A0A077ZH76_TRITR Loading...

E3 ubiquitin-protein ligase RNF170

AlphaFold DB , UniProt , Accession A0A077ZH76, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 247 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	40.4	Very low	39.6	Very low	242 Å²	242	148.4 Å²	148.4	100%	1.192	86%	0.86	S	S	*	*				0	96.1	0	-167.5	174.4	-179.9	0	0	107.1
2	M	40.5	Very low	39.8	Very low	200 Å²	200	150.6 Å²	150.6	99%	0.985	86%	0.857	S	S	*	*			trans	-154.6	110.7	171.1	-117.3	162	168.1	0	0	105.6
3	Q	38.1	Very low	40.1	Very low	180 Å²	180	151.7 Å²	151.7	84%	0.841	86%	0.859	S	S	*	*			trans	-114.1	161.7	177.1	-99.5	171.8	-24.4	0	0	107.7
4	S	40.7	Very low	40.4	Very low	113 Å²	113	152.2 Å²	152.2	79%	0.79	86%	0.858	S	S	*	*			trans	79.7	131.6	175.3	76.5	0	0	0	0	113.8
5	T	41.4	Very low	40.6	Very low	121 Å²	121	153.7 Å²	153.7	74%	0.742	85%	0.852	S	S	*	*			cis	-150.8	123.6	39.8	48.6	0	0	0	0	112.5
6	D	39	Very low	40.9	Very low	166 Å²	166	153.8 Å²	153.8	89%	0.888	85%	0.849	S	S	*	*			trans	-91.6	108.1	158.7	-74.1	-36.6	0	0	0	108.2	V8	D6-V8 PolarHBondContact O-N 3.17Å
7	S	41	Very low	41.5	Very low	116 Å²	116	153.7 Å²	153.7	81%	0.811	85%	0.845	S	S	*	*			trans	-81.5	94.6	170.8	49.1	0	0	0	0	108.9
8	V	38.3	Very low	42.1	Very low	129 Å²	129	149.9 Å²	149.9	78%	0.782	85%	0.847	S	S	*	*			trans	-86.9	124.4	169.6	175.9	0	0	0	0	108.5	D6 E10	D6-V8 PolarHBondContact O-N 3.17Å; V8-E10 PolarHBondContact O-N 2.82Å
9	A	38	Very low	42.3	Very low	94 Å²	94	149.8 Å²	149.8	78%	0.777	84%	0.837	S	S	*	*			trans	-51.2	110.4	-179.6	0	0	0	0	0	113.5
10	E	37	Very low	43.5	Very low	202 Å²	202	144.7 Å²	144.7	94%	0.944	82%	0.819	S	S	*	*			trans	-90	94.5	155.1	-73.5	179.7	141.7	0	0	107.4	V8	V8-E10 PolarHBondContact O-N 2.82Å
11	G	40.7	Very low	44.6	Very low	69 Å²	69	143.8 Å²	143.8	71%	0.711	81%	0.812	S	S	*	*			trans	177.2	44.4	-178.7	0	0	0	0	0	114.9
12	E	41.9	Very low	46.1	Very low	175 Å²	175	139 Å²	139	82%	0.818	79%	0.787	S	S	*	*			trans	-152.8	64.7	173.9	-152.8	169.2	149.4	0	0	112.7
13	N	44.4	Very low	47.5	Very low	165 Å²	165	132.2 Å²	132.2	88%	0.882	76%	0.757	S	S	*	*			trans	-149.8	19	159.8	-91.1	-31	0	0	0	114.3	F15	N13-F15 PolarHBondContact O-N 3.46Å
14	D	43.7	Very low	49	Very low	159 Å²	159	129 Å²	129	85%	0.85	75%	0.745	S	S	*	*			trans	-89.9	30.5	174	-118.6	11	0	0	0	112.2	I16	D14-I16 PolarHBondContact O-N 2.8Å
15	F	43.3	Very low	50.2	Low	174 Å²	174	126.9 Å²	126.9	76%	0.763	72%	0.721	S	S	*	*			trans	-87.2	18	-159.3	-159.9	-101.3	0	0	0	116.6	N13	N13-F15 PolarHBondContact O-N 3.46Å
16	I	45.9	Very low	51.6	Low	156 Å²	156	125.2 Å²	125.2	80%	0.8	71%	0.711	S	S	*	*	S	Bend	trans	-112.7	90.2	171	-53.2	-175.7	0	0	0	110.7	D14 G18	D14-I16 PolarHBondContact O-N 2.8Å; I16-G18 PolarHBondContact O-N 3.13Å
17	L	51.6	Low	53.4	Low	152 Å²	152	121.6 Å²	121.6	80%	0.796	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-3.1	103.3	166.5	-79.3	83.2	0	0	0	116.8	F19	L17-F19 VanDerWaalsContact C-N 3.3Å; L17-F19 PolarHBondContact O-N 3.28Å
18	G	51.3	Low	55.1	Low	85 Å²	85	120.4 Å²	120.4	88%	0.876	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.7	-9.8	141	0	0	0	0	0	118.3	I16	I16-G18 PolarHBondContact O-N 3.13Å
19	F	46.5	Very low	56.9	Low	149 Å²	149	115.4 Å²	115.4	65%	0.654	65%	0.645	S	S	*	*			trans	-111.3	108	169.1	-76	-85.8	0	0	0	108	L17 V23	L17-F19 VanDerWaalsContact C-N 3.3Å; L17-F19 PolarHBondContact O-N 3.28Å; F19-V23 HydrophobicContact CD1-CB 4.03Å; F19-V23 HydrophobicContact CD1-CG1 3.73Å; F19-V23 HydrophobicContact CD1-CG2 4.37Å; F19-V23 HydrophobicContact CE1-CG1 4.26Å
20	G	65.2	Low	58.8	Low	47 Å²	47	113.6 Å²	113.6	49%	0.485	63%	0.629	S	S	.	*			trans	-52.5	145.6	172.8	0	0	0	0	0	110.2	E22 V23	G20-E22 PolarHBondContact O-N 3.38Å; G20-V23 PolarHBondContact O-N 2.85Å
21	N	67.4	Low	60.8	Low	125 Å²	125	109.7 Å²	109.7	67%	0.668	62%	0.615	S	S	*	*	H	α-helix	trans	-48.2	-29.4	-178.3	-67.4	-27	0	0	0	112.9	V23 L24 F25	N21-V23 VanDerWaalsContact C-N 3.35Å; N21-V23 PolarHBondContact O-N 3.35Å; N21-L24 PolarHBondContact O-N 3.11Å; N21-F25 VanDerWaalsContact O-CB 3.24Å; N21-F25 WeakPolarHBondContact O-CB 3.2Å; N21-F25 PolarHBondContact O-N 2.68Å
22	E	72.1	Confident	62.5	Low	142 Å²	142	110 Å²	110	66%	0.664	60%	0.599	S	S	*	*	H	α-helix	trans	-54.4	-40.1	172.3	-55	-58.5	158	0	0	114.4	G20 T26	G20-E22 PolarHBondContact O-N 3.38Å; E22-T26 VanDerWaalsContact O-CG2 3.3Å; E22-T26 WeakPolarHBondContact O-CG2 3.42Å; E22-T26 PolarHBondContact O-N 3.2Å; E22-T26 PolarHBondContact O-OG1 2.88Å; E22-T26 VanDerWaalsContact O-OG1 3.06Å
23	V	70.5	Confident	64.2	Low	57 Å²	57	104.6 Å²	104.6	35%	0.345	58%	0.578	S	S	.	*	H	α-helix	trans	-76.6	-41.8	-177.7	-174.8	0	0	0	0	110.8	F19 G20 N21 F25 T26 I27	F19-V23 HydrophobicContact CD1-CB 4.03Å; F19-V23 HydrophobicContact CD1-CG1 3.73Å; F19-V23 HydrophobicContact CD1-CG2 4.37Å; F19-V23 HydrophobicContact CE1-CG1 4.26Å; G20-V23 PolarHBondContact O-N 2.85Å; N21-V23 VanDerWaalsContact C-N 3.35Å; N21-V23 PolarHBondContact O-N 3.35Å; V23-F25 PolarHBondContact O-N 3.23Å; V23-T26 WeakPolarHBondContact CA-OG1 3.5Å; V23-T26 PolarHBondContact O-N 3.48Å; V23-T26 PolarHBondContact O-OG1 3.38Å; V23-I27 HydrophobicContact CG1-CD1 4.01Å; V23-I27 VanDerWaalsContact O-CG1 3.27Å; V23-I27 WeakPolarHBondContact O-CG1 3.37Å; V23-I27 PolarHBondContact O-N 3.16Å; V23-I27 VanDerWaalsContact O-N 3.07Å
24	L	68.3	Low	65.8	Low	114 Å²	114	99.5 Å²	99.5	60%	0.597	56%	0.559	S	S	*	*	H	α-helix	trans	-59.5	-41	173.5	-175.1	68.2	0	0	0	110.4	N21 I27 L28	N21-L24 PolarHBondContact O-N 3.11Å; L24-I27 PolarHBondContact O-N 3.4Å; L24-L28 WeakPolarHBondContact O-CB 3.46Å; L24-L28 PolarHBondContact O-N 3.41Å
25	F	67.3	Low	67.5	Low	68 Å²	68	95.5 Å²	95.5	30%	0.298	54%	0.542	S	S	.	.	H	α-helix	trans	-64.4	-48.7	178.5	-175.7	-111	0	0	0	112.9	N21 V23 I27 L28 V29 A202 L203	N21-F25 VanDerWaalsContact O-CB 3.24Å; N21-F25 WeakPolarHBondContact O-CB 3.2Å; N21-F25 PolarHBondContact O-N 2.68Å; V23-F25 PolarHBondContact O-N 3.23Å; F25-I27 VanDerWaalsContact C-N 3.3Å; F25-I27 PolarHBondContact O-N 3.28Å; F25-L28 PolarHBondContact O-N 3.19Å; F25-V29 HydrophobicContact CD1-CG2 4.42Å; F25-V29 HydrophobicContact CD2-CG2 4.37Å; F25-V29 HydrophobicContact CE1-CG2 4.15Å; F25-V29 HydrophobicContact CE2-CG2 4.06Å; F25-V29 HydrophobicContact CZ-CG2 3.95Å; F25-V29 WeakPolarHBondContact O-CG2 3.49Å; F25-V29 PolarHBondContact O-N 2.81Å; F25-A202 HydrophobicContact CE2-CB 3.67Å; F25-A202 HydrophobicContact CZ-CB 4.13Å; F25-A202 VanDerWaalsContact CZ-O 3.25Å; F25-A202 WeakPolarHBondContact CZ-O 3.47Å; F25-L203 HydrophobicContact CE1-CD2 3.41Å; F25-L203 VanDerWaalsContact CE1-CD2 3.41Å; F25-L203 HydrophobicContact CE1-CG 4.3Å; F25-L203 HydrophobicContact CE2-CD2 4.45Å; F25-L203 HydrophobicContact CZ-CB 4.34Å; F25-L203 HydrophobicContact CZ-CD2 3.34Å; F25-L203 HydrophobicContact CZ-CG 3.72Å
26	T	70.1	Confident	69.1	Low	85 Å²	85	92.7 Å²	92.7	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-61.2	-37.7	177.3	49.4	0	0	0	0	112.5	E22 V23 A30	E22-T26 VanDerWaalsContact O-CG2 3.3Å; E22-T26 WeakPolarHBondContact O-CG2 3.42Å; E22-T26 PolarHBondContact O-N 3.2Å; E22-T26 PolarHBondContact O-OG1 2.88Å; E22-T26 VanDerWaalsContact O-OG1 3.06Å; V23-T26 WeakPolarHBondContact CA-OG1 3.5Å; V23-T26 PolarHBondContact O-N 3.48Å; V23-T26 PolarHBondContact O-OG1 3.38Å; T26-A30 VanDerWaalsContact O-CB 3.29Å; T26-A30 WeakPolarHBondContact O-CB 3.19Å; T26-A30 PolarHBondContact O-N 3.23Å
27	I	76.1	Confident	70.6	Confident	91 Å²	91	88.7 Å²	88.7	47%	0.467	51%	0.512	S	S	.	.	H	α-helix	trans	-65.9	-45.8	174.9	-67.1	167.7	0	0	0	111	V23 L24 F25 V29 A30 L31	V23-I27 HydrophobicContact CG1-CD1 4.01Å; V23-I27 VanDerWaalsContact O-CG1 3.27Å; V23-I27 WeakPolarHBondContact O-CG1 3.37Å; V23-I27 PolarHBondContact O-N 3.16Å; V23-I27 VanDerWaalsContact O-N 3.07Å; L24-I27 PolarHBondContact O-N 3.4Å; F25-I27 VanDerWaalsContact C-N 3.3Å; F25-I27 PolarHBondContact O-N 3.28Å; I27-V29 PolarHBondContact O-N 2.86Å; I27-A30 PolarHBondContact O-N 2.75Å; I27-L31 HydrophobicContact CG2-CD1 4.04Å; I27-L31 HydrophobicContact CG2-CG 4.4Å; I27-L31 VanDerWaalsContact O-CG 3.3Å; I27-L31 WeakPolarHBondContact O-CG 3.35Å; I27-L31 PolarHBondContact O-N 3.35Å
28	L	77.2	Confident	72	Confident	90 Å²	90	84.3 Å²	84.3	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-65.3	-40.6	-177.1	-159.7	150.8	0	0	0	111.7	L24 F25 L31 L32	L24-L28 WeakPolarHBondContact O-CB 3.46Å; L24-L28 PolarHBondContact O-N 3.41Å; F25-L28 PolarHBondContact O-N 3.19Å; L28-L31 PolarHBondContact O-N 2.87Å; L28-L32 HydrophobicContact CD2-CD1 3.64Å; L28-L32 WeakPolarHBondContact O-CG 3.49Å; L28-L32 PolarHBondContact O-N 3.02Å
29	V	75.8	Confident	73.5	Confident	25 Å²	25	86.9 Å²	86.9	15%	0.152	48%	0.477	C	S	.	.	H	α-helix	trans	-65	-45.6	174.6	173.4	0	0	0	0	110.9	F25 I27 L31 L32 V33 L203	F25-V29 HydrophobicContact CD1-CG2 4.42Å; F25-V29 HydrophobicContact CD2-CG2 4.37Å; F25-V29 HydrophobicContact CE1-CG2 4.15Å; F25-V29 HydrophobicContact CE2-CG2 4.06Å; F25-V29 HydrophobicContact CZ-CG2 3.95Å; F25-V29 WeakPolarHBondContact O-CG2 3.49Å; F25-V29 PolarHBondContact O-N 2.81Å; I27-V29 PolarHBondContact O-N 2.86Å; V29-L31 VanDerWaalsContact C-N 3.28Å; V29-L31 PolarHBondContact O-N 2.83Å; V29-L32 PolarHBondContact O-N 2.85Å; V29-L32 VanDerWaalsContact O-N 3.16Å; V29-V33 HydrophobicContact CG1-CG2 3.88Å; V29-V33 WeakPolarHBondContact O-CB 3.44Å; V29-V33 WeakPolarHBondContact O-CG2 3.43Å; V29-V33 PolarHBondContact O-N 2.95Å; V29-L203 HydrophobicContact CB-CD2 4.28Å; V29-L203 HydrophobicContact CG1-CD1 3.81Å; V29-L203 HydrophobicContact CG1-CD2 3.89Å; V29-L203 HydrophobicContact CG1-CG 4.39Å; V29-L203 HydrophobicContact CG2-CD1 4.08Å; V29-L203 HydrophobicContact CG2-CD2 3.47Å; V29-L203 VanDerWaalsContact CG2-CD2 3.47Å; V29-L203 HydrophobicContact CG2-CG 3.9Å
30	A	77.5	Confident	75	Confident	55 Å²	55	83.1 Å²	83.1	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-59.5	-40.5	176.8	0	0	0	0	0	111.6	T26 I27 L32 A34	T26-A30 VanDerWaalsContact O-CB 3.29Å; T26-A30 WeakPolarHBondContact O-CB 3.19Å; T26-A30 PolarHBondContact O-N 3.23Å; I27-A30 PolarHBondContact O-N 2.75Å; A30-L32 VanDerWaalsContact C-N 3.28Å; A30-L32 PolarHBondContact O-N 3.32Å; A30-A34 WeakPolarHBondContact O-CB 3.28Å; A30-A34 PolarHBondContact O-N 3Å
31	L	80.9	Confident	75.7	Confident	121 Å²	121	84.9 Å²	84.9	63%	0.634	47%	0.465	S	S	*	.	H	α-helix	trans	-66.4	-24.4	178.4	-73	175.4	0	0	0	114	I27 L28 V29 P35	I27-L31 HydrophobicContact CG2-CD1 4.04Å; I27-L31 HydrophobicContact CG2-CG 4.4Å; I27-L31 VanDerWaalsContact O-CG 3.3Å; I27-L31 WeakPolarHBondContact O-CG 3.35Å; I27-L31 PolarHBondContact O-N 3.35Å; L28-L31 PolarHBondContact O-N 2.87Å; V29-L31 VanDerWaalsContact C-N 3.28Å; V29-L31 PolarHBondContact O-N 2.83Å; L31-P35 WeakPolarHBondContact O-CD 3.19Å; L31-P35 WeakPolarHBondContact O-CG 3.28Å
32	L	75.3	Confident	76.4	Confident	74 Å²	74	84.6 Å²	84.6	39%	0.387	46%	0.46	S	S	.	.	H	α-helix	trans	-99.2	-37.2	-179	-63.5	174.9	0	0	0	112.6	L28 V29 A30 P35 I199	L28-L32 HydrophobicContact CD2-CD1 3.64Å; L28-L32 WeakPolarHBondContact O-CG 3.49Å; L28-L32 PolarHBondContact O-N 3.02Å; V29-L32 PolarHBondContact O-N 2.85Å; V29-L32 VanDerWaalsContact O-N 3.16Å; A30-L32 VanDerWaalsContact C-N 3.28Å; A30-L32 PolarHBondContact O-N 3.32Å; L32-P35 WeakPolarHBondContact O-CD 3.26Å; L32-P35 WeakPolarHBondContact O-CG 3.49Å; L32-I199 HydrophobicContact CB-CD1 4.15Å; L32-I199 HydrophobicContact CD1-CD1 3.26Å; L32-I199 HydrophobicContact CD1-CG1 3.95Å; L32-I199 HydrophobicContact CG-CD1 4.27Å
33	V	78	Confident	76.5	Confident	62 Å²	62	82.4 Å²	82.4	38%	0.376	45%	0.452	S	S	.	.	H	α-helix	trans	-78.6	-40.8	179.8	178.6	0	0	0	0	111.3	V29 F36 V37	V29-V33 HydrophobicContact CG1-CG2 3.88Å; V29-V33 WeakPolarHBondContact O-CB 3.44Å; V29-V33 WeakPolarHBondContact O-CG2 3.43Å; V29-V33 PolarHBondContact O-N 2.95Å; V33-F36 PolarHBondContact O-N 3.34Å; V33-V37 HydrophobicContact CG1-CG2 3.72Å; V33-V37 WeakPolarHBondContact O-CB 3.4Å; V33-V37 VanDerWaalsContact O-CG2 3.3Å; V33-V37 WeakPolarHBondContact O-CG2 3.47Å; V33-V37 PolarHBondContact O-N 3.31Å
34	A	78.5	Confident	76.7	Confident	59 Å²	59	84.8 Å²	84.8	49%	0.488	46%	0.462	S	S	.	.	H	α-helix	trans	-58.3	-46.2	-179.6	0	0	0	0	0	114	A30 F36 S38	A30-A34 WeakPolarHBondContact O-CB 3.28Å; A30-A34 PolarHBondContact O-N 3Å; A34-F36 VanDerWaalsContact C-N 3.35Å; A34-S38 WeakPolarHBondContact O-CB 3.48Å; A34-S38 PolarHBondContact O-N 3.49Å
35	P	77.8	Confident	76.9	Confident	74 Å²	74	82 Å²	82	48%	0.481	45%	0.453	S	S	.	.	H	α-helix	trans	-68.8	-33.3	176.3	25.8	-33.7	0	0	0	112.3	L31 L32 S38 W39	L31-P35 WeakPolarHBondContact O-CD 3.19Å; L31-P35 WeakPolarHBondContact O-CG 3.28Å; L32-P35 WeakPolarHBondContact O-CD 3.26Å; L32-P35 WeakPolarHBondContact O-CG 3.49Å; P35-S38 PolarHBondContact O-N 3.33Å; P35-W39 VanDerWaalsContact O-CB 3.26Å; P35-W39 WeakPolarHBondContact O-CB 3.22Å; P35-W39 PolarHBondContact O-N 3.1Å
36	F	78	Confident	76.4	Confident	116 Å²	116	86.5 Å²	86.5	51%	0.509	47%	0.474	S	S	.	.	H	α-helix	trans	-67	-45	175.7	-178	-101.2	0	0	0	111.9	V33 A34 W39 L40	V33-F36 PolarHBondContact O-N 3.34Å; A34-F36 VanDerWaalsContact C-N 3.35Å; F36-W39 HydrophobicContact CD2-CE3 4.27Å; F36-W39 HydrophobicContact CE2-CE3 4.16Å; F36-W39 HydrophobicContact CE2-CZ3 4.11Å; F36-W39 PolarHBondContact O-N 3.07Å; F36-L40 WeakPolarHBondContact O-CB 3.48Å; F36-L40 PolarHBondContact O-N 3.46Å
37	V	77.6	Confident	75.7	Confident	71 Å²	71	87.3 Å²	87.3	43%	0.43	48%	0.483	S	S	.	.	H	α-helix	trans	-65	-41.6	174.8	174	0	0	0	0	110.3	V33 L40 V41	V33-V37 HydrophobicContact CG1-CG2 3.72Å; V33-V37 WeakPolarHBondContact O-CB 3.4Å; V33-V37 VanDerWaalsContact O-CG2 3.3Å; V33-V37 WeakPolarHBondContact O-CG2 3.47Å; V33-V37 PolarHBondContact O-N 3.31Å; V37-L40 PolarHBondContact O-N 3.48Å; V37-V41 HydrophobicContact CG1-CG2 4.18Å; V37-V41 WeakPolarHBondContact O-CB 3.44Å; V37-V41 VanDerWaalsContact O-CG2 3.23Å; V37-V41 WeakPolarHBondContact O-CG2 3.19Å; V37-V41 PolarHBondContact O-N 2.86Å
38	S	80.7	Confident	74.3	Confident	60 Å²	60	86.3 Å²	86.3	42%	0.42	48%	0.484	S	S	.	.	H	α-helix	trans	-61	-45.7	175.1	-172.3	0	0	0	0	111.6	A34 P35 V41 Q42	A34-S38 WeakPolarHBondContact O-CB 3.48Å; A34-S38 PolarHBondContact O-N 3.49Å; P35-S38 PolarHBondContact O-N 3.33Å; S38-V41 PolarHBondContact O-N 2.85Å; S38-Q42 WeakPolarHBondContact O-CB 3.49Å; S38-Q42 VanDerWaalsContact O-CG 3.27Å; S38-Q42 WeakPolarHBondContact O-CG 3.44Å; S38-Q42 PolarHBondContact O-N 3.5Å
39	W	83.1	Confident	72.9	Confident	139 Å²	139	87.7 Å²	87.7	53%	0.527	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-43.4	175.1	178.4	71	0	0	0	112.1	P35 F36 Q42 L43	P35-W39 VanDerWaalsContact O-CB 3.26Å; P35-W39 WeakPolarHBondContact O-CB 3.22Å; P35-W39 PolarHBondContact O-N 3.1Å; F36-W39 HydrophobicContact CD2-CE3 4.27Å; F36-W39 HydrophobicContact CE2-CE3 4.16Å; F36-W39 HydrophobicContact CE2-CZ3 4.11Å; F36-W39 PolarHBondContact O-N 3.07Å; W39-Q42 PolarHBondContact O-N 3.18Å; W39-L43 HydrophobicContact CZ2-CD1 4.07Å; W39-L43 WeakPolarHBondContact O-CB 3.37Å; W39-L43 PolarHBondContact O-N 3.3Å
40	L	77.6	Confident	71.3	Confident	71 Å²	71	93.1 Å²	93.1	37%	0.372	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-43.2	177.7	-176.1	65.2	0	0	0	112	F36 V37 Q42 L43 L44	F36-L40 WeakPolarHBondContact O-CB 3.48Å; F36-L40 PolarHBondContact O-N 3.46Å; V37-L40 PolarHBondContact O-N 3.48Å; L40-Q42 VanDerWaalsContact C-N 3.32Å; L40-L43 WeakPolarHBondContact O-CB 3.3Å; L40-L43 PolarHBondContact O-N 3.04Å; L40-L44 HydrophobicContact CD1-CD1 4.39Å; L40-L44 HydrophobicContact CD1-CG 4.49Å; L40-L44 HydrophobicContact CG-CD1 4.06Å; L40-L44 WeakPolarHBondContact O-CB 3.37Å; L40-L44 VanDerWaalsContact O-CG 3.29Å; L40-L44 WeakPolarHBondContact O-CG 3.31Å; L40-L44 PolarHBondContact O-N 2.77Å
41	V	80.7	Confident	69.8	Low	84 Å²	84	95.1 Å²	95.1	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-65.1	-37.3	174.9	170.5	0	0	0	0	110.7	V37 S38 S45	V37-V41 HydrophobicContact CG1-CG2 4.18Å; V37-V41 WeakPolarHBondContact O-CB 3.44Å; V37-V41 VanDerWaalsContact O-CG2 3.23Å; V37-V41 WeakPolarHBondContact O-CG2 3.19Å; V37-V41 PolarHBondContact O-N 2.86Å; S38-V41 PolarHBondContact O-N 2.85Å; V41-S45 WeakPolarHBondContact O-CB 3.47Å; V41-S45 PolarHBondContact O-N 2.81Å; V41-S45 PolarHBondContact O-OG 2.8Å
