A0A087XMH4_POEFO Loading...

Ankyrin repeat domain 46b

AlphaFold DB (M3ZIA2), UniProt , Accession A0A087XMH4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 228 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	36.3	Very low	42.8	Very low	219 Å²	219	142 Å²	142	100%	1.079	76%	0.758	S	S	*	*				0	103.7	0	-97.2	78.9	169.5	0	0	108.8	Y3	M1-Y3 HydrophobicContact CB-CE2 4.5Å; M1-Y3 PolarHBondContact O-N 3.03Å
2	S	37.7	Very low	43.2	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	73%	0.728	S	S	*	*			trans	-79.2	109.2	173.2	-38.7	0	0	0	0	107.7	V4	S2-V4 PolarHBondContact O-N 2.92Å
3	Y	37.8	Very low	44.3	Very low	193 Å²	193	129.3 Å²	129.3	76%	0.757	70%	0.701	S	S	*	*			trans	-74.1	108.2	178.7	-90.3	-90.7	0	0	0	109.5	M1 F5	M1-Y3 HydrophobicContact CB-CE2 4.5Å; M1-Y3 PolarHBondContact O-N 3.03Å; Y3-F5 PolarHBondContact O-N 3.22Å
4	V	44.5	Very low	46.6	Very low	122 Å²	122	121.8 Å²	121.8	74%	0.739	66%	0.662	S	S	*	*			trans	-73.2	110.9	167.4	176.6	0	0	0	0	107	S2 I6	S2-V4 PolarHBondContact O-N 2.92Å; V4-I6 PolarHBondContact O-N 3.47Å
5	F	48.3	Very low	49.3	Very low	153 Å²	153	116.9 Å²	116.9	67%	0.671	64%	0.638	S	S	*	*			trans	-76	113.1	174.4	-72	-83.3	0	0	0	109.1	Y3 N7 P15	Y3-F5 PolarHBondContact O-N 3.22Å; F5-N7 PolarHBondContact O-N 3.21Å; F5-P15 HydrophobicContact CE1-CG 4.07Å
6	I	43.6	Very low	51.8	Low	146 Å²	146	109.6 Å²	109.6	75%	0.749	60%	0.598	S	S	*	*			trans	-71.5	120.6	177.7	-62.8	174.4	0	0	0	108.4	V4 D8	V4-I6 PolarHBondContact O-N 3.47Å; I6-D8 PolarHBondContact O-N 3.42Å
7	N	41.9	Very low	54.1	Low	143 Å²	143	103.4 Å²	103.4	77%	0.765	56%	0.564	S	S	*	*			trans	-77.2	95.1	172	-178.7	27.9	0	0	0	109	F5	F5-N7 PolarHBondContact O-N 3.21Å
8	D	40.2	Very low	56.1	Low	102 Å²	102	101.1 Å²	101.1	55%	0.545	55%	0.549	S	S	.	.			trans	-110.1	137.8	165.4	-159.5	-2	0	0	0	110.3	I6 S10 S13	I6-D8 PolarHBondContact O-N 3.42Å; D8-S10 PolarHBondContact O-N 3.02Å; D8-S13 PolarHBondContact O-OG 3.27Å
9	S	47.2	Very low	57.9	Low	115 Å²	115	95.9 Å²	95.9	80%	0.804	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	10.8	-152.5	56.3	0	0	0	0	115.1
10	S	48	Very low	59.6	Low	100 Å²	100	91.1 Å²	91.1	70%	0.699	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	6.3	179.4	67.6	0	0	0	0	114.7	D8	D8-S10 PolarHBondContact O-N 3.02Å
11	Q	45.5	Very low	61.1	Low	150 Å²	150	88.4 Å²	88.4	70%	0.701	48%	0.48	S	S	*	.	S	Bend	trans	-128	143.6	172.4	-64.1	-83.6	13	0	0	107.5	S13	Q11-S13 PolarHBondContact O-N 2.76Å; Q11-S13 PolarHBondContact O-OG 3.41Å
12	T	47.7	Very low	63.6	Low	65 Å²	65	83 Å²	83	40%	0.399	46%	0.456	S	S	.	.			trans	-62.5	74.9	169.4	34.6	0	0	0	0	110.4	V14 Q18	T12-V14 PolarHBondContact O-N 2.94Å; T12-Q18 PolarHBondContact OG1-OE1 3.16Å
13	S	56.8	Low	66.2	Low	54 Å²	54	78.7 Å²	78.7	38%	0.378	43%	0.43	S	S	.	.			trans	-78.3	47.2	-165.2	44.7	0	0	0	0	114.3	D8 Q11	D8-S13 PolarHBondContact O-OG 3.27Å; Q11-S13 PolarHBondContact O-N 2.76Å; Q11-S13 PolarHBondContact O-OG 3.41Å
14	V	77.3	Confident	68.8	Low	24 Å²	24	72.9 Å²	72.9	15%	0.145	41%	0.412	C	S	.	.			trans	-135.1	107.6	168.6	-176.4	0	0	0	0	108.9	T12 L16 L17 Q18 I40	T12-V14 PolarHBondContact O-N 2.94Å; V14-L16 HydrophobicContact CG1-CB 4.34Å; V14-L16 PolarHBondContact O-N 3.44Å; V14-L16 VanDerWaalsContact O-N 3.1Å; V14-L17 HydrophobicContact CB-CB 4.13Å; V14-L17 HydrophobicContact CB-CD1 3.84Å; V14-L17 HydrophobicContact CB-CG 3.79Å; V14-L17 HydrophobicContact CG1-CB 4.41Å; V14-L17 HydrophobicContact CG1-CD1 4.24Å; V14-L17 HydrophobicContact CG1-CG 3.81Å; V14-L17 HydrophobicContact CG2-CD1 4.07Å; V14-L17 PolarHBondContact O-N 2.89Å; V14-Q18 PolarHBondContact O-N 2.71Å; V14-Q18 VanDerWaalsContact O-N 3.17Å; V14-I40 HydrophobicContact CB-CD1 4.28Å; V14-I40 HydrophobicContact CG1-CB 4.31Å; V14-I40 HydrophobicContact CG1-CD1 3.4Å; V14-I40 VanDerWaalsContact CG1-CD1 3.4Å; V14-I40 HydrophobicContact CG1-CG1 3.79Å; V14-I40 HydrophobicContact CG1-CG2 3.65Å; V14-I40 HydrophobicContact CG2-CD1 3.82Å; V14-I40 HydrophobicContact CG2-CG1 3.98Å
15	P	86.5	Confident	71.2	Confident	48 Å²	48	70.1 Å²	70.1	31%	0.312	39%	0.393	S	S	.	.	H	α-helix	trans	-52.9	-36.3	-176.2	-28.6	34.8	0	0	0	114	F5 Q18 A19 F27 L31	F5-P15 HydrophobicContact CE1-CG 4.07Å; P15-Q18 PolarHBondContact O-N 3.26Å; P15-A19 PolarHBondContact O-N 3.37Å; P15-F27 HydrophobicContact CB-CE1 4.46Å; P15-L31 HydrophobicContact CB-CD1 3.83Å; P15-L31 HydrophobicContact CB-CD2 4.25Å
