Å²	91.9	51%	0.51	52%	0.516	S	S	.	.	S	Bend	trans	-100.2	81.3	176	-54.8	0	0	0	0	109	L27 V28	L27-S31 PolarHBondContact O-N 3.15Å; L27-S31 PolarHBondContact O-OG 3.06Å; V28-S31 WeakPolarHBondContact O-CA 3.21Å; V28-S31 PolarHBondContact O-N 3.49Å
32	F	33.2	Very low	33.9	Very low	205 Å²	205	92 Å²	92	90%	0.899	52%	0.516	S	S	*	.	S	Bend	trans	34.9	107.9	160.9	-63	-86.6	0	0	0	118.4
33	G	29.5	Very low	33.5	Very low	64 Å²	64	88.5 Å²	88.5	66%	0.66	52%	0.52	S	S	*	.			trans	101.8	33.4	150.5	0	0	0	0	0	118.7
34	L	31.4	Very low	33.1	Very low	53 Å²	53	87.1 Å²	87.1	28%	0.277	51%	0.513	S	S	.	.			trans	-99	32.3	-170.9	-69.1	153.8	0	0	0	115.8	V28 S29 E36 F37	V28-L34 HydrophobicContact CB-CD1 4.22Å; V28-L34 HydrophobicContact CG1-CD1 3.41Å; V28-L34 VanDerWaalsContact CG1-CD1 3.41Å; V28-L34 HydrophobicContact CG1-CD2 3.75Å; V28-L34 HydrophobicContact CG1-CG 4.25Å; V28-L34 WeakPolarHBondContact O-CD1 3.43Å; S29-L34 VanDerWaalsContact CA-CD1 3.4Å; L34-E36 PolarHBondContact O-N 2.7Å; L34-F37 HydrophobicContact CB-CB 4.12Å; L34-F37 HydrophobicContact CD2-CB 3.28Å; L34-F37 HydrophobicContact CD2-CD1 4.47Å; L34-F37 HydrophobicContact CD2-CD2 3.76Å; L34-F37 HydrophobicContact CD2-CG 3.6Å; L34-F37 HydrophobicContact CG-CB 4.27Å; L34-F37 PolarHBondContact O-N 3.38Å
35	D	31.6	Very low	32.4	Very low	177 Å²	177	97.8 Å²	97.8	95%	0.947	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-13.6	169	-73.5	-25.5	0	0	0	112
36	E	32.8	Very low	32	Very low	174 Å²	174	98 Å²	98	81%	0.813	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-0.3	179.8	-76.6	-174.7	153	0	0	115.4	L34 N38	L34-E36 PolarHBondContact O-N 2.7Å; E36-N38 PolarHBondContact O-N 2.91Å; E36-N38 VanDerWaalsContact O-N 3.09Å
37	F	29.9	Very low	31.6	Very low	69 Å²	69	100 Å²	100	30%	0.303	57%	0.573	S	S	.	*			trans	-85.8	93.1	-176	-157.9	-94.5	0	0	0	112.1	L34 L39	L34-F37 HydrophobicContact CB-CB 4.12Å; L34-F37 HydrophobicContact CD2-CB 3.28Å; L34-F37 HydrophobicContact CD2-CD1 4.47Å; L34-F37 HydrophobicContact CD2-CD2 3.76Å; L34-F37 HydrophobicContact CD2-CG 3.6Å; L34-F37 HydrophobicContact CG-CB 4.27Å; L34-F37 PolarHBondContact O-N 3.38Å; F37-L39 HydrophobicContact CD1-CG 4.19Å; F37-L39 HydrophobicContact CE1-CG 4.47Å; F37-L39 PolarHBondContact O-N 3.26Å
38	N	29.7	Very low	31.4	Very low	94 Å²	94	98.4 Å²	98.4	50%	0.503	56%	0.564	S	S	.	*			trans	-77.8	93.1	178.3	-167.5	-7.4	0	0	0	112.1	E36 T40 T41	E36-N38 PolarHBondContact O-N 2.91Å; E36-N38 VanDerWaalsContact O-N 3.09Å; N38-T40 PolarHBondContact ND2-OG1 3.02Å; N38-T40 PolarHBondContact O-N 3.36Å; N38-T40 WeakPolarHBondContact OD1-CB 3.33Å; N38-T40 WeakPolarHBondContact OD1-CG2 3.42Å; N38-T40 PolarHBondContact OD1-N 2.74Å; N38-T40 VanDerWaalsContact OD1-N 3.14Å; N38-T40 PolarHBondContact OD1-OG1 3.13Å; N38-T41 PolarHBondContact O-N 3.45Å; N38-T41 VanDerWaalsContact O-N 3.15Å; N38-T41 PolarHBondContact O-OG1 2.85Å
39	L	28.8	Very low	31.1	Very low	89 Å²	89	103.5 Å²	103.5	47%	0.466	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.5	-15.1	174.9	-87.9	141.2	0	0	0	115.2	C25 F37 T41	C25-L39 WeakPolarHBondContact SG-CD2 3.23Å; F37-L39 HydrophobicContact CD1-CG 4.19Å; F37-L39 HydrophobicContact CE1-CG 4.47Å; F37-L39 PolarHBondContact O-N 3.26Å; L39-T41 PolarHBondContact O-N 3.31Å
40	T	26.9	Very low	31.3	Very low	120 Å²	120	101.2 Å²	101.2	74%	0.736	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-19.7	176.2	61	0	0	0	0	113.5	N38	N38-T40 PolarHBondContact ND2-OG1 3.02Å; N38-T40 PolarHBondContact O-N 3.36Å; N38-T40 WeakPolarHBondContact OD1-CB 3.33Å; N38-T40 WeakPolarHBondContact OD1-CG2 3.42Å; N38-T40 PolarHBondContact OD1-N 2.74Å; N38-T40 VanDerWaalsContact OD1-N 3.14Å; N38-T40 PolarHBondContact OD1-OG1 3.13Å
41	T	28.4	Very low	31.3	Very low	112 Å²	112	102.4 Å²	102.4	69%	0.687	56%	0.562	S	S	*	*	S	Bend	trans	-98.3	-15.7	-177.9	60.8	0	0	0	0	113.8	N38 L39	N38-T41 PolarHBondContact O-N 3.45Å; N38-T41 VanDerWaalsContact O-N 3.15Å; N38-T41 PolarHBondContact O-OG1 2.85Å; L39-T41 PolarHBondContact O-N 3.31Å
42	C	28.6	Very low	31.4	Very low	50 Å²	50	103.1 Å²	103.1	34%	0.338	56%	0.556	S	S	.	*			trans	-110.5	79.5	-177.3	-76.1	0	0	0	0	110.9
43	G	28.1	Very low	31.6	Very low	70 Å²	70	95.8 Å²	95.8	72%	0.722	53%	0.526	S	S	*	.			trans	-91.9	120.1	173	0	0	0	0	0	112.3
44	I	34.1	Very low	32	Very low	68 Å²	68	97.6 Å²	97.6	35%	0.349	52%	0.516	S	S	.	.			trans	-87.3	113.5	167.5	-60.2	177.7	0	0	0	108.1	F20 L48	F20-I44 HydrophobicContact CD1-CD1 4.16Å; F20-I44 HydrophobicContact CE1-CD1 3.6Å; I44-L48 HydrophobicContact CG2-CD1 3.61Å