42	Q	80.5	Confident	67.8	Low	118 Å²	118	95 Å²	95	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-64.9	-41.7	171.8	-76.9	176.1	-3.9	0	0	111.4	S38 W39 L40 S45 H46	S38-Q42 WeakPolarHBondContact O-CB 3.49Å; S38-Q42 VanDerWaalsContact O-CG 3.27Å; S38-Q42 WeakPolarHBondContact O-CG 3.44Å; S38-Q42 PolarHBondContact O-N 3.5Å; W39-Q42 PolarHBondContact O-N 3.18Å; L40-Q42 VanDerWaalsContact C-N 3.32Å; Q42-S45 WeakPolarHBondContact CA-OG 3.12Å; Q42-S45 PolarHBondContact O-OG 2.99Å; Q42-H46 VanDerWaalsContact O-CB 3.22Å; Q42-H46 WeakPolarHBondContact O-CB 3.23Å; Q42-H46 PolarHBondContact O-N 2.81Å
43	L	74.4	Confident	65.9	Low	97 Å²	97	96.6 Å²	96.6	51%	0.508	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-45	177.3	-140.3	82.8	0	0	0	111.6	W39 L40 S47	W39-L43 HydrophobicContact CZ2-CD1 4.07Å; W39-L43 WeakPolarHBondContact O-CB 3.37Å; W39-L43 PolarHBondContact O-N 3.3Å; L40-L43 WeakPolarHBondContact O-CB 3.3Å; L40-L43 PolarHBondContact O-N 3.04Å; L43-S47 PolarHBondContact O-N 3.3Å
44	L	74.3	Confident	64.1	Low	106 Å²	106	98.5 Å²	98.5	56%	0.555	58%	0.579	S	S	*	*	H	α-helix	trans	-71.3	-40.8	178.7	-69.1	171.4	0	0	0	112	L40 S47 S48	L40-L44 HydrophobicContact CD1-CD1 4.39Å; L40-L44 HydrophobicContact CD1-CG 4.49Å; L40-L44 HydrophobicContact CG-CD1 4.06Å; L40-L44 WeakPolarHBondContact O-CB 3.37Å; L40-L44 VanDerWaalsContact O-CG 3.29Å; L40-L44 WeakPolarHBondContact O-CG 3.31Å; L40-L44 PolarHBondContact O-N 2.77Å; L44-S47 CarbonylContact O-C 3.5Å; L44-S47 WeakPolarHBondContact O-CA 3.31Å; L44-S47 WeakPolarHBondContact O-CB 3.39Å; L44-S47 PolarHBondContact O-N 3.48Å; L44-S47 VanDerWaalsContact O-N 3.13Å; L44-S48 WeakPolarHBondContact O-CB 3.45Å; L44-S48 PolarHBondContact O-N 3.42Å
45	S	73.6	Confident	62.1	Low	57 Å²	57	100.3 Å²	100.3	40%	0.399	59%	0.594	S	S	.	*	H	α-helix	trans	-70.6	-34.1	178.6	61.6	0	0	0	0	112.3	V41 Q42 S47 S48 V49	V41-S45 WeakPolarHBondContact O-CB 3.47Å; V41-S45 PolarHBondContact O-N 2.81Å; V41-S45 PolarHBondContact O-OG 2.8Å; Q42-S45 WeakPolarHBondContact CA-OG 3.12Å; Q42-S45 PolarHBondContact O-OG 2.99Å; S45-S47 PolarHBondContact O-N 3.5Å; S45-S48 PolarHBondContact O-N 3.25Å; S45-S48 VanDerWaalsContact O-N 3.13Å; S45-S48 PolarHBondContact O-OG 2.91Å; S45-V49 PolarHBondContact O-N 2.87Å
46	H	57	Low	59.9	Low	162 Å²	162	105.8 Å²	105.8	75%	0.75	61%	0.613	S	S	*	*	H	α-helix	trans	-69.2	-23.7	171.2	-150	-63.4	0	0	0	112	Q42	Q42-H46 VanDerWaalsContact O-CB 3.22Å; Q42-H46 WeakPolarHBondContact O-CB 3.23Å; Q42-H46 PolarHBondContact O-N 2.81Å
47	S	56.1	Low	57.9	Low	102 Å²	102	111.7 Å²	111.7	71%	0.713	63%	0.632	S	S	*	*	H	α-helix	trans	-81	-23.4	169.4	-171	0	0	0	0	113.2	L43 L44 S45	L43-S47 PolarHBondContact O-N 3.3Å; L44-S47 CarbonylContact O-C 3.5Å; L44-S47 WeakPolarHBondContact O-CA 3.31Å; L44-S47 WeakPolarHBondContact O-CB 3.39Å; L44-S47 PolarHBondContact O-N 3.48Å; L44-S47 VanDerWaalsContact O-N 3.13Å; S45-S47 PolarHBondContact O-N 3.5Å
48	S	45.1	Very low	55.6	Low	69 Å²	69	116 Å²	116	48%	0.483	65%	0.653	S	S	.	*			trans	-98.7	19.2	-174.9	85.4	0	0	0	0	114.2	L44 S45 N50	L44-S48 WeakPolarHBondContact O-CB 3.45Å; L44-S48 PolarHBondContact O-N 3.42Å; S45-S48 PolarHBondContact O-N 3.25Å; S45-S48 VanDerWaalsContact O-N 3.13Å; S45-S48 PolarHBondContact O-OG 2.91Å; S48-N50 PolarHBondContact O-N 2.99Å
49	V	48.6	Very low	53.2	Low	119 Å²	119	116.1 Å²	116.1	72%	0.721	66%	0.664	S	S	*	*			trans	-67.9	83.5	164	-178.1	0	0	0	0	107.1	S45 P51	S45-V49 PolarHBondContact O-N 2.87Å; V49-P51 VanDerWaalsContact O-CD 3.28Å; V49-P51 WeakPolarHBondContact O-CD 3.4Å
50	N	42.3	Very low	50.7	Low	140 Å²	140	118.6 Å²	118.6	75%	0.749	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-59.4	118.7	172.7	-70.5	-47	0	0	0	108.1	S48	S48-N50 PolarHBondContact O-N 2.99Å
51	P	46.5	Very low	48.6	Very low	97 Å²	97	124 Å²	124	63%	0.63	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-66.1	150.9	159.9	25.3	-23.6	0	0	0	108.9	V49 A53	V49-P51 VanDerWaalsContact O-CD 3.28Å; V49-P51 WeakPolarHBondContact O-CD 3.4Å; P51-A53 PolarHBondContact O-N 2.79Å
52	P	38.3	Very low	46.6	Very low	118 Å²	118	128.2 Å²	128.2	77%	0.766	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-61.3	129.1	-169.9	23.8	-32.3	0	0	0	110.9	S54	P52-S54 PolarHBondContact O-N 3.02Å; P52-S54 VanDerWaalsContact O-N 3.16Å
53	A	34.5	Very low	44.8	Very low	108 Å²	108	127.1 Å²	127.1	89%	0.893	73%	0.729	S	S	*	*			trans	-61.5	110.6	163.9	0	0	0	0	0	108.5	P51	P51-A53 PolarHBondContact O-N 2.79Å
54	S	41.3	Very low	43.1	Very low	102 Å²	102	128.9 Å²	128.9	71%	0.713	74%	0.738	S	S	*	*			trans	-140.9	112.1	163.5	59.6	0	0	0	0	110.1	P52	P52-S54 PolarHBondContact O-N 3.02Å; P52-S54 VanDerWaalsContact O-N 3.16Å
55	A	36.8	Very low	41.5	Very low	96 Å²	96	128.3 Å²	128.3	79%	0.793	74%	0.739	S	S	*	*			trans	73.9	100.9	146.7	0	0	0	0	0	118.4
56	E	31	Very low	39.8	Very low	190 Å²	190	131 Å²	131	89%	0.888	76%	0.758	S	S	*	*			trans	-40.4	130.3	140	-64.6	152.9	129.6	0	0	111.4
57	R	35.5	Very low	39.2	Very low	240 Å²	240	125 Å²	125	91%	0.906	74%	0.736	S	S	*	*			trans	-152.1	114.5	147.8	-133.6	-179.3	-153.5	-175.9	4.3	109.9
58	D	29.2	Very low	38.4	Very low	161 Å²	161	126 Å²	126	86%	0.861	74%	0.74	S	S	*	*			trans	-57.5	147.8	161.7	-58	-64	0	0	0	110.8
59	G	30.2	Very low	38.3	Very low	63 Å²	63	126.4 Å²	126.4	65%	0.649	74%	0.74	S	S	*	*			trans	100.2	107.4	163.6	0	0	0	0	0	115.8
60	E	31.6	Very low	38.1	Very low	190 Å²	190	130.3 Å²	130.3	89%	0.888	74%	0.741	S	S	*	*				58.3	129.9	125.7	-63.3	169	149.9	0	0	121
61	E	34.2	Very low	38.2	Very low	185 Å²	185	128.1 Å²	128.1	86%	0.864	73%	0.733	S	S	*	*			trans	77.2	110.6	158.1	-66.5	-178.9	137.4	0	0	120.7
62	E	37.7	Very low	38.2	Very low	172 Å²	172	127.4 Å²	127.4	80%	0.804	73%	0.727	S	S	*	*			trans	44.2	78.7	147	-59.1	-166.9	157.7	0	0	118.9	I64	E62-I64 PolarHBondContact O-N 2.88Å
63	A	41.6	Very low	38.8	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	73%	0.731	S	S	*	*			trans	-73.6	78.3	157	0	0	0	0	0	110.7	V65	A63-V65 HydrophobicContact CB-CG2 4.37Å; A63-V65 PolarHBondContact O-N 2.98Å
64	I	38.8	Very low	40.3	Very low	135 Å²	135	126.8 Å²	126.8	69%	0.692	71%	0.707	S	S	*	*			trans	-67.5	91.6	152.3	-60.3	175.2	0	0	0	105.5	E62 S66	E62-I64 PolarHBondContact O-N 2.88Å; I64-S66 PolarHBondContact O-N 3.3Å
65	V	42.2	Very low	42.3	Very low	94 Å²	94	127.6 Å²	127.6	57%	0.57	70%	0.703	S	S	*	*			trans	-67	100.5	173.2	174.2	0	0	0	0	107.7	A63 A67	A63-V65 HydrophobicContact CB-CG2 4.37Å; A63-V65 PolarHBondContact O-N 2.98Å; V65-A67 HydrophobicContact CG1-CB 4.29Å; V65-A67 PolarHBondContact O-N 3.37Å
66	S	36.7	Very low	44.9	Very low	113 Å²	113	126 Å²	126	79%	0.79	68%	0.683	S	S	*	*			trans	-68.2	64.1	166.5	-47.4	0	0	0	0	110.2	I64	I64-S66 PolarHBondContact O-N 3.3Å
67	A	44.7	Very low	47.9	Very low	37 Å²	37	116.9 Å²	116.9	31%	0.306	64%	0.641	S	S	.	*			trans	-66.5	141.2	161.6	0	0	0	0	0	107.8	V65 V69	V65-A67 HydrophobicContact CG1-CB 4.29Å; V65-A67 PolarHBondContact O-N 3.37Å; A67-V69 WeakPolarHBondContact O-CG2 3.35Å; A67-V69 PolarHBondContact O-N 3.43Å
68	P	39.5	Very low	50.6	Low	122 Å²	122	107.7 Å²	107.7	79%	0.792	61%	0.613	S	S	*	*			trans	-62.3	101	177	24.5	-30.8	0	0	0	108	R70	P68-R70 PolarHBondContact O-N 2.88Å
69	V	43.1	Very low	53.7	Low	78 Å²	78	103.1 Å²	103.1	47%	0.473	59%	0.59	S	S	.	*			trans	-64	109.9	179.1	-166.9	0	0	0	0	105.5	A67 T71	A67-V69 WeakPolarHBondContact O-CG2 3.35Å; A67-V69 PolarHBondContact O-N 3.43Å; V69-T71 HydrophobicContact CB-CG2 3.83Å; V69-T71 HydrophobicContact CG1-CG2 3.22Å; V69-T71 PolarHBondContact O-N 3.43Å
70	R	44	Very low	56.8	Low	201 Å²	201	102.6 Å²	102.6	76%	0.758	58%	0.576	S	S	*	*			trans	-71.3	71	159.5	-69.1	-170.8	176.2	-148	0.3	106	P68 T72	P68-R70 PolarHBondContact O-N 2.88Å; R70-T72 PolarHBondContact O-N 2.89Å
71	T	43.9	Very low	59.8	Low	94 Å²	94	99.9 Å²	99.9	58%	0.577	57%	0.567	S	S	*	*			trans	-65.3	89.7	167.1	47.6	0	0	0	0	105.6	V69 D73	V69-T71 HydrophobicContact CB-CG2 3.83Å; V69-T71 HydrophobicContact CG1-CG2 3.22Å; V69-T71 PolarHBondContact O-N 3.43Å; T71-D73 PolarHBondContact O-N 3.16Å
72	T	48.3	Very low	62.7	Low	82 Å²	82	96.7 Å²	96.7	50%	0.503	55%	0.554	S	S	.	*			trans	-58.1	118.9	141.6	47.9	0	0	0	0	104.7	R70 S74	R70-T72 PolarHBondContact O-N 2.89Å; T72-S74 PolarHBondContact O-N 3.06Å
73	D	50.7	Low	65.3	Low	158 Å²	158	93.4 Å²	93.4	85%	0.845	55%	0.545	S	S	*	.	S	Bend	trans	-52.8	14.7	-171.9	-73	-41.6	0	0	0	117	T71 N75	T71-D73 PolarHBondContact O-N 3.16Å; D73-N75 PolarHBondContact O-N 3.25Å
74	S	64.9	Low	67.8	Low	55 Å²	55	90.2 Å²	90.2	39%	0.385	51%	0.514	S	S	.	.			trans	-86.1	104.9	174.2	60.7	0	0	0	0	110.2	T72 V76 H84	T72-S74 PolarHBondContact O-N 3.06Å; S74-V76 PolarHBondContact O-N 3.01Å; S74-H84 PolarHBondContact O-CE1 3.42Å
75	N	83.1	Confident	70.4	Confident	119 Å²	119	92.9 Å²	92.9	64%	0.636	52%	0.515	S	S	*	.			trans	-63.4	22.4	156.1	-73.3	-38.5	0	0	0	112.5	D73 V83 H84	D73-N75 PolarHBondContact O-N 3.25Å; N75-V83 WeakPolarHBondContact O-CA 3.28Å; N75-H84 VanDerWaalsContact C-CE1 3.47Å; N75-H84 PolarHBondContact O-N 3.3Å; N75-H84 PolarHBondContact O-ND1 3.31Å; N75-H84 VanDerWaalsContact O-ND1 3.11Å
76	V	91.8	Very high	73	Confident	61 Å²	61	89.2 Å²	89.2	37%	0.37	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-119.7	129.8	-173.1	-178	0	0	0	0	108.5	S74 L81 M82 H84	S74-V76 PolarHBondContact O-N 3.01Å; V76-L81 VanDerWaalsContact CG1-C 3.43Å; V76-M82 CarbonylContact C-O 3.56Å; V76-M82 WeakPolarHBondContact CA-O 3.48Å; V76-H84 PolarHBondContact N-CE1 3.3Å; V76-H84 PolarHBondContact N-ND1 3.41Å; V76-H84 PolarHBondContact O-CE1 3.35Å; V76-H84 VanDerWaalsContact O-CE1 3.28Å
77	C	94.7	Very high	75.7	Confident	0 Å²	0	85.1 Å²	85.1	0%	0	46%	0.463	C	S	.	.			trans	-74.9	127.5	174.9	178.1	0	0	0	0	110.3	V79 L81 M82 C97	C77-V79 PolarHBondContact O-N 3.3Å; C77-V79 VanDerWaalsContact O-N 3.13Å; C77-L81 WeakPolarHBondContact O-CA 3.14Å; C77-L81 PolarHBondContact O-N 2.92Å; C77-M82 PolarHBondContact N-O 2.91Å; C77-C97 VanDerWaalsContact CB-SG 3.55Å; C77-C97 PolarHBondContact SG-N 2.88Å
78	C	92.4	Very high	78.1	Confident	47 Å²	47	83.4 Å²	83.4	32%	0.318	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-11.1	-178.9	77.5	0	0	0	0	114.7	F96 M118	C78-F96 VanDerWaalsContact SG-CE1 3.52Å; C78-M118 HydrophobicContact CB-CG 4.39Å; C78-M118 HydrophobicContact CB-SD 3.42Å; C78-M118 WeakPolarHBondContact CB-SD 3.47Å
79	V	93.8	Very high	80.6	Confident	64 Å²	64	78.3 Å²	78.3	39%	0.388	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-48.8	-178.6	-178.5	0	0	0	0	110.7	C77 F96 C100 P117	C77-V79 PolarHBondContact O-N 3.3Å; C77-V79 VanDerWaalsContact O-N 3.13Å; V79-F96 HydrophobicContact CG2-CD1 4.17Å; V79-C100 HydrophobicContact CB-CB 3.84Å; V79-C100 HydrophobicContact CG1-CB 3.87Å; V79-C100 HydrophobicContact CG2-CB 4.34Å; V79-P117 HydrophobicContact CG2-CG 4.31Å
80	C	95.6	Very high	82.8	Confident	52 Å²	52	74.6 Å²	74.6	35%	0.351	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-7.2	179.7	64.1	0	0	0	0	114.2	M82	C80-M82 PolarHBondContact O-N 3.36Å
81	L	94.2	Very high	84.8	Confident	133 Å²	133	68.3 Å²	68.3	70%	0.696	37%	0.373	S	S	*	.	S	Bend	trans	58	23.6	-177.7	-51	178.4	0	0	0	114.2	V76 C77	V76-L81 VanDerWaalsContact CG1-C 3.43Å; C77-L81 WeakPolarHBondContact O-CA 3.14Å; C77-L81 PolarHBondContact O-N 2.92Å
82	M	94.8	Very high	86.7	Confident	119 Å²	119	65.5 Å²	65.5	59%	0.586	36%	0.357	S	S	*	.	S	Bend	trans	-115.2	165.3	177.5	-63.9	-63.7	-126.9	0	0	110.9	V76 C77 C80 H84	V76-M82 CarbonylContact C-O 3.56Å; V76-M82 WeakPolarHBondContact CA-O 3.48Å; C77-M82 PolarHBondContact N-O 2.91Å; C80-M82 PolarHBondContact O-N 3.36Å; M82-H84 PolarHBondContact O-N 2.99Å
83	V	93.5	Very high	88.4	Confident	103 Å²	103	62.1 Å²	62.1	62%	0.624	34%	0.339	S	S	*	.	B	Isolated β-bridge	trans	-54.7	138.8	171.6	178.8	0	0	0	0	110.2	N75 R85	N75-V83 WeakPolarHBondContact O-CA 3.28Å; V83-R85 PolarHBondContact O-N 3.35Å
84	H	92.8	Very high	90.3	Very high	27 Å²	27	56 Å²	56	13%	0.125	31%	0.305	C	S	.	.			trans	-54.7	123	-178.3	-65.1	92.2	0	0	0	111.7	S74 N75 V76 M82 P87 M95	S74-H84 PolarHBondContact O-CE1 3.42Å; N75-H84 VanDerWaalsContact C-CE1 3.47Å; N75-H84 PolarHBondContact O-N 3.3Å; N75-H84 PolarHBondContact O-ND1 3.31Å; N75-H84 VanDerWaalsContact O-ND1 3.11Å; V76-H84 PolarHBondContact N-CE1 3.3Å; V76-H84 PolarHBondContact N-ND1 3.41Å; V76-H84 PolarHBondContact O-CE1 3.35Å; V76-H84 VanDerWaalsContact O-CE1 3.28Å; M82-H84 PolarHBondContact O-N 2.99Å; H84-P87 HydrophobicContact CB-CB 4.12Å; H84-M95 HydrophobicContact CB-CE 4.49Å; H84-M95 PolarHBondContact NE2-O 3.2Å
85	R	94.4	Very high	91.5	Very high	192 Å²	192	56.4 Å²	56.4	73%	0.725	30%	0.302	S	S	*	.	S	Bend	trans	-107.6	128.2	168.6	-66.3	-176	-177.1	-176.2	0	108.5	V83 C97	V83-R85 PolarHBondContact O-N 3.35Å; R85-C97 PolarHBondContact N-SG 3.39Å; R85-C97 VanDerWaalsContact O-CA 3.28Å; R85-C97 WeakPolarHBondContact O-CA 3.38Å; R85-C97 VanDerWaalsContact O-CB 3.28Å; R85-C97 WeakPolarHBondContact O-CB 3.38Å
86	L	95.7	Very high	92.1	Very high	17 Å²	17	50.8 Å²	50.8	9%	0.089	27%	0.271	C	S	.	.	S	Bend	trans	50.3	65.6	-172.9	-60.9	173.3	0	0	0	110	T88 A98 F130 E134 N138 I141	L86-T88 PolarHBondContact O-N 3.21Å; L86-T88 PolarHBondContact O-OG1 2.94Å; L86-A98 HydrophobicContact CB-CB 3.9Å; L86-A98 WeakPolarHBondContact O-CB 3.43Å; L86-A98 PolarHBondContact O-N 3.07Å; L86-F130 HydrophobicContact CB-CD1 4.03Å; L86-F130 HydrophobicContact CB-CE1 3.59Å; L86-F130 HydrophobicContact CB-CE2 4.29Å; L86-F130 HydrophobicContact CB-CZ 3.75Å; L86-F130 HydrophobicContact CD2-CD1 4.26Å; L86-F130 HydrophobicContact CD2-CD2 4.01Å; L86-F130 HydrophobicContact CD2-CE1 4.49Å; L86-F130 HydrophobicContact CD2-CE2 4.22Å; L86-F130 HydrophobicContact CD2-CG 4.08Å; L86-F130 HydrophobicContact CD2-CZ 4.48Å; L86-F130 VanDerWaalsContact O-CE1 3.26Å; L86-F130 WeakPolarHBondContact O-CE1 3.37Å; L86-E134 HydrophobicContact CD2-CB 3.66Å; L86-E134 HydrophobicContact CD2-CG 3.85Å; L86-N138 HydrophobicContact CD1-CB 4.32Å; L86-I141 HydrophobicContact CD1-CD1 3.41Å; L86-I141 VanDerWaalsContact CD1-CD1 3.41Å
87	P	94.5	Very high	92.3	Very high	27 Å²	27	48.2 Å²	48.2	18%	0.175	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	131.4	-173.5	22.2	-30.8	0	0	0	110.9	H84 M95 C129 F130	H84-P87 HydrophobicContact CB-CB 4.12Å; P87-M95 HydrophobicContact CB-CE 4.38Å; P87-M95 HydrophobicContact CB-CG 4.01Å; P87-M95 HydrophobicContact CB-SD 3.62Å; P87-C129 HydrophobicContact CB-CB 4.27Å; P87-C129 HydrophobicContact CG-CB 4.04Å; P87-C129 WeakPolarHBondContact CG-O 3.23Å; P87-C129 WeakPolarHBondContact O-CA 3.31Å; P87-C129 WeakPolarHBondContact O-CB 3.39Å; P87-C129 PolarHBondContact O-N 3.41Å; P87-F130 WeakPolarHBondContact O-CD1 3.3Å; P87-F130 WeakPolarHBondContact O-CE1 3.02Å
88	T	94.5	Very high	92.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.9	178.6	-55.3	0	0	0	0	108.8	L86 F96 A98 I101 L126 M127 I145	L86-T88 PolarHBondContact O-N 3.21Å; L86-T88 PolarHBondContact O-OG1 2.94Å; T88-F96 PolarHBondContact N-O 3.47Å; T88-F96 PolarHBondContact O-N 2.8Å; T88-A98 WeakPolarHBondContact OG1-CA 3.27Å; T88-A98 WeakPolarHBondContact OG1-CB 3.48Å; T88-I101 HydrophobicContact CG2-CG2 4.46Å; T88-L126 HydrophobicContact CG2-CB 3.8Å; T88-L126 HydrophobicContact CG2-CD2 4.07Å; T88-L126 HydrophobicContact CG2-CG 4.4Å; T88-M127 WeakPolarHBondContact CA-O 3.46Å; T88-I145 HydrophobicContact CG2-CD1 4.09Å
89	L	91.8	Very high	92.6	Very high	15 Å²	15	52.5 Å²	52.5	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131	-179	-173.5	70.1	0	0	0	110.2	G93 M95 L126 M127	L89-G93 WeakPolarHBondContact CD1-O 3.48Å; L89-M95 HydrophobicContact CD1-CB 4.32Å; L89-L126 CarbonylContact O-C 3.54Å; L89-M127 HydrophobicContact CB-CB 4.29Å; L89-M127 HydrophobicContact CB-CE 4.38Å; L89-M127 HydrophobicContact CD2-CE 3.94Å; L89-M127 HydrophobicContact CG-CE 4.06Å; L89-M127 PolarHBondContact N-O 3.08Å; L89-M127 PolarHBondContact O-N 3.11Å
90	S	90	Very high	92.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	156.7	172.1	58.9	0	0	0	0	111.5	C92 G93 H94	S90-C92 PolarHBondContact O-N 2.77Å; S90-C92 PolarHBondContact OG-SG 3.19Å; S90-G93 PolarHBondContact O-N 2.96Å; S90-H94 PolarHBondContact N-O 2.84Å; S90-H94 PolarHBondContact OG-N 2.99Å; S90-H94 PolarHBondContact OG-O 2.82Å