16	L	89.6	Confident	73.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-66.2	-41.2	178.5	-179.7	62.9	0	0	0	112.1	V14 Q18 A19 C20 A28 L31 L32 I40 L64	V14-L16 HydrophobicContact CG1-CB 4.34Å; V14-L16 PolarHBondContact O-N 3.44Å; V14-L16 VanDerWaalsContact O-N 3.1Å; L16-Q18 VanDerWaalsContact C-N 3.34Å; L16-A19 WeakPolarHBondContact O-CB 3.4Å; L16-A19 PolarHBondContact O-N 3Å; L16-C20 PolarHBondContact O-N 3.27Å; L16-C20 VanDerWaalsContact O-N 3.07Å; L16-C20 PolarHBondContact O-SG 2.71Å; L16-A28 HydrophobicContact CD1-CB 4.23Å; L16-L31 HydrophobicContact CB-CD1 4.22Å; L16-L31 HydrophobicContact CD1-CB 4.27Å; L16-L32 HydrophobicContact CD1-CD1 4.46Å; L16-L32 HydrophobicContact CD1-CD2 4.14Å; L16-L32 HydrophobicContact CD1-CG 3.97Å; L16-L32 HydrophobicContact CD2-CD2 3.74Å; L16-L32 HydrophobicContact CD2-CG 4.47Å; L16-I40 HydrophobicContact CD2-CG2 4.18Å; L16-L64 HydrophobicContact CD2-CD2 4.49Å
17	L	90.7	Very high	75.8	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-67.1	-39.5	178.6	-61.6	-174.5	0	0	0	110.9	V14 C20 I21 I40 D42 L51	V14-L17 HydrophobicContact CB-CB 4.13Å; V14-L17 HydrophobicContact CB-CD1 3.84Å; V14-L17 HydrophobicContact CB-CG 3.79Å; V14-L17 HydrophobicContact CG1-CB 4.41Å; V14-L17 HydrophobicContact CG1-CD1 4.24Å; V14-L17 HydrophobicContact CG1-CG 3.81Å; V14-L17 HydrophobicContact CG2-CD1 4.07Å; V14-L17 PolarHBondContact O-N 2.89Å; L17-C20 WeakPolarHBondContact O-CB 3.32Å; L17-C20 PolarHBondContact O-N 3.44Å; L17-I21 WeakPolarHBondContact O-CG1 3.29Å; L17-I21 PolarHBondContact O-N 2.95Å; L17-I40 HydrophobicContact CD1-CG2 4.47Å; L17-I40 HydrophobicContact CD2-CG2 3.84Å; L17-I40 HydrophobicContact CG-CG2 4Å; L17-D42 HydrophobicContact CD1-CB 3.83Å; L17-L51 HydrophobicContact CB-CD1 3.8Å; L17-L51 HydrophobicContact CD2-CD1 3.99Å; L17-L51 HydrophobicContact CG-CD1 4.33Å
18	Q	89.6	Confident	78.3	Confident	63 Å²	63	57.7 Å²	57.7	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-61.7	-45.6	174.8	-168.7	57	48.6	0	0	111.3	T12 V14 P15 L16 C20 I21 D22	T12-Q18 PolarHBondContact OG1-OE1 3.16Å; V14-Q18 PolarHBondContact O-N 2.71Å; V14-Q18 VanDerWaalsContact O-N 3.17Å; P15-Q18 PolarHBondContact O-N 3.26Å; L16-Q18 VanDerWaalsContact C-N 3.34Å; Q18-C20 VanDerWaalsContact C-N 3.25Å; Q18-C20 PolarHBondContact O-N 3.23Å; Q18-I21 WeakPolarHBondContact O-CB 3.38Å; Q18-I21 PolarHBondContact O-N 2.94Å; Q18-D22 WeakPolarHBondContact CG-OD2 3.41Å; Q18-D22 VanDerWaalsContact NE2-CG 3.28Å; Q18-D22 PolarHBondContact NE2-OD1 2.84Å; Q18-D22 PolarHBondContact NE2-OD2 3.43Å; Q18-D22 VanDerWaalsContact O-CG 3.31Å; Q18-D22 PolarHBondContact O-N 2.97Å
19	A	91.4	Very high	80.9	Confident	2 Å²	2	57.6 Å²	57.6	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-57.2	-38.3	174.6	0	0	0	0	0	112.7	P15 L16 D22 G23 D24 F27 A28	P15-A19 PolarHBondContact O-N 3.37Å; L16-A19 WeakPolarHBondContact O-CB 3.4Å; L16-A19 PolarHBondContact O-N 3Å; A19-D22 PolarHBondContact O-N 3.29Å; A19-G23 PolarHBondContact O-N 3.49Å; A19-D24 PolarHBondContact O-N 2.92Å; A19-D24 VanDerWaalsContact O-N 3.09Å; A19-F27 HydrophobicContact CB-CD1 3.75Å; A19-F27 HydrophobicContact CB-CE1 4.45Å; A19-A28 HydrophobicContact CB-CB 3.91Å
20	C	92.4	Very high	83.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-67.5	-36.6	176.4	-63.8	0	0	0	0	112.8	L16 L17 Q18 L51 A52 I60	L16-C20 PolarHBondContact O-N 3.27Å; L16-C20 VanDerWaalsContact O-N 3.07Å; L16-C20 PolarHBondContact O-SG 2.71Å; L17-C20 WeakPolarHBondContact O-CB 3.32Å; L17-C20 PolarHBondContact O-N 3.44Å; Q18-C20 VanDerWaalsContact C-N 3.25Å; Q18-C20 PolarHBondContact O-N 3.23Å; C20-L51 HydrophobicContact CB-CB 4.25Å; C20-A52 HydrophobicContact CB-CB 4.36Å; C20-I60 HydrophobicContact CB-CG2 4.32Å
21	I	89.9	Confident	85.3	Confident	34 Å²	34	57 Å²	57	17%	0.174	30%	0.297	C	S	.	.	H	α-helix	trans	-67.4	-44.2	175.6	-66.7	167.8	0	0	0	110.4	L17 Q18 G23 L51	L17-I21 WeakPolarHBondContact O-CG1 3.29Å; L17-I21 PolarHBondContact O-N 2.95Å; Q18-I21 WeakPolarHBondContact O-CB 3.38Å; Q18-I21 PolarHBondContact O-N 2.94Å; I21-G23 VanDerWaalsContact C-N 3.34Å; I21-L51 HydrophobicContact CD1-CD1 4.08Å; I21-L51 HydrophobicContact CG1-CB 4.11Å; I21-L51 HydrophobicContact CG1-CD1 3.9Å; I21-L51 HydrophobicContact CG1-CD2 4.35Å; I21-L51 HydrophobicContact CG1-CG 4.34Å
22	D	89.6	Confident	87.5	Confident	106 Å²	106	50.1 Å²	50.1	57%	0.567	27%	0.266	S	S	*	.	H	α-helix	trans	-79.1	-18.9	-174	-64.1	-22.3	0	0	0	112.7	Q18 A19	Q18-D22 WeakPolarHBondContact CG-OD2 3.41Å; Q18-D22 VanDerWaalsContact NE2-CG 3.28Å; Q18-D22 PolarHBondContact NE2-OD1 2.84Å; Q18-D22 PolarHBondContact NE2-OD2 3.43Å; Q18-D22 VanDerWaalsContact O-CG 3.31Å; Q18-D22 PolarHBondContact O-N 2.97Å; A19-D22 PolarHBondContact O-N 3.29Å
23	G	91.5	Very high	89.6	Confident	29 Å²	29	52.7 Å²	52.7	30%	0.299	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	15.3	-176.1	0	0	0	0	0	113.7	A19 I21 L25 N57 I60	A19-G23 PolarHBondContact O-N 3.49Å; I21-G23 VanDerWaalsContact C-N 3.34Å; G23-L25 PolarHBondContact O-N 3.42Å; G23-N57 VanDerWaalsContact CA-ND2 3.28Å; G23-N57 WeakPolarHBondContact CA-ND2 3.37Å; G23-I60 VanDerWaalsContact C-CD1 3.5Å; G23-I60 VanDerWaalsContact CA-CD1 3.48Å