45	R	30.1	Very low	32.5	Very low	254 Å²	254	101.1 Å²	101.1	96%	0.958	53%	0.529	S	S	*	.			trans	-114.3	101	-179	-145.3	-179.8	-173.5	-136.4	2.5	109
46	G	29.2	Very low	33	Very low	42 Å²	42	95 Å²	95	43%	0.433	50%	0.496	S	S	.	.	S	Bend	trans	151.5	161.3	173.3	0	0	0	0	0	115.1	L48	G46-L48 PolarHBondContact O-N 2.63Å
47	T	31.3	Very low	33.3	Very low	118 Å²	118	95.7 Å²	95.7	72%	0.724	50%	0.5	S	S	*	.			trans	-79	100.2	170.2	-16.1	0	0	0	0	108.5	K49	T47-K49 PolarHBondContact O-N 3.33Å
48	L	35.5	Very low	34	Very low	52 Å²	52	96 Å²	96	27%	0.272	50%	0.504	S	S	.	.			trans	-87.9	106.2	177	-68.4	168.8	0	0	0	109	F20 I44 G46 M50	F20-L48 HydrophobicContact CE1-CD1 4.45Å; I44-L48 HydrophobicContact CG2-CD1 3.61Å; G46-L48 PolarHBondContact O-N 2.63Å; L48-M50 HydrophobicContact CB-CE 4.44Å; L48-M50 HydrophobicContact CB-CG 4.44Å; L48-M50 HydrophobicContact CD1-CE 4.1Å; L48-M50 PolarHBondContact O-N 3.36Å; L48-M50 VanDerWaalsContact O-N 3.13Å
49	K	33.7	Very low	34.5	Very low	127 Å²	127	92 Å²	92	55%	0.552	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	95.6	160.3	-168.1	174.4	-175.5	177.2	0	107.6	T47 Q51	T47-K49 PolarHBondContact O-N 3.33Å; K49-Q51 PolarHBondContact O-N 3.08Å
50	M	37.2	Very low	35.2	Very low	34 Å²	34	88.2 Å²	88.2	17%	0.167	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	119.1	175.4	-66.9	-152.8	170.9	0	0	109.8	G12 F20 L48 F62	G12-M50 VanDerWaalsContact CA-O 3.23Å; G12-M50 WeakPolarHBondContact CA-O 3.18Å; F20-M50 HydrophobicContact CD1-CE 4.44Å; F20-M50 HydrophobicContact CD2-CE 3.8Å; F20-M50 HydrophobicContact CD2-SD 4.35Å; F20-M50 HydrophobicContact CE1-CE 3.77Å; F20-M50 HydrophobicContact CE2-CE 3.04Å; F20-M50 HydrophobicContact CE2-SD 3.65Å; F20-M50 HydrophobicContact CG-CE 4.46Å; F20-M50 HydrophobicContact CZ-CE 3.05Å; F20-M50 HydrophobicContact CZ-SD 4.18Å; L48-M50 HydrophobicContact CB-CE 4.44Å; L48-M50 HydrophobicContact CB-CG 4.44Å; L48-M50 HydrophobicContact CD1-CE 4.1Å; L48-M50 PolarHBondContact O-N 3.36Å; L48-M50 VanDerWaalsContact O-N 3.13Å; M50-F62 HydrophobicContact CE-CD1 3.41Å; M50-F62 VanDerWaalsContact CE-CD1 3.41Å; M50-F62 HydrophobicContact CE-CE1 3.83Å; M50-F62 HydrophobicContact CE-CG 4.38Å; M50-F62 HydrophobicContact SD-CD1 4.09Å; M50-F62 HydrophobicContact SD-CE1 4.38Å
51	Q	33.5	Very low	36	Very low	105 Å²	105	83.4 Å²	83.4	49%	0.491	43%	0.433	S	S	.	.			trans	-98.8	-33.3	174	-68.1	-174.4	-20.2	0	0	111.8	K49	K49-Q51 PolarHBondContact O-N 3.08Å
52	F	35.4	Very low	36.9	Very low	88 Å²	88	79.4 Å²	79.4	39%	0.386	41%	0.406	S	S	.	.			trans	-147.1	126.2	-176.2	-62.7	-73.5	0	0	0	111.2	F9 L63	F9-F52 AromaticContact CD1-CD1 3.88Å; F9-F52 HydrophobicContact CD1-CD1 3.88Å; F9-F52 AromaticContact CD1-CE1 3.91Å; F9-F52 HydrophobicContact CD1-CE1 3.91Å; F9-F52 AromaticContact CE1-CD1 3.54Å; F9-F52 HydrophobicContact CE1-CD1 3.54Å; F9-F52 AromaticContact CE1-CE1 3.52Å; F9-F52 HydrophobicContact CE1-CE1 3.52Å; F52-L63 HydrophobicContact CB-CD1 4.2Å
53	L	38.1	Very low	37.6	Very low	51 Å²	51	78.5 Å²	78.5	27%	0.267	40%	0.398	S	S	.	.			trans	-113	113.8	165	-168.2	82.3	0	0	0	106.2	F55 L60 F62	L53-F55 HydrophobicContact CD2-CD2 4.2Å; L53-F55 HydrophobicContact CD2-CE2 3.41Å; L53-F55 VanDerWaalsContact CD2-CE2 3.41Å; L53-F55 HydrophobicContact CD2-CZ 4.01Å; L53-F55 HydrophobicContact CG-CE2 4.1Å; L53-L60 HydrophobicContact CD1-CD1 4.1Å; L53-F62 HydrophobicContact CD1-CD1 3.95Å; L53-F62 HydrophobicContact CD1-CE1 3.55Å; L53-F62 HydrophobicContact CD1-CZ 4.38Å
54	K	38.3	Very low	38.1	Very low	103 Å²	103	75.6 Å²	75.6	45%	0.448	37%	0.368	S	S	.	.			trans	-115.6	117	172.9	-168.2	175.5	-177.1	-177.7	0	108.3
55	F	41.8	Very low	38.1	Very low	127 Å²	127	75.1 Å²	75.1	56%	0.557	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	123	166.6	-76.3	-86.1	0	0	0	108.2	L27 L53 L60	L27-F55 HydrophobicContact CD2-CZ 3.92Å; L53-F55 HydrophobicContact CD2-CD2 4.2Å; L53-F55 HydrophobicContact CD2-CE2 3.41Å; L53-F55 VanDerWaalsContact CD2-CE2 3.41Å; L53-F55 HydrophobicContact CD2-CZ 4.01Å; L53-F55 HydrophobicContact CG-CE2 4.1Å; F55-L60 HydrophobicContact CD1-CD1 4.4Å; F55-L60 HydrophobicContact CE1-CD1 3.82Å; F55-L60 HydrophobicContact CZ-CD1 4.04Å
56	L	41.6	Very low	38.4	Very low	47 Å²	47	65.1 Å²	65.1	25%	0.246	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	86.3	175.1	-156.7	90.1	0	0	0	108.7	N58 T59 N112	L56-N58 PolarHBondContact O-N 3.17Å; L56-T59 PolarHBondContact N-O 3.11Å; L56-T59 PolarHBondContact O-N 3.36Å; L56-N112 WeakPolarHBondContact CD2-ND2 3.41Å