91	N	84.9	Confident	92.8	Very high	69 Å²	69	48.2 Å²	48.2	37%	0.369	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-22.5	171.6	63.5	-47.6	0	0	0	114.4	G93 S122 V123 T124 L125	N91-G93 VanDerWaalsContact C-N 3.26Å; N91-S122 PolarHBondContact ND2-O 2.76Å; N91-S122 VanDerWaalsContact ND2-O 3.13Å; N91-S122 PolarHBondContact OD1-O 2.92Å; N91-V123 VanDerWaalsContact OD1-CA 3.23Å; N91-V123 WeakPolarHBondContact OD1-CA 3.45Å; N91-T124 PolarHBondContact ND2-OG1 3.29Å; N91-T124 PolarHBondContact OD1-N 3.35Å; N91-L125 HydrophobicContact CB-CB 4.21Å; N91-L125 PolarHBondContact N-O 2.54Å; N91-L125 VanDerWaalsContact N-O 3.08Å
92	C	84.3	Confident	92.8	Very high	36 Å²	36	42 Å²	42	24%	0.243	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	0.5	174.5	73.6	0	0	0	0	114.1	S90 H94 C116 C119	S90-C92 PolarHBondContact O-N 2.77Å; S90-C92 PolarHBondContact OG-SG 3.19Å; C92-H94 PolarHBondContact SG-ND1 2.94Å; C92-C116 PolarHBondContact SG-SG 3.02Å; C92-C119 PolarHBondContact SG-SG 3.34Å
93	G	84.2	Confident	92.8	Very high	11 Å²	11	37.2 Å²	37.2	11%	0.113	19%	0.193	C	C	.	.	S	Bend	trans	87.7	0.4	176.7	0	0	0	0	0	115.5	L89 S90 N91	L89-G93 WeakPolarHBondContact CD1-O 3.48Å; S90-G93 PolarHBondContact O-N 2.96Å; N91-G93 VanDerWaalsContact C-N 3.26Å
94	H	89.6	Confident	92.8	Very high	30 Å²	30	37.2 Å²	37.2	14%	0.139	18%	0.183	C	C	.	.			trans	-89.3	145	176.1	-63	98.2	0	0	0	111.7	S90 C92 F96 M118 C119	S90-H94 PolarHBondContact N-O 2.84Å; S90-H94 PolarHBondContact OG-N 2.99Å; S90-H94 PolarHBondContact OG-O 2.82Å; C92-H94 PolarHBondContact SG-ND1 2.94Å; H94-F96 HydrophobicContact CB-CE2 3.76Å; H94-F96 HydrophobicContact CB-CZ 3.68Å; H94-M118 HydrophobicContact CB-CB 4.25Å; H94-M118 HydrophobicContact CB-CG 4.23Å; H94-M118 VanDerWaalsContact CD2-CB 3.5Å; H94-M118 WeakPolarHBondContact CD2-CB 3.38Å; H94-C119 VanDerWaalsContact CE1-CB 3.49Å; H94-C119 WeakPolarHBondContact CE1-CB 3.38Å
95	M	92.1	Very high	92.7	Very high	63 Å²	63	37.7 Å²	37.7	31%	0.31	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.5	-175	-168	165.8	70.4	0	0	112.3	H84 P87 L89	H84-M95 HydrophobicContact CB-CE 4.49Å; H84-M95 PolarHBondContact NE2-O 3.2Å; P87-M95 HydrophobicContact CB-CE 4.38Å; P87-M95 HydrophobicContact CB-CG 4.01Å; P87-M95 HydrophobicContact CB-SD 3.62Å; L89-M95 HydrophobicContact CD1-CB 4.32Å
96	F	95.3	Very high	92.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	162.5	-178.3	-50.8	-83.7	0	0	0	110.9	C78 V79 T88 H94 I101 P117 M118	C78-F96 VanDerWaalsContact SG-CE1 3.52Å; V79-F96 HydrophobicContact CG2-CD1 4.17Å; T88-F96 PolarHBondContact N-O 3.47Å; T88-F96 PolarHBondContact O-N 2.8Å; H94-F96 HydrophobicContact CB-CE2 3.76Å; H94-F96 HydrophobicContact CB-CZ 3.68Å; F96-I101 HydrophobicContact CB-CB 3.91Å; F96-I101 HydrophobicContact CB-CG2 4.49Å; F96-I101 HydrophobicContact CD2-CB 4.47Å; F96-I101 HydrophobicContact CD2-CD1 3.89Å; F96-I101 HydrophobicContact CD2-CG1 4.18Å; F96-I101 HydrophobicContact CE2-CD1 4.22Å; F96-I101 HydrophobicContact CG-CB 4.33Å; F96-I101 HydrophobicContact CG-CD1 4.09Å; F96-I101 HydrophobicContact CG-CG1 4.45Å; F96-P117 HydrophobicContact CE1-CB 4.1Å; F96-P117 HydrophobicContact CE1-CG 4Å; F96-P117 HydrophobicContact CZ-CG 4.32Å; F96-M118 HydrophobicContact CE1-CG 3.83Å; F96-M118 HydrophobicContact CZ-CB 4.49Å; F96-M118 HydrophobicContact CZ-CG 3.9Å
97	C	96.4	Very high	92	Very high	8 Å²	8	41.2 Å²	41.2	5%	0.054	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	140	164.7	-55.4	0	0	0	0	109.2	C77 R85 Q99 C100 I101	C77-C97 VanDerWaalsContact CB-SG 3.55Å; C77-C97 PolarHBondContact SG-N 2.88Å; R85-C97 PolarHBondContact N-SG 3.39Å; R85-C97 VanDerWaalsContact O-CA 3.28Å; R85-C97 WeakPolarHBondContact O-CA 3.38Å; R85-C97 VanDerWaalsContact O-CB 3.28Å; R85-C97 WeakPolarHBondContact O-CB 3.38Å; C97-Q99 VanDerWaalsContact C-N 3.33Å; C97-Q99 PolarHBondContact O-N 3.48Å; C97-C100 HydrophobicContact CB-CB 3.95Å; C97-C100 WeakPolarHBondContact O-CB 3.45Å; C97-C100 PolarHBondContact O-N 3.26Å; C97-I101 PolarHBondContact O-N 3.13Å
98	A	96.8	Very high	91.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-52.7	-49.6	179.2	0	0	0	0	0	112.5	L86 T88 C100 I101 L102 F130 I141 I145	L86-A98 HydrophobicContact CB-CB 3.9Å; L86-A98 WeakPolarHBondContact O-CB 3.43Å; L86-A98 PolarHBondContact O-N 3.07Å; T88-A98 WeakPolarHBondContact OG1-CA 3.27Å; T88-A98 WeakPolarHBondContact OG1-CB 3.48Å; A98-C100 VanDerWaalsContact C-N 3.29Å; A98-C100 PolarHBondContact O-N 3.49Å; A98-I101 WeakPolarHBondContact O-CG2 3.43Å; A98-I101 PolarHBondContact O-N 3.22Å; A98-L102 VanDerWaalsContact O-CB 3.31Å; A98-L102 WeakPolarHBondContact O-CB 3.49Å; A98-L102 VanDerWaalsContact O-CG 3.23Å; A98-L102 WeakPolarHBondContact O-CG 3.35Å; A98-L102 PolarHBondContact O-N 2.91Å; A98-F130 HydrophobicContact CB-CE1 4.14Å; A98-F130 HydrophobicContact CB-CZ 3.66Å; A98-I141 HydrophobicContact CB-CG2 3.5Å; A98-I145 HydrophobicContact CB-CD1 4.2Å
99	Q	96.7	Very high	90.1	Very high	137 Å²	137	47.8 Å²	47.8	64%	0.64	25%	0.245	S	C	*	.	H	α-helix	trans	-63.7	-34.2	178.4	-66.9	179	-1.3	0	0	112.7	C97 G103 I141	C97-Q99 VanDerWaalsContact C-N 3.33Å; C97-Q99 PolarHBondContact O-N 3.48Å; Q99-G103 WeakPolarHBondContact O-CA 3.47Å; Q99-G103 PolarHBondContact O-N 3.33Å; Q99-I141 HydrophobicContact CG-CD1 4Å
100	C	96.5	Very high	89	Confident	25 Å²	25	51 Å²	51	17%	0.169	26%	0.261	C	S	.	.	H	α-helix	trans	-71.2	-43.9	179.6	-67.7	0	0	0	0	111.9	V79 C97 A98 Y104	V79-C100 HydrophobicContact CB-CB 3.84Å; V79-C100 HydrophobicContact CG1-CB 3.87Å; V79-C100 HydrophobicContact CG2-CB 4.34Å; C97-C100 HydrophobicContact CB-CB 3.95Å; C97-C100 WeakPolarHBondContact O-CB 3.45Å; C97-C100 PolarHBondContact O-N 3.26Å; A98-C100 VanDerWaalsContact C-N 3.29Å; A98-C100 PolarHBondContact O-N 3.49Å; C100-Y104 WeakPolarHBondContact O-CB 3.36Å; C100-Y104 PolarHBondContact O-N 3.3Å
101	I	95.2	Very high	88.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-73.2	-38.2	-179	-164.3	60.7	0	0	0	111.7	T88 F96 C97 A98 Y104 W105 L114 P117 L126	T88-I101 HydrophobicContact CG2-CG2 4.46Å; F96-I101 HydrophobicContact CB-CB 3.91Å; F96-I101 HydrophobicContact CB-CG2 4.49Å; F96-I101 HydrophobicContact CD2-CB 4.47Å; F96-I101 HydrophobicContact CD2-CD1 3.89Å; F96-I101 HydrophobicContact CD2-CG1 4.18Å; F96-I101 HydrophobicContact CE2-CD1 4.22Å; F96-I101 HydrophobicContact CG-CB 4.33Å; F96-I101 HydrophobicContact CG-CD1 4.09Å; F96-I101 HydrophobicContact CG-CG1 4.45Å; C97-I101 PolarHBondContact O-N 3.13Å; A98-I101 WeakPolarHBondContact O-CG2 3.43Å; A98-I101 PolarHBondContact O-N 3.22Å; I101-Y104 HydrophobicContact CD1-CD1 4.35Å; I101-Y104 PolarHBondContact O-N 2.93Å; I101-W105 PolarHBondContact O-N 2.8Å; I101-L114 HydrophobicContact CD1-CD1 3.72Å; I101-L114 HydrophobicContact CD1-CD2 4.02Å; I101-L114 HydrophobicContact CG1-CD1 4.41Å; I101-L114 HydrophobicContact CG1-CD2 3.91Å; I101-P117 HydrophobicContact CD1-CG 4.28Å; I101-L126 HydrophobicContact CG1-CD2 4.02Å; I101-L126 HydrophobicContact CG2-CD1 4.32Å; I101-L126 HydrophobicContact CG2-CD2 4.34Å
102	L	95.3	Very high	87.8	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-45.7	172.9	-69.8	172.7	0	0	0	111.4	A98 Y104 W105 Q106 L126 I141 E144 I145	A98-L102 VanDerWaalsContact O-CB 3.31Å; A98-L102 WeakPolarHBondContact O-CB 3.49Å; A98-L102 VanDerWaalsContact O-CG 3.23Å; A98-L102 WeakPolarHBondContact O-CG 3.35Å; A98-L102 PolarHBondContact O-N 2.91Å; L102-Y104 VanDerWaalsContact C-N 3.35Å; L102-Y104 PolarHBondContact O-N 3.31Å; L102-W105 WeakPolarHBondContact O-CB 3.5Å; L102-W105 PolarHBondContact O-N 3.41Å; L102-Q106 VanDerWaalsContact O-CG 3.31Å; L102-Q106 WeakPolarHBondContact O-CG 3.45Å; L102-Q106 PolarHBondContact O-N 2.96Å; L102-L126 HydrophobicContact CD2-CD1 4.5Å; L102-I141 HydrophobicContact CD1-CG2 4.21Å; L102-E144 HydrophobicContact CD1-CB 3.73Å; L102-E144 HydrophobicContact CD2-CB 4.11Å; L102-I145 HydrophobicContact CD1-CG1 4.15Å; L102-I145 HydrophobicContact CD2-CG1 4.33Å; L102-I145 HydrophobicContact CG-CG1 4.48Å
103	G	94.2	Very high	87.9	Confident	18 Å²	18	54.3 Å²	54.3	19%	0.186	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-43.3	175.3	0	0	0	0	0	111.9	Q99 W105 Q106 H107	Q99-G103 WeakPolarHBondContact O-CA 3.47Å; Q99-G103 PolarHBondContact O-N 3.33Å; G103-W105 VanDerWaalsContact C-N 3.31Å; G103-W105 PolarHBondContact O-N 3.27Å; G103-Q106 PolarHBondContact O-N 3.2Å; G103-H107 PolarHBondContact O-N 2.68Å; G103-H107 PolarHBondContact O-ND1 3.02Å
104	Y	93.6	Very high	88.1	Confident	102 Å²	102	54.3 Å²	54.3	40%	0.4	29%	0.289	S	S	.	.	H	α-helix	trans	-59.3	-42	174.5	175.3	-100.3	0	0	0	112.1	C100 I101 L102 H107 G108 L114 R115 P117	C100-Y104 WeakPolarHBondContact O-CB 3.36Å; C100-Y104 PolarHBondContact O-N 3.3Å; I101-Y104 HydrophobicContact CD1-CD1 4.35Å; I101-Y104 PolarHBondContact O-N 2.93Å; L102-Y104 VanDerWaalsContact C-N 3.35Å; L102-Y104 PolarHBondContact O-N 3.31Å; Y104-H107 PolarHBondContact O-N 3.41Å; Y104-G108 PolarHBondContact O-N 3.24Å; Y104-L114 HydrophobicContact CD1-CB 4.44Å; Y104-L114 HydrophobicContact CD1-CD1 4.23Å; Y104-L114 HydrophobicContact CE1-CB 4.35Å; Y104-L114 HydrophobicContact CE1-CD1 4.18Å; Y104-R115 WeakPolarHBondContact CE1-O 3.38Å; Y104-R115 PolarHBondContact OH-O 3.45Å; Y104-P117 HydrophobicContact CD1-CG 4Å; Y104-P117 HydrophobicContact CD2-CG 4.45Å; Y104-P117 HydrophobicContact CE1-CG 3.89Å; Y104-P117 HydrophobicContact CE2-CG 4.34Å; Y104-P117 HydrophobicContact CG-CG 4.27Å
105	W	91.3	Very high	88.1	Confident	37 Å²	37	61.4 Å²	61.4	14%	0.14	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-42.1	174.7	172.1	60.7	0	0	0	112.9	I101 L102 G103 H107 G108 L114 Y148 R151 F152	I101-W105 PolarHBondContact O-N 2.8Å; L102-W105 WeakPolarHBondContact O-CB 3.5Å; L102-W105 PolarHBondContact O-N 3.41Å; G103-W105 VanDerWaalsContact C-N 3.31Å; G103-W105 PolarHBondContact O-N 3.27Å; W105-H107 PolarHBondContact O-N 3.33Å; W105-G108 PolarHBondContact O-N 2.87Å; W105-L114 HydrophobicContact CB-CB 4.26Å; W105-L114 HydrophobicContact CB-CD2 3.73Å; W105-L114 HydrophobicContact CG-CD2 4.27Å; W105-Y148 AromaticContact CD1-CE2 3.69Å; W105-Y148 AromaticContact CD2-CD2 3.81Å; W105-Y148 HydrophobicContact CD2-CD2 3.81Å; W105-Y148 HydrophobicContact CD2-CE2 4.02Å; W105-Y148 AromaticContact CE2-CD2 3.82Å; W105-Y148 AromaticContact CE2-CE2 3.97Å; W105-Y148 HydrophobicContact CE3-CD2 4.24Å; W105-Y148 HydrophobicContact CG-CD2 4.08Å; W105-Y148 AromaticContact CG-CE2 3.82Å; W105-Y148 HydrophobicContact CG-CE2 3.82Å; W105-Y148 HydrophobicContact CZ2-CD2 4.24Å; W105-Y148 AromaticContact NE1-CE2 3.74Å; W105-R151 VanDerWaalsContact CH2-NH1 3.32Å; W105-F152 AromaticContact CE2-CE2 3.99Å; W105-F152 HydrophobicContact CZ2-CE2 4.01Å; W105-F152 HydrophobicContact CZ2-CZ 4.45Å; W105-F152 AromaticContact NE1-CE2 3.66Å; W105-F152 AromaticContact NE1-CZ 3.9Å
106	Q	87.8	Confident	88	Confident	114 Å²	114	58.4 Å²	58.4	53%	0.533	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-29.3	179.2	-71.1	168.7	6.8	0	0	113.1	L102 G103 G108 E144	L102-Q106 VanDerWaalsContact O-CG 3.31Å; L102-Q106 WeakPolarHBondContact O-CG 3.45Å; L102-Q106 PolarHBondContact O-N 2.96Å; G103-Q106 PolarHBondContact O-N 3.2Å; Q106-G108 VanDerWaalsContact C-N 3.34Å; Q106-E144 PolarHBondContact NE2-OE2 2.89Å
107	H	86.3	Confident	87.8	Confident	169 Å²	169	60.4 Å²	60.4	78%	0.782	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.9	175	-67	79.9	0	0	0	113.3	G103 Y104 W105	G103-H107 PolarHBondContact O-N 2.68Å; G103-H107 PolarHBondContact O-ND1 3.02Å; Y104-H107 PolarHBondContact O-N 3.41Å; W105-H107 PolarHBondContact O-N 3.33Å
108	G	78.7	Confident	87.5	Confident	40 Å²	40	63.9 Å²	63.9	41%	0.412	33%	0.329	S	S	.	.	S	Bend	trans	-80.1	-175.7	178.9	0	0	0	0	0	113.8	Y104 W105 Q106 I110	Y104-G108 PolarHBondContact O-N 3.24Å; W105-G108 PolarHBondContact O-N 2.87Å; Q106-G108 VanDerWaalsContact C-N 3.34Å; G108-I110 PolarHBondContact O-N 3.39Å
109	F	70.9	Confident	87	Confident	126 Å²	126	66.7 Å²	66.7	55%	0.553	35%	0.348	S	S	*	.			trans	-70.3	119.4	174.9	-172.9	-94	0	0	0	110.6	G111 N112	F109-G111 PolarHBondContact O-N 3.32Å; F109-N112 HydrophobicContact CD1-CB 4.46Å; F109-N112 WeakPolarHBondContact CD1-ND2 3.38Å; F109-N112 PolarHBondContact O-N 2.9Å
110	I	68.7	Low	86.6	Confident	83 Å²	83	70 Å²	70	43%	0.426	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	124.5	-179.3	-60.1	169.2	0	0	0	109.4	G108	G108-I110 PolarHBondContact O-N 3.39Å
111	G	70.7	Confident	85.9	Confident	44 Å²	44	70.2 Å²	70.2	45%	0.454	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.8	-13.5	173.2	0	0	0	0	0	115.8	F109	F109-G111 PolarHBondContact O-N 3.32Å
112	N	79.7	Confident	85.5	Confident	98 Å²	98	74 Å²	74	52%	0.524	39%	0.387	S	S	.	.	S	Bend	trans	-100.1	150.6	174.8	-72.3	-27.4	0	0	0	111.7	F109 F152	F109-N112 HydrophobicContact CD1-CB 4.46Å; F109-N112 WeakPolarHBondContact CD1-ND2 3.38Å; F109-N112 PolarHBondContact O-N 2.9Å; N112-F152 WeakPolarHBondContact O-CZ 3.15Å
113	A	85.8	Confident	85.3	Confident	32 Å²	32	73.8 Å²	73.8	26%	0.264	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-58.5	138.5	166.8	0	0	0	0	0	109.3	F152	A113-F152 HydrophobicContact CB-CB 4.29Å; A113-F152 HydrophobicContact CB-CD1 3.72Å; A113-F152 HydrophobicContact CB-CE1 4.21Å; A113-F152 HydrophobicContact CB-CG 3.98Å
114	L	88.1	Confident	85	Confident	10 Å²	10	75.4 Å²	75.4	5%	0.052	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-66	150.1	178.2	73.9	90.8	0	0	0	110.2	I101 Y104 W105 V123 Y148	I101-L114 HydrophobicContact CD1-CD1 3.72Å; I101-L114 HydrophobicContact CD1-CD2 4.02Å; I101-L114 HydrophobicContact CG1-CD1 4.41Å; I101-L114 HydrophobicContact CG1-CD2 3.91Å; Y104-L114 HydrophobicContact CD1-CB 4.44Å; Y104-L114 HydrophobicContact CD1-CD1 4.23Å; Y104-L114 HydrophobicContact CE1-CB 4.35Å; Y104-L114 HydrophobicContact CE1-CD1 4.18Å; W105-L114 HydrophobicContact CB-CB 4.26Å; W105-L114 HydrophobicContact CB-CD2 3.73Å; W105-L114 HydrophobicContact CG-CD2 4.27Å; L114-V123 HydrophobicContact CD1-CB 3.72Å; L114-V123 HydrophobicContact CD1-CG1 4.32Å; L114-V123 HydrophobicContact CD1-CG2 3.62Å; L114-V123 HydrophobicContact CG-CB 3.92Å; L114-V123 HydrophobicContact CG-CG1 4.42Å; L114-V123 HydrophobicContact CG-CG2 4.38Å; L114-V123 PolarHBondContact O-N 2.99Å; L114-Y148 HydrophobicContact CD2-CE2 3.7Å; L114-Y148 HydrophobicContact CG-CE2 4.31Å; L114-Y148 VanDerWaalsContact CG-OH 3.31Å; L114-Y148 WeakPolarHBondContact CG-OH 3.37Å; L114-Y148 PolarHBondContact N-OH 3.47Å; L114-Y148 VanDerWaalsContact N-OH 3.11Å
115	R	89.4	Confident	84.9	Confident	179 Å²	179	73.4 Å²	73.4	68%	0.675	39%	0.388	S	S	*	.	B	Isolated β-bridge	trans	-92	130.3	169.1	-69.5	-175.3	179.2	167.7	-1.4	109.7	Y104 P117 G121	Y104-R115 WeakPolarHBondContact CE1-O 3.38Å; Y104-R115 PolarHBondContact OH-O 3.45Å; R115-P117 WeakPolarHBondContact O-CD 3.29Å; R115-G121 CarbonylContact C-O 3.56Å; R115-G121 WeakPolarHBondContact CA-O 3.31Å
116	C	90.1	Very high	85.1	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.007	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-52.3	125	-179.4	176.1	0	0	0	0	111.1	C92 M118 C119 R120 G121 V123	C92-C116 PolarHBondContact SG-SG 3.02Å; C116-M118 PolarHBondContact O-N 3.29Å; C116-M118 VanDerWaalsContact O-N 3.16Å; C116-M118 PolarHBondContact SG-N 3.31Å; C116-M118 VanDerWaalsContact SG-N 3.41Å; C116-C119 PolarHBondContact SG-N 2.77Å; C116-R120 WeakPolarHBondContact O-CA 3.31Å; C116-R120 PolarHBondContact O-N 2.87Å; C116-G121 PolarHBondContact N-O 3.48Å; C116-V123 HydrophobicContact CB-CG2 3.79Å
117	P	91.5	Very high	85.3	Confident	42 Å²	42	68 Å²	68	27%	0.273	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.4	177.1	-27.3	34.7	0	0	0	114.4	V79 F96 I101 Y104 R115	V79-P117 HydrophobicContact CG2-CG 4.31Å; F96-P117 HydrophobicContact CE1-CB 4.1Å; F96-P117 HydrophobicContact CE1-CG 4Å; F96-P117 HydrophobicContact CZ-CG 4.32Å; I101-P117 HydrophobicContact CD1-CG 4.28Å; Y104-P117 HydrophobicContact CD1-CG 4Å; Y104-P117 HydrophobicContact CD2-CG 4.45Å; Y104-P117 HydrophobicContact CE1-CG 3.89Å; Y104-P117 HydrophobicContact CE2-CG 4.34Å; Y104-P117 HydrophobicContact CG-CG 4.27Å; R115-P117 WeakPolarHBondContact O-CD 3.29Å
118	M	89.9	Confident	85.8	Confident	81 Å²	81	61.8 Å²	61.8	40%	0.399	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-55.2	-177.9	-66.3	-71.9	-81.2	0	0	112.7	C78 H94 F96 C116	C78-M118 HydrophobicContact CB-CG 4.39Å; C78-M118 HydrophobicContact CB-SD 3.42Å; C78-M118 WeakPolarHBondContact CB-SD 3.47Å; H94-M118 HydrophobicContact CB-CB 4.25Å; H94-M118 HydrophobicContact CB-CG 4.23Å; H94-M118 VanDerWaalsContact CD2-CB 3.5Å; H94-M118 WeakPolarHBondContact CD2-CB 3.38Å; F96-M118 HydrophobicContact CE1-CG 3.83Å; F96-M118 HydrophobicContact CZ-CB 4.49Å; F96-M118 HydrophobicContact CZ-CG 3.9Å; C116-M118 PolarHBondContact O-N 3.29Å; C116-M118 VanDerWaalsContact O-N 3.16Å; C116-M118 PolarHBondContact SG-N 3.31Å; C116-M118 VanDerWaalsContact SG-N 3.41Å