24	D	93.6	Very high	91.2	Very high	71 Å²	71	55.2 Å²	55.2	38%	0.38	29%	0.286	S	S	.	.			trans	-79.4	85.1	-179.3	-168.1	-22.6	0	0	0	111.2	A19 P26 F27 A28	A19-D24 PolarHBondContact O-N 2.92Å; A19-D24 VanDerWaalsContact O-N 3.09Å; D24-P26 VanDerWaalsContact OD1-CD 3.22Å; D24-P26 WeakPolarHBondContact OD1-CD 3.38Å; D24-F27 HydrophobicContact CB-CB 4.02Å; D24-F27 PolarHBondContact O-N 3.45Å; D24-F27 VanDerWaalsContact OD1-CB 3.28Å; D24-F27 WeakPolarHBondContact OD1-CB 3.31Å; D24-F27 PolarHBondContact OD1-N 3.45Å; D24-F27 VanDerWaalsContact OD2-CB 3.32Å; D24-F27 WeakPolarHBondContact OD2-CB 3.48Å; D24-A28 VanDerWaalsContact O-CB 3.32Å; D24-A28 WeakPolarHBondContact O-CB 3.21Å; D24-A28 PolarHBondContact O-N 2.9Å
25	L	94.6	Very high	91.6	Very high	63 Å²	63	57.2 Å²	57.2	33%	0.33	31%	0.312	S	S	.	.	H	α-helix	trans	-59.3	-47.7	178.4	179.8	76.7	0	0	0	112.9	G23 F27 A28 K29 E59 I60 L63	G23-L25 PolarHBondContact O-N 3.42Å; L25-F27 VanDerWaalsContact C-N 3.33Å; L25-F27 PolarHBondContact O-N 2.88Å; L25-A28 PolarHBondContact O-N 3.4Å; L25-K29 WeakPolarHBondContact O-CB 3.05Å; L25-K29 PolarHBondContact O-N 3.43Å; L25-E59 HydrophobicContact CD1-CB 4.17Å; L25-E59 HydrophobicContact CD2-CB 4.17Å; L25-I60 HydrophobicContact CB-CG1 4.27Å; L25-I60 HydrophobicContact CD1-CG1 3.93Å; L25-L63 HydrophobicContact CD1-CB 4.09Å; L25-L63 HydrophobicContact CD1-CD2 3.73Å; L25-L63 HydrophobicContact CD1-CG 4.47Å
26	P	95.3	Very high	91.6	Very high	93 Å²	93	56.7 Å²	56.7	60%	0.604	31%	0.309	S	S	*	.	H	α-helix	trans	-57.7	-42.5	176.6	-25.4	32.9	0	0	0	113.6	D24 R30	D24-P26 VanDerWaalsContact OD1-CD 3.22Å; D24-P26 WeakPolarHBondContact OD1-CD 3.38Å; P26-R30 PolarHBondContact O-N 3.42Å; P26-R30 VanDerWaalsContact O-N 3.14Å
27	F	93.4	Very high	91.6	Very high	89 Å²	89	60.9 Å²	60.9	39%	0.39	33%	0.331	S	S	.	.	H	α-helix	trans	-71.5	-44.3	-179.4	-172.2	-123.2	0	0	0	111.7	P15 A19 D24 L25 K29 R30 L31	P15-F27 HydrophobicContact CB-CE1 4.46Å; A19-F27 HydrophobicContact CB-CD1 3.75Å; A19-F27 HydrophobicContact CB-CE1 4.45Å; D24-F27 HydrophobicContact CB-CB 4.02Å; D24-F27 PolarHBondContact O-N 3.45Å; D24-F27 VanDerWaalsContact OD1-CB 3.28Å; D24-F27 WeakPolarHBondContact OD1-CB 3.31Å; D24-F27 PolarHBondContact OD1-N 3.45Å; D24-F27 VanDerWaalsContact OD2-CB 3.32Å; D24-F27 WeakPolarHBondContact OD2-CB 3.48Å; L25-F27 VanDerWaalsContact C-N 3.33Å; L25-F27 PolarHBondContact O-N 2.88Å; F27-K29 VanDerWaalsContact C-N 3.3Å; F27-K29 PolarHBondContact O-N 2.77Å; F27-R30 PolarHBondContact O-N 3.31Å; F27-L31 HydrophobicContact CD1-CD1 4.02Å; F27-L31 HydrophobicContact CE1-CD1 3.73Å; F27-L31 HydrophobicContact CE2-CD1 4.49Å; F27-L31 HydrophobicContact CZ-CD1 3.98Å; F27-L31 HydrophobicContact CZ-CD2 4.45Å; F27-L31 HydrophobicContact CZ-CG 4.39Å; F27-L31 WeakPolarHBondContact O-CG 3.25Å; F27-L31 PolarHBondContact O-N 2.88Å; F27-L31 VanDerWaalsContact O-N 3.08Å
28	A	93.9	Very high	91.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-56.9	-43.7	173.9	0	0	0	0	0	111.8	L16 A19 D24 L25 L31 L32 L63	L16-A28 HydrophobicContact CD1-CB 4.23Å; A19-A28 HydrophobicContact CB-CB 3.91Å; D24-A28 VanDerWaalsContact O-CB 3.32Å; D24-A28 WeakPolarHBondContact O-CB 3.21Å; D24-A28 PolarHBondContact O-N 2.9Å; L25-A28 PolarHBondContact O-N 3.4Å; A28-L31 PolarHBondContact O-N 3.5Å; A28-L32 WeakPolarHBondContact O-CG 3.23Å; A28-L32 PolarHBondContact O-N 3.49Å; A28-L63 HydrophobicContact CB-CD2 4.09Å
29	K	94.6	Very high	91.7	Very high	100 Å²	100	60.7 Å²	60.7	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-60.5	-47.6	177.8	-179.6	175.8	172.1	-176	0	111.9	L25 F27 L31 L32 E33 L63	L25-K29 WeakPolarHBondContact O-CB 3.05Å; L25-K29 PolarHBondContact O-N 3.43Å; F27-K29 VanDerWaalsContact C-N 3.3Å; F27-K29 PolarHBondContact O-N 2.77Å; K29-L31 VanDerWaalsContact C-N 3.3Å; K29-L31 PolarHBondContact O-N 3.33Å; K29-L32 PolarHBondContact O-N 2.85Å; K29-E33 WeakPolarHBondContact CE-OE1 3.45Å; K29-E33 HydrophobicContact CG-CG 4.42Å; K29-E33 IonicContact NZ-OE1 3.9Å; K29-E33 WeakPolarHBondContact O-CB 3.24Å; K29-E33 WeakPolarHBondContact O-CG 3.29Å; K29-E33 PolarHBondContact O-N 2.87Å; K29-L63 HydrophobicContact CB-CD1 4.2Å; K29-L63 HydrophobicContact CB-CD2 3.79Å; K29-L63 HydrophobicContact CG-CD1 4.15Å
30	R	94.8	Very high	91.7	Very high	172 Å²	172	63 Å²	63	65%	0.649	35%	0.345	S	S	*	.	H	α-helix	trans	-59.1	-42.9	178.4	-170.2	-177.3	-59.6	-165.2	1.8	111.5	P26 F27 E33 T34	P26-R30 PolarHBondContact O-N 3.42Å; P26-R30 VanDerWaalsContact O-N 3.14Å; F27-R30 PolarHBondContact O-N 3.31Å; R30-E33 PolarHBondContact O-N 3.48Å; R30-T34 WeakPolarHBondContact O-CG2 3.33Å; R30-T34 PolarHBondContact O-N 3.35Å; R30-T34 VanDerWaalsContact O-N 3.08Å