57	E	39.8	Very low	38.5	Very low	190 Å²	190	70.1 Å²	70.1	89%	0.888	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	-19.2	173.6	-73.7	-177	163.6	0	0	120
58	N	43.4	Very low	38.7	Very low	75 Å²	75	71.5 Å²	71.5	40%	0.401	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-173.2	0	-174.7	-82.1	-39.2	0	0	0	111.8	L56 M77	L56-N58 PolarHBondContact O-N 3.17Å; N58-M77 CarbonylContact C-O 3.59Å; N58-M77 WeakPolarHBondContact CB-O 3.47Å; N58-M77 CarbonylContact O-C 3.53Å; N58-M77 WeakPolarHBondContact O-CA 3.44Å; N58-M77 WeakPolarHBondContact O-CB 3.39Å; N58-M77 PolarHBondContact O-N 3.49Å; N58-M77 VanDerWaalsContact O-N 3.13Å
59	T	40.6	Very low	38.6	Very low	9 Å²	9	71.2 Å²	71.2	6%	0.055	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.6	-174.8	-55.1	0	0	0	0	111.1	L56 I61 V76 L108	L56-T59 PolarHBondContact N-O 3.11Å; L56-T59 PolarHBondContact O-N 3.36Å; T59-I61 HydrophobicContact CG2-CD1 4.49Å; T59-I61 HydrophobicContact CG2-CG1 3.92Å; T59-V76 HydrophobicContact CG2-CB 4.46Å; T59-V76 HydrophobicContact CG2-CG2 4.03Å; T59-L108 HydrophobicContact CG2-CD2 4.27Å
60	L	43.4	Very low	38.8	Very low	11 Å²	11	66 Å²	66	6%	0.058	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	113.7	176.9	-171.9	67.1	0	0	0	109.4	F24 L53 F55 F62 L75	F24-L60 HydrophobicContact CE2-CD2 3.82Å; L53-L60 HydrophobicContact CD1-CD1 4.1Å; F55-L60 HydrophobicContact CD1-CD1 4.4Å; F55-L60 HydrophobicContact CE1-CD1 3.82Å; F55-L60 HydrophobicContact CZ-CD1 4.04Å; L60-F62 HydrophobicContact CD1-CE2 4.37Å; L60-F62 HydrophobicContact CD1-CZ 3.95Å; L60-F62 HydrophobicContact CD2-CE2 3.36Å; L60-F62 HydrophobicContact CD2-CZ 3.37Å; L60-F62 HydrophobicContact CG-CD2 4.3Å; L60-F62 HydrophobicContact CG-CE1 4.38Å; L60-F62 HydrophobicContact CG-CE2 3.44Å; L60-F62 VanDerWaalsContact CG-CE2 3.44Å; L60-F62 HydrophobicContact CG-CZ 3.5Å; L60-F62 VanDerWaalsContact CG-CZ 3.5Å; L60-L75 CarbonylContact C-O 3.37Å; L60-L75 HydrophobicContact CB-CB 4.32Å; L60-L75 HydrophobicContact CD2-CD2 4.08Å; L60-L75 PolarHBondContact N-O 3.43Å; L60-L75 CarbonylContact O-C 3.55Å; L60-L75 WeakPolarHBondContact O-CA 3.35Å; L60-L75 WeakPolarHBondContact O-CB 3.46Å; L60-L75 PolarHBondContact O-N 3.34Å
61	I	43.7	Very low	38.9	Very low	18 Å²	18	69.2 Å²	69.2	9%	0.092	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.7	-176.3	-51.5	165.3	0	0	0	108.9	T59 I74 L104 L108	T59-I61 HydrophobicContact CG2-CD1 4.49Å; T59-I61 HydrophobicContact CG2-CG1 3.92Å; I61-I74 HydrophobicContact CG1-CG2 4.44Å; I61-L104 HydrophobicContact CG2-CD2 4.44Å; I61-L108 HydrophobicContact CD1-CD1 3.38Å; I61-L108 HydrophobicContact CG1-CD1 4.08Å
62	F	46.6	Very low	39.3	Very low	28 Å²	28	65.1 Å²	65.1	12%	0.123	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.8	174.8	-64.3	-71.2	0	0	0	111.7	F20 F24 M50 L53 L60 G73	F20-F62 HydrophobicContact CE2-CE1 4.44Å; F20-F62 HydrophobicContact CZ-CD1 4.29Å; F20-F62 AromaticContact CZ-CE1 3.78Å; F20-F62 HydrophobicContact CZ-CE1 3.78Å; F20-F62 HydrophobicContact CZ-CZ 4.28Å; F24-F62 HydrophobicContact CD2-CE2 4.31Å; F24-F62 AromaticContact CD2-CZ 3.71Å; F24-F62 HydrophobicContact CD2-CZ 3.71Å; F24-F62 AromaticContact CE2-CE2 3.58Å; F24-F62 HydrophobicContact CE2-CE2 3.58Å; F24-F62 AromaticContact CE2-CZ 3.4Å; F24-F62 HydrophobicContact CE2-CZ 3.4Å; F24-F62 HydrophobicContact CZ-CE2 4.39Å; M50-F62 HydrophobicContact CE-CD1 3.41Å; M50-F62 VanDerWaalsContact CE-CD1 3.41Å; M50-F62 HydrophobicContact CE-CE1 3.83Å; M50-F62 HydrophobicContact CE-CG 4.38Å; M50-F62 HydrophobicContact SD-CD1 4.09Å; M50-F62 HydrophobicContact SD-CE1 4.38Å; L53-F62 HydrophobicContact CD1-CD1 3.95Å; L53-F62 HydrophobicContact CD1-CE1 3.55Å; L53-F62 HydrophobicContact CD1-CZ 4.38Å; L60-F62 HydrophobicContact CD1-CE2 4.37Å; L60-F62 HydrophobicContact CD1-CZ 3.95Å; L60-F62 HydrophobicContact CD2-CE2 3.36Å; L60-F62 HydrophobicContact CD2-CZ 3.37Å; L60-F62 HydrophobicContact CG-CD2 4.3Å; L60-F62 HydrophobicContact CG-CE1 4.38Å; L60-F62 HydrophobicContact CG-CE2 3.44Å; L60-F62 VanDerWaalsContact CG-CE2 3.44Å; L60-F62 HydrophobicContact CG-CZ 3.5Å; L60-F62 VanDerWaalsContact CG-CZ 3.5Å; F62-G73 CarbonylContact C-O 3.59Å; F62-G73 WeakPolarHBondContact CA-O 3.39Å; F62-G73 PolarHBondContact N-O 2.97Å; F62-G73 PolarHBondContact O-N 2.87Å
63	L	43.6	Very low	39.6	Very low	32 Å²	32	62.4 Å²	62.4	17%	0.168	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	114.6	174	-70.2	142.7	0	0	0	108.8	F52 I72 L101	F52-L63 HydrophobicContact CB-CD1 4.2Å; L63-I72 HydrophobicContact CD2-CD1 3.75Å; L63-I72 HydrophobicContact CD2-CG1 3.95Å; L63-I72 HydrophobicContact CD2-CG2 4.16Å; L63-L101 HydrophobicContact CD1-CD1 3.5Å; L63-L101 VanDerWaalsContact CD1-CD1 3.5Å; L63-L101 HydrophobicContact CD2-CD1 3.91Å; L63-L101 HydrophobicContact CG-CD1 4.36Å