119	C	86.7	Confident	86.4	Confident	59 Å²	59	63 Å²	63	40%	0.399	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-2	-173.9	68.9	0	0	0	0	114.9	C92 H94 C116 G121	C92-C119 PolarHBondContact SG-SG 3.34Å; H94-C119 VanDerWaalsContact CE1-CB 3.49Å; H94-C119 WeakPolarHBondContact CE1-CB 3.38Å; C116-C119 PolarHBondContact SG-N 2.77Å; C119-G121 PolarHBondContact O-N 3.28Å
120	R	89.2	Confident	87.5	Confident	207 Å²	207	58.2 Å²	58.2	78%	0.781	32%	0.32	S	S	*	.			trans	62.2	5.2	-178.4	-50.1	178.9	-178.9	-151.4	-1.2	115.5	C116	C116-R120 WeakPolarHBondContact O-CA 3.31Å; C116-R120 PolarHBondContact O-N 2.87Å
121	G	81.5	Confident	88.6	Confident	29 Å²	29	58 Å²	58	30%	0.299	32%	0.323	S	S	.	.			trans	-66.7	158.6	172.8	0	0	0	0	0	112.7	R115 C116 C119	R115-G121 CarbonylContact C-O 3.56Å; R115-G121 WeakPolarHBondContact CA-O 3.31Å; C116-G121 PolarHBondContact N-O 3.48Å; C119-G121 PolarHBondContact O-N 3.28Å
122	S	86.9	Confident	89.7	Confident	78 Å²	78	59.9 Å²	59.9	55%	0.545	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-70.4	130.3	176.5	48.8	0	0	0	0	111.3	N91	N91-S122 PolarHBondContact ND2-O 2.76Å; N91-S122 VanDerWaalsContact ND2-O 3.13Å; N91-S122 PolarHBondContact OD1-O 2.92Å
123	V	90	Very high	90.4	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.345	C	S	.	.			trans	-100.4	99.7	177.5	179.7	0	0	0	0	109.9	N91 L114 C116 L126 Y148	N91-V123 VanDerWaalsContact OD1-CA 3.23Å; N91-V123 WeakPolarHBondContact OD1-CA 3.45Å; L114-V123 HydrophobicContact CD1-CB 3.72Å; L114-V123 HydrophobicContact CD1-CG1 4.32Å; L114-V123 HydrophobicContact CD1-CG2 3.62Å; L114-V123 HydrophobicContact CG-CB 3.92Å; L114-V123 HydrophobicContact CG-CG1 4.42Å; L114-V123 HydrophobicContact CG-CG2 4.38Å; L114-V123 PolarHBondContact O-N 2.99Å; C116-V123 HydrophobicContact CB-CG2 3.79Å; V123-L126 HydrophobicContact CG1-CD2 3.69Å; V123-L126 HydrophobicContact CG1-CG 4.21Å; V123-Y148 HydrophobicContact CG1-CE1 4.34Å; V123-Y148 WeakPolarHBondContact O-CE1 3.28Å; V123-Y148 PolarHBondContact O-OH 2.91Å
124	T	88.7	Confident	90.9	Very high	52 Å²	52	64.5 Å²	64.5	32%	0.319	35%	0.347	S	S	.	.			trans	-92.8	-20.9	179.2	50.9	0	0	0	0	113	N91 F152 S153	N91-T124 PolarHBondContact ND2-OG1 3.29Å; N91-T124 PolarHBondContact OD1-N 3.35Å; T124-F152 WeakPolarHBondContact CB-O 3.33Å; T124-F152 WeakPolarHBondContact CG2-O 3.46Å; T124-F152 CarbonylContact O-C 3.6Å; T124-F152 VanDerWaalsContact O-C 3.25Å; T124-S153 WeakPolarHBondContact O-CA 3.42Å; T124-S153 PolarHBondContact O-N 3.42Å
125	L	91.5	Very high	91.1	Very high	60 Å²	60	70 Å²	70	31%	0.314	37%	0.367	S	S	.	.			trans	-137.7	134.6	-177	-169.4	73	0	0	0	110.7	N91 M127 N149	N91-L125 HydrophobicContact CB-CB 4.21Å; N91-L125 PolarHBondContact N-O 2.54Å; N91-L125 VanDerWaalsContact N-O 3.08Å; L125-M127 HydrophobicContact CD2-CG 3.9Å; L125-M127 HydrophobicContact CD2-SD 4.01Å; L125-M127 HydrophobicContact CG-CG 4.13Å; L125-N149 HydrophobicContact CD1-CB 4.15Å
126	L	94.4	Very high	91.4	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	119.1	171.6	-68.8	177.5	0	0	0	108.9	T88 L89 I101 L102 V123 I145 Y148 N149	T88-L126 HydrophobicContact CG2-CB 3.8Å; T88-L126 HydrophobicContact CG2-CD2 4.07Å; T88-L126 HydrophobicContact CG2-CG 4.4Å; L89-L126 CarbonylContact O-C 3.54Å; I101-L126 HydrophobicContact CG1-CD2 4.02Å; I101-L126 HydrophobicContact CG2-CD1 4.32Å; I101-L126 HydrophobicContact CG2-CD2 4.34Å; L102-L126 HydrophobicContact CD2-CD1 4.5Å; V123-L126 HydrophobicContact CG1-CD2 3.69Å; V123-L126 HydrophobicContact CG1-CG 4.21Å; L126-I145 HydrophobicContact CB-CG2 3.94Å; L126-I145 WeakPolarHBondContact O-CG2 3.2Å; L126-Y148 HydrophobicContact CB-CD1 4.34Å; L126-Y148 HydrophobicContact CD1-CD1 3.49Å; L126-Y148 VanDerWaalsContact CD1-CD1 3.49Å; L126-Y148 HydrophobicContact CD1-CD2 4.27Å; L126-Y148 HydrophobicContact CD1-CE1 3.87Å; L126-Y148 HydrophobicContact CD1-CG 3.73Å; L126-Y148 HydrophobicContact CG-CD1 3.69Å; L126-Y148 HydrophobicContact CG-CE1 3.81Å; L126-Y148 HydrophobicContact CG-CG 4.44Å; L126-N149 PolarHBondContact N-OD1 2.7Å; L126-N149 PolarHBondContact O-ND2 3.2Å; L126-N149 PolarHBondContact O-OD1 3.03Å
127	M	93.6	Very high	91.7	Very high	38 Å²	38	73 Å²	73	19%	0.187	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	106.7	-178.6	-66.3	167.4	-75.8	0	0	108.6	T88 L89 L125 C129	T88-M127 WeakPolarHBondContact CA-O 3.46Å; L89-M127 HydrophobicContact CB-CB 4.29Å; L89-M127 HydrophobicContact CB-CE 4.38Å; L89-M127 HydrophobicContact CD2-CE 3.94Å; L89-M127 HydrophobicContact CG-CE 4.06Å; L89-M127 PolarHBondContact N-O 3.08Å; L89-M127 PolarHBondContact O-N 3.11Å; L125-M127 HydrophobicContact CD2-CG 3.9Å; L125-M127 HydrophobicContact CD2-SD 4.01Å; L125-M127 HydrophobicContact CG-CG 4.13Å; M127-C129 PolarHBondContact O-N 3.22Å
128	P	95.1	Very high	91.9	Very high	38 Å²	38	73.2 Å²	73.2	25%	0.247	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	120.1	179.1	27.9	-30.4	0	0	0	110.1	F130 I142 I145	P128-F130 VanDerWaalsContact C-N 3.25Å; P128-F130 HydrophobicContact CB-CD1 3.84Å; P128-F130 HydrophobicContact CB-CD2 4.23Å; P128-F130 HydrophobicContact CB-CE1 3.62Å; P128-F130 HydrophobicContact CB-CE2 4.08Å; P128-F130 HydrophobicContact CB-CG 4.09Å; P128-F130 HydrophobicContact CB-CZ 3.74Å; P128-F130 PolarHBondContact O-N 3.37Å; P128-I142 HydrophobicContact CB-CD1 4.07Å; P128-I142 HydrophobicContact CG-CD1 4.07Å; P128-I145 HydrophobicContact CB-CD1 3.99Å; P128-I145 HydrophobicContact CG-CG2 4.34Å
129	C	92.7	Very high	92.2	Very high	66 Å²	66	73 Å²	73	45%	0.446	41%	0.405	S	S	.	.			trans	-92.9	45.9	176.7	-57.8	0	0	0	0	110.7	P87 M127	P87-C129 HydrophobicContact CB-CB 4.27Å; P87-C129 HydrophobicContact CG-CB 4.04Å; P87-C129 WeakPolarHBondContact CG-O 3.23Å; P87-C129 WeakPolarHBondContact O-CA 3.31Å; P87-C129 WeakPolarHBondContact O-CB 3.39Å; P87-C129 PolarHBondContact O-N 3.41Å; M127-C129 PolarHBondContact O-N 3.22Å
130	F	92.9	Very high	92.7	Very high	26 Å²	26	75.6 Å²	75.6	11%	0.114	42%	0.415	C	S	.	.			trans	-87.9	146.5	-173.7	-57.9	1	0	0	0	110	L86 P87 A98 P128 E134 R135 I141 I142 I145	L86-F130 HydrophobicContact CB-CD1 4.03Å; L86-F130 HydrophobicContact CB-CE1 3.59Å; L86-F130 HydrophobicContact CB-CE2 4.29Å; L86-F130 HydrophobicContact CB-CZ 3.75Å; L86-F130 HydrophobicContact CD2-CD1 4.26Å; L86-F130 HydrophobicContact CD2-CD2 4.01Å; L86-F130 HydrophobicContact CD2-CE1 4.49Å; L86-F130 HydrophobicContact CD2-CE2 4.22Å; L86-F130 HydrophobicContact CD2-CG 4.08Å; L86-F130 HydrophobicContact CD2-CZ 4.48Å; L86-F130 VanDerWaalsContact O-CE1 3.26Å; L86-F130 WeakPolarHBondContact O-CE1 3.37Å; P87-F130 WeakPolarHBondContact O-CD1 3.3Å; P87-F130 WeakPolarHBondContact O-CE1 3.02Å; A98-F130 HydrophobicContact CB-CE1 4.14Å; A98-F130 HydrophobicContact CB-CZ 3.66Å; P128-F130 VanDerWaalsContact C-N 3.25Å; P128-F130 HydrophobicContact CB-CD1 3.84Å; P128-F130 HydrophobicContact CB-CD2 4.23Å; P128-F130 HydrophobicContact CB-CE1 3.62Å; P128-F130 HydrophobicContact CB-CE2 4.08Å; P128-F130 HydrophobicContact CB-CG 4.09Å; P128-F130 HydrophobicContact CB-CZ 3.74Å; P128-F130 PolarHBondContact O-N 3.37Å; F130-E134 HydrophobicContact CB-CB 4.01Å; F130-R135 HydrophobicContact CB-CB 4.47Å; F130-I141 HydrophobicContact CE2-CG2 3.93Å; F130-I141 HydrophobicContact CZ-CG2 3.9Å; F130-I142 HydrophobicContact CD2-CD1 3.55Å; F130-I142 HydrophobicContact CD2-CG1 4.26Å; F130-I142 HydrophobicContact CE2-CD1 3.48Å; F130-I142 VanDerWaalsContact CE2-CD1 3.48Å; F130-I142 HydrophobicContact CE2-CG1 4.13Å; F130-I142 HydrophobicContact CZ-CD1 4.43Å; F130-I145 HydrophobicContact CE2-CD1 4.46Å; F130-I145 HydrophobicContact CZ-CD1 3.79Å
131	T	92.6	Very high	93	Very high	78 Å²	78	66.4 Å²	66.4	48%	0.479	38%	0.381	S	S	.	.			trans	-64.5	159	165.2	62.5	0	0	0	0	110.7	Q133 E134 R135	T131-Q133 PolarHBondContact O-N 2.81Å; T131-E134 WeakPolarHBondContact CB-OE2 3.32Å; T131-E134 WeakPolarHBondContact CG2-OE2 3.29Å; T131-E134 PolarHBondContact N-OE2 3.36Å; T131-E134 PolarHBondContact O-N 3.32Å; T131-E134 VanDerWaalsContact O-N 3.16Å; T131-E134 WeakPolarHBondContact OG1-CB 3.36Å; T131-E134 VanDerWaalsContact OG1-CD 3.32Å; T131-E134 WeakPolarHBondContact OG1-CG 3.48Å; T131-E134 PolarHBondContact OG1-N 2.84Å; T131-E134 PolarHBondContact OG1-OE2 3.04Å; T131-R135 WeakPolarHBondContact O-CB 3.44Å; T131-R135 PolarHBondContact O-N 3.21Å
132	A	93.5	Very high	93.7	Very high	83 Å²	83	66 Å²	66	69%	0.686	37%	0.372	S	S	*	.	H	α-helix	trans	-55.9	-39.6	177.4	0	0	0	0	0	112.4	R135 Q136	A132-R135 PolarHBondContact O-N 2.69Å; A132-Q136 PolarHBondContact O-N 3.48Å
133	Q	95.4	Very high	94.1	Very high	164 Å²	164	68.9 Å²	68.9	77%	0.766	38%	0.377	S	S	*	.	H	α-helix	trans	-65.3	-47	176.7	-64.6	-179.9	7.2	0	0	111.7	T131 R135 Q136 A137	T131-Q133 PolarHBondContact O-N 2.81Å; Q133-R135 VanDerWaalsContact C-N 3.31Å; Q133-R135 PolarHBondContact O-N 2.85Å; Q133-Q136 PolarHBondContact O-N 3.45Å; Q133-A137 VanDerWaalsContact O-CB 3.3Å; Q133-A137 WeakPolarHBondContact O-CB 3.26Å; Q133-A137 PolarHBondContact O-N 3.22Å
134	E	94.6	Very high	94.3	Very high	64 Å²	64	72.1 Å²	72.1	30%	0.299	39%	0.392	S	S	.	.	H	α-helix	trans	-62.1	-39.1	176.7	-76.8	170.2	138.3	0	0	112.2	L86 F130 T131 A137 N138	L86-E134 HydrophobicContact CD2-CB 3.66Å; L86-E134 HydrophobicContact CD2-CG 3.85Å; F130-E134 HydrophobicContact CB-CB 4.01Å; T131-E134 WeakPolarHBondContact CB-OE2 3.32Å; T131-E134 WeakPolarHBondContact CG2-OE2 3.29Å; T131-E134 PolarHBondContact N-OE2 3.36Å; T131-E134 PolarHBondContact O-N 3.32Å; T131-E134 VanDerWaalsContact O-N 3.16Å; T131-E134 WeakPolarHBondContact OG1-CB 3.36Å; T131-E134 VanDerWaalsContact OG1-CD 3.32Å; T131-E134 WeakPolarHBondContact OG1-CG 3.48Å; T131-E134 PolarHBondContact OG1-N 2.84Å; T131-E134 PolarHBondContact OG1-OE2 3.04Å; E134-A137 PolarHBondContact O-N 2.88Å; E134-N138 WeakPolarHBondContact O-CB 3.44Å; E134-N138 PolarHBondContact O-N 3.43Å; E134-N138 PolarHBondContact O-ND2 3.48Å
135	R	93.7	Very high	94.6	Very high	125 Å²	125	69.7 Å²	69.7	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-43.6	176.9	-169.2	179.9	-173.2	97.2	0.9	111.5	F130 T131 A132 Q133 I142	F130-R135 HydrophobicContact CB-CB 4.47Å; T131-R135 WeakPolarHBondContact O-CB 3.44Å; T131-R135 PolarHBondContact O-N 3.21Å; A132-R135 PolarHBondContact O-N 2.69Å; Q133-R135 VanDerWaalsContact C-N 3.31Å; Q133-R135 PolarHBondContact O-N 2.85Å; R135-I142 HydrophobicContact CG-CD1 3.96Å; R135-I142 HydrophobicContact CG-CG1 3.91Å
136	Q	95.1	Very high	94.7	Very high	168 Å²	168	69.6 Å²	69.6	79%	0.785	38%	0.379	S	S	*	.	H	α-helix	trans	-70.9	-36.4	177.2	-171.8	175.4	4.5	0	0	112.3	A132 Q133 N138	A132-Q136 PolarHBondContact O-N 3.48Å; Q133-Q136 PolarHBondContact O-N 3.45Å; Q136-N138 VanDerWaalsContact C-N 3.33Å
137	A	96.6	Very high	94.5	Very high	75 Å²	75	71.2 Å²	71.2	62%	0.62	39%	0.39	S	S	*	.	H	α-helix	trans	-73.1	-23.2	178.8	0	0	0	0	0	113.5	Q133 E134 P139	Q133-A137 VanDerWaalsContact O-CB 3.3Å; Q133-A137 WeakPolarHBondContact O-CB 3.26Å; Q133-A137 PolarHBondContact O-N 3.22Å; E134-A137 PolarHBondContact O-N 2.88Å; A137-P139 WeakPolarHBondContact O-CD 3.05Å
138	N	96.1	Very high	94.4	Very high	47 Å²	47	69.4 Å²	69.4	25%	0.251	38%	0.381	S	S	.	.			trans	-123.6	58.5	-175	-60.4	-86.6	0	0	0	113	L86 E134 Q136 N140 I141 I142	L86-N138 HydrophobicContact CD1-CB 4.32Å; E134-N138 WeakPolarHBondContact O-CB 3.44Å; E134-N138 PolarHBondContact O-N 3.43Å; E134-N138 PolarHBondContact O-ND2 3.48Å; Q136-N138 VanDerWaalsContact C-N 3.33Å; N138-N140 VanDerWaalsContact C-N 3.28Å; N138-N140 PolarHBondContact O-N 3.31Å; N138-I141 HydrophobicContact CB-CB 4.23Å; N138-I141 HydrophobicContact CB-CD1 4.1Å; N138-I141 HydrophobicContact CB-CG1 4.36Å; N138-I141 PolarHBondContact O-N 3.32Å; N138-I142 PolarHBondContact O-N 3.4Å
139	P	95.4	Very high	94.3	Very high	76 Å²	76	69 Å²	69	49%	0.494	38%	0.377	S	S	.	.	H	α-helix	trans	-62.8	-35.2	-177.2	26.8	-34.5	0	0	0	112.5	A137 I141 I142 Q143	A137-P139 WeakPolarHBondContact O-CD 3.05Å; P139-I141 PolarHBondContact O-N 3.26Å; P139-I142 PolarHBondContact O-N 3.16Å; P139-Q143 WeakPolarHBondContact O-CB 3.19Å; P139-Q143 PolarHBondContact O-N 3.13Å
140	N	96.6	Very high	94	Very high	113 Å²	113	71 Å²	71	60%	0.604	38%	0.375	S	S	*	.	H	α-helix	trans	-63.1	-43.8	179.5	-61.8	-20.3	0	0	0	111.9	N138 I142 Q143 E144	N138-N140 VanDerWaalsContact C-N 3.28Å; N138-N140 PolarHBondContact O-N 3.31Å; N140-I142 VanDerWaalsContact C-N 3.34Å; N140-I142 PolarHBondContact O-N 3.11Å; N140-Q143 WeakPolarHBondContact O-CB 3.29Å; N140-Q143 PolarHBondContact O-N 3.47Å; N140-E144 PolarHBondContact O-N 3.27Å
141	I	96	Very high	93.6	Very high	15 Å²	15	74.2 Å²	74.2	8%	0.077	39%	0.387	C	S	.	.	H	α-helix	trans	-65.4	-41.1	179.2	-64.4	178.7	0	0	0	110.3	L86 A98 Q99 L102 F130 N138 P139 Q143 E144 I145	L86-I141 HydrophobicContact CD1-CD1 3.41Å; L86-I141 VanDerWaalsContact CD1-CD1 3.41Å; A98-I141 HydrophobicContact CB-CG2 3.5Å; Q99-I141 HydrophobicContact CG-CD1 4Å; L102-I141 HydrophobicContact CD1-CG2 4.21Å; F130-I141 HydrophobicContact CE2-CG2 3.93Å; F130-I141 HydrophobicContact CZ-CG2 3.9Å; N138-I141 HydrophobicContact CB-CB 4.23Å; N138-I141 HydrophobicContact CB-CD1 4.1Å; N138-I141 HydrophobicContact CB-CG1 4.36Å; N138-I141 PolarHBondContact O-N 3.32Å; P139-I141 PolarHBondContact O-N 3.26Å; I141-Q143 VanDerWaalsContact C-N 3.34Å; I141-E144 PolarHBondContact O-N 3.1Å; I141-I145 HydrophobicContact CG2-CD1 4.07Å; I141-I145 WeakPolarHBondContact O-CG1 3.27Å; I141-I145 PolarHBondContact O-N 3.07Å
142	I	96.3	Very high	93.3	Very high	20 Å²	20	72 Å²	72	10%	0.103	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-45	174.6	-66.9	-65.6	0	0	0	110.6	P128 F130 R135 N138 P139 N140 E144 I145 T146	P128-I142 HydrophobicContact CB-CD1 4.07Å; P128-I142 HydrophobicContact CG-CD1 4.07Å; F130-I142 HydrophobicContact CD2-CD1 3.55Å; F130-I142 HydrophobicContact CD2-CG1 4.26Å; F130-I142 HydrophobicContact CE2-CD1 3.48Å; F130-I142 VanDerWaalsContact CE2-CD1 3.48Å; F130-I142 HydrophobicContact CE2-CG1 4.13Å; F130-I142 HydrophobicContact CZ-CD1 4.43Å; R135-I142 HydrophobicContact CG-CD1 3.96Å; R135-I142 HydrophobicContact CG-CG1 3.91Å; N138-I142 PolarHBondContact O-N 3.4Å; P139-I142 PolarHBondContact O-N 3.16Å; N140-I142 VanDerWaalsContact C-N 3.34Å; N140-I142 PolarHBondContact O-N 3.11Å; I142-E144 VanDerWaalsContact C-N 3.32Å; I142-E144 PolarHBondContact O-N 3.29Å; I142-I145 PolarHBondContact O-N 2.85Å; I142-T146 WeakPolarHBondContact O-CB 3.43Å; I142-T146 PolarHBondContact O-N 2.83Å; I142-T146 PolarHBondContact O-OG1 2.77Å
143	Q	95.7	Very high	92.7	Very high	138 Å²	138	70.5 Å²	70.5	65%	0.645	36%	0.355	S	S	*	.	H	α-helix	trans	-60	-41.8	177.2	-174.2	179.4	-2.4	0	0	111.9	P139 N140 I141 T146 S147	P139-Q143 WeakPolarHBondContact O-CB 3.19Å; P139-Q143 PolarHBondContact O-N 3.13Å; N140-Q143 WeakPolarHBondContact O-CB 3.29Å; N140-Q143 PolarHBondContact O-N 3.47Å; I141-Q143 VanDerWaalsContact C-N 3.34Å; Q143-T146 PolarHBondContact O-N 2.83Å; Q143-S147 WeakPolarHBondContact O-CB 2.91Å; Q143-S147 PolarHBondContact O-N 3.29Å
144	E	94.9	Very high	91.6	Very high	68 Å²	68	65.7 Å²	65.7	32%	0.318	35%	0.35	S	S	.	.	H	α-helix	trans	-62.5	-47.7	175.1	-75.5	-175.1	-126.4	0	0	111.9	L102 Q106 N140 I141 I142 T146 S147 Y148	L102-E144 HydrophobicContact CD1-CB 3.73Å; L102-E144 HydrophobicContact CD2-CB 4.11Å; Q106-E144 PolarHBondContact NE2-OE2 2.89Å; N140-E144 PolarHBondContact O-N 3.27Å; I141-E144 PolarHBondContact O-N 3.1Å; I142-E144 VanDerWaalsContact C-N 3.32Å; I142-E144 PolarHBondContact O-N 3.29Å; E144-T146 VanDerWaalsContact C-N 3.35Å; E144-T146 PolarHBondContact O-N 2.96Å; E144-S147 PolarHBondContact O-N 3.37Å; E144-S147 PolarHBondContact O-OG 2.9Å; E144-Y148 PolarHBondContact O-N 3.44Å