31	L	91.7	Very high	91.6	Very high	29 Å²	29	68.4 Å²	68.4	15%	0.152	37%	0.365	C	S	.	.	H	α-helix	trans	-63.6	-44.3	178.6	-69.7	170	0	0	0	111.9	P15 L16 F27 A28 K29 E33 T34 C36	P15-L31 HydrophobicContact CB-CD1 3.83Å; P15-L31 HydrophobicContact CB-CD2 4.25Å; L16-L31 HydrophobicContact CB-CD1 4.22Å; L16-L31 HydrophobicContact CD1-CB 4.27Å; F27-L31 HydrophobicContact CD1-CD1 4.02Å; F27-L31 HydrophobicContact CE1-CD1 3.73Å; F27-L31 HydrophobicContact CE2-CD1 4.49Å; F27-L31 HydrophobicContact CZ-CD1 3.98Å; F27-L31 HydrophobicContact CZ-CD2 4.45Å; F27-L31 HydrophobicContact CZ-CG 4.39Å; F27-L31 WeakPolarHBondContact O-CG 3.25Å; F27-L31 PolarHBondContact O-N 2.88Å; F27-L31 VanDerWaalsContact O-N 3.08Å; A28-L31 PolarHBondContact O-N 3.5Å; K29-L31 VanDerWaalsContact C-N 3.3Å; K29-L31 PolarHBondContact O-N 3.33Å; L31-E33 PolarHBondContact O-N 3.46Å; L31-T34 PolarHBondContact O-N 2.81Å; L31-T34 PolarHBondContact O-OG1 3.32Å; L31-C36 HydrophobicContact CB-CB 4.4Å; L31-C36 WeakPolarHBondContact O-CB 3.35Å; L31-C36 PolarHBondContact O-N 3.24Å
32	L	92.3	Very high	91.5	Very high	6 Å²	6	67.6 Å²	67.6	3%	0.031	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-40.1	176.9	-68	167.9	0	0	0	112.1	L16 A28 K29 T34 G35 P38 L63 L64 F67	L16-L32 HydrophobicContact CD1-CD1 4.46Å; L16-L32 HydrophobicContact CD1-CD2 4.14Å; L16-L32 HydrophobicContact CD1-CG 3.97Å; L16-L32 HydrophobicContact CD2-CD2 3.74Å; L16-L32 HydrophobicContact CD2-CG 4.47Å; A28-L32 WeakPolarHBondContact O-CG 3.23Å; A28-L32 PolarHBondContact O-N 3.49Å; K29-L32 PolarHBondContact O-N 2.85Å; L32-T34 PolarHBondContact O-N 3.37Å; L32-G35 PolarHBondContact O-N 3.36Å; L32-P38 HydrophobicContact CD2-CB 3.85Å; L32-L63 HydrophobicContact CD1-CD2 3.91Å; L32-L63 HydrophobicContact CD1-CG 3.76Å; L32-L64 HydrophobicContact CD1-CD2 4.16Å; L32-L64 HydrophobicContact CD2-CD2 4.36Å; L32-F67 HydrophobicContact CB-CB 4.37Å; L32-F67 HydrophobicContact CB-CD1 3.71Å; L32-F67 HydrophobicContact CB-CD2 3.9Å; L32-F67 HydrophobicContact CB-CE1 3.86Å; L32-F67 HydrophobicContact CB-CE2 4.06Å; L32-F67 HydrophobicContact CB-CG 3.73Å; L32-F67 HydrophobicContact CB-CZ 4.03Å; L32-F67 HydrophobicContact CD1-CB 4.21Å; L32-F67 HydrophobicContact CD1-CD2 3.78Å; L32-F67 HydrophobicContact CD1-CE2 4.37Å; L32-F67 HydrophobicContact CD1-CG 4.04Å; L32-F67 HydrophobicContact CD2-CB 4.12Å; L32-F67 HydrophobicContact CD2-CG 4.4Å; L32-F67 HydrophobicContact CG-CB 4.47Å; L32-F67 HydrophobicContact CG-CD2 4.4Å; L32-F67 HydrophobicContact CG-CG 4.28Å
33	E	92.9	Very high	91.4	Very high	119 Å²	119	68.7 Å²	68.7	56%	0.556	37%	0.367	S	S	*	.	H	α-helix	trans	-63.8	-27.3	174.6	-72.5	173.8	168.4	0	0	113	K29 R30 L31 G35 F67	K29-E33 WeakPolarHBondContact CE-OE1 3.45Å; K29-E33 HydrophobicContact CG-CG 4.42Å; K29-E33 IonicContact NZ-OE1 3.9Å; K29-E33 WeakPolarHBondContact O-CB 3.24Å; K29-E33 WeakPolarHBondContact O-CG 3.29Å; K29-E33 PolarHBondContact O-N 2.87Å; R30-E33 PolarHBondContact O-N 3.48Å; L31-E33 PolarHBondContact O-N 3.46Å; E33-G35 PolarHBondContact O-N 2.76Å; E33-F67 HydrophobicContact CG-CE1 4.27Å; E33-F67 HydrophobicContact CG-CZ 3.78Å
34	T	89.9	Confident	91.1	Very high	107 Å²	107	74.9 Å²	74.9	66%	0.656	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	0.6	172.7	59.6	0	0	0	0	114.1	R30 L31 L32	R30-T34 WeakPolarHBondContact O-CG2 3.33Å; R30-T34 PolarHBondContact O-N 3.35Å; R30-T34 VanDerWaalsContact O-N 3.08Å; L31-T34 PolarHBondContact O-N 2.81Å; L31-T34 PolarHBondContact O-OG1 3.32Å; L32-T34 PolarHBondContact O-N 3.37Å
35	G	84.9	Confident	91	Very high	67 Å²	67	71.5 Å²	71.5	69%	0.691	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	19.9	179.8	0	0	0	0	0	114.1	L32 E33	L32-G35 PolarHBondContact O-N 3.36Å; E33-G35 PolarHBondContact O-N 2.76Å
36	C	87.7	Confident	90.8	Very high	36 Å²	36	71.5 Å²	71.5	24%	0.243	36%	0.359	C	S	.	.			trans	-63.3	135.8	171.4	-169.7	0	0	0	0	110	L31 P38	L31-C36 HydrophobicContact CB-CB 4.4Å; L31-C36 WeakPolarHBondContact O-CB 3.35Å; L31-C36 PolarHBondContact O-N 3.24Å; C36-P38 WeakPolarHBondContact O-CD 3.44Å
37	D	89.1	Confident	90.8	Very high	88 Å²	88	67.1 Å²	67.1	47%	0.471	33%	0.331	S	S	.	.			trans	-65.3	117.5	177.8	179.1	8.4	0	0	0	110.6	N39 I40	D37-N39 PolarHBondContact O-N 3.23Å; D37-N39 WeakPolarHBondContact OD1-CB 3.22Å; D37-N39 PolarHBondContact OD1-N 3.46Å; D37-I40 WeakPolarHBondContact O-CG2 3.31Å; D37-I40 PolarHBondContact O-N 3.36Å
38	P	90.8	Very high	90.8	Very high	15 Å²	15	62.9 Å²	62.9	10%	0.097	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.4	177.8	30	-38.5	0	0	0	113.5	L32 C36 L64 F67 A69	L32-P38 HydrophobicContact CD2-CB 3.85Å; C36-P38 WeakPolarHBondContact O-CD 3.44Å; P38-L64 HydrophobicContact CB-CD2 4.37Å; P38-F67 WeakPolarHBondContact CG-O 3.29Å; P38-A69 HydrophobicContact CB-CB 4.11Å