64	G	39.2	Very low	39.9	Very low	9 Å²	9	60.4 Å²	60.4	9%	0.093	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.9	176.7	0	0	0	0	0	112	H71	G64-H71 PolarHBondContact N-O 3.08Å; G64-H71 PolarHBondContact O-N 2.86Å; G64-H71 VanDerWaalsContact O-N 3.08Å
65	S	34.5	Very low	40.1	Very low	58 Å²	58	56.7 Å²	56.7	41%	0.406	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113.9	167.5	-177.3	0	0	0	0	109.9
66	G	35.6	Very low	40.2	Very low	43 Å²	43	51.8 Å²	51.8	44%	0.443	29%	0.293	S	S	.	.			trans	-132.1	96.3	168.5	0	0	0	0	0	108
67	N	32.7	Very low	40.1	Very low	148 Å²	148	53.4 Å²	53.4	79%	0.791	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	109.4	170.7	-116.7	-3.4	0	0	0	117.3	T69	N67-T69 PolarHBondContact O-N 2.86Å
68	L	34.3	Very low	40	Very low	147 Å²	147	51.4 Å²	51.4	77%	0.77	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	-11.1	167.1	-70.4	159.1	0	0	0	119.3	Y94	L68-Y94 WeakPolarHBondContact O-CE1 3.46Å
69	T	34.1	Very low	39.8	Very low	46 Å²	46	54.2 Å²	54.2	28%	0.282	30%	0.304	S	S	.	.			trans	-137.1	94	169.5	45.9	0	0	0	0	109.5	N67 H71 Y94	N67-T69 PolarHBondContact O-N 2.86Å; T69-H71 PolarHBondContact O-CD2 3.29Å; T69-H71 PolarHBondContact O-N 3.23Å; T69-Y94 HydrophobicContact CG2-CE2 4.3Å; T69-Y94 WeakPolarHBondContact CG2-OH 3.41Å
70	A	37.1	Very low	39.6	Very low	17 Å²	17	57.4 Å²	57.4	14%	0.14	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-64	123.7	172.5	0	0	0	0	0	108.8	L93	A70-L93 HydrophobicContact CB-CB 4.42Å
71	H	39.2	Very low	39.3	Very low	102 Å²	102	63.6 Å²	63.6	47%	0.472	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.9	174	-73.2	-70.3	0	0	0	108.2	G64 T69	G64-H71 PolarHBondContact N-O 3.08Å; G64-H71 PolarHBondContact O-N 2.86Å; G64-H71 VanDerWaalsContact O-N 3.08Å; T69-H71 PolarHBondContact O-CD2 3.29Å; T69-H71 PolarHBondContact O-N 3.23Å
72	I	42.2	Very low	39.1	Very low	18 Å²	18	66.8 Å²	66.8	9%	0.092	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119.1	175.5	-56.5	-167.8	0	0	0	108.7	L63 I74 F89 L93 I100 L104	L63-I72 HydrophobicContact CD2-CD1 3.75Å; L63-I72 HydrophobicContact CD2-CG1 3.95Å; L63-I72 HydrophobicContact CD2-CG2 4.16Å; I72-I74 HydrophobicContact CG2-CD1 4.4Å; I72-I74 HydrophobicContact CG2-CG1 3.92Å; I72-F89 CarbonylContact O-C 3.43Å; I72-L93 HydrophobicContact CD1-CD1 3.21Å; I72-L93 HydrophobicContact CG1-CD1 3.76Å; I72-I100 HydrophobicContact CD1-CG2 4.31Å; I72-L104 HydrophobicContact CD1-CD2 4.44Å; I72-L104 HydrophobicContact CG2-CD2 3.85Å
73	G	41.7	Very low	38.7	Very low	31 Å²	31	70 Å²	70	32%	0.32	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.4	171.4	0	0	0	0	0	110	F62	F62-G73 CarbonylContact C-O 3.59Å; F62-G73 WeakPolarHBondContact CA-O 3.39Å; F62-G73 PolarHBondContact N-O 2.97Å; F62-G73 PolarHBondContact O-N 2.87Å
74	I	44	Very low	38.4	Very low	9 Å²	9	72.5 Å²	72.5	5%	0.046	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.4	176.3	-49.4	178.8	0	0	0	108.1	I61 I72 V76 F89 L104 L108	I61-I74 HydrophobicContact CG1-CG2 4.44Å; I72-I74 HydrophobicContact CG2-CD1 4.4Å; I72-I74 HydrophobicContact CG2-CG1 3.92Å; I74-V76 HydrophobicContact CG2-CG2 3.73Å; I74-F89 HydrophobicContact CB-CD2 4.2Å; I74-F89 HydrophobicContact CD1-CD2 3.67Å; I74-F89 HydrophobicContact CD1-CE2 3.89Å; I74-F89 HydrophobicContact CD1-CG 4.44Å; I74-F89 HydrophobicContact CG1-CD2 4.01Å; I74-L104 HydrophobicContact CD1-CD1 3.33Å; I74-L104 HydrophobicContact CD1-CD2 3.8Å; I74-L104 HydrophobicContact CD1-CG 3.84Å; I74-L104 HydrophobicContact CG1-CD2 4.34Å; I74-L108 HydrophobicContact CG2-CD2 4.11Å
75	L	43.7	Very low	38.3	Very low	26 Å²	26	79.3 Å²	79.3	14%	0.136	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	100.4	171.4	-175.8	70.2	0	0	0	108.5	L60 M77 I86	L60-L75 CarbonylContact C-O 3.37Å; L60-L75 HydrophobicContact CB-CB 4.32Å; L60-L75 HydrophobicContact CD2-CD2 4.08Å; L60-L75 PolarHBondContact N-O 3.43Å; L60-L75 CarbonylContact O-C 3.55Å; L60-L75 WeakPolarHBondContact O-CA 3.35Å; L60-L75 WeakPolarHBondContact O-CB 3.46Å; L60-L75 PolarHBondContact O-N 3.34Å; L75-M77 HydrophobicContact CD2-CG 4.22Å; L75-M77 HydrophobicContact CD2-SD 4.14Å; L75-M77 HydrophobicContact CG-CG 4.05Å; L75-I86 HydrophobicContact CD1-CB 4.39Å; L75-I86 HydrophobicContact CD1-CD1 4.48Å; L75-I86 HydrophobicContact CD1-CG1 3.87Å; L75-I86 HydrophobicContact CD1-CG2 4.12Å