145	I	94.7	Very high	90.2	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-61.3	-43.1	176	-68.6	172.8	0	0	0	111.1	T88 A98 L102 L126 P128 F130 I141 I142 S147 Y148 N149	T88-I145 HydrophobicContact CG2-CD1 4.09Å; A98-I145 HydrophobicContact CB-CD1 4.2Å; L102-I145 HydrophobicContact CD1-CG1 4.15Å; L102-I145 HydrophobicContact CD2-CG1 4.33Å; L102-I145 HydrophobicContact CG-CG1 4.48Å; L126-I145 HydrophobicContact CB-CG2 3.94Å; L126-I145 WeakPolarHBondContact O-CG2 3.2Å; P128-I145 HydrophobicContact CB-CD1 3.99Å; P128-I145 HydrophobicContact CG-CG2 4.34Å; F130-I145 HydrophobicContact CE2-CD1 4.46Å; F130-I145 HydrophobicContact CZ-CD1 3.79Å; I141-I145 HydrophobicContact CG2-CD1 4.07Å; I141-I145 WeakPolarHBondContact O-CG1 3.27Å; I141-I145 PolarHBondContact O-N 3.07Å; I142-I145 PolarHBondContact O-N 2.85Å; I145-S147 VanDerWaalsContact C-N 3.34Å; I145-S147 PolarHBondContact O-N 2.82Å; I145-Y148 WeakPolarHBondContact O-CB 3.36Å; I145-Y148 PolarHBondContact O-N 3.44Å; I145-N149 WeakPolarHBondContact O-CB 3.46Å; I145-N149 VanDerWaalsContact O-CG 3.26Å; I145-N149 PolarHBondContact O-N 3.06Å; I145-N149 PolarHBondContact O-ND2 3.41Å
146	T	92.7	Very high	88.6	Confident	58 Å²	58	65.2 Å²	65.2	36%	0.356	37%	0.372	S	S	.	.	H	α-helix	trans	-62.6	-41	176	-63.4	0	0	0	0	111.3	I142 Q143 E144 N149 R150	I142-T146 WeakPolarHBondContact O-CB 3.43Å; I142-T146 PolarHBondContact O-N 2.83Å; I142-T146 PolarHBondContact O-OG1 2.77Å; Q143-T146 PolarHBondContact O-N 2.83Å; E144-T146 VanDerWaalsContact C-N 3.35Å; E144-T146 PolarHBondContact O-N 2.96Å; T146-N149 PolarHBondContact O-N 2.94Å; T146-R150 WeakPolarHBondContact O-CB 3.41Å; T146-R150 PolarHBondContact O-N 3.24Å
147	S	90.6	Very high	86.9	Confident	35 Å²	35	58.6 Å²	58.6	25%	0.245	34%	0.34	C	S	.	.	H	α-helix	trans	-64.5	-40.2	175.9	78.6	0	0	0	0	111.9	Q143 E144 I145 R150 R151	Q143-S147 WeakPolarHBondContact O-CB 2.91Å; Q143-S147 PolarHBondContact O-N 3.29Å; E144-S147 PolarHBondContact O-N 3.37Å; E144-S147 PolarHBondContact O-OG 2.9Å; I145-S147 VanDerWaalsContact C-N 3.34Å; I145-S147 PolarHBondContact O-N 2.82Å; S147-R150 PolarHBondContact O-N 3.27Å; S147-R151 VanDerWaalsContact O-CG 3.31Å; S147-R151 WeakPolarHBondContact O-CG 3.19Å; S147-R151 PolarHBondContact O-N 2.83Å; S147-R151 VanDerWaalsContact O-N 3.13Å
148	Y	91.6	Very high	85.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-52.5	174.4	-177.4	-84.5	0	0	0	111	W105 L114 V123 L126 E144 I145 R150 R151 F152	W105-Y148 AromaticContact CD1-CE2 3.69Å; W105-Y148 AromaticContact CD2-CD2 3.81Å; W105-Y148 HydrophobicContact CD2-CD2 3.81Å; W105-Y148 HydrophobicContact CD2-CE2 4.02Å; W105-Y148 AromaticContact CE2-CD2 3.82Å; W105-Y148 AromaticContact CE2-CE2 3.97Å; W105-Y148 HydrophobicContact CE3-CD2 4.24Å; W105-Y148 HydrophobicContact CG-CD2 4.08Å; W105-Y148 AromaticContact CG-CE2 3.82Å; W105-Y148 HydrophobicContact CG-CE2 3.82Å; W105-Y148 HydrophobicContact CZ2-CD2 4.24Å; W105-Y148 AromaticContact NE1-CE2 3.74Å; L114-Y148 HydrophobicContact CD2-CE2 3.7Å; L114-Y148 HydrophobicContact CG-CE2 4.31Å; L114-Y148 VanDerWaalsContact CG-OH 3.31Å; L114-Y148 WeakPolarHBondContact CG-OH 3.37Å; L114-Y148 PolarHBondContact N-OH 3.47Å; L114-Y148 VanDerWaalsContact N-OH 3.11Å; V123-Y148 HydrophobicContact CG1-CE1 4.34Å; V123-Y148 WeakPolarHBondContact O-CE1 3.28Å; V123-Y148 PolarHBondContact O-OH 2.91Å; L126-Y148 HydrophobicContact CB-CD1 4.34Å; L126-Y148 HydrophobicContact CD1-CD1 3.49Å; L126-Y148 VanDerWaalsContact CD1-CD1 3.49Å; L126-Y148 HydrophobicContact CD1-CD2 4.27Å; L126-Y148 HydrophobicContact CD1-CE1 3.87Å; L126-Y148 HydrophobicContact CD1-CG 3.73Å; L126-Y148 HydrophobicContact CG-CD1 3.69Å; L126-Y148 HydrophobicContact CG-CE1 3.81Å; L126-Y148 HydrophobicContact CG-CG 4.44Å; E144-Y148 PolarHBondContact O-N 3.44Å; I145-Y148 WeakPolarHBondContact O-CB 3.36Å; I145-Y148 PolarHBondContact O-N 3.44Å; Y148-R150 VanDerWaalsContact C-N 3.3Å; Y148-R150 PolarHBondContact O-N 3.11Å; Y148-R151 WeakPolarHBondContact O-CB 3.19Å; Y148-R151 PolarHBondContact O-N 3.44Å; Y148-R151 VanDerWaalsContact O-N 3.1Å; Y148-F152 HydrophobicContact CD1-CD2 4.04Å; Y148-F152 AromaticContact CD2-CD2 3.69Å; Y148-F152 HydrophobicContact CD2-CD2 3.69Å; Y148-F152 AromaticContact CD2-CE2 3.7Å; Y148-F152 HydrophobicContact CD2-CE2 3.7Å; Y148-F152 HydrophobicContact CE1-CB 4.34Å; Y148-F152 AromaticContact CE1-CD2 3.79Å; Y148-F152 HydrophobicContact CE1-CD2 3.79Å; Y148-F152 HydrophobicContact CE1-CG 4.48Å; Y148-F152 AromaticContact CE2-CD2 3.43Å; Y148-F152 HydrophobicContact CE2-CD2 3.43Å; Y148-F152 VanDerWaalsContact CE2-CD2 3.43Å; Y148-F152 AromaticContact CE2-CE2 3.48Å; Y148-F152 HydrophobicContact CE2-CE2 3.48Å; Y148-F152 VanDerWaalsContact CE2-CE2 3.48Å; Y148-F152 AromaticContact CG-CD2 3.97Å; Y148-F152 HydrophobicContact CG-CD2 3.97Å; Y148-F152 HydrophobicContact CG-CE2 4.37Å; Y148-F152 AromaticContact CZ-CD2 3.46Å; Y148-F152 VanDerWaalsContact CZ-CD2 3.46Å; Y148-F152 AromaticContact CZ-CE2 3.98Å; Y148-F152 VanDerWaalsContact O-CD2 3.28Å; Y148-F152 WeakPolarHBondContact O-CD2 3.17Å; Y148-F152 PolarHBondContact O-N 3.19Å
149	N	91.7	Very high	84.7	Confident	28 Å²	28	67.1 Å²	67.1	15%	0.15	36%	0.362	C	S	.	.	H	α-helix	trans	-59.5	-43.6	179.8	-71.6	-16.8	0	0	0	111	L125 L126 I145 T146 R151 F152 S153	L125-N149 HydrophobicContact CD1-CB 4.15Å; L126-N149 PolarHBondContact N-OD1 2.7Å; L126-N149 PolarHBondContact O-ND2 3.2Å; L126-N149 PolarHBondContact O-OD1 3.03Å; I145-N149 WeakPolarHBondContact O-CB 3.46Å; I145-N149 VanDerWaalsContact O-CG 3.26Å; I145-N149 PolarHBondContact O-N 3.06Å; I145-N149 PolarHBondContact O-ND2 3.41Å; T146-N149 PolarHBondContact O-N 2.94Å; N149-R151 PolarHBondContact O-N 2.86Å; N149-F152 PolarHBondContact O-N 2.96Å; N149-S153 WeakPolarHBondContact O-CB 3.35Å; N149-S153 PolarHBondContact O-N 2.94Å; N149-S153 PolarHBondContact O-OG 3.34Å
150	R	87.2	Confident	83.6	Confident	109 Å²	109	69.5 Å²	69.5	41%	0.411	37%	0.37	S	S	.	.	H	α-helix	trans	-59.7	-36.7	177.7	-166.3	-176.8	-58.4	153.3	5.3	112.4	T146 S147 Y148 R157 E161	T146-R150 WeakPolarHBondContact O-CB 3.41Å; T146-R150 PolarHBondContact O-N 3.24Å; S147-R150 PolarHBondContact O-N 3.27Å; Y148-R150 VanDerWaalsContact C-N 3.3Å; Y148-R150 PolarHBondContact O-N 3.11Å; R150-R157 HydrophobicContact CG-CG 4.15Å; R150-R157 WeakPolarHBondContact O-CD 3.16Å; R150-R157 WeakPolarHBondContact O-CG 3.48Å; R150-E161 WeakPolarHBondContact CD-OE1 3.38Å; R150-E161 WeakPolarHBondContact CD-OE2 3.34Å; R150-E161 IonicContact CZ-OE1 3.45Å; R150-E161 IonicContact NE-OE1 3.97Å; R150-E161 IonicContact NH1-OE1 2.75Å; R150-E161 PolarHBondContact NH1-OE1 2.75Å; R150-E161 IonicContact NH1-OE2 3.84Å
151	R	83.7	Confident	82	Confident	94 Å²	94	65.8 Å²	65.8	36%	0.355	35%	0.35	S	S	.	.	H	α-helix	trans	-70.6	-40.5	178.3	-75.1	172.2	176.8	-179.6	3.8	113.2	W105 S147 Y148 N149 E165	W105-R151 VanDerWaalsContact CH2-NH1 3.32Å; S147-R151 VanDerWaalsContact O-CG 3.31Å; S147-R151 WeakPolarHBondContact O-CG 3.19Å; S147-R151 PolarHBondContact O-N 2.83Å; S147-R151 VanDerWaalsContact O-N 3.13Å; Y148-R151 WeakPolarHBondContact O-CB 3.19Å; Y148-R151 PolarHBondContact O-N 3.44Å; Y148-R151 VanDerWaalsContact O-N 3.1Å; N149-R151 PolarHBondContact O-N 2.86Å; R151-E165 IonicContact CZ-OE1 3.18Å; R151-E165 IonicContact NE-OE1 2.77Å; R151-E165 PolarHBondContact NE-OE1 3.5Å; R151-E165 IonicContact NE-OE2 3.78Å; R151-E165 IonicContact NH2-OE1 2.81Å; R151-E165 PolarHBondContact NH2-OE1 3.39Å
152	F	86.3	Confident	80.7	Confident	31 Å²	31	70.6 Å²	70.6	14%	0.136	37%	0.367	C	S	.	.	H	α-helix	trans	-117.9	-9.9	-164.4	-57.6	-63.2	0	0	0	115.4	W105 N112 A113 T124 Y148 N149 G154	W105-F152 AromaticContact CE2-CE2 3.99Å; W105-F152 HydrophobicContact CZ2-CE2 4.01Å; W105-F152 HydrophobicContact CZ2-CZ 4.45Å; W105-F152 AromaticContact NE1-CE2 3.66Å; W105-F152 AromaticContact NE1-CZ 3.9Å; N112-F152 WeakPolarHBondContact O-CZ 3.15Å; A113-F152 HydrophobicContact CB-CB 4.29Å; A113-F152 HydrophobicContact CB-CD1 3.72Å; A113-F152 HydrophobicContact CB-CE1 4.21Å; A113-F152 HydrophobicContact CB-CG 3.98Å; T124-F152 WeakPolarHBondContact CB-O 3.33Å; T124-F152 WeakPolarHBondContact CG2-O 3.46Å; T124-F152 CarbonylContact O-C 3.6Å; T124-F152 VanDerWaalsContact O-C 3.25Å; Y148-F152 HydrophobicContact CD1-CD2 4.04Å; Y148-F152 AromaticContact CD2-CD2 3.69Å; Y148-F152 HydrophobicContact CD2-CD2 3.69Å; Y148-F152 AromaticContact CD2-CE2 3.7Å; Y148-F152 HydrophobicContact CD2-CE2 3.7Å; Y148-F152 HydrophobicContact CE1-CB 4.34Å; Y148-F152 AromaticContact CE1-CD2 3.79Å; Y148-F152 HydrophobicContact CE1-CD2 3.79Å; Y148-F152 HydrophobicContact CE1-CG 4.48Å; Y148-F152 AromaticContact CE2-CD2 3.43Å; Y148-F152 HydrophobicContact CE2-CD2 3.43Å; Y148-F152 VanDerWaalsContact CE2-CD2 3.43Å; Y148-F152 AromaticContact CE2-CE2 3.48Å; Y148-F152 HydrophobicContact CE2-CE2 3.48Å; Y148-F152 VanDerWaalsContact CE2-CE2 3.48Å; Y148-F152 AromaticContact CG-CD2 3.97Å; Y148-F152 HydrophobicContact CG-CD2 3.97Å; Y148-F152 HydrophobicContact CG-CE2 4.37Å; Y148-F152 AromaticContact CZ-CD2 3.46Å; Y148-F152 VanDerWaalsContact CZ-CD2 3.46Å; Y148-F152 AromaticContact CZ-CE2 3.98Å; Y148-F152 VanDerWaalsContact O-CD2 3.28Å; Y148-F152 WeakPolarHBondContact O-CD2 3.17Å; Y148-F152 PolarHBondContact O-N 3.19Å; N149-F152 PolarHBondContact O-N 2.96Å; F152-G154 PolarHBondContact O-N 3.18Å
153	S	82	Confident	79.7	Confident	51 Å²	51	74.5 Å²	74.5	36%	0.357	39%	0.387	S	S	.	.	S	Bend	trans	-72.2	-6.9	-178.9	68.5	0	0	0	0	114	T124 N149 A155	T124-S153 WeakPolarHBondContact O-CA 3.42Å; T124-S153 PolarHBondContact O-N 3.42Å; N149-S153 WeakPolarHBondContact O-CB 3.35Å; N149-S153 PolarHBondContact O-N 2.94Å; N149-S153 PolarHBondContact O-OG 3.34Å; S153-A155 PolarHBondContact O-N 3.22Å; S153-A155 VanDerWaalsContact OG-CB 3.3Å; S153-A155 WeakPolarHBondContact OG-CB 3.24Å; S153-A155 PolarHBondContact OG-N 3.31Å
154	G	71.2	Confident	78.6	Confident	64 Å²	64	72.3 Å²	72.3	66%	0.66	38%	0.384	S	S	*	.			trans	73.1	5.9	-171.5	0	0	0	0	0	113.5	F152	F152-G154 PolarHBondContact O-N 3.18Å
155	A	66.1	Low	77	Confident	45 Å²	45	70.9 Å²	70.9	37%	0.372	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-61.1	141.9	172.1	0	0	0	0	0	110.4	S153 R157	S153-A155 PolarHBondContact O-N 3.22Å; S153-A155 VanDerWaalsContact OG-CB 3.3Å; S153-A155 WeakPolarHBondContact OG-CB 3.24Å; S153-A155 PolarHBondContact OG-N 3.31Å; A155-R157 PolarHBondContact O-N 3.39Å; A155-R157 VanDerWaalsContact O-N 3.15Å
156	P	61.2	Low	76.1	Confident	134 Å²	134	74.7 Å²	74.7	87%	0.87	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.1	121.6	175.5	24.5	-32.7	0	0	0	109.6
157	R	57.9	Low	75	Confident	28 Å²	28	75.2 Å²	75.2	11%	0.106	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-100	137.6	174.5	-58	-178.1	73.9	-168.9	5.4	109.6	R150 A155 E161 Y162 E165	R150-R157 HydrophobicContact CG-CG 4.15Å; R150-R157 WeakPolarHBondContact O-CD 3.16Å; R150-R157 WeakPolarHBondContact O-CG 3.48Å; A155-R157 PolarHBondContact O-N 3.39Å; A155-R157 VanDerWaalsContact O-N 3.15Å; R157-E161 IonicContact CZ-OE2 2.69Å; R157-E161 VanDerWaalsContact CZ-OE2 3.27Å; R157-E161 IonicContact NE-OE2 2.71Å; R157-E161 PolarHBondContact NE-OE2 3.37Å; R157-E161 IonicContact NH2-OE2 2.95Å; R157-E161 PolarHBondContact NH2-OE2 2.78Å; R157-Y162 HydrophobicContact CB-CD2 4.45Å; R157-Y162 HydrophobicContact CB-CE2 3.62Å; R157-E165 IonicContact CZ-OE1 3.55Å; R157-E165 IonicContact CZ-OE2 3.27Å; R157-E165 IonicContact NH1-OE1 3.21Å; R157-E165 PolarHBondContact NH1-OE1 3.15Å; R157-E165 IonicContact NH1-OE2 2.94Å; R157-E165 PolarHBondContact NH1-OE2 3.35Å; R157-E165 IonicContact NH2-OE1 3.71Å; R157-E165 PolarHBondContact NH2-OE1 3.35Å; R157-E165 IonicContact NH2-OE2 2.77Å
158	P	72.7	Confident	73.9	Confident	77 Å²	77	77.8 Å²	77.8	50%	0.5	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-63.6	144.9	172.7	27.5	-33.3	0	0	0	110.5	L160 E161	P158-L160 PolarHBondContact O-N 2.8Å; P158-E161 HydrophobicContact CG-CG 4.13Å; P158-E161 PolarHBondContact O-N 2.81Å; P158-E161 VanDerWaalsContact O-N 3.08Å
159	W	74.4	Confident	72.7	Confident	224 Å²	224	81.4 Å²	81.4	85%	0.848	43%	0.434	S	S	*	.	H	α-helix	trans	-53.1	-31.7	-178.1	-77.4	67.5	0	0	0	113.4	E161 Y162 I163	W159-E161 VanDerWaalsContact C-N 3.31Å; W159-E161 PolarHBondContact O-N 3.38Å; W159-Y162 WeakPolarHBondContact O-CB 3.28Å; W159-Y162 PolarHBondContact O-N 3.22Å; W159-Y162 VanDerWaalsContact O-N 3.17Å; W159-I163 PolarHBondContact O-N 3.26Å
160	L	71.9	Confident	71.8	Confident	126 Å²	126	83.6 Å²	83.6	66%	0.66	45%	0.445	S	S	*	.	H	α-helix	trans	-60.1	-36.4	-179.9	-170.9	68.2	0	0	0	113.2	P158 Y162 I163 T164	P158-L160 PolarHBondContact O-N 2.8Å; L160-Y162 VanDerWaalsContact C-N 3.33Å; L160-I163 PolarHBondContact O-N 3.26Å; L160-T164 PolarHBondContact O-N 2.84Å; L160-T164 VanDerWaalsContact O-N 3.11Å
161	E	62.4	Low	71.2	Confident	36 Å²	36	82.2 Å²	82.2	17%	0.168	45%	0.452	C	S	.	.	H	α-helix	trans	-71.3	-30.1	178.7	-72.6	-171.8	-174.7	0	0	112.8	R150 R157 P158 W159 I163 T164 E165	R150-E161 WeakPolarHBondContact CD-OE1 3.38Å; R150-E161 WeakPolarHBondContact CD-OE2 3.34Å; R150-E161 IonicContact CZ-OE1 3.45Å; R150-E161 IonicContact NE-OE1 3.97Å; R150-E161 IonicContact NH1-OE1 2.75Å; R150-E161 PolarHBondContact NH1-OE1 2.75Å; R150-E161 IonicContact NH1-OE2 3.84Å; R157-E161 IonicContact CZ-OE2 2.69Å; R157-E161 VanDerWaalsContact CZ-OE2 3.27Å; R157-E161 IonicContact NE-OE2 2.71Å; R157-E161 PolarHBondContact NE-OE2 3.37Å; R157-E161 IonicContact NH2-OE2 2.95Å; R157-E161 PolarHBondContact NH2-OE2 2.78Å; P158-E161 HydrophobicContact CG-CG 4.13Å; P158-E161 PolarHBondContact O-N 2.81Å; P158-E161 VanDerWaalsContact O-N 3.08Å; W159-E161 VanDerWaalsContact C-N 3.31Å; W159-E161 PolarHBondContact O-N 3.38Å; E161-I163 VanDerWaalsContact C-N 3.33Å; E161-T164 WeakPolarHBondContact CA-OG1 3.22Å; E161-T164 PolarHBondContact O-OG1 3.5Å; E161-E165 WeakPolarHBondContact O-CG 3.49Å; E161-E165 PolarHBondContact O-N 2.77Å
162	Y	70.3	Confident	70.5	Confident	115 Å²	115	81.1 Å²	81.1	45%	0.451	45%	0.451	S	S	.	.	H	α-helix	trans	-65.5	-43.7	171.7	-66.3	-81.1	0	0	0	109.7	R157 W159 L160 T164 E165 I166	R157-Y162 HydrophobicContact CB-CD2 4.45Å; R157-Y162 HydrophobicContact CB-CE2 3.62Å; W159-Y162 WeakPolarHBondContact O-CB 3.28Å; W159-Y162 PolarHBondContact O-N 3.22Å; W159-Y162 VanDerWaalsContact O-N 3.17Å; L160-Y162 VanDerWaalsContact C-N 3.33Å; Y162-T164 VanDerWaalsContact C-N 3.3Å; Y162-T164 PolarHBondContact O-N 2.79Å; Y162-E165 PolarHBondContact O-N 2.94Å; Y162-E165 VanDerWaalsContact O-N 3.1Å; Y162-I166 WeakPolarHBondContact O-CG1 3.41Å; Y162-I166 PolarHBondContact O-N 3.16Å
163	I	74.1	Confident	69.6	Low	102 Å²	102	84.3 Å²	84.3	52%	0.523	47%	0.467	S	S	.	.	H	α-helix	trans	-60.2	-39.6	179.1	-63.4	170.6	0	0	0	111.8	W159 L160 E161 E165 P167	W159-I163 PolarHBondContact O-N 3.26Å; L160-I163 PolarHBondContact O-N 3.26Å; E161-I163 VanDerWaalsContact C-N 3.33Å; I163-E165 VanDerWaalsContact C-N 3.27Å; I163-E165 PolarHBondContact O-N 2.87Å; I163-P167 WeakPolarHBondContact O-CD 3.32Å
164	T	72.7	Confident	69	Low	92 Å²	92	87.6 Å²	87.6	56%	0.564	48%	0.475	S	S	*	.	H	α-helix	trans	-69.4	-25.1	178.6	56.2	0	0	0	0	113.2	L160 E161 Y162	L160-T164 PolarHBondContact O-N 2.84Å; L160-T164 VanDerWaalsContact O-N 3.11Å; E161-T164 WeakPolarHBondContact CA-OG1 3.22Å; E161-T164 PolarHBondContact O-OG1 3.5Å; Y162-T164 VanDerWaalsContact C-N 3.3Å; Y162-T164 PolarHBondContact O-N 2.79Å
165	E	61.2	Low	68.9	Low	39 Å²	39	94.8 Å²	94.8	18%	0.182	48%	0.483	C	S	.	.	H	α-helix	trans	-89.7	-28.2	179.3	-69.1	176.1	178.5	0	0	113.2	R151 R157 E161 Y162 I163 P167 V168 L169	R151-E165 IonicContact CZ-OE1 3.18Å; R151-E165 IonicContact NE-OE1 2.77Å; R151-E165 PolarHBondContact NE-OE1 3.5Å; R151-E165 IonicContact NE-OE2 3.78Å; R151-E165 IonicContact NH2-OE1 2.81Å; R151-E165 PolarHBondContact NH2-OE1 3.39Å; R157-E165 IonicContact CZ-OE1 3.55Å; R157-E165 IonicContact CZ-OE2 3.27Å; R157-E165 IonicContact NH1-OE1 3.21Å; R157-E165 PolarHBondContact NH1-OE1 3.15Å; R157-E165 IonicContact NH1-OE2 2.94Å; R157-E165 PolarHBondContact NH1-OE2 3.35Å; R157-E165 IonicContact NH2-OE1 3.71Å; R157-E165 PolarHBondContact NH2-OE1 3.35Å; R157-E165 IonicContact NH2-OE2 2.77Å; E161-E165 WeakPolarHBondContact O-CG 3.49Å; E161-E165 PolarHBondContact O-N 2.77Å; Y162-E165 PolarHBondContact O-N 2.94Å; Y162-E165 VanDerWaalsContact O-N 3.1Å; I163-E165 VanDerWaalsContact C-N 3.27Å; I163-E165 PolarHBondContact O-N 2.87Å; E165-P167 VanDerWaalsContact C-CD 3.45Å; E165-V168 PolarHBondContact O-N 3.39Å; E165-V168 VanDerWaalsContact O-N 3.11Å; E165-L169 WeakPolarHBondContact O-CD1 3.4Å; E165-L169 PolarHBondContact O-N 2.96Å