39	N	92	Very high	90.8	Very high	48 Å²	48	63 Å²	63	26%	0.257	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	10.9	-177.1	-65.8	-54.1	0	0	0	113.6	D37 R41 G68 A69 D70	D37-N39 PolarHBondContact O-N 3.23Å; D37-N39 WeakPolarHBondContact OD1-CB 3.22Å; D37-N39 PolarHBondContact OD1-N 3.46Å; N39-R41 WeakPolarHBondContact O-CG 3.2Å; N39-G68 PolarHBondContact ND2-O 3.2Å; N39-A69 WeakPolarHBondContact OD1-CA 3.43Å; N39-D70 PolarHBondContact OD1-N 3.27Å
40	I	90.6	Very high	90.8	Very high	51 Å²	51	58.2 Å²	58.2	26%	0.262	29%	0.292	S	S	.	.			trans	-55.2	140.4	174.9	-165.8	151.9	0	0	0	111.3	V14 L16 L17 D37 T47	V14-I40 HydrophobicContact CB-CD1 4.28Å; V14-I40 HydrophobicContact CG1-CB 4.31Å; V14-I40 HydrophobicContact CG1-CD1 3.4Å; V14-I40 VanDerWaalsContact CG1-CD1 3.4Å; V14-I40 HydrophobicContact CG1-CG1 3.79Å; V14-I40 HydrophobicContact CG1-CG2 3.65Å; V14-I40 HydrophobicContact CG2-CD1 3.82Å; V14-I40 HydrophobicContact CG2-CG1 3.98Å; L16-I40 HydrophobicContact CD2-CG2 4.18Å; L17-I40 HydrophobicContact CD1-CG2 4.47Å; L17-I40 HydrophobicContact CD2-CG2 3.84Å; L17-I40 HydrophobicContact CG-CG2 4Å; D37-I40 WeakPolarHBondContact O-CG2 3.31Å; D37-I40 PolarHBondContact O-N 3.36Å; I40-T47 WeakPolarHBondContact O-CA 3.25Å
41	R	90.2	Very high	90.7	Very high	113 Å²	113	50.5 Å²	50.5	43%	0.426	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-115.5	143.9	-172.1	-66	-179.9	175.8	-127.7	1.6	111.6	N39 G45 R46 T47 T74	N39-R41 WeakPolarHBondContact O-CG 3.2Å; R41-G45 PolarHBondContact NH1-O 3.39Å; R41-R46 CarbonylContact C-O 3.51Å; R41-R46 WeakPolarHBondContact CA-O 3.34Å; R41-T47 HydrophobicContact CG-CG2 3.99Å; R41-T74 PolarHBondContact NH1-O 3.08Å
42	D	87.8	Confident	90.8	Very high	18 Å²	18	49.1 Å²	49.1	10%	0.096	26%	0.256	C	S	.	.			trans	-81.7	-176.9	168.2	74.8	1.3	0	0	0	112.6	L17 R44 G45 R46	L17-D42 HydrophobicContact CD1-CB 3.83Å; D42-R44 PolarHBondContact O-N 3.03Å; D42-R44 WeakPolarHBondContact OD1-CA 3.24Å; D42-R44 WeakPolarHBondContact OD1-CB 3.48Å; D42-R44 PolarHBondContact OD1-N 3.36Å; D42-G45 PolarHBondContact O-N 3.41Å; D42-G45 PolarHBondContact OD1-N 2.93Å; D42-G45 VanDerWaalsContact OD1-N 3.14Å; D42-R46 PolarHBondContact N-O 3.21Å; D42-R46 WeakPolarHBondContact OD1-CB 3.45Å; D42-R46 PolarHBondContact OD1-N 3.46Å; D42-R46 IonicContact OD1-NE 3.71Å; D42-R46 IonicContact OD2-CZ 3.11Å; D42-R46 IonicContact OD2-NE 2.76Å; D42-R46 PolarHBondContact OD2-NE 3.11Å; D42-R46 IonicContact OD2-NH2 2.67Å; D42-R46 PolarHBondContact OD2-NH2 3.45Å
43	N	87.5	Confident	90.8	Very high	128 Å²	128	48.8 Å²	48.8	68%	0.684	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-6.6	177.7	64.9	-2.1	0	0	0	115.2	Y76	N43-Y76 VanDerWaalsContact O-CE2 3.28Å; N43-Y76 WeakPolarHBondContact O-CE2 3.26Å
44	R	86.5	Confident	90.8	Very high	160 Å²	160	45.5 Å²	45.5	60%	0.604	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.8	6.9	173.1	-63.2	-177.2	-178	-160.5	-0.1	112	D42 R46 Y76	D42-R44 PolarHBondContact O-N 3.03Å; D42-R44 WeakPolarHBondContact OD1-CA 3.24Å; D42-R44 WeakPolarHBondContact OD1-CB 3.48Å; D42-R44 PolarHBondContact OD1-N 3.36Å; R44-R46 HydrophobicContact CB-CG 4.1Å; R44-R46 PolarHBondContact O-N 3.38Å; R44-Y76 VanDerWaalsContact C-CE2 3.44Å; R44-Y76 WeakPolarHBondContact O-CD2 3.33Å; R44-Y76 PolarHBondContact O-N 3.27Å; R44-Y76 VanDerWaalsContact O-N 3.14Å
45	G	89.7	Confident	90.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	76.6	9.8	-177.1	0	0	0	0	0	113.6	R41 D42 Y76	R41-G45 PolarHBondContact NH1-O 3.39Å; D42-G45 PolarHBondContact O-N 3.41Å; D42-G45 PolarHBondContact OD1-N 2.93Å; D42-G45 VanDerWaalsContact OD1-N 3.14Å; G45-Y76 VanDerWaalsContact CA-CE1 3.49Å
46	R	91.8	Very high	91	Very high	63 Å²	63	45.2 Å²	45.2	24%	0.238	22%	0.219	C	C	.	.			trans	-81.6	132.4	-177.7	-59.2	178.8	-62.5	172.8	3.4	110	R41 D42 R44 H50 L51 D75	R41-R46 CarbonylContact C-O 3.51Å; R41-R46 WeakPolarHBondContact CA-O 3.34Å; D42-R46 PolarHBondContact N-O 3.21Å; D42-R46 WeakPolarHBondContact OD1-CB 3.45Å; D42-R46 PolarHBondContact OD1-N 3.46Å; D42-R46 IonicContact OD1-NE 3.71Å; D42-R46 IonicContact OD2-CZ 3.11Å; D42-R46 IonicContact OD2-NE 2.76Å; D42-R46 PolarHBondContact OD2-NE 3.11Å; D42-R46 IonicContact OD2-NH2 2.67Å; D42-R46 PolarHBondContact OD2-NH2 3.45Å; R44-R46 HydrophobicContact CB-CG 4.1Å; R44-R46 PolarHBondContact O-N 3.38Å; R46-H50 HydrophobicContact CB-CB 3.93Å; R46-H50 HydrophobicContact CG-CB 4.43Å; R46-L51 HydrophobicContact CB-CD2 4.38Å; R46-D75 HydrophobicContact CG-CB 3.86Å
47	T	94.3	Very high	91.2	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-84.7	171	172.3	66.8	0	0	0	0	112	I40 R41 L49 H50 L51 A73	I40-T47 WeakPolarHBondContact O-CA 3.25Å; R41-T47 HydrophobicContact CG-CG2 3.99Å; T47-L49 PolarHBondContact O-N 3.07Å; T47-L49 VanDerWaalsContact O-N 3.17Å; T47-L49 PolarHBondContact OG1-N 3.41Å; T47-H50 PolarHBondContact N-ND1 3.31Å; T47-H50 VanDerWaalsContact N-ND1 3.14Å; T47-H50 WeakPolarHBondContact O-CB 3.24Å; T47-H50 PolarHBondContact O-N 2.88Å; T47-H50 VanDerWaalsContact O-N 3.1Å; T47-H50 PolarHBondContact OG1-ND1 2.88Å; T47-L51 PolarHBondContact O-N 2.9Å; T47-A73 HydrophobicContact CG2-CB 4.03Å