76	V	43.2	Very low	38.6	Very low	23 Å²	23	81.5 Å²	81.5	14%	0.139	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	112.3	173.2	-172.9	0	0	0	0	108.1	T59 I74 L108	T59-V76 HydrophobicContact CG2-CB 4.46Å; T59-V76 HydrophobicContact CG2-CG2 4.03Å; I74-V76 HydrophobicContact CG2-CG2 3.73Å; V76-L108 HydrophobicContact CG2-CD2 4.35Å
77	M	39.2	Very low	38.7	Very low	81 Å²	81	84.5 Å²	84.5	40%	0.399	44%	0.443	S	S	.	.			trans	-102.1	94.3	173.9	-62.4	-169.5	-67	0	0	108.4	N58 L75 N79	N58-M77 CarbonylContact C-O 3.59Å; N58-M77 WeakPolarHBondContact CB-O 3.47Å; N58-M77 CarbonylContact O-C 3.53Å; N58-M77 WeakPolarHBondContact O-CA 3.44Å; N58-M77 WeakPolarHBondContact O-CB 3.39Å; N58-M77 PolarHBondContact O-N 3.49Å; N58-M77 VanDerWaalsContact O-N 3.13Å; L75-M77 HydrophobicContact CD2-CG 4.22Å; L75-M77 HydrophobicContact CD2-SD 4.14Å; L75-M77 HydrophobicContact CG-CG 4.05Å; M77-N79 PolarHBondContact O-N 2.93Å
78	K	38.1	Very low	39	Very low	148 Å²	148	87.2 Å²	87.2	64%	0.643	44%	0.442	S	S	*	.			trans	-65.6	137.3	170.5	-160.9	174.4	-179.1	-176.8	0	107.9	D80	K78-D80 PolarHBondContact O-N 2.94Å
79	N	38.5	Very low	39.1	Very low	135 Å²	135	84.7 Å²	84.7	72%	0.722	43%	0.425	S	S	*	.	S	Bend	trans	-66.9	29.5	-179.4	-153	13.6	0	0	0	113.8	M77	M77-N79 PolarHBondContact O-N 2.93Å
80	D	38.2	Very low	39.2	Very low	76 Å²	76	87.1 Å²	87.1	41%	0.406	44%	0.44	S	S	.	.			trans	-125	95.9	178.8	-169.2	-12.3	0	0	0	106.3	K78 S82 N83	K78-D80 PolarHBondContact O-N 2.94Å; D80-S82 PolarHBondContact O-N 3.11Å; D80-S82 PolarHBondContact OD1-OG 2.88Å; D80-N83 PolarHBondContact O-N 3.47Å
81	L	37	Very low	38.9	Very low	140 Å²	140	88.1 Å²	88.1	73%	0.733	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-18	-177.4	-101.6	87.1	0	0	0	113.1
82	S	37.7	Very low	38.4	Very low	86 Å²	86	85.2 Å²	85.2	60%	0.601	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-18.2	-179.6	70.4	0	0	0	0	114.9	D80	D80-S82 PolarHBondContact O-N 3.11Å; D80-S82 PolarHBondContact OD1-OG 2.88Å
83	N	39.3	Very low	38.1	Very low	94 Å²	94	87.1 Å²	87.1	50%	0.503	46%	0.459	S	S	.	.			trans	-140.3	35.3	-167.9	-87.7	-56.5	0	0	0	113.5	D80 R85	D80-N83 PolarHBondContact O-N 3.47Å; N83-R85 PolarHBondContact O-N 2.91Å
84	S	37.2	Very low	37.6	Very low	85 Å²	85	94.3 Å²	94.3	59%	0.594	48%	0.478	S	S	*	.			trans	-63.6	108.8	171.2	60.8	0	0	0	0	109.6
85	R	37.7	Very low	37	Very low	153 Å²	153	96.1 Å²	96.1	58%	0.577	50%	0.499	S	S	*	.			trans	-106.8	115.8	174.8	-70.7	-168.3	-176.4	-159.1	2.8	109.2	N83 W87	N83-R85 PolarHBondContact O-N 2.91Å; R85-W87 PolarHBondContact O-N 3.1Å
86	I	41	Very low	36.7	Very low	103 Å²	103	101.8 Å²	101.8	53%	0.528	53%	0.529	S	S	.	.			trans	-78.5	110.7	170	-56.7	177.7	0	0	0	107.7	L75	L75-I86 HydrophobicContact CD1-CB 4.39Å; L75-I86 HydrophobicContact CD1-CD1 4.48Å; L75-I86 HydrophobicContact CD1-CG1 3.87Å; L75-I86 HydrophobicContact CD1-CG2 4.12Å
87	W	37.5	Very low	36.5	Very low	107 Å²	107	105.5 Å²	105.5	41%	0.405	55%	0.552	S	S	.	*	B	Isolated β-bridge	trans	-98.3	102	174.1	-66.2	96.4	0	0	0	110	R85 F89 W111	R85-W87 PolarHBondContact O-N 3.1Å; W87-F89 HydrophobicContact CB-CE2 4.14Å; W87-F89 PolarHBondContact O-N 3.47Å; W87-W111 AromaticContact NE1-CH2 3.76Å
88	R	38.7	Very low	36.4	Very low	205 Å²	205	105.8 Å²	105.8	77%	0.774	56%	0.56	S	S	*	*			trans	-85.4	105.7	176.5	-167.9	-177.5	175.4	169.8	-3	109.9	T90	R88-T90 HydrophobicContact CG-CG2 4.05Å; R88-T90 PolarHBondContact O-N 3.36Å; R88-T90 VanDerWaalsContact O-N 3.17Å
89	F	35.7	Very low	36.4	Very low	94 Å²	94	104.4 Å²	104.4	41%	0.412	56%	0.56	S	S	.	*			trans	-81.7	86.4	170.1	-74.5	-87.2	0	0	0	110.7	I72 I74 W87 G91	I72-F89 CarbonylContact O-C 3.43Å; I74-F89 HydrophobicContact CB-CD2 4.2Å; I74-F89 HydrophobicContact CD1-CD2 3.67Å; I74-F89 HydrophobicContact CD1-CE2 3.89Å; I74-F89 HydrophobicContact CD1-CG 4.44Å; I74-F89 HydrophobicContact CG1-CD2 4.01Å; W87-F89 HydrophobicContact CB-CE2 4.14Å; W87-F89 PolarHBondContact O-N 3.47Å; F89-G91 VanDerWaalsContact C-N 3.28Å; F89-G91 PolarHBondContact O-N 3.47Å; F89-G91 VanDerWaalsContact O-N 3.11Å
90	T	35.5	Very low	36.5	Very low	97 Å²	97	99.8 Å²	99.8	60%	0.595	54%	0.535	S	S	*	.			trans	-83.2	76.8	165.9	46.4	0	0	0	0	109.9	R88	R88-T90 HydrophobicContact CG-CG2 4.05Å; R88-T90 PolarHBondContact O-N 3.36Å; R88-T90 VanDerWaalsContact O-N 3.17Å
91	G	31.2	Very low	36.8	Very low	37 Å²	37	98.7 Å²	98.7	38%	0.381	53%	0.528	S	S	.	.			trans	-114.8	123.7	168.8	0	0	0	0	0	109.7	F89 L93	F89-G91 VanDerWaalsContact C-N 3.28Å; F89-G91 PolarHBondContact O-N 3.47Å; F89-G91 VanDerWaalsContact O-N 3.11Å; G91-L93 PolarHBondContact O-N 3.13Å