166	I	75.2	Confident	69	Low	80 Å²	80	98 Å²	98	41%	0.41	49%	0.49	S	S	.	.	H	α-helix	trans	-46.2	-47.8	177.4	-79	169	0	0	0	114	Y162 V168 L169 I170	Y162-I166 WeakPolarHBondContact O-CG1 3.41Å; Y162-I166 PolarHBondContact O-N 3.16Å; I166-V168 VanDerWaalsContact C-N 3.27Å; I166-V168 PolarHBondContact O-N 3.13Å; I166-L169 PolarHBondContact O-N 3.01Å; I166-I170 HydrophobicContact CG2-CD1 3.22Å; I166-I170 HydrophobicContact CG2-CG1 3.78Å; I166-I170 WeakPolarHBondContact O-CB 3.07Å; I166-I170 VanDerWaalsContact O-CG1 3.27Å; I166-I170 WeakPolarHBondContact O-CG1 3.39Å; I166-I170 PolarHBondContact O-N 3.16Å
167	P	70.4	Confident	69.3	Low	70 Å²	70	94.9 Å²	94.9	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-33.3	-177.6	21.3	-33.2	0	0	0	113.6	I163 E165 S171	I163-P167 WeakPolarHBondContact O-CD 3.32Å; E165-P167 VanDerWaalsContact C-CD 3.45Å; P167-S171 WeakPolarHBondContact O-CB 3.14Å; P167-S171 PolarHBondContact O-N 3.15Å; P167-S171 PolarHBondContact O-OG 3.36Å
168	V	68.5	Low	69.7	Low	89 Å²	89	97.5 Å²	97.5	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-70.7	-46.9	177	179.2	0	0	0	0	110.4	E165 I166 S171 H172	E165-V168 PolarHBondContact O-N 3.39Å; E165-V168 VanDerWaalsContact O-N 3.11Å; I166-V168 VanDerWaalsContact C-N 3.27Å; I166-V168 PolarHBondContact O-N 3.13Å; V168-S171 PolarHBondContact O-N 3.4Å; V168-H172 PolarHBondContact O-N 2.94Å; V168-H172 VanDerWaalsContact O-N 3.11Å
169	L	65.5	Low	69.5	Low	75 Å²	75	96.9 Å²	96.9	39%	0.393	47%	0.473	S	S	.	.	H	α-helix	trans	-63.6	-46.8	178	-88.7	71.5	0	0	0	111.1	E165 I166 S171 H172 M173	E165-L169 WeakPolarHBondContact O-CD1 3.4Å; E165-L169 PolarHBondContact O-N 2.96Å; I166-L169 PolarHBondContact O-N 3.01Å; L169-S171 VanDerWaalsContact C-N 3.3Å; L169-S171 PolarHBondContact O-N 3.1Å; L169-H172 PolarHBondContact O-N 3.34Å; L169-H172 VanDerWaalsContact O-N 3.16Å; L169-M173 WeakPolarHBondContact O-CB 3.21Å; L169-M173 VanDerWaalsContact O-CG 3.29Å; L169-M173 WeakPolarHBondContact O-CG 3.48Å; L169-M173 PolarHBondContact O-N 2.96Å
170	I	73.8	Confident	69	Low	74 Å²	74	89.2 Å²	89.2	38%	0.379	45%	0.45	S	S	.	.	H	α-helix	trans	-56.5	-45.9	176.8	-78.4	-175.7	0	0	0	110.5	I166 H172 M173 F174	I166-I170 HydrophobicContact CG2-CD1 3.22Å; I166-I170 HydrophobicContact CG2-CG1 3.78Å; I166-I170 WeakPolarHBondContact O-CB 3.07Å; I166-I170 VanDerWaalsContact O-CG1 3.27Å; I166-I170 WeakPolarHBondContact O-CG1 3.39Å; I166-I170 PolarHBondContact O-N 3.16Å; I170-H172 VanDerWaalsContact C-N 3.32Å; I170-H172 PolarHBondContact O-N 3.11Å; I170-M173 PolarHBondContact O-N 3.34Å; I170-F174 HydrophobicContact CG2-CD2 3.3Å; I170-F174 HydrophobicContact CG2-CE2 3.19Å; I170-F174 HydrophobicContact CG2-CZ 4.43Å; I170-F174 WeakPolarHBondContact O-CB 3.3Å; I170-F174 WeakPolarHBondContact O-CD2 3.47Å; I170-F174 PolarHBondContact O-N 3.22Å
171	S	73.2	Confident	68.9	Low	80 Å²	80	85.6 Å²	85.6	56%	0.559	44%	0.444	S	S	*	.	H	α-helix	trans	-61.7	-41.1	178.8	-61.8	0	0	0	0	112.1	P167 V168 L169 R175	P167-S171 WeakPolarHBondContact O-CB 3.14Å; P167-S171 PolarHBondContact O-N 3.15Å; P167-S171 PolarHBondContact O-OG 3.36Å; V168-S171 PolarHBondContact O-N 3.4Å; L169-S171 VanDerWaalsContact C-N 3.3Å; L169-S171 PolarHBondContact O-N 3.1Å; S171-R175 PolarHBondContact O-N 3.22Å
172	H	70	Confident	69.2	Low	71 Å²	71	86.4 Å²	86.4	33%	0.329	45%	0.449	S	S	.	.	H	α-helix	trans	-67.2	-44.2	175.7	-165.9	75	0	0	0	111.9	V168 L169 I170 R175 Q176	V168-H172 PolarHBondContact O-N 2.94Å; V168-H172 VanDerWaalsContact O-N 3.11Å; L169-H172 PolarHBondContact O-N 3.34Å; L169-H172 VanDerWaalsContact O-N 3.16Å; I170-H172 VanDerWaalsContact C-N 3.32Å; I170-H172 PolarHBondContact O-N 3.11Å; H172-R175 PolarHBondContact O-N 3.17Å; H172-Q176 PolarHBondContact O-N 3.26Å
173	M	66.6	Low	69	Low	99 Å²	99	81.5 Å²	81.5	49%	0.488	43%	0.431	S	S	.	.	H	α-helix	trans	-61.3	-46.4	177.2	-73.2	-174.1	74.3	0	0	111.4	L169 I170 R175 Q176 F177	L169-M173 WeakPolarHBondContact O-CB 3.21Å; L169-M173 VanDerWaalsContact O-CG 3.29Å; L169-M173 WeakPolarHBondContact O-CG 3.48Å; L169-M173 PolarHBondContact O-N 2.96Å; I170-M173 PolarHBondContact O-N 3.34Å; M173-R175 VanDerWaalsContact C-N 3.28Å; M173-R175 PolarHBondContact O-N 3.08Å; M173-Q176 CarbonylContact O-C 3.55Å; M173-Q176 WeakPolarHBondContact O-CA 3.45Å; M173-Q176 PolarHBondContact O-N 3.33Å; M173-F177 HydrophobicContact CB-CD2 4.2Å; M173-F177 HydrophobicContact CB-CE2 4.15Å; M173-F177 HydrophobicContact CE-CE2 3.7Å; M173-F177 HydrophobicContact CE-CZ 4.27Å; M173-F177 WeakPolarHBondContact O-CD2 3.44Å; M173-F177 PolarHBondContact O-N 3.33Å
174	F	69.3	Low	69	Low	119 Å²	119	81.4 Å²	81.4	52%	0.522	43%	0.429	S	S	.	.	H	α-helix	trans	-55.9	-44.8	177.5	-89.7	-62.4	0	0	0	111.5	I170 Q176 F177 F178	I170-F174 HydrophobicContact CG2-CD2 3.3Å; I170-F174 HydrophobicContact CG2-CE2 3.19Å; I170-F174 HydrophobicContact CG2-CZ 4.43Å; I170-F174 WeakPolarHBondContact O-CB 3.3Å; I170-F174 WeakPolarHBondContact O-CD2 3.47Å; I170-F174 PolarHBondContact O-N 3.22Å; F174-Q176 PolarHBondContact O-N 3.41Å; F174-F177 PolarHBondContact O-N 3.49Å; F174-F178 HydrophobicContact CD1-CE2 4.11Å; F174-F178 WeakPolarHBondContact O-CD2 3.36Å; F174-F178 PolarHBondContact O-N 2.95Å
175	R	69.4	Low	69	Low	216 Å²	216	84.2 Å²	84.2	82%	0.815	43%	0.43	S	S	*	.	H	α-helix	trans	-59.3	-33.2	177.1	-166.3	176	-177.8	-169.9	0.5	112.5	S171 H172 M173	S171-R175 PolarHBondContact O-N 3.22Å; H172-R175 PolarHBondContact O-N 3.17Å; M173-R175 VanDerWaalsContact C-N 3.28Å; M173-R175 PolarHBondContact O-N 3.08Å
176	Q	67.4	Low	69.4	Low	111 Å²	111	84.5 Å²	84.5	52%	0.519	43%	0.432	S	S	.	.	H	α-helix	trans	-83.4	-30.1	178.1	-168.5	154.6	-3.9	0	0	113.3	H172 M173 F174 F178 S179 N182	H172-Q176 PolarHBondContact O-N 3.26Å; M173-Q176 CarbonylContact O-C 3.55Å; M173-Q176 WeakPolarHBondContact O-CA 3.45Å; M173-Q176 PolarHBondContact O-N 3.33Å; F174-Q176 PolarHBondContact O-N 3.41Å; Q176-F178 VanDerWaalsContact C-N 3.31Å; Q176-F178 PolarHBondContact O-N 3.05Å; Q176-S179 PolarHBondContact O-N 2.9Å; Q176-N182 PolarHBondContact O-ND2 2.9Å
177	F	69.4	Low	69.4	Low	69 Å²	69	84.4 Å²	84.4	30%	0.303	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-31.3	177.1	-90	-72.5	0	0	0	113.2	M173 F174 S179 N182	M173-F177 HydrophobicContact CB-CD2 4.2Å; M173-F177 HydrophobicContact CB-CE2 4.15Å; M173-F177 HydrophobicContact CE-CE2 3.7Å; M173-F177 HydrophobicContact CE-CZ 4.27Å; M173-F177 WeakPolarHBondContact O-CD2 3.44Å; M173-F177 PolarHBondContact O-N 3.33Å; F174-F177 PolarHBondContact O-N 3.49Å; F177-S179 PolarHBondContact O-N 3.42Å; F177-N182 WeakPolarHBondContact O-CB 3.44Å
178	F	64.6	Low	69.6	Low	83 Å²	83	89.1 Å²	89.1	36%	0.364	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	20	179.5	-67.4	-66.5	0	0	0	115.2	F174 Q176 M186 V227 V231	F174-F178 HydrophobicContact CD1-CE2 4.11Å; F174-F178 WeakPolarHBondContact O-CD2 3.36Å; F174-F178 PolarHBondContact O-N 2.95Å; Q176-F178 VanDerWaalsContact C-N 3.31Å; Q176-F178 PolarHBondContact O-N 3.05Å; F178-M186 HydrophobicContact CD1-CE 4.29Å; F178-M186 HydrophobicContact CE1-CE 4.43Å; F178-V227 HydrophobicContact CE1-CG1 4.18Å; F178-V231 HydrophobicContact CD1-CB 4.5Å; F178-V231 HydrophobicContact CD1-CG1 4.25Å; F178-V231 HydrophobicContact CD1-CG2 3.44Å; F178-V231 VanDerWaalsContact CD1-CG2 3.44Å; F178-V231 HydrophobicContact CE1-CG2 3.71Å; F178-V231 HydrophobicContact CG-CG2 4.44Å
179	S	69.1	Low	70.1	Confident	65 Å²	65	88.3 Å²	88.3	46%	0.455	43%	0.429	S	S	.	.	S	Bend	trans	-81.2	149.1	170.5	-179.5	0	0	0	0	111.8	Q176 F177 G181 N182 L183	Q176-S179 PolarHBondContact O-N 2.9Å; F177-S179 PolarHBondContact O-N 3.42Å; S179-G181 VanDerWaalsContact C-N 3.26Å; S179-G181 PolarHBondContact O-N 3.26Å; S179-N182 CarbonylContact O-C 3.25Å; S179-N182 WeakPolarHBondContact O-CA 3.46Å; S179-N182 PolarHBondContact O-N 2.96Å; S179-L183 PolarHBondContact O-N 3.3Å
180	V	63.9	Low	70.5	Confident	62 Å²	62	89.7 Å²	89.7	38%	0.376	43%	0.429	S	S	.	.	H	α-helix	trans	-52.6	-41.1	-179.3	-178.6	0	0	0	0	112.6	N182 L183 I235	V180-N182 VanDerWaalsContact C-N 3.33Å; V180-L183 WeakPolarHBondContact O-CB 3.22Å; V180-L183 PolarHBondContact O-N 3.45Å; V180-I235 HydrophobicContact CG2-CD1 3.8Å; V180-I235 HydrophobicContact CG2-CG1 4.47Å; V180-I235 HydrophobicContact CG2-CG2 3.74Å
181	G	69.9	Low	70.7	Confident	51 Å²	51	91.4 Å²	91.4	53%	0.526	44%	0.438	S	S	.	.	H	α-helix	trans	-67.4	-34.8	178.2	0	0	0	0	0	112.8	S179	S179-G181 VanDerWaalsContact C-N 3.26Å; S179-G181 PolarHBondContact O-N 3.26Å
182	N	69	Low	70.9	Confident	53 Å²	53	91.3 Å²	91.3	28%	0.283	43%	0.434	S	S	.	.	H	α-helix	trans	-83.6	-17.8	-179.2	-67.8	-12.7	0	0	0	112.6	Q176 F177 S179 V180 M184 W185 M186	Q176-N182 PolarHBondContact O-ND2 2.9Å; F177-N182 WeakPolarHBondContact O-CB 3.44Å; S179-N182 CarbonylContact O-C 3.25Å; S179-N182 WeakPolarHBondContact O-CA 3.46Å; S179-N182 PolarHBondContact O-N 2.96Å; V180-N182 VanDerWaalsContact C-N 3.33Å; N182-M184 PolarHBondContact O-N 3.13Å; N182-W185 WeakPolarHBondContact O-CA 3.38Å; N182-W185 WeakPolarHBondContact O-CB 3.08Å; N182-W185 PolarHBondContact O-N 3.3Å; N182-M186 PolarHBondContact O-N 2.83Å; N182-M186 VanDerWaalsContact O-N 3.13Å
183	L	67	Low	71.3	Confident	11 Å²	11	92 Å²	92	6%	0.058	44%	0.443	C	S	.	.	H	α-helix	trans	-56.6	-39.9	170.3	-174.7	62.8	0	0	0	111.6	S179 V180 W185 M186 F187 L228	S179-L183 PolarHBondContact O-N 3.3Å; V180-L183 WeakPolarHBondContact O-CB 3.22Å; V180-L183 PolarHBondContact O-N 3.45Å; L183-W185 VanDerWaalsContact C-N 3.25Å; L183-W185 PolarHBondContact O-N 3.19Å; L183-M186 HydrophobicContact CD1-CE 3.42Å; L183-M186 VanDerWaalsContact CD1-CE 3.42Å; L183-M186 WeakPolarHBondContact O-CB 3.38Å; L183-M186 PolarHBondContact O-N 2.91Å; L183-M186 VanDerWaalsContact O-N 3.15Å; L183-F187 HydrophobicContact CD1-CE2 4.23Å; L183-F187 HydrophobicContact CD2-CE2 4.3Å; L183-F187 HydrophobicContact CG-CD2 4.32Å; L183-F187 HydrophobicContact CG-CE2 3.82Å; L183-F187 VanDerWaalsContact O-CD2 3.24Å; L183-F187 WeakPolarHBondContact O-CD2 3.31Å; L183-F187 PolarHBondContact O-N 3.13Å; L183-F187 VanDerWaalsContact O-N 3.16Å; L183-L228 HydrophobicContact CD1-CD2 3.24Å; L183-L228 HydrophobicContact CG-CD2 4.49Å
184	M	73.1	Confident	71.8	Confident	100 Å²	100	90.6 Å²	90.6	49%	0.493	44%	0.442	S	S	.	.	H	α-helix	trans	-64.3	-31.7	174.2	-64.4	-60.7	115.1	0	0	112.3	N182 F187 R188	N182-M184 PolarHBondContact O-N 3.13Å; M184-F187 HydrophobicContact CE-CD2 3.78Å; M184-F187 HydrophobicContact CE-CE2 3.84Å; M184-F187 PolarHBondContact O-N 3.2Å; M184-F187 HydrophobicContact SD-CD2 4.31Å; M184-R188 WeakPolarHBondContact O-CG 3.37Å; M184-R188 PolarHBondContact O-N 3.41Å
185	W	72.6	Confident	72.1	Confident	152 Å²	152	88.1 Å²	88.1	58%	0.576	44%	0.437	S	S	*	.	H	α-helix	trans	-65.4	-39.8	172.9	-109.9	89.9	0	0	0	111.6	N182 L183 R188 L189	N182-W185 WeakPolarHBondContact O-CA 3.38Å; N182-W185 WeakPolarHBondContact O-CB 3.08Å; N182-W185 PolarHBondContact O-N 3.3Å; L183-W185 VanDerWaalsContact C-N 3.25Å; L183-W185 PolarHBondContact O-N 3.19Å; W185-R188 PolarHBondContact O-N 2.9Å; W185-L189 HydrophobicContact CE3-CD1 4.16Å; W185-L189 HydrophobicContact CE3-CD2 4.3Å; W185-L189 HydrophobicContact CE3-CG 4.05Å; W185-L189 HydrophobicContact CZ3-CD2 4.2Å; W185-L189 HydrophobicContact CZ3-CG 4.44Å; W185-L189 WeakPolarHBondContact O-CB 3.41Å; W185-L189 VanDerWaalsContact O-CG 3.3Å; W185-L189 WeakPolarHBondContact O-CG 3.45Å; W185-L189 PolarHBondContact O-N 3.19Å
186	M	69.9	Low	72.6	Confident	45 Å²	45	82 Å²	82	22%	0.222	42%	0.419	C	S	.	.	H	α-helix	trans	-62.9	-42.5	174.4	-64.7	-165.9	-69.1	0	0	112	F178 N182 L183 R188 L189 R190 L228	F178-M186 HydrophobicContact CD1-CE 4.29Å; F178-M186 HydrophobicContact CE1-CE 4.43Å; N182-M186 PolarHBondContact O-N 2.83Å; N182-M186 VanDerWaalsContact O-N 3.13Å; L183-M186 HydrophobicContact CD1-CE 3.42Å; L183-M186 VanDerWaalsContact CD1-CE 3.42Å; L183-M186 WeakPolarHBondContact O-CB 3.38Å; L183-M186 PolarHBondContact O-N 2.91Å; L183-M186 VanDerWaalsContact O-N 3.15Å; M186-R188 VanDerWaalsContact C-N 3.34Å; M186-R188 PolarHBondContact O-N 2.75Å; M186-L189 PolarHBondContact O-N 3.49Å; M186-R190 PolarHBondContact O-N 3.28Å; M186-L228 HydrophobicContact CB-CD2 4.35Å; M186-L228 HydrophobicContact CE-CD2 3.67Å
187	F	75.5	Confident	73.1	Confident	77 Å²	77	79.2 Å²	79.2	34%	0.338	41%	0.41	S	S	.	.	H	α-helix	trans	-62.3	-39.5	174.1	-72.5	-63.3	0	0	0	112.7	L183 M184 R190 I191 L228	L183-F187 HydrophobicContact CD1-CE2 4.23Å; L183-F187 HydrophobicContact CD2-CE2 4.3Å; L183-F187 HydrophobicContact CG-CD2 4.32Å; L183-F187 HydrophobicContact CG-CE2 3.82Å; L183-F187 VanDerWaalsContact O-CD2 3.24Å; L183-F187 WeakPolarHBondContact O-CD2 3.31Å; L183-F187 PolarHBondContact O-N 3.13Å; L183-F187 VanDerWaalsContact O-N 3.16Å; M184-F187 HydrophobicContact CE-CD2 3.78Å; M184-F187 HydrophobicContact CE-CE2 3.84Å; M184-F187 PolarHBondContact O-N 3.2Å; M184-F187 HydrophobicContact SD-CD2 4.31Å; F187-R190 WeakPolarHBondContact O-CB 3.31Å; F187-R190 PolarHBondContact O-N 3.39Å; F187-I191 PolarHBondContact O-N 2.84Å; F187-L228 HydrophobicContact CD1-CD1 4.23Å; F187-L228 HydrophobicContact CE1-CD1 3.66Å; F187-L228 HydrophobicContact CZ-CD1 4.1Å; F187-L228 HydrophobicContact CZ-CD2 4.32Å
188	R	75	Confident	73.4	Confident	169 Å²	169	78.6 Å²	78.6	64%	0.638	42%	0.417	S	S	*	.	H	α-helix	trans	-66.7	-42	174.9	-72	176.1	-177.9	-168.2	0.2	111.9	M184 W185 M186 R190 I191 V192	M184-R188 WeakPolarHBondContact O-CG 3.37Å; M184-R188 PolarHBondContact O-N 3.41Å; W185-R188 PolarHBondContact O-N 2.9Å; M186-R188 VanDerWaalsContact C-N 3.34Å; M186-R188 PolarHBondContact O-N 2.75Å; R188-R190 VanDerWaalsContact C-N 3.3Å; R188-R190 PolarHBondContact O-N 2.9Å; R188-I191 PolarHBondContact O-N 3.43Å; R188-V192 WeakPolarHBondContact O-CG2 3.47Å; R188-V192 PolarHBondContact O-N 3.11Å
189	L	77.1	Confident	74	Confident	73 Å²	73	76 Å²	76	38%	0.382	41%	0.407	S	S	.	.	H	α-helix	trans	-60.3	-40	175.4	-75.1	171.5	0	0	0	111.6	W185 M186 I191 V192 V193	W185-L189 HydrophobicContact CE3-CD1 4.16Å; W185-L189 HydrophobicContact CE3-CD2 4.3Å; W185-L189 HydrophobicContact CE3-CG 4.05Å; W185-L189 HydrophobicContact CZ3-CD2 4.2Å; W185-L189 HydrophobicContact CZ3-CG 4.44Å; W185-L189 WeakPolarHBondContact O-CB 3.41Å; W185-L189 VanDerWaalsContact O-CG 3.3Å; W185-L189 WeakPolarHBondContact O-CG 3.45Å; W185-L189 PolarHBondContact O-N 3.19Å; M186-L189 PolarHBondContact O-N 3.49Å; L189-I191 PolarHBondContact O-N 2.85Å; L189-V192 PolarHBondContact O-N 2.97Å; L189-V193 VanDerWaalsContact O-CG2 3.31Å; L189-V193 WeakPolarHBondContact O-CG2 3.35Å; L189-V193 PolarHBondContact O-N 2.73Å
190	R	75.7	Confident	74.4	Confident	103 Å²	103	77.1 Å²	77.1	39%	0.389	41%	0.411	S	S	.	.	H	α-helix	trans	-55	-50.1	173	-175.9	-176.7	-178.9	-145.2	3.2	111.4	M186 F187 R188 V192 V193 C194 D221	M186-R190 PolarHBondContact O-N 3.28Å; F187-R190 WeakPolarHBondContact O-CB 3.31Å; F187-R190 PolarHBondContact O-N 3.39Å; R188-R190 VanDerWaalsContact C-N 3.3Å; R188-R190 PolarHBondContact O-N 2.9Å; R190-V192 VanDerWaalsContact C-N 3.34Å; R190-V192 PolarHBondContact O-N 2.69Å; R190-V193 PolarHBondContact O-N 3.48Å; R190-C194 WeakPolarHBondContact O-CB 3.39Å; R190-C194 PolarHBondContact O-N 3.38Å; R190-C194 PolarHBondContact O-SG 3.27Å; R190-D221 IonicContact CZ-OD1 3.58Å; R190-D221 IonicContact CZ-OD2 3.66Å; R190-D221 IonicContact NE-OD1 2.79Å; R190-D221 PolarHBondContact NE-OD1 3.46Å; R190-D221 IonicContact NE-OD2 3.5Å; R190-D221 IonicContact NH2-OD1 3.6Å; R190-D221 PolarHBondContact NH2-OD1 2.99Å; R190-D221 IonicContact NH2-OD2 2.84Å; R190-D221 PolarHBondContact NH2-OD2 3.34Å
191	I	76.2	Confident	74.7	Confident	110 Å²	110	78.7 Å²	78.7	56%	0.564	41%	0.411	S	S	*	.	H	α-helix	trans	-60.6	-44.5	178	-62.6	169	0	0	0	110.7	F187 R188 L189 C194 V195	F187-I191 PolarHBondContact O-N 2.84Å; R188-I191 PolarHBondContact O-N 3.43Å; L189-I191 PolarHBondContact O-N 2.85Å; I191-C194 PolarHBondContact O-N 2.71Å; I191-V195 HydrophobicContact CG2-CG2 4.33Å; I191-V195 WeakPolarHBondContact O-CB 3.46Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.29Å; I191-V195 PolarHBondContact O-N 3.43Å
192	V	78.2	Confident	74.8	Confident	79 Å²	79	79 Å²	79	48%	0.479	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-45.1	179.1	173	0	0	0	0	111.5	R188 L189 R190 V195 I196	R188-V192 WeakPolarHBondContact O-CG2 3.47Å; R188-V192 PolarHBondContact O-N 3.11Å; L189-V192 PolarHBondContact O-N 2.97Å; R190-V192 VanDerWaalsContact C-N 3.34Å; R190-V192 PolarHBondContact O-N 2.69Å; V192-V195 PolarHBondContact O-N 3.43Å; V192-I196 HydrophobicContact CG1-CD1 3.84Å; V192-I196 HydrophobicContact CG1-CG1 4.43Å; V192-I196 VanDerWaalsContact O-CG1 3.3Å; V192-I196 WeakPolarHBondContact O-CG1 3.42Å; V192-I196 PolarHBondContact O-N 3.2Å