48	G	93.2	Very high	91.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-53.7	-35.1	172.8	0	0	0	0	0	112.6	H50 L51 A52	G48-H50 PolarHBondContact O-N 2.95Å; G48-L51 PolarHBondContact O-N 2.99Å; G48-A52 WeakPolarHBondContact O-CB 3.37Å; G48-A52 PolarHBondContact O-N 3.26Å
49	L	95.1	Very high	91.7	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-65.3	-40.7	179.6	-171.7	72.5	0	0	0	112	T47 L51 A53 C61 L64 L71 A81 L94	T47-L49 PolarHBondContact O-N 3.07Å; T47-L49 VanDerWaalsContact O-N 3.17Å; T47-L49 PolarHBondContact OG1-N 3.41Å; L49-L51 VanDerWaalsContact C-N 3.32Å; L49-L51 PolarHBondContact O-N 3.4Å; L49-A53 WeakPolarHBondContact O-CB 3.36Å; L49-A53 PolarHBondContact O-N 3.37Å; L49-C61 HydrophobicContact CD1-CB 3.83Å; L49-L64 HydrophobicContact CB-CD1 4.27Å; L49-L71 HydrophobicContact CD1-CD2 4.19Å; L49-L71 HydrophobicContact CD2-CB 4.34Å; L49-L71 HydrophobicContact CD2-CD2 3.53Å; L49-L71 HydrophobicContact CD2-CG 4.48Å; L49-A81 HydrophobicContact CD2-CB 3.86Å; L49-A81 HydrophobicContact CG-CB 3.82Å; L49-L94 HydrophobicContact CD2-CD2 4.41Å
50	H	94.1	Very high	91.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-44.5	175.2	-70	90.5	0	0	0	111.5	R46 T47 G48 A54 A73 N79 L84	R46-H50 HydrophobicContact CB-CB 3.93Å; R46-H50 HydrophobicContact CG-CB 4.43Å; T47-H50 PolarHBondContact N-ND1 3.31Å; T47-H50 VanDerWaalsContact N-ND1 3.14Å; T47-H50 WeakPolarHBondContact O-CB 3.24Å; T47-H50 PolarHBondContact O-N 2.88Å; T47-H50 VanDerWaalsContact O-N 3.1Å; T47-H50 PolarHBondContact OG1-ND1 2.88Å; G48-H50 PolarHBondContact O-N 2.95Å; H50-A54 VanDerWaalsContact O-CB 3.29Å; H50-A54 WeakPolarHBondContact O-CB 3.24Å; H50-A54 PolarHBondContact O-N 3.1Å; H50-A73 PolarHBondContact CE1-O 3.39Å; H50-A73 PolarHBondContact NE2-O 3.03Å; H50-A73 VanDerWaalsContact NE2-O 3.12Å; H50-N79 PolarHBondContact NE2-O 3.47Å; H50-L84 HydrophobicContact CB-CD1 3.91Å
51	L	93.1	Very high	92.1	Very high	9 Å²	9	42.2 Å²	42.2	5%	0.047	20%	0.197	C	C	.	.	H	α-helix	trans	-69.5	-46.6	-177.5	-59.1	173.8	0	0	0	111.2	L17 C20 I21 R46 T47 G48 L49 A54 R55	L17-L51 HydrophobicContact CB-CD1 3.8Å; L17-L51 HydrophobicContact CD2-CD1 3.99Å; L17-L51 HydrophobicContact CG-CD1 4.33Å; C20-L51 HydrophobicContact CB-CB 4.25Å; I21-L51 HydrophobicContact CD1-CD1 4.08Å; I21-L51 HydrophobicContact CG1-CB 4.11Å; I21-L51 HydrophobicContact CG1-CD1 3.9Å; I21-L51 HydrophobicContact CG1-CD2 4.35Å; I21-L51 HydrophobicContact CG1-CG 4.34Å; R46-L51 HydrophobicContact CB-CD2 4.38Å; T47-L51 PolarHBondContact O-N 2.9Å; G48-L51 PolarHBondContact O-N 2.99Å; L49-L51 VanDerWaalsContact C-N 3.32Å; L49-L51 PolarHBondContact O-N 3.4Å; L51-A54 PolarHBondContact O-N 3.34Å; L51-R55 WeakPolarHBondContact O-CG 3.31Å; L51-R55 PolarHBondContact O-N 2.99Å; L51-R55 VanDerWaalsContact O-N 3.15Å
52	A	93.6	Very high	92.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63	-42.7	177.2	0	0	0	0	0	111.8	C20 G48 R55 G56 N57 I60 L64	C20-A52 HydrophobicContact CB-CB 4.36Å; G48-A52 WeakPolarHBondContact O-CB 3.37Å; G48-A52 PolarHBondContact O-N 3.26Å; A52-R55 PolarHBondContact O-N 3.45Å; A52-G56 PolarHBondContact O-N 3.03Å; A52-N57 HydrophobicContact CB-CB 4.42Å; A52-N57 PolarHBondContact O-N 2.96Å; A52-I60 HydrophobicContact CB-CB 4.05Å; A52-I60 HydrophobicContact CB-CG2 3.72Å; A52-L64 HydrophobicContact CB-CD1 4.42Å
53	A	92.8	Very high	92.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-40.3	178.7	0	0	0	0	0	112.4	L49 R55 G56 A81 C85 L94	L49-A53 WeakPolarHBondContact O-CB 3.36Å; L49-A53 PolarHBondContact O-N 3.37Å; A53-R55 PolarHBondContact O-N 2.96Å; A53-G56 PolarHBondContact O-N 2.94Å; A53-A81 HydrophobicContact CB-CB 3.99Å; A53-C85 HydrophobicContact CB-CB 4.05Å; A53-C85 WeakPolarHBondContact O-CA 3.22Å; A53-C85 WeakPolarHBondContact O-CB 3.34Å; A53-L94 HydrophobicContact CB-CD1 4.47Å
54	A	91.2	Very high	93.1	Very high	49 Å²	49	36.3 Å²	36.3	41%	0.405	17%	0.165	S	C	.	.	H	α-helix	trans	-65.1	-27.5	175	0	0	0	0	0	113.2	H50 L51 L84	H50-A54 VanDerWaalsContact O-CB 3.29Å; H50-A54 WeakPolarHBondContact O-CB 3.24Å; H50-A54 PolarHBondContact O-N 3.1Å; L51-A54 PolarHBondContact O-N 3.34Å; A54-L84 HydrophobicContact CB-CB 4.27Å
55	R	89.9	Confident	93.5	Very high	151 Å²	151	32 Å²	32	57%	0.57	15%	0.152	S	C	*	.	H	α-helix	trans	-88.9	-11.6	176	-69.2	-68.7	-168.5	-178.2	2.2	114.2	L51 A52 A53	L51-R55 WeakPolarHBondContact O-CG 3.31Å; L51-R55 PolarHBondContact O-N 2.99Å; L51-R55 VanDerWaalsContact O-N 3.15Å; A52-R55 PolarHBondContact O-N 3.45Å; A53-R55 PolarHBondContact O-N 2.96Å