92	G	30	Very low	37.1	Very low	41 Å²	41	97.9 Å²	97.9	42%	0.423	52%	0.521	S	S	.	.			trans	-76.8	108.6	168.6	0	0	0	0	0	108.6	Y94	G92-Y94 PolarHBondContact O-N 3.42Å
93	L	34.8	Very low	37.5	Very low	58 Å²	58	100 Å²	100	30%	0.304	52%	0.521	S	S	.	.	B	Isolated β-bridge	trans	-85.5	99.3	177.2	-69.5	159.8	0	0	0	109.5	A70 I72 G91 I100	A70-L93 HydrophobicContact CB-CB 4.42Å; I72-L93 HydrophobicContact CD1-CD1 3.21Å; I72-L93 HydrophobicContact CG1-CD1 3.76Å; G91-L93 PolarHBondContact O-N 3.13Å; L93-I100 HydrophobicContact CB-CD1 3.87Å; L93-I100 HydrophobicContact CD1-CB 4.28Å; L93-I100 HydrophobicContact CD1-CD1 4.13Å; L93-I100 HydrophobicContact CD1-CG2 3.4Å; L93-I100 VanDerWaalsContact CD1-CG2 3.4Å; L93-I100 HydrophobicContact CD2-CB 4.44Å; L93-I100 HydrophobicContact CD2-CD1 3.68Å; L93-I100 HydrophobicContact CD2-CG1 3.93Å; L93-I100 HydrophobicContact CD2-CG2 3.74Å; L93-I100 HydrophobicContact CG-CD1 4.08Å; L93-I100 HydrophobicContact CG-CG2 4.16Å
94	Y	31.7	Very low	38.1	Very low	182 Å²	182	96.5 Å²	96.5	71%	0.714	50%	0.502	S	S	*	.			trans	-88.7	94.9	168.6	-73	-87.2	0	0	0	108.3	L68 T69 G92	L68-Y94 WeakPolarHBondContact O-CE1 3.46Å; T69-Y94 HydrophobicContact CG2-CE2 4.3Å; T69-Y94 WeakPolarHBondContact CG2-OH 3.41Å; G92-Y94 PolarHBondContact O-N 3.42Å
95	G	31.6	Very low	38.6	Very low	47 Å²	47	95.4 Å²	95.4	49%	0.485	49%	0.489	S	S	.	.	S	Bend	trans	158.2	151.9	177.6	0	0	0	0	0	112.7	T97	G95-T97 PolarHBondContact O-N 2.94Å
96	N	37.1	Very low	39.1	Very low	145 Å²	145	91.9 Å²	91.9	78%	0.775	48%	0.482	S	S	*	.			trans	-49.5	129.1	-175.5	-73.6	-27.8	0	0	0	112.1	P98	N96-P98 WeakPolarHBondContact O-CD 3.45Å
97	T	39.7	Very low	39.4	Very low	101 Å²	101	91 Å²	91	62%	0.62	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-4.8	-158	24.8	0	0	0	0	120.2	G95	G95-T97 PolarHBondContact O-N 2.94Å
98	P	36.7	Very low	39.9	Very low	87 Å²	87	86.7 Å²	86.7	57%	0.565	46%	0.462	S	S	*	.	H	α-helix	trans	-83.4	-34.6	177.6	22	-18	0	0	0	114.6	N96 I100 L101 H102	N96-P98 WeakPolarHBondContact O-CD 3.45Å; P98-I100 PolarHBondContact O-N 3.24Å; P98-L101 PolarHBondContact O-N 3.15Å; P98-H102 PolarHBondContact O-N 3.01Å
99	D	38.1	Very low	40.2	Very low	120 Å²	120	80.6 Å²	80.6	64%	0.642	45%	0.445	S	S	*	.	H	α-helix	trans	-69.8	-38.7	-173	-66.1	-33.9	0	0	0	112.3	L101 H102 E103	D99-L101 VanDerWaalsContact C-N 3.29Å; D99-L101 PolarHBondContact O-N 3.03Å; D99-H102 WeakPolarHBondContact O-CB 3.16Å; D99-H102 PolarHBondContact O-N 3.43Å; D99-H102 VanDerWaalsContact O-N 3.15Å; D99-E103 PolarHBondContact O-N 3.18Å
100	I	40.9	Very low	40.3	Very low	37 Å²	37	81.7 Å²	81.7	19%	0.19	45%	0.45	C	S	.	.	H	α-helix	trans	-68.8	-32.6	-179.7	-59	144.8	0	0	0	111.4	I72 L93 P98 H102 E103 L104	I72-I100 HydrophobicContact CD1-CG2 4.31Å; L93-I100 HydrophobicContact CB-CD1 3.87Å; L93-I100 HydrophobicContact CD1-CB 4.28Å; L93-I100 HydrophobicContact CD1-CD1 4.13Å; L93-I100 HydrophobicContact CD1-CG2 3.4Å; L93-I100 VanDerWaalsContact CD1-CG2 3.4Å; L93-I100 HydrophobicContact CD2-CB 4.44Å; L93-I100 HydrophobicContact CD2-CD1 3.68Å; L93-I100 HydrophobicContact CD2-CG1 3.93Å; L93-I100 HydrophobicContact CD2-CG2 3.74Å; L93-I100 HydrophobicContact CG-CD1 4.08Å; L93-I100 HydrophobicContact CG-CG2 4.16Å; P98-I100 PolarHBondContact O-N 3.24Å; I100-H102 VanDerWaalsContact C-N 3.33Å; I100-E103 PolarHBondContact O-N 3.09Å; I100-L104 WeakPolarHBondContact O-CB 2.87Å; I100-L104 PolarHBondContact O-N 3.35Å
101	L	43.3	Very low	40.6	Very low	53 Å²	53	81 Å²	81	28%	0.277	44%	0.437	S	S	.	.	H	α-helix	trans	-67.2	-40.2	174.5	-167.3	74.4	0	0	0	110.5	L63 P98 D99 L104 I105	L63-L101 HydrophobicContact CD1-CD1 3.5Å; L63-L101 VanDerWaalsContact CD1-CD1 3.5Å; L63-L101 HydrophobicContact CD2-CD1 3.91Å; L63-L101 HydrophobicContact CG-CD1 4.36Å; P98-L101 PolarHBondContact O-N 3.15Å; D99-L101 VanDerWaalsContact C-N 3.29Å; D99-L101 PolarHBondContact O-N 3.03Å; L101-L104 PolarHBondContact O-N 2.85Å; L101-I105 HydrophobicContact CG-CD1 4.05Å; L101-I105 WeakPolarHBondContact O-CB 3.23Å; L101-I105 WeakPolarHBondContact O-CD1 3.05Å; L101-I105 WeakPolarHBondContact O-CG1 3.46Å; L101-I105 PolarHBondContact O-N 3.37Å