193	V	79.1	Confident	75.2	Confident	84 Å²	84	80 Å²	80	51%	0.509	41%	0.413	S	S	.	.	H	α-helix	trans	-63	-45.3	177.2	172.2	0	0	0	0	110.6	L189 R190 V195 I196 V197	L189-V193 VanDerWaalsContact O-CG2 3.31Å; L189-V193 WeakPolarHBondContact O-CG2 3.35Å; L189-V193 PolarHBondContact O-N 2.73Å; R190-V193 PolarHBondContact O-N 3.48Å; V193-V195 VanDerWaalsContact C-N 3.31Å; V193-V195 PolarHBondContact O-N 3.45Å; V193-I196 PolarHBondContact O-N 3.43Å; V193-V197 HydrophobicContact CG1-CG2 4.42Å; V193-V197 WeakPolarHBondContact O-CG2 3.45Å; V193-V197 PolarHBondContact O-N 2.95Å
194	C	75.9	Confident	75.6	Confident	71 Å²	71	81.8 Å²	81.8	48%	0.48	43%	0.427	S	S	.	.	H	α-helix	trans	-59.8	-41.1	175.6	-68.1	0	0	0	0	112	R190 I191 V197 A198	R190-C194 WeakPolarHBondContact O-CB 3.39Å; R190-C194 PolarHBondContact O-N 3.38Å; R190-C194 PolarHBondContact O-SG 3.27Å; I191-C194 PolarHBondContact O-N 2.71Å; C194-V197 PolarHBondContact O-N 2.98Å; C194-A198 VanDerWaalsContact O-CB 3.3Å; C194-A198 WeakPolarHBondContact O-CB 3.26Å; C194-A198 PolarHBondContact O-N 2.85Å
195	V	76.8	Confident	75.5	Confident	67 Å²	67	82.7 Å²	82.7	41%	0.406	44%	0.44	S	S	.	.	H	α-helix	trans	-65.6	-44	176.2	167.2	0	0	0	0	111.1	I191 V192 V193 V197 A198 I199	I191-V195 HydrophobicContact CG2-CG2 4.33Å; I191-V195 WeakPolarHBondContact O-CB 3.46Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.29Å; I191-V195 PolarHBondContact O-N 3.43Å; V192-V195 PolarHBondContact O-N 3.43Å; V193-V195 VanDerWaalsContact C-N 3.31Å; V193-V195 PolarHBondContact O-N 3.45Å; V195-V197 PolarHBondContact O-N 2.93Å; V195-A198 PolarHBondContact O-N 2.85Å; V195-I199 HydrophobicContact CG1-CD1 3.66Å; V195-I199 HydrophobicContact CG1-CG1 4.37Å; V195-I199 WeakPolarHBondContact O-CB 3.27Å; V195-I199 VanDerWaalsContact O-CD1 3.3Å; V195-I199 WeakPolarHBondContact O-CD1 3.13Å; V195-I199 WeakPolarHBondContact O-CG1 3.13Å; V195-I199 PolarHBondContact O-N 3.32Å
196	I	79.7	Confident	75.4	Confident	86 Å²	86	82.2 Å²	82.2	44%	0.441	44%	0.442	S	S	.	.	H	α-helix	trans	-60.5	-47.2	175.7	-69.3	166.6	0	0	0	110.7	V192 V193 A198 I199 V200	V192-I196 HydrophobicContact CG1-CD1 3.84Å; V192-I196 HydrophobicContact CG1-CG1 4.43Å; V192-I196 VanDerWaalsContact O-CG1 3.3Å; V192-I196 WeakPolarHBondContact O-CG1 3.42Å; V192-I196 PolarHBondContact O-N 3.2Å; V193-I196 PolarHBondContact O-N 3.43Å; I196-A198 VanDerWaalsContact C-N 3.33Å; I196-A198 PolarHBondContact O-N 3.31Å; I196-I199 PolarHBondContact O-N 3.21Å; I196-V200 HydrophobicContact CG2-CG2 4.33Å; I196-V200 WeakPolarHBondContact O-CG2 3.3Å; I196-V200 PolarHBondContact O-N 3.37Å
197	V	77	Confident	75.2	Confident	53 Å²	53	85.9 Å²	85.9	32%	0.321	46%	0.463	S	S	.	.	H	α-helix	trans	-60.9	-43.5	177.3	171.8	0	0	0	0	110.8	V193 C194 V195 I199 V200 Y201 L217	V193-V197 HydrophobicContact CG1-CG2 4.42Å; V193-V197 WeakPolarHBondContact O-CG2 3.45Å; V193-V197 PolarHBondContact O-N 2.95Å; C194-V197 PolarHBondContact O-N 2.98Å; V195-V197 PolarHBondContact O-N 2.93Å; V197-I199 VanDerWaalsContact C-N 3.34Å; V197-I199 PolarHBondContact O-N 3.34Å; V197-V200 PolarHBondContact O-N 3.21Å; V197-Y201 VanDerWaalsContact O-CB 3.3Å; V197-Y201 WeakPolarHBondContact O-CB 3.35Å; V197-Y201 PolarHBondContact O-N 2.84Å; V197-L217 HydrophobicContact CG1-CD2 4.12Å
198	A	75.5	Confident	74.6	Confident	56 Å²	56	88.3 Å²	88.3	46%	0.463	48%	0.478	S	S	.	.	H	α-helix	trans	-63.2	-38.5	176.7	0	0	0	0	0	112.5	C194 V195 I196 Y201 A202	C194-A198 VanDerWaalsContact O-CB 3.3Å; C194-A198 WeakPolarHBondContact O-CB 3.26Å; C194-A198 PolarHBondContact O-N 2.85Å; V195-A198 PolarHBondContact O-N 2.85Å; I196-A198 VanDerWaalsContact C-N 3.33Å; I196-A198 PolarHBondContact O-N 3.31Å; A198-Y201 PolarHBondContact O-N 2.85Å; A198-A202 WeakPolarHBondContact O-CB 3.42Å; A198-A202 PolarHBondContact O-N 2.84Å
199	I	78	Confident	74	Confident	28 Å²	28	82.2 Å²	82.2	14%	0.144	46%	0.458	C	S	.	.	H	α-helix	trans	-67.2	-47.3	175.3	-67.8	157.3	0	0	0	110.9	L32 V195 I196 V197 Y201 A202 L203	L32-I199 HydrophobicContact CB-CD1 4.15Å; L32-I199 HydrophobicContact CD1-CD1 3.26Å; L32-I199 HydrophobicContact CD1-CG1 3.95Å; L32-I199 HydrophobicContact CG-CD1 4.27Å; V195-I199 HydrophobicContact CG1-CD1 3.66Å; V195-I199 HydrophobicContact CG1-CG1 4.37Å; V195-I199 WeakPolarHBondContact O-CB 3.27Å; V195-I199 VanDerWaalsContact O-CD1 3.3Å; V195-I199 WeakPolarHBondContact O-CD1 3.13Å; V195-I199 WeakPolarHBondContact O-CG1 3.13Å; V195-I199 PolarHBondContact O-N 3.32Å; I196-I199 PolarHBondContact O-N 3.21Å; V197-I199 VanDerWaalsContact C-N 3.34Å; V197-I199 PolarHBondContact O-N 3.34Å; I199-Y201 PolarHBondContact O-N 3.44Å; I199-A202 PolarHBondContact O-N 2.95Å; I199-L203 HydrophobicContact CG2-CD1 3.52Å; I199-L203 HydrophobicContact CG2-CG 4.19Å; I199-L203 VanDerWaalsContact O-CB 3.25Å; I199-L203 WeakPolarHBondContact O-CB 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.23Å; I199-L203 PolarHBondContact O-N 3.39Å
200	V	77.6	Confident	73.5	Confident	89 Å²	89	82.7 Å²	82.7	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-60.4	-40.2	177.6	170.5	0	0	0	0	110.2	I196 V197 S204	I196-V200 HydrophobicContact CG2-CG2 4.33Å; I196-V200 WeakPolarHBondContact O-CG2 3.3Å; I196-V200 PolarHBondContact O-N 3.37Å; V197-V200 PolarHBondContact O-N 3.21Å; V200-S204 VanDerWaalsContact O-CB 3.3Å; V200-S204 WeakPolarHBondContact O-CB 3.21Å; V200-S204 PolarHBondContact O-N 2.84Å
201	Y	70.2	Confident	73.1	Confident	96 Å²	96	86.1 Å²	86.1	38%	0.376	49%	0.485	S	S	.	.	H	α-helix	trans	-62	-51.4	174	-179	-105	0	0	0	111.7	V197 A198 I199 L203 S204 D207 I209	V197-Y201 VanDerWaalsContact O-CB 3.3Å; V197-Y201 WeakPolarHBondContact O-CB 3.35Å; V197-Y201 PolarHBondContact O-N 2.84Å; A198-Y201 PolarHBondContact O-N 2.85Å; I199-Y201 PolarHBondContact O-N 3.44Å; Y201-L203 VanDerWaalsContact C-N 3.29Å; Y201-L203 PolarHBondContact O-N 2.78Å; Y201-S204 PolarHBondContact O-N 2.81Å; Y201-D207 WeakPolarHBondContact CE2-OD1 3.3Å; Y201-D207 PolarHBondContact OH-OD1 3.47Å; Y201-I209 HydrophobicContact CD2-CD1 3.62Å; Y201-I209 HydrophobicContact CD2-CG1 4.16Å; Y201-I209 HydrophobicContact CE2-CD1 4.4Å; Y201-I209 HydrophobicContact CG-CD1 4.49Å
202	A	72.4	Confident	72.8	Confident	58 Å²	58	84.2 Å²	84.2	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-65	-31.9	-179.8	0	0	0	0	0	113.1	F25 A198 I199	F25-A202 HydrophobicContact CE2-CB 3.67Å; F25-A202 HydrophobicContact CZ-CB 4.13Å; F25-A202 VanDerWaalsContact CZ-O 3.25Å; F25-A202 WeakPolarHBondContact CZ-O 3.47Å; A198-A202 WeakPolarHBondContact O-CB 3.42Å; A198-A202 PolarHBondContact O-N 2.84Å; I199-A202 PolarHBondContact O-N 2.95Å
203	L	77	Confident	72.3	Confident	72 Å²	72	84.2 Å²	84.2	38%	0.377	48%	0.483	S	S	.	.	H	α-helix	trans	-80.8	-18.5	177.6	-78.6	172.1	0	0	0	113.9	F25 V29 I199 Y201 P205	F25-L203 HydrophobicContact CE1-CD2 3.41Å; F25-L203 VanDerWaalsContact CE1-CD2 3.41Å; F25-L203 HydrophobicContact CE1-CG 4.3Å; F25-L203 HydrophobicContact CE2-CD2 4.45Å; F25-L203 HydrophobicContact CZ-CB 4.34Å; F25-L203 HydrophobicContact CZ-CD2 3.34Å; F25-L203 HydrophobicContact CZ-CG 3.72Å; V29-L203 HydrophobicContact CB-CD2 4.28Å; V29-L203 HydrophobicContact CG1-CD1 3.81Å; V29-L203 HydrophobicContact CG1-CD2 3.89Å; V29-L203 HydrophobicContact CG1-CG 4.39Å; V29-L203 HydrophobicContact CG2-CD1 4.08Å; V29-L203 HydrophobicContact CG2-CD2 3.47Å; V29-L203 VanDerWaalsContact CG2-CD2 3.47Å; V29-L203 HydrophobicContact CG2-CG 3.9Å; I199-L203 HydrophobicContact CG2-CD1 3.52Å; I199-L203 HydrophobicContact CG2-CG 4.19Å; I199-L203 VanDerWaalsContact O-CB 3.25Å; I199-L203 WeakPolarHBondContact O-CB 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.23Å; I199-L203 PolarHBondContact O-N 3.39Å; Y201-L203 VanDerWaalsContact C-N 3.29Å; Y201-L203 PolarHBondContact O-N 2.78Å; L203-P205 WeakPolarHBondContact O-CD 3.41Å
204	S	74.5	Confident	71.9	Confident	49 Å²	49	86.3 Å²	86.3	34%	0.343	49%	0.486	S	S	.	.			trans	-73.8	113.7	-178	-176.6	0	0	0	0	109.5	V200 Y201 F206	V200-S204 VanDerWaalsContact O-CB 3.3Å; V200-S204 WeakPolarHBondContact O-CB 3.21Å; V200-S204 PolarHBondContact O-N 2.84Å; Y201-S204 PolarHBondContact O-N 2.81Å; S204-F206 PolarHBondContact O-N 3.42Å; S204-F206 PolarHBondContact OG-N 3.37Å; S204-F206 PolarHBondContact OG-O 2.85Å
205	P	70.6	Confident	71.9	Confident	119 Å²	119	85 Å²	85	77%	0.773	48%	0.484	S	S	*	.	S	Bend	trans	-69	-12.7	173	30.1	-35.1	0	0	0	112.3	L203	L203-P205 WeakPolarHBondContact O-CD 3.41Å
206	F	71.4	Confident	71.9	Confident	142 Å²	142	87.1 Å²	87.1	62%	0.623	49%	0.493	S	S	*	.	S	Bend	trans	-105.4	108.8	175.7	-66.6	-72.7	0	0	0	108.6	S204 I208	S204-F206 PolarHBondContact O-N 3.42Å; S204-F206 PolarHBondContact OG-N 3.37Å; S204-F206 PolarHBondContact OG-O 2.85Å; F206-I208 HydrophobicContact CB-CD1 3.87Å; F206-I208 HydrophobicContact CB-CG1 3.97Å; F206-I208 HydrophobicContact CD1-CD1 4.07Å; F206-I208 HydrophobicContact CG-CD1 4.22Å; F206-I208 PolarHBondContact O-N 3.16Å
207	D	66.6	Low	71.6	Confident	122 Å²	122	86.7 Å²	86.7	65%	0.652	49%	0.491	S	S	*	.			trans	-72.5	51	169.7	-157.5	17.4	0	0	0	110.5	Y201	Y201-D207 WeakPolarHBondContact CE2-OD1 3.3Å; Y201-D207 PolarHBondContact OH-OD1 3.47Å
208	I	61.9	Low	71.4	Confident	128 Å²	128	85.6 Å²	85.6	66%	0.656	49%	0.49	S	S	*	.			trans	-105.2	41.9	178.3	-51.3	169.5	0	0	0	108.5	F206 P210	F206-I208 HydrophobicContact CB-CD1 3.87Å; F206-I208 HydrophobicContact CB-CG1 3.97Å; F206-I208 HydrophobicContact CD1-CD1 4.07Å; F206-I208 HydrophobicContact CG-CD1 4.22Å; F206-I208 PolarHBondContact O-N 3.16Å; I208-P210 WeakPolarHBondContact O-CD 3.23Å
209	I	63.1	Low	71.5	Confident	42 Å²	42	88.5 Å²	88.5	22%	0.215	50%	0.496	C	S	.	.			trans	-86.1	98.9	151.8	-59.2	-167.7	0	0	0	104.3	Y201 E211 L213 F214	Y201-I209 HydrophobicContact CD2-CD1 3.62Å; Y201-I209 HydrophobicContact CD2-CG1 4.16Å; Y201-I209 HydrophobicContact CE2-CD1 4.4Å; Y201-I209 HydrophobicContact CG-CD1 4.49Å; I209-E211 PolarHBondContact O-N 2.96Å; I209-L213 HydrophobicContact CD1-CD2 4.5Å; I209-L213 HydrophobicContact CG2-CB 3.52Å; I209-L213 HydrophobicContact CG2-CD2 3.6Å; I209-L213 HydrophobicContact CG2-CG 4.13Å; I209-F214 HydrophobicContact CG2-CD2 4.43Å; I209-F214 HydrophobicContact CG2-CE2 4.27Å
210	P	65.2	Low	71.4	Confident	82 Å²	82	91.3 Å²	91.3	53%	0.532	51%	0.51	S	S	.	.			trans	-53.3	134	172.4	22.4	-31.2	0	0	0	107	I208 A212 L213	I208-P210 WeakPolarHBondContact O-CD 3.23Å; P210-A212 HydrophobicContact CB-CB 4.38Å; P210-A212 PolarHBondContact O-N 3.25Å; P210-L213 PolarHBondContact O-N 2.86Å
211	E	69	Low	71.4	Confident	175 Å²	175	89.3 Å²	89.3	82%	0.818	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	-23.4	179.3	-63.3	152.3	172.9	0	0	112.3	I209 L213 F214	I209-E211 PolarHBondContact O-N 2.96Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.41Å; E211-F214 WeakPolarHBondContact O-CB 3.45Å; E211-F214 PolarHBondContact O-N 3.29Å; E211-F214 VanDerWaalsContact O-N 3.16Å
212	A	68.2	Low	71.9	Confident	71 Å²	71	89.5 Å²	89.5	59%	0.587	50%	0.504	S	S	*	.	H	α-helix	trans	-53.7	-34.4	169	0	0	0	0	0	115.3	P210 F214 G215 L216	P210-A212 HydrophobicContact CB-CB 4.38Å; P210-A212 PolarHBondContact O-N 3.25Å; A212-F214 VanDerWaalsContact C-N 3.32Å; A212-G215 PolarHBondContact O-N 2.89Å; A212-L216 PolarHBondContact O-N 3.18Å
213	L	68.7	Low	72.2	Confident	79 Å²	79	91.5 Å²	91.5	41%	0.414	51%	0.506	S	S	.	.	H	α-helix	trans	-69.1	-32.3	178.1	-166.8	69.5	0	0	0	111.2	I209 P210 E211 G215 L216 L217	I209-L213 HydrophobicContact CD1-CD2 4.5Å; I209-L213 HydrophobicContact CG2-CB 3.52Å; I209-L213 HydrophobicContact CG2-CD2 3.6Å; I209-L213 HydrophobicContact CG2-CG 4.13Å; P210-L213 PolarHBondContact O-N 2.86Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.41Å; L213-G215 VanDerWaalsContact C-N 3.26Å; L213-G215 PolarHBondContact O-N 3.38Å; L213-L216 PolarHBondContact O-N 2.81Å; L213-L217 VanDerWaalsContact O-CB 3.29Å; L213-L217 WeakPolarHBondContact O-CB 3.07Å; L213-L217 PolarHBondContact O-N 3.27Å
214	F	71.3	Confident	72.4	Confident	128 Å²	128	93.6 Å²	93.6	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-61.7	-37.6	173.3	-77.3	-85.6	0	0	0	111.4	I209 E211 A212 G218	I209-F214 HydrophobicContact CG2-CD2 4.43Å; I209-F214 HydrophobicContact CG2-CE2 4.27Å; E211-F214 WeakPolarHBondContact O-CB 3.45Å; E211-F214 PolarHBondContact O-N 3.29Å; E211-F214 VanDerWaalsContact O-N 3.16Å; A212-F214 VanDerWaalsContact C-N 3.32Å; F214-G218 PolarHBondContact O-N 3.16Å
215	G	75.1	Confident	72.6	Confident	43 Å²	43	94.3 Å²	94.3	44%	0.443	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-48.4	172.5	0	0	0	0	0	112.5	A212 L213 G218 M219	A212-G215 PolarHBondContact O-N 2.89Å; L213-G215 VanDerWaalsContact C-N 3.26Å; L213-G215 PolarHBondContact O-N 3.38Å; G215-G218 PolarHBondContact O-N 2.89Å; G215-M219 WeakPolarHBondContact O-CG 3.01Å; G215-M219 PolarHBondContact O-N 2.99Å
216	L	76.1	Confident	73	Confident	112 Å²	112	92.6 Å²	92.6	59%	0.586	50%	0.501	S	S	*	.	H	α-helix	trans	-65.9	-40.7	177.8	-74	171.1	0	0	0	113	A212 L213 M219 L220	A212-L216 PolarHBondContact O-N 3.18Å; L213-L216 PolarHBondContact O-N 2.81Å; L216-M219 PolarHBondContact O-N 2.85Å; L216-L220 WeakPolarHBondContact O-CB 3.43Å; L216-L220 PolarHBondContact O-N 3.39Å
217	L	74.4	Confident	73.3	Confident	76 Å²	76	88.7 Å²	88.7	40%	0.398	49%	0.489	S	S	.	.	H	α-helix	trans	-68	-38.9	179	-149.3	78.1	0	0	0	110.8	V197 L213 L220 D221	V197-L217 HydrophobicContact CG1-CD2 4.12Å; L213-L217 VanDerWaalsContact O-CB 3.29Å; L213-L217 WeakPolarHBondContact O-CB 3.07Å; L213-L217 PolarHBondContact O-N 3.27Å; L217-L220 PolarHBondContact O-N 2.95Å; L217-D221 WeakPolarHBondContact O-CB 3.3Å; L217-D221 PolarHBondContact O-N 3.2Å
218	G	73.5	Confident	73.8	Confident	30 Å²	30	83.8 Å²	83.8	31%	0.309	46%	0.463	S	S	.	.	H	α-helix	trans	-62.3	-46.7	171.7	0	0	0	0	0	112.1	F214 G215 L220 D221 D222	F214-G218 PolarHBondContact O-N 3.16Å; G215-G218 PolarHBondContact O-N 2.89Å; G218-L220 VanDerWaalsContact C-N 3.32Å; G218-L220 PolarHBondContact O-N 3.22Å; G218-D221 WeakPolarHBondContact O-CB 3.5Å; G218-D221 PolarHBondContact O-N 3.34Å; G218-D221 VanDerWaalsContact O-N 3.16Å; G218-D222 PolarHBondContact O-N 3.47Å
219	M	77	Confident	74.7	Confident	118 Å²	118	82.3 Å²	82.3	58%	0.581	46%	0.456	S	S	*	.	H	α-helix	trans	-59.4	-41.2	174.6	-76.5	-177.3	62.6	0	0	112.7	G215 L216 D222 I223	G215-M219 WeakPolarHBondContact O-CG 3.01Å; G215-M219 PolarHBondContact O-N 2.99Å; L216-M219 PolarHBondContact O-N 2.85Å; M219-D222 PolarHBondContact O-N 2.94Å; M219-I223 VanDerWaalsContact O-CG1 3.3Å; M219-I223 WeakPolarHBondContact O-CG1 3.38Å; M219-I223 PolarHBondContact O-N 2.89Å
220	L	76.3	Confident	75.7	Confident	87 Å²	87	85.4 Å²	85.4	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-63.6	-42.9	176.4	-174.9	72.4	0	0	0	110.9	L216 L217 G218 I223 F224	L216-L220 WeakPolarHBondContact O-CB 3.43Å; L216-L220 PolarHBondContact O-N 3.39Å; L217-L220 PolarHBondContact O-N 2.95Å; G218-L220 VanDerWaalsContact C-N 3.32Å; G218-L220 PolarHBondContact O-N 3.22Å; L220-I223 PolarHBondContact O-N 3.28Å; L220-F224 HydrophobicContact CD1-CD2 4.48Å; L220-F224 HydrophobicContact CD1-CE2 3.93Å; L220-F224 HydrophobicContact CD2-CE2 3.92Å; L220-F224 HydrophobicContact CG-CD2 3.95Å; L220-F224 HydrophobicContact CG-CE2 3.57Å; L220-F224 WeakPolarHBondContact O-CD2 3.29Å; L220-F224 PolarHBondContact O-N 2.86Å
221	D	77.7	Confident	76.4	Confident	46 Å²	46	82.3 Å²	82.3	25%	0.246	45%	0.451	C	S	.	.	H	α-helix	trans	-60.8	-45.2	174.9	-169.9	59.3	0	0	0	112	R190 L217 G218 I223 F224 V225	R190-D221 IonicContact CZ-OD1 3.58Å; R190-D221 IonicContact CZ-OD2 3.66Å; R190-D221 IonicContact NE-OD1 2.79Å; R190-D221 PolarHBondContact NE-OD1 3.46Å; R190-D221 IonicContact NE-OD2 3.5Å; R190-D221 IonicContact NH2-OD1 3.6Å; R190-D221 PolarHBondContact NH2-OD1 2.99Å; R190-D221 IonicContact NH2-OD2 2.84Å; R190-D221 PolarHBondContact NH2-OD2 3.34Å; L217-D221 WeakPolarHBondContact O-CB 3.3Å; L217-D221 PolarHBondContact O-N 3.2Å; G218-D221 WeakPolarHBondContact O-CB 3.5Å; G218-D221 PolarHBondContact O-N 3.34Å; G218-D221 VanDerWaalsContact O-N 3.16Å; D221-I223 VanDerWaalsContact C-N 3.35Å; D221-I223 PolarHBondContact O-N 3.46Å; D221-F224 WeakPolarHBondContact O-CB 3.48Å; D221-F224 PolarHBondContact O-N 3.46Å; D221-F224 VanDerWaalsContact O-N 3.11Å; D221-V225 WeakPolarHBondContact O-CG2 3.34Å; D221-V225 PolarHBondContact O-N 3.36Å