56	G	89.6	Confident	93.7	Very high	18 Å²	18	40.3 Å²	40.3	19%	0.186	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	12.1	-176.2	0	0	0	0	0	114.9	A52 A53 V58 H87	A52-G56 PolarHBondContact O-N 3.03Å; A53-G56 PolarHBondContact O-N 2.94Å; G56-V58 VanDerWaalsContact C-N 3.33Å; G56-V58 PolarHBondContact O-N 3.47Å; G56-H87 WeakPolarHBondContact CA-CD2 3.5Å; G56-H87 VanDerWaalsContact CA-CG 3.47Å; G56-H87 PolarHBondContact N-CD2 3.41Å; G56-H87 VanDerWaalsContact N-CD2 3.34Å
57	N	92.9	Very high	93.8	Very high	47 Å²	47	40.9 Å²	40.9	25%	0.251	19%	0.192	S	C	.	.			trans	-82.1	74.4	-175.7	-67	-28.3	0	0	0	111.3	G23 A52 E59 I60 C61	G23-N57 VanDerWaalsContact CA-ND2 3.28Å; G23-N57 WeakPolarHBondContact CA-ND2 3.37Å; A52-N57 HydrophobicContact CB-CB 4.42Å; A52-N57 PolarHBondContact O-N 2.96Å; N57-E59 VanDerWaalsContact C-N 3.27Å; N57-E59 PolarHBondContact O-N 3.15Å; N57-I60 HydrophobicContact CB-CB 4.19Å; N57-I60 HydrophobicContact CB-CD1 4.2Å; N57-I60 HydrophobicContact CB-CG1 4.28Å; N57-I60 PolarHBondContact O-N 2.93Å; N57-I60 VanDerWaalsContact O-N 3.11Å; N57-C61 PolarHBondContact O-N 3.12Å; N57-C61 VanDerWaalsContact O-N 3.08Å; N57-C61 PolarHBondContact O-SG 3.17Å
58	V	94.3	Very high	93.7	Very high	15 Å²	15	43.1 Å²	43.1	9%	0.091	22%	0.216	C	C	.	.	H	α-helix	trans	-54.7	-41.6	-177.6	-177.3	0	0	0	0	112.5	G56 I60 C61 R62 D89 T90 F93	G56-V58 VanDerWaalsContact C-N 3.33Å; G56-V58 PolarHBondContact O-N 3.47Å; V58-I60 VanDerWaalsContact C-N 3.26Å; V58-I60 PolarHBondContact O-N 2.89Å; V58-C61 CarbonylContact O-C 3.57Å; V58-C61 WeakPolarHBondContact O-CA 3.3Å; V58-C61 WeakPolarHBondContact O-CB 3.25Å; V58-C61 PolarHBondContact O-N 3.45Å; V58-R62 HydrophobicContact CG1-CG 4.26Å; V58-R62 WeakPolarHBondContact O-CG 3.24Å; V58-R62 PolarHBondContact O-N 2.83Å; V58-D89 HydrophobicContact CG2-CB 3.47Å; V58-D89 VanDerWaalsContact CG2-CB 3.47Å; V58-T90 HydrophobicContact CB-CG2 4.26Å; V58-T90 HydrophobicContact CG2-CG2 3.37Å; V58-F93 HydrophobicContact CG1-CB 4.12Å; V58-F93 HydrophobicContact CG1-CG 4.43Å
59	E	95.9	Very high	93.7	Very high	110 Å²	110	43.4 Å²	43.4	51%	0.514	22%	0.218	S	C	.	.	H	α-helix	trans	-63.4	-35.4	-178.1	-62.1	-50.1	119.8	0	0	112	L25 N57 R62 L63	L25-E59 HydrophobicContact CD1-CB 4.17Å; L25-E59 HydrophobicContact CD2-CB 4.17Å; N57-E59 VanDerWaalsContact C-N 3.27Å; N57-E59 PolarHBondContact O-N 3.15Å; E59-R62 PolarHBondContact O-N 3.18Å; E59-R62 IonicContact OE1-NE 3.64Å; E59-L63 WeakPolarHBondContact O-CB 3.33Å; E59-L63 PolarHBondContact O-N 2.93Å
60	I	95.2	Very high	93.5	Very high	3 Å²	3	47 Å²	47	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-71.1	-39.4	172.8	-63.6	-176.2	0	0	0	110.4	C20 G23 L25 A52 N57 V58 R62 L63 L64	C20-I60 HydrophobicContact CB-CG2 4.32Å; G23-I60 VanDerWaalsContact C-CD1 3.5Å; G23-I60 VanDerWaalsContact CA-CD1 3.48Å; L25-I60 HydrophobicContact CB-CG1 4.27Å; L25-I60 HydrophobicContact CD1-CG1 3.93Å; A52-I60 HydrophobicContact CB-CB 4.05Å; A52-I60 HydrophobicContact CB-CG2 3.72Å; N57-I60 HydrophobicContact CB-CB 4.19Å; N57-I60 HydrophobicContact CB-CD1 4.2Å; N57-I60 HydrophobicContact CB-CG1 4.28Å; N57-I60 PolarHBondContact O-N 2.93Å; N57-I60 VanDerWaalsContact O-N 3.11Å; V58-I60 VanDerWaalsContact C-N 3.26Å; V58-I60 PolarHBondContact O-N 2.89Å; I60-R62 VanDerWaalsContact C-N 3.33Å; I60-R62 PolarHBondContact O-N 3.28Å; I60-L63 PolarHBondContact O-N 3.33Å; I60-L64 HydrophobicContact CG2-CD1 3.91Å; I60-L64 HydrophobicContact CG2-CG 4.17Å; I60-L64 WeakPolarHBondContact O-CB 3.44Å; I60-L64 VanDerWaalsContact O-CG 3.29Å; I60-L64 WeakPolarHBondContact O-CG 3.5Å; I60-L64 PolarHBondContact O-N 3Å
61	C	95.2	Very high	93.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-43.9	173.6	-62.4	0	0	0	0	111.9	L49 N57 V58 L64 H65 F93	L49-C61 HydrophobicContact CD1-CB 3.83Å; N57-C61 PolarHBondContact O-N 3.12Å; N57-C61 VanDerWaalsContact O-N 3.08Å; N57-C61 PolarHBondContact O-SG 3.17Å; V58-C61 CarbonylContact O-C 3.57Å; V58-C61 WeakPolarHBondContact O-CA 3.3Å; V58-C61 WeakPolarHBondContact O-CB 3.25Å; V58-C61 PolarHBondContact O-N 3.45Å; C61-L64 PolarHBondContact O-N 2.72Å; C61-H65 WeakPolarHBondContact O-CB 3.4Å; C61-H65 PolarHBondContact O-N 2.7Å; C61-F93 HydrophobicContact CB-CD1 3.85Å; C61-F93 HydrophobicContact CB-CE1 3.72Å
62	R	95.8	Very high	93.2	Very high	115 Å²	115	52 Å²	52	43%	0.434	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-45.2	175.3	-71.3	-179.4	-170	-70.8	-4.7	111.5	V58 E59 I60 H65 K66 F93	V58-R62 HydrophobicContact CG1-CG 4.26Å; V58-R62 WeakPolarHBondContact O-CG 3.24Å; V58-R62 PolarHBondContact O-N 2.83Å; E59-R62 PolarHBondContact O-N 3.18Å; E59-R62 IonicContact OE1-NE 3.64Å; I60-R62 VanDerWaalsContact C-N 3.33Å; I60-R62 PolarHBondContact O-N 3.28Å; R62-H65 PolarHBondContact O-N 3.25Å; R62-K66 WeakPolarHBondContact O-CB 3.5Å; R62-K66 PolarHBondContact O-N 3.17Å; R62-F93 HydrophobicContact CB-CE2 4.3Å; R62-F93 HydrophobicContact CB-CZ 4.45Å; R62-F93 HydrophobicContact CG-CD2 3.74Å; R62-F93 HydrophobicContact CG-CE2 3.53Å; R62-F93 HydrophobicContact CG-CG 4.4Å; R62-F93 HydrophobicContact CG-CZ 4.05Å