102	H	44.6	Very low	40.9	Very low	124 Å²	124	83.9 Å²	83.9	57%	0.574	44%	0.443	S	S	*	.	H	α-helix	trans	-63.4	-44	175.9	-160.6	110.1	0	0	0	111.2	P98 D99 I100 I105 N106	P98-H102 PolarHBondContact O-N 3.01Å; D99-H102 WeakPolarHBondContact O-CB 3.16Å; D99-H102 PolarHBondContact O-N 3.43Å; D99-H102 VanDerWaalsContact O-N 3.15Å; I100-H102 VanDerWaalsContact C-N 3.33Å; H102-I105 PolarHBondContact O-N 3.42Å; H102-N106 PolarHBondContact CD2-ND2 3.42Å; H102-N106 VanDerWaalsContact CD2-ND2 3.28Å; H102-N106 WeakPolarHBondContact O-CB 3.12Å; H102-N106 VanDerWaalsContact O-CG 3.24Å; H102-N106 PolarHBondContact O-N 2.85Å
103	E	46.1	Very low	41.3	Very low	129 Å²	129	86.4 Å²	86.4	60%	0.603	45%	0.451	S	S	*	.	H	α-helix	trans	-68.2	-37.3	178.2	-158.6	169.4	-156.9	0	0	112.2	D99 I100 N106 L107	D99-E103 PolarHBondContact O-N 3.18Å; I100-E103 PolarHBondContact O-N 3.09Å; E103-N106 PolarHBondContact O-N 3.41Å; E103-L107 PolarHBondContact O-N 2.87Å
104	L	50.4	Low	41	Very low	21 Å²	21	87 Å²	87	11%	0.11	47%	0.471	C	S	.	.	H	α-helix	trans	-66.7	-43.3	174.8	-163.9	74.9	0	0	0	112.2	I61 I72 I74 I100 L101 N106 L107 L108	I61-L104 HydrophobicContact CG2-CD2 4.44Å; I72-L104 HydrophobicContact CD1-CD2 4.44Å; I72-L104 HydrophobicContact CG2-CD2 3.85Å; I74-L104 HydrophobicContact CD1-CD1 3.33Å; I74-L104 HydrophobicContact CD1-CD2 3.8Å; I74-L104 HydrophobicContact CD1-CG 3.84Å; I74-L104 HydrophobicContact CG1-CD2 4.34Å; I100-L104 WeakPolarHBondContact O-CB 2.87Å; I100-L104 PolarHBondContact O-N 3.35Å; L101-L104 PolarHBondContact O-N 2.85Å; L104-N106 VanDerWaalsContact C-N 3.27Å; L104-N106 PolarHBondContact O-N 3.49Å; L104-L107 PolarHBondContact O-N 2.71Å; L104-L108 HydrophobicContact CG-CD1 4.21Å; L104-L108 WeakPolarHBondContact O-CB 3.47Å; L104-L108 WeakPolarHBondContact O-CD1 3.27Å; L104-L108 VanDerWaalsContact O-CG 3.27Å; L104-L108 WeakPolarHBondContact O-CG 3.24Å; L104-L108 PolarHBondContact O-N 3.33Å
105	I	48	Very low	40.7	Very low	62 Å²	62	81.2 Å²	81.2	32%	0.318	46%	0.457	S	S	.	.	H	α-helix	trans	-62.6	-39.2	174	-70.9	165.9	0	0	0	109.9	L101 H102 L108 N109	L101-I105 HydrophobicContact CG-CD1 4.05Å; L101-I105 WeakPolarHBondContact O-CB 3.23Å; L101-I105 WeakPolarHBondContact O-CD1 3.05Å; L101-I105 WeakPolarHBondContact O-CG1 3.46Å; L101-I105 PolarHBondContact O-N 3.37Å; H102-I105 PolarHBondContact O-N 3.42Å; I105-L108 PolarHBondContact O-N 2.83Å; I105-N109 WeakPolarHBondContact O-CB 3.32Å; I105-N109 PolarHBondContact O-N 2.96Å; I105-N109 PolarHBondContact O-ND2 3.45Å
106	N	48.1	Very low	40.6	Very low	79 Å²	79	80.6 Å²	80.6	42%	0.422	45%	0.448	S	S	.	.	H	α-helix	trans	-65.1	-43.6	175	-75.3	-13.4	0	0	0	112.2	H102 E103 L104 L108 N109 F110	H102-N106 PolarHBondContact CD2-ND2 3.42Å; H102-N106 VanDerWaalsContact CD2-ND2 3.28Å; H102-N106 WeakPolarHBondContact O-CB 3.12Å; H102-N106 VanDerWaalsContact O-CG 3.24Å; H102-N106 PolarHBondContact O-N 2.85Å; E103-N106 PolarHBondContact O-N 3.41Å; L104-N106 VanDerWaalsContact C-N 3.27Å; L104-N106 PolarHBondContact O-N 3.49Å; N106-L108 VanDerWaalsContact C-N 3.33Å; N106-L108 PolarHBondContact O-N 2.79Å; N106-N109 PolarHBondContact O-N 3.28Å; N106-F110 WeakPolarHBondContact O-CB 3.43Å; N106-F110 PolarHBondContact O-N 2.93Å
107	L	47.8	Very low	39.9	Very low	85 Å²	85	80.7 Å²	80.7	45%	0.445	45%	0.446	S	S	.	.	H	α-helix	trans	-60.6	-41.7	174.4	-84.9	163.1	0	0	0	112	E103 L104 F110 W111	E103-L107 PolarHBondContact O-N 2.87Å; L104-L107 PolarHBondContact O-N 2.71Å; L107-F110 PolarHBondContact O-N 3.01Å; L107-W111 WeakPolarHBondContact O-CB 3.48Å; L107-W111 PolarHBondContact O-N 2.59Å
108	L	49	Very low	39.3	Very low	16 Å²	16	82.2 Å²	82.2	8%	0.084	45%	0.445	C	S	.	.	H	α-helix	trans	-69.9	-37.7	177.5	-71.9	163.2	0	0	0	112.1	T59 I61 I74 V76 L104 I105 N106 F110 W111 N112	T59-L108 HydrophobicContact CG2-CD2 4.27Å; I61-L108 HydrophobicContact CD1-CD1 3.38Å; I61-L108 HydrophobicContact CG1-CD1 4.08Å; I74-L108 HydrophobicContact CG2-CD2 4.11Å; V76-L108 HydrophobicContact CG2-CD2 4.35Å; L104-L108 HydrophobicContact CG-CD1 4.21Å; L104-L108 WeakPolarHBondContact O-CB 3.47Å; L104-L108 WeakPolarHBondContact O-CD1 3.27Å; L104-L108 VanDerWaalsContact O-CG 3.27Å; L104-L108 WeakPolarHBondContact O-CG 3.24Å; L104-L108 PolarHBondContact O-N 3.33Å; I105-L108 PolarHBondContact O-N 2.83Å; N106-L108 VanDerWaalsContact C-N 3.33Å; N106-L108 PolarHBondContact O-N 2.79Å; L108-F110 VanDerWaalsContact C-N 3.35Å; L108-W111 WeakPolarHBondContact O-CB 3.4Å; L108-W111 PolarHBondContact O-N 3.14Å; L108-N112 PolarHBondContact O-N 3.46Å
109	N	43.8	Very low	38.6	Very low	77 Å²	77	86.5 Å²	86.5	41%	0.412	46%	0.459	S	S	.	.	H	α-helix	trans	-63.2	-41.7	170.7	-75.4	-23.1	0	0	0	111.1	I105 N106 W111 N112 T113	I105-N109 WeakPolarHBondContact O-CB 3.32Å; I105-N109 PolarHBondContact O-N 2.96Å; I105-N109 PolarHBondContact O-ND2 3.45Å; N106-N109 PolarHBondContact O-N 3.28Å; N109-W111 VanDerWaalsContact C-N 3.28Å; N109-W111 PolarHBondContact O-N 3.13Å; N109-N112 PolarHBondContact O-N 3.03Å; N109-T113 WeakPolarHBondContact O-CG2 3.47Å; N109-T113 PolarHBondContact O-N 3.02Å; N109-T113 PolarHBondContact O-OG1 2.95Å