222	D	79.8	Confident	77	Confident	101 Å²	101	81.4 Å²	81.4	54%	0.54	44%	0.442	S	S	.	.	H	α-helix	trans	-60	-43.2	175.6	-72.7	-27.3	0	0	0	111.6	G218 M219 F224 V225 V226	G218-D222 PolarHBondContact O-N 3.47Å; M219-D222 PolarHBondContact O-N 2.94Å; D222-F224 VanDerWaalsContact C-N 3.34Å; D222-F224 PolarHBondContact O-N 2.89Å; D222-V225 PolarHBondContact O-N 2.79Å; D222-V226 VanDerWaalsContact O-CG2 3.31Å; D222-V226 WeakPolarHBondContact O-CG2 3.3Å; D222-V226 PolarHBondContact O-N 3.5Å
223	I	79.8	Confident	77.8	Confident	99 Å²	99	82.4 Å²	82.4	51%	0.508	44%	0.437	S	S	.	.	H	α-helix	trans	-59.8	-44.9	173.8	-70.2	166.4	0	0	0	110.5	M219 L220 D221 V226 V227	M219-I223 VanDerWaalsContact O-CG1 3.3Å; M219-I223 WeakPolarHBondContact O-CG1 3.38Å; M219-I223 PolarHBondContact O-N 2.89Å; L220-I223 PolarHBondContact O-N 3.28Å; D221-I223 VanDerWaalsContact C-N 3.35Å; D221-I223 PolarHBondContact O-N 3.46Å; I223-V226 PolarHBondContact O-N 2.86Å; I223-V227 HydrophobicContact CG2-CG2 4.47Å; I223-V227 VanDerWaalsContact O-CG2 3.32Å; I223-V227 WeakPolarHBondContact O-CG2 3.3Å; I223-V227 PolarHBondContact O-N 3.47Å
224	F	80	Confident	78.6	Confident	117 Å²	117	81.1 Å²	81.1	51%	0.513	44%	0.435	S	S	.	.	H	α-helix	trans	-60.9	-45.4	176.1	-80.5	-64.6	0	0	0	111.7	L220 D221 D222 V226 V227 L228	L220-F224 HydrophobicContact CD1-CD2 4.48Å; L220-F224 HydrophobicContact CD1-CE2 3.93Å; L220-F224 HydrophobicContact CD2-CE2 3.92Å; L220-F224 HydrophobicContact CG-CD2 3.95Å; L220-F224 HydrophobicContact CG-CE2 3.57Å; L220-F224 WeakPolarHBondContact O-CD2 3.29Å; L220-F224 PolarHBondContact O-N 2.86Å; D221-F224 WeakPolarHBondContact O-CB 3.48Å; D221-F224 PolarHBondContact O-N 3.46Å; D221-F224 VanDerWaalsContact O-N 3.11Å; D222-F224 VanDerWaalsContact C-N 3.34Å; D222-F224 PolarHBondContact O-N 2.89Å; F224-V226 PolarHBondContact O-N 3.24Å; F224-V227 PolarHBondContact O-N 3.37Å; F224-L228 WeakPolarHBondContact O-CB 3.33Å; F224-L228 WeakPolarHBondContact O-CD1 3.3Å; F224-L228 WeakPolarHBondContact O-CG 3.16Å; F224-L228 PolarHBondContact O-N 3.02Å
225	V	78.5	Confident	79.2	Confident	63 Å²	63	76.4 Å²	76.4	38%	0.382	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-43.8	177.6	172.2	0	0	0	0	111.4	D221 D222 L228 L229	D221-V225 WeakPolarHBondContact O-CG2 3.34Å; D221-V225 PolarHBondContact O-N 3.36Å; D222-V225 PolarHBondContact O-N 2.79Å; V225-L228 PolarHBondContact O-N 3.47Å; V225-L229 WeakPolarHBondContact O-CB 3.49Å; V225-L229 PolarHBondContact O-N 3.37Å
226	V	78.9	Confident	79.7	Confident	83 Å²	83	76.3 Å²	76.3	50%	0.503	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-46.8	177	171	0	0	0	0	111.1	D222 I223 F224 L228 L229 L230	D222-V226 VanDerWaalsContact O-CG2 3.31Å; D222-V226 WeakPolarHBondContact O-CG2 3.3Å; D222-V226 PolarHBondContact O-N 3.5Å; I223-V226 PolarHBondContact O-N 2.86Å; F224-V226 PolarHBondContact O-N 3.24Å; V226-L228 VanDerWaalsContact C-N 3.31Å; V226-L228 PolarHBondContact O-N 2.86Å; V226-L229 PolarHBondContact O-N 2.98Å; V226-L230 HydrophobicContact CG1-CD1 4.27Å; V226-L230 WeakPolarHBondContact O-CG 3.34Å; V226-L230 PolarHBondContact O-N 3.41Å
227	V	79.2	Confident	80.2	Confident	60 Å²	60	78.2 Å²	78.2	36%	0.364	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-43.1	176.7	170.5	0	0	0	0	110.8	F178 I223 F224 L229 L230 V231	F178-V227 HydrophobicContact CE1-CG1 4.18Å; I223-V227 HydrophobicContact CG2-CG2 4.47Å; I223-V227 VanDerWaalsContact O-CG2 3.32Å; I223-V227 WeakPolarHBondContact O-CG2 3.3Å; I223-V227 PolarHBondContact O-N 3.47Å; F224-V227 PolarHBondContact O-N 3.37Å; V227-L229 PolarHBondContact O-N 3.3Å; V227-L230 PolarHBondContact O-N 3.25Å; V227-V231 HydrophobicContact CG1-CG2 4.47Å; V227-V231 VanDerWaalsContact O-CG2 3.26Å; V227-V231 WeakPolarHBondContact O-CG2 3.4Å; V227-V231 PolarHBondContact O-N 3.16Å
228	L	77.2	Confident	80.7	Confident	20 Å²	20	83.4 Å²	83.4	11%	0.105	42%	0.424	C	S	.	.	H	α-helix	trans	-62	-42.5	176.7	-71.3	167.3	0	0	0	112	L183 M186 F187 F224 V225 V226 V231 Y232	L183-L228 HydrophobicContact CD1-CD2 3.24Å; L183-L228 HydrophobicContact CG-CD2 4.49Å; M186-L228 HydrophobicContact CB-CD2 4.35Å; M186-L228 HydrophobicContact CE-CD2 3.67Å; F187-L228 HydrophobicContact CD1-CD1 4.23Å; F187-L228 HydrophobicContact CE1-CD1 3.66Å; F187-L228 HydrophobicContact CZ-CD1 4.1Å; F187-L228 HydrophobicContact CZ-CD2 4.32Å; F224-L228 WeakPolarHBondContact O-CB 3.33Å; F224-L228 WeakPolarHBondContact O-CD1 3.3Å; F224-L228 WeakPolarHBondContact O-CG 3.16Å; F224-L228 PolarHBondContact O-N 3.02Å; V225-L228 PolarHBondContact O-N 3.47Å; V226-L228 VanDerWaalsContact C-N 3.31Å; V226-L228 PolarHBondContact O-N 2.86Å; L228-V231 PolarHBondContact O-N 3.32Å; L228-Y232 WeakPolarHBondContact O-CB 3.29Å; L228-Y232 PolarHBondContact O-N 3.35Å
229	L	79.8	Confident	81.3	Confident	97 Å²	97	89.5 Å²	89.5	51%	0.508	44%	0.438	S	S	.	.	H	α-helix	trans	-63.6	-43.6	176.8	-176.6	140.4	0	0	0	111.3	V225 V226 V227 V231 Y232 L233	V225-L229 WeakPolarHBondContact O-CB 3.49Å; V225-L229 PolarHBondContact O-N 3.37Å; V226-L229 PolarHBondContact O-N 2.98Å; V227-L229 PolarHBondContact O-N 3.3Å; L229-V231 PolarHBondContact O-N 2.78Å; L229-Y232 PolarHBondContact O-N 3.01Å; L229-L233 HydrophobicContact CD2-CD1 3.57Å; L229-L233 HydrophobicContact CD2-CG 4.23Å; L229-L233 HydrophobicContact CG-CD1 4.4Å; L229-L233 WeakPolarHBondContact O-CB 3.43Å; L229-L233 VanDerWaalsContact O-CG 3.29Å; L229-L233 WeakPolarHBondContact O-CG 3.3Å; L229-L233 PolarHBondContact O-N 3.5Å
230	L	83.5	Confident	81.8	Confident	106 Å²	106	89.4 Å²	89.4	56%	0.555	43%	0.434	S	S	*	.	H	α-helix	trans	-62.7	-42.8	175.8	-69.7	176.5	0	0	0	112.2	V226 V227 L233 S234	V226-L230 HydrophobicContact CG1-CD1 4.27Å; V226-L230 WeakPolarHBondContact O-CG 3.34Å; V226-L230 PolarHBondContact O-N 3.41Å; V227-L230 PolarHBondContact O-N 3.25Å; L230-L233 PolarHBondContact O-N 3.4Å; L230-S234 WeakPolarHBondContact O-CB 3.32Å; L230-S234 PolarHBondContact O-N 3.25Å
231	V	81.4	Confident	82.5	Confident	17 Å²	17	88.1 Å²	88.1	10%	0.103	43%	0.427	C	S	.	.	H	α-helix	trans	-62.1	-46.9	175.2	171.5	0	0	0	0	110.2	F178 V227 L228 L229 L233 S234 I235	F178-V231 HydrophobicContact CD1-CB 4.5Å; F178-V231 HydrophobicContact CD1-CG1 4.25Å; F178-V231 HydrophobicContact CD1-CG2 3.44Å; F178-V231 VanDerWaalsContact CD1-CG2 3.44Å; F178-V231 HydrophobicContact CE1-CG2 3.71Å; F178-V231 HydrophobicContact CG-CG2 4.44Å; V227-V231 HydrophobicContact CG1-CG2 4.47Å; V227-V231 VanDerWaalsContact O-CG2 3.26Å; V227-V231 WeakPolarHBondContact O-CG2 3.4Å; V227-V231 PolarHBondContact O-N 3.16Å; L228-V231 PolarHBondContact O-N 3.32Å; L229-V231 PolarHBondContact O-N 2.78Å; V231-L233 PolarHBondContact O-N 3.21Å; V231-S234 PolarHBondContact O-N 2.81Å; V231-S234 PolarHBondContact O-OG 3.2Å; V231-I235 HydrophobicContact CG1-CD1 3.79Å; V231-I235 VanDerWaalsContact O-CG1 3.31Å; V231-I235 WeakPolarHBondContact O-CG1 3.36Å; V231-I235 PolarHBondContact O-N 2.97Å
232	Y	81.1	Confident	83	Confident	156 Å²	156	88.6 Å²	88.6	61%	0.612	44%	0.435	S	S	*	.	H	α-helix	trans	-58.5	-48.4	177.1	178.2	-95.3	0	0	0	111.9	L228 L229 S234 I235 A236	L228-Y232 WeakPolarHBondContact O-CB 3.29Å; L228-Y232 PolarHBondContact O-N 3.35Å; L229-Y232 PolarHBondContact O-N 3.01Å; Y232-S234 VanDerWaalsContact C-N 3.33Å; Y232-S234 PolarHBondContact O-N 3.36Å; Y232-I235 PolarHBondContact O-N 3.37Å; Y232-A236 WeakPolarHBondContact O-CB 3.35Å; Y232-A236 PolarHBondContact O-N 3.47Å
233	L	85	Confident	83.4	Confident	92 Å²	92	90 Å²	90	48%	0.482	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-41.9	176.2	-71.7	178.8	0	0	0	111.8	L229 L230 V231 I235 A236 Y237	L229-L233 HydrophobicContact CD2-CD1 3.57Å; L229-L233 HydrophobicContact CD2-CG 4.23Å; L229-L233 HydrophobicContact CG-CD1 4.4Å; L229-L233 WeakPolarHBondContact O-CB 3.43Å; L229-L233 VanDerWaalsContact O-CG 3.29Å; L229-L233 WeakPolarHBondContact O-CG 3.3Å; L229-L233 PolarHBondContact O-N 3.5Å; L230-L233 PolarHBondContact O-N 3.4Å; V231-L233 PolarHBondContact O-N 3.21Å; L233-I235 VanDerWaalsContact C-N 3.28Å; L233-I235 PolarHBondContact O-N 3Å; L233-A236 PolarHBondContact O-N 2.88Å; L233-Y237 VanDerWaalsContact O-CB 3.29Å; L233-Y237 WeakPolarHBondContact O-CB 3.25Å; L233-Y237 PolarHBondContact O-N 3.38Å
234	S	85.5	Confident	83.7	Confident	53 Å²	53	90 Å²	90	37%	0.371	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-37.7	177.9	80.9	0	0	0	0	112.2	L230 V231 Y232 R238	L230-S234 WeakPolarHBondContact O-CB 3.32Å; L230-S234 PolarHBondContact O-N 3.25Å; V231-S234 PolarHBondContact O-N 2.81Å; V231-S234 PolarHBondContact O-OG 3.2Å; Y232-S234 VanDerWaalsContact C-N 3.33Å; Y232-S234 PolarHBondContact O-N 3.36Å; S234-R238 WeakPolarHBondContact O-CB 3.24Å; S234-R238 VanDerWaalsContact O-CG 3.27Å; S234-R238 WeakPolarHBondContact O-CG 3.2Å; S234-R238 PolarHBondContact O-N 3.06Å
235	I	84.1	Confident	84	Confident	29 Å²	29	90.8 Å²	90.8	15%	0.149	44%	0.443	C	S	.	.	H	α-helix	trans	-74.7	-43.5	178.4	-65.9	166.7	0	0	0	110.3	V180 V231 Y232 L233 Y237 R238 R239	V180-I235 HydrophobicContact CG2-CD1 3.8Å; V180-I235 HydrophobicContact CG2-CG1 4.47Å; V180-I235 HydrophobicContact CG2-CG2 3.74Å; V231-I235 HydrophobicContact CG1-CD1 3.79Å; V231-I235 VanDerWaalsContact O-CG1 3.31Å; V231-I235 WeakPolarHBondContact O-CG1 3.36Å; V231-I235 PolarHBondContact O-N 2.97Å; Y232-I235 PolarHBondContact O-N 3.37Å; L233-I235 VanDerWaalsContact C-N 3.28Å; L233-I235 PolarHBondContact O-N 3Å; I235-Y237 VanDerWaalsContact C-N 3.31Å; I235-Y237 PolarHBondContact O-N 3.07Å; I235-R238 PolarHBondContact O-N 3.41Å; I235-R239 WeakPolarHBondContact O-CB 3.38Å; I235-R239 WeakPolarHBondContact O-CG 3.3Å; I235-R239 PolarHBondContact O-N 2.95Å
236	A	84.2	Confident	83.9	Confident	40 Å²	40	95.7 Å²	95.7	33%	0.331	46%	0.461	S	S	.	.	H	α-helix	trans	-58.7	-44.2	175.4	0	0	0	0	0	111	Y232 L233 R239 F240	Y232-A236 WeakPolarHBondContact O-CB 3.35Å; Y232-A236 PolarHBondContact O-N 3.47Å; L233-A236 PolarHBondContact O-N 2.88Å; A236-R239 PolarHBondContact O-N 3.42Å; A236-F240 WeakPolarHBondContact O-CB 3.27Å; A236-F240 PolarHBondContact O-N 3.03Å
237	Y	86.6	Confident	83.3	Confident	153 Å²	153	103.7 Å²	103.7	60%	0.6	48%	0.482	S	S	*	.	H	α-helix	trans	-63.3	-45.9	175.4	-178.1	-113.2	0	0	0	112.5	L233 I235 R239 F240 I241	L233-Y237 VanDerWaalsContact O-CB 3.29Å; L233-Y237 WeakPolarHBondContact O-CB 3.25Å; L233-Y237 PolarHBondContact O-N 3.38Å; I235-Y237 VanDerWaalsContact C-N 3.31Å; I235-Y237 PolarHBondContact O-N 3.07Å; Y237-R239 VanDerWaalsContact C-N 3.31Å; Y237-R239 PolarHBondContact O-N 2.92Å; Y237-F240 PolarHBondContact O-N 2.8Å; Y237-I241 HydrophobicContact CD1-CD1 3.69Å; Y237-I241 HydrophobicContact CD2-CD1 4.3Å; Y237-I241 HydrophobicContact CE1-CD1 3.17Å; Y237-I241 HydrophobicContact CE1-CG1 4.32Å; Y237-I241 HydrophobicContact CE2-CD1 3.85Å; Y237-I241 HydrophobicContact CE2-CG1 4.2Å; Y237-I241 HydrophobicContact CG-CD1 4.23Å; Y237-I241 PolarHBondContact O-N 3.2Å
238	R	86.3	Confident	83.5	Confident	185 Å²	185	105.9 Å²	105.9	70%	0.698	49%	0.488	S	S	*	.	H	α-helix	trans	-59.1	-41	174.5	-77.1	174.3	-173.8	-89.4	0.1	112.2	S234 I235 S242	S234-R238 WeakPolarHBondContact O-CB 3.24Å; S234-R238 VanDerWaalsContact O-CG 3.27Å; S234-R238 WeakPolarHBondContact O-CG 3.2Å; S234-R238 PolarHBondContact O-N 3.06Å; I235-R238 PolarHBondContact O-N 3.41Å; R238-S242 VanDerWaalsContact O-CB 3.28Å; R238-S242 WeakPolarHBondContact O-CB 3.08Å; R238-S242 PolarHBondContact O-N 2.8Å
239	R	86.1	Confident	83.8	Confident	158 Å²	158	110.4 Å²	110.4	60%	0.596	51%	0.508	S	S	*	.	H	α-helix	trans	-66.9	-42	176.5	-74.1	177	179.1	-171.9	-1.2	111.8	I235 A236 Y237 S242 F243	I235-R239 WeakPolarHBondContact O-CB 3.38Å; I235-R239 WeakPolarHBondContact O-CG 3.3Å; I235-R239 PolarHBondContact O-N 2.95Å; A236-R239 PolarHBondContact O-N 3.42Å; Y237-R239 VanDerWaalsContact C-N 3.31Å; Y237-R239 PolarHBondContact O-N 2.92Å; R239-S242 PolarHBondContact O-N 2.84Å; R239-F243 WeakPolarHBondContact O-CB 3.17Å; R239-F243 PolarHBondContact O-N 3.43Å
240	F	87.8	Confident	84.1	Confident	115 Å²	115	111.2 Å²	111.2	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-61	-47.8	176.1	-179.5	-98.1	0	0	0	111.7	A236 Y237 F243 H244	A236-F240 WeakPolarHBondContact O-CB 3.27Å; A236-F240 PolarHBondContact O-N 3.03Å; Y237-F240 PolarHBondContact O-N 2.8Å; F240-F243 PolarHBondContact O-N 3.3Å; F240-H244 AromaticContact CE1-CD2 3.57Å; F240-H244 AromaticContact CE1-NE2 3.77Å; F240-H244 AromaticContact CE2-NE2 3.59Å; F240-H244 AromaticContact CZ-CD2 3.48Å; F240-H244 VanDerWaalsContact CZ-CD2 3.48Å; F240-H244 WeakPolarHBondContact CZ-CD2 3.25Å; F240-H244 AromaticContact CZ-NE2 3.14Å; F240-H244 WeakPolarHBondContact CZ-NE2 3.17Å; F240-H244 PolarHBondContact O-N 2.82Å; F240-H244 VanDerWaalsContact O-N 3.07Å
241	I	90.4	Very high	84.1	Confident	60 Å²	60	111.5 Å²	111.5	31%	0.308	51%	0.506	S	S	.	.	H	α-helix	trans	-61.3	-46.8	174.6	-71.8	166.1	0	0	0	111.3	Y237 F243 H244 L245	Y237-I241 HydrophobicContact CD1-CD1 3.69Å; Y237-I241 HydrophobicContact CD2-CD1 4.3Å; Y237-I241 HydrophobicContact CE1-CD1 3.17Å; Y237-I241 HydrophobicContact CE1-CG1 4.32Å; Y237-I241 HydrophobicContact CE2-CD1 3.85Å; Y237-I241 HydrophobicContact CE2-CG1 4.2Å; Y237-I241 HydrophobicContact CG-CD1 4.23Å; Y237-I241 PolarHBondContact O-N 3.2Å; I241-F243 VanDerWaalsContact C-N 3.26Å; I241-F243 PolarHBondContact O-N 2.91Å; I241-H244 PolarHBondContact O-N 3.27Å; I241-H244 VanDerWaalsContact O-N 3.1Å; I241-L245 HydrophobicContact CG2-CD1 3.42Å; I241-L245 VanDerWaalsContact CG2-CD1 3.42Å; I241-L245 HydrophobicContact CG2-CG 4.17Å; I241-L245 PolarHBondContact O-N 3.22Å
242	S	88.5	Confident	84.3	Confident	57 Å²	57	117.4 Å²	117.4	40%	0.399	53%	0.531	S	S	.	.	H	α-helix	trans	-59	-39.5	178.6	175.2	0	0	0	0	111.7	R238 R239 H244 L245 H246	R238-S242 VanDerWaalsContact O-CB 3.28Å; R238-S242 WeakPolarHBondContact O-CB 3.08Å; R238-S242 PolarHBondContact O-N 2.8Å; R239-S242 PolarHBondContact O-N 2.84Å; S242-H244 PolarHBondContact O-N 3.36Å; S242-L245 PolarHBondContact O-N 3.23Å; S242-H246 PolarHBondContact O-CD2 2.65Å; S242-H246 PolarHBondContact O-N 3.34Å
243	F	87.2	Confident	84.5	Confident	130 Å²	130	114.8 Å²	114.8	57%	0.57	53%	0.525	S	S	*	.	H	α-helix	trans	-65.1	-35.8	175.2	180	-101.3	0	0	0	112.9	R239 F240 I241	R239-F243 WeakPolarHBondContact O-CB 3.17Å; R239-F243 PolarHBondContact O-N 3.43Å; F240-F243 PolarHBondContact O-N 3.3Å; I241-F243 VanDerWaalsContact C-N 3.26Å; I241-F243 PolarHBondContact O-N 2.91Å
244	H	86.2	Confident	84.4	Confident	99 Å²	99	116.4 Å²	116.4	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-80.9	-27.8	177	-79	-9.8	0	0	0	114.6	F240 I241 S242 H246	F240-H244 AromaticContact CE1-CD2 3.57Å; F240-H244 AromaticContact CE1-NE2 3.77Å; F240-H244 AromaticContact CE2-NE2 3.59Å; F240-H244 AromaticContact CZ-CD2 3.48Å; F240-H244 VanDerWaalsContact CZ-CD2 3.48Å; F240-H244 WeakPolarHBondContact CZ-CD2 3.25Å; F240-H244 AromaticContact CZ-NE2 3.14Å; F240-H244 WeakPolarHBondContact CZ-NE2 3.17Å; F240-H244 PolarHBondContact O-N 2.82Å; F240-H244 VanDerWaalsContact O-N 3.07Å; I241-H244 PolarHBondContact O-N 3.27Å; I241-H244 VanDerWaalsContact O-N 3.1Å; S242-H244 PolarHBondContact O-N 3.36Å; H244-H246 VanDerWaalsContact C-N 3.34Å
245	L	86.4	Confident	84.3	Confident	134 Å²	134	121.3 Å²	121.3	70%	0.702	54%	0.541	S	S	*	.	H	α-helix	trans	-73.9	-25.2	175.4	-81.9	162.1	0	0	0	113.2	I241 S242	I241-L245 HydrophobicContact CG2-CD1 3.42Å; I241-L245 VanDerWaalsContact CG2-CD1 3.42Å; I241-L245 HydrophobicContact CG2-CG 4.17Å; I241-L245 PolarHBondContact O-N 3.22Å; S242-L245 PolarHBondContact O-N 3.23Å
246	H	76	Confident	84.4	Confident	165 Å²	165	129 Å²	129	76%	0.764	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	6.7	179.9	-73	-61.4	0	0	0	114.3	S242 H244	S242-H246 PolarHBondContact O-CD2 2.65Å; S242-H246 PolarHBondContact O-N 3.34Å; H244-H246 VanDerWaalsContact C-N 3.34Å
247	R	66.9	Low	84.4	Confident	252 Å²	252	137.1 Å²	137.1	95%	0.951	60%	0.595	S	S	*	*			trans	-114.3	0	175.1	-175.3	177.9	-176.6	170.1	1.8	110.3

Retrieved 247 of 247 residues in 519.5 ms (Link to these results)

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