110	F	38.9	Very low	38	Very low	118 Å²	118	93.4 Å²	93.4	52%	0.518	49%	0.488	S	S	.	.	H	α-helix	trans	-66.5	-30	176.4	-149.3	-97.7	0	0	0	112.7	N106 L107 L108 T113 S115 A116	N106-F110 WeakPolarHBondContact O-CB 3.43Å; N106-F110 PolarHBondContact O-N 2.93Å; L107-F110 PolarHBondContact O-N 3.01Å; L108-F110 VanDerWaalsContact C-N 3.35Å; F110-T113 WeakPolarHBondContact CA-OG1 3.28Å; F110-T113 PolarHBondContact O-OG1 3.16Å; F110-S115 WeakPolarHBondContact CE1-O 3.49Å; F110-S115 PolarHBondContact O-N 3.5Å; F110-A116 HydrophobicContact CD1-CB 4.27Å
111	W	40.1	Very low	37.8	Very low	83 Å²	83	96.2 Å²	96.2	31%	0.314	50%	0.502	S	S	.	.	H	α-helix	trans	-71.9	-43.4	172.9	-159.4	-54.9	0	0	0	111.4	W87 L107 L108 N109 T113 G114 A116 F118	W87-W111 AromaticContact NE1-CH2 3.76Å; L107-W111 WeakPolarHBondContact O-CB 3.48Å; L107-W111 PolarHBondContact O-N 2.59Å; L108-W111 WeakPolarHBondContact O-CB 3.4Å; L108-W111 PolarHBondContact O-N 3.14Å; N109-W111 VanDerWaalsContact C-N 3.28Å; N109-W111 PolarHBondContact O-N 3.13Å; W111-T113 PolarHBondContact O-N 2.76Å; W111-G114 PolarHBondContact O-N 2.82Å; W111-A116 HydrophobicContact CB-CB 4.5Å; W111-A116 HydrophobicContact CE3-CB 4.49Å; W111-F118 HydrophobicContact CE3-CE2 4.06Å; W111-F118 HydrophobicContact CH2-CE2 4.38Å; W111-F118 AromaticContact CZ3-CE2 3.64Å; W111-F118 HydrophobicContact CZ3-CE2 3.64Å; W111-F118 HydrophobicContact CZ3-CZ 4.32Å
112	N	39	Very low	37.5	Very low	96 Å²	96	98.5 Å²	98.5	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-66.3	-25.1	176.4	-90.4	-9.9	0	0	0	113.2	L56 L108 N109 G114	L56-N112 WeakPolarHBondContact CD2-ND2 3.41Å; L108-N112 PolarHBondContact O-N 3.46Å; N109-N112 PolarHBondContact O-N 3.03Å; N112-G114 PolarHBondContact O-N 3.29Å
113	T	37.3	Very low	37.1	Very low	94 Å²	94	97.1 Å²	97.1	58%	0.577	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	7.2	170.8	58.8	0	0	0	0	113.4	N109 F110 W111 S115	N109-T113 WeakPolarHBondContact O-CG2 3.47Å; N109-T113 PolarHBondContact O-N 3.02Å; N109-T113 PolarHBondContact O-OG1 2.95Å; F110-T113 WeakPolarHBondContact CA-OG1 3.28Å; F110-T113 PolarHBondContact O-OG1 3.16Å; W111-T113 PolarHBondContact O-N 2.76Å; T113-S115 PolarHBondContact O-N 3.05Å; T113-S115 PolarHBondContact O-OG 2.79Å
114	G	28.4	Very low	36.6	Very low	71 Å²	71	95.2 Å²	95.2	73%	0.732	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	13.6	175.6	0	0	0	0	0	114.9	W111 N112	W111-G114 PolarHBondContact O-N 2.82Å; N112-G114 PolarHBondContact O-N 3.29Å
115	S	26.8	Very low	35.8	Very low	60 Å²	60	99.8 Å²	99.8	42%	0.42	53%	0.53	S	S	.	.			trans	-104.6	-1.4	-169.8	-61.9	0	0	0	0	114.2	F110 T113 I117	F110-S115 WeakPolarHBondContact CE1-O 3.49Å; F110-S115 PolarHBondContact O-N 3.5Å; T113-S115 PolarHBondContact O-N 3.05Å; T113-S115 PolarHBondContact O-OG 2.79Å; S115-I117 PolarHBondContact O-N 2.88Å
116	A	27.8	Very low	34.9	Very low	35 Å²	35	102.3 Å²	102.3	29%	0.289	55%	0.545	S	S	.	.			trans	-72.7	89.2	179.4	0	0	0	0	0	112	F110 W111 F118	F110-A116 HydrophobicContact CD1-CB 4.27Å; W111-A116 HydrophobicContact CB-CB 4.5Å; W111-A116 HydrophobicContact CE3-CB 4.49Å; A116-F118 HydrophobicContact CB-CE2 4.11Å
117	I	23.8	Very low	34	Very low	146 Å²	146	104 Å²	104	75%	0.749	55%	0.553	S	S	*	*			trans	-84.4	105.4	166	-56.8	171	0	0	0	107.1	S115 M119	S115-I117 PolarHBondContact O-N 2.88Å; I117-M119 HydrophobicContact CG2-CG 4.44Å
118	F	27.3	Very low	32.9	Very low	134 Å²	134	105.5 Å²	105.5	59%	0.588	56%	0.562	S	S	*	*			trans	-86.1	109.8	163.4	-72.6	-84.5	0	0	0	107.8	W111 A116	W111-F118 HydrophobicContact CE3-CE2 4.06Å; W111-F118 HydrophobicContact CH2-CE2 4.38Å; W111-F118 AromaticContact CZ3-CE2 3.64Å; W111-F118 HydrophobicContact CZ3-CE2 3.64Å; W111-F118 HydrophobicContact CZ3-CZ 4.32Å; A116-F118 HydrophobicContact CB-CE2 4.11Å
119	M	20.8	Very low	31.6	Very low	176 Å²	176	112.9 Å²	112.9	87%	0.867	60%	0.601	S	S	*	*			trans	-69.3	141.4	163.9	-71.1	-174.6	175	0	0	108.8	I117	I117-M119 HydrophobicContact CG2-CG 4.44Å
120	Q	25.3	Very low	30.5	Very low	265 Å²	265	116.2 Å²	116.2	100%	1.238	62%	0.619	S	S	*	*			trans	-60.5	0	-174.3	-165.9	176.1	7.6	0	0	113.5

Retrieved 120 of 120 residues in 24.3 ms (Link to these results)

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