63	L	95.9	Very high	93.1	Very high	20 Å²	20	52.3 Å²	52.3	11%	0.105	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-51.9	178	-180	70.9	0	0	0	111.1	L25 A28 K29 L32 E59 I60 H65 K66 F67	L25-L63 HydrophobicContact CD1-CB 4.09Å; L25-L63 HydrophobicContact CD1-CD2 3.73Å; L25-L63 HydrophobicContact CD1-CG 4.47Å; A28-L63 HydrophobicContact CB-CD2 4.09Å; K29-L63 HydrophobicContact CB-CD1 4.2Å; K29-L63 HydrophobicContact CB-CD2 3.79Å; K29-L63 HydrophobicContact CG-CD1 4.15Å; L32-L63 HydrophobicContact CD1-CD2 3.91Å; L32-L63 HydrophobicContact CD1-CG 3.76Å; E59-L63 WeakPolarHBondContact O-CB 3.33Å; E59-L63 PolarHBondContact O-N 2.93Å; I60-L63 PolarHBondContact O-N 3.33Å; L63-H65 VanDerWaalsContact C-N 3.31Å; L63-H65 PolarHBondContact O-N 3.16Å; L63-K66 WeakPolarHBondContact O-CB 3.04Å; L63-K66 PolarHBondContact O-N 2.78Å; L63-K66 VanDerWaalsContact O-N 3.15Å; L63-F67 HydrophobicContact CD1-CD2 3.96Å; L63-F67 HydrophobicContact CD1-CE2 3.65Å; L63-F67 HydrophobicContact CG-CD2 4.34Å; L63-F67 HydrophobicContact CG-CE2 4.44Å; L63-F67 WeakPolarHBondContact O-CD2 3.45Å; L63-F67 PolarHBondContact O-N 3.27Å; L63-F67 VanDerWaalsContact O-N 3.13Å
64	L	94.8	Very high	93.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-56	-46.9	177.7	-75.7	171.2	0	0	0	111.5	L16 L32 P38 L49 A52 I60 C61 K66 F67 G68 A69	L16-L64 HydrophobicContact CD2-CD2 4.49Å; L32-L64 HydrophobicContact CD1-CD2 4.16Å; L32-L64 HydrophobicContact CD2-CD2 4.36Å; P38-L64 HydrophobicContact CB-CD2 4.37Å; L49-L64 HydrophobicContact CB-CD1 4.27Å; A52-L64 HydrophobicContact CB-CD1 4.42Å; I60-L64 HydrophobicContact CG2-CD1 3.91Å; I60-L64 HydrophobicContact CG2-CG 4.17Å; I60-L64 WeakPolarHBondContact O-CB 3.44Å; I60-L64 VanDerWaalsContact O-CG 3.29Å; I60-L64 WeakPolarHBondContact O-CG 3.5Å; I60-L64 PolarHBondContact O-N 3Å; C61-L64 PolarHBondContact O-N 2.72Å; L64-K66 VanDerWaalsContact C-N 3.34Å; L64-K66 PolarHBondContact O-N 2.8Å; L64-F67 CarbonylContact O-C 3.59Å; L64-F67 PolarHBondContact O-N 3.37Å; L64-F67 VanDerWaalsContact O-N 3.13Å; L64-G68 PolarHBondContact O-N 3.42Å; L64-A69 VanDerWaalsContact C-CB 3.43Å; L64-A69 HydrophobicContact CB-CB 3.79Å; L64-A69 WeakPolarHBondContact O-CB 3.44Å; L64-A69 PolarHBondContact O-N 2.88Å
65	H	94.8	Very high	93.1	Very high	69 Å²	69	53.1 Å²	53.1	32%	0.319	27%	0.266	S	S	.	.	H	α-helix	trans	-60.8	-42.5	177.5	-177.2	52.7	0	0	0	112.2	C61 R62 L63 F67 G68 L71 F93 N97	C61-H65 WeakPolarHBondContact O-CB 3.4Å; C61-H65 PolarHBondContact O-N 2.7Å; R62-H65 PolarHBondContact O-N 3.25Å; L63-H65 VanDerWaalsContact C-N 3.31Å; L63-H65 PolarHBondContact O-N 3.16Å; H65-F67 PolarHBondContact O-N 3.2Å; H65-G68 PolarHBondContact O-N 3.04Å; H65-L71 HydrophobicContact CB-CD2 4.2Å; H65-F93 HydrophobicContact CB-CE1 4.48Å; H65-F93 HydrophobicContact CB-CZ 3.84Å; H65-N97 PolarHBondContact NE2-OD1 3.18Å
66	K	95.3	Very high	93.2	Very high	174 Å²	174	53.1 Å²	53.1	76%	0.757	27%	0.267	S	S	*	.	H	α-helix	trans	-58.4	-33.2	175.8	-177.3	180	179.6	-179.9	0	112.8	R62 L63 L64 G68	R62-K66 WeakPolarHBondContact O-CB 3.5Å; R62-K66 PolarHBondContact O-N 3.17Å; L63-K66 WeakPolarHBondContact O-CB 3.04Å; L63-K66 PolarHBondContact O-N 2.78Å; L63-K66 VanDerWaalsContact O-N 3.15Å; L64-K66 VanDerWaalsContact C-N 3.34Å; L64-K66 PolarHBondContact O-N 2.8Å; K66-G68 VanDerWaalsContact C-N 3.3Å
67	F	93.4	Very high	93.3	Very high	75 Å²	75	57.7 Å²	57.7	33%	0.329	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	7	177.2	-80.8	-91	0	0	0	113.7	L32 E33 P38 L63 L64 H65	L32-F67 HydrophobicContact CB-CB 4.37Å; L32-F67 HydrophobicContact CB-CD1 3.71Å; L32-F67 HydrophobicContact CB-CD2 3.9Å; L32-F67 HydrophobicContact CB-CE1 3.86Å; L32-F67 HydrophobicContact CB-CE2 4.06Å; L32-F67 HydrophobicContact CB-CG 3.73Å; L32-F67 HydrophobicContact CB-CZ 4.03Å; L32-F67 HydrophobicContact CD1-CB 4.21Å; L32-F67 HydrophobicContact CD1-CD2 3.78Å; L32-F67 HydrophobicContact CD1-CE2 4.37Å; L32-F67 HydrophobicContact CD1-CG 4.04Å; L32-F67 HydrophobicContact CD2-CB 4.12Å; L32-F67 HydrophobicContact CD2-CG 4.4Å; L32-F67 HydrophobicContact CG-CB 4.47Å; L32-F67 HydrophobicContact CG-CD2 4.4Å; L32-F67 HydrophobicContact CG-CG 4.28Å; E33-F67 HydrophobicContact CG-CE1 4.27Å; E33-F67 HydrophobicContact CG-CZ 3.78Å; P38-F67 WeakPolarHBondContact CG-O 3.29Å; L63-F67 HydrophobicContact CD1-CD2 3.96Å; L63-F67 HydrophobicContact CD1-CE2 3.65Å; L63-F67 HydrophobicContact CG-CD2 4.34Å; L63-F67 HydrophobicContact CG-CE2 4.44Å; L63-F67 WeakPolarHBondContact O-CD2 3.45Å; L63-F67 PolarHBondContact O-N 3.27Å; L63-F67 VanDerWaalsContact O-N 3.13Å; L64-F67 CarbonylContact O-C 3.59Å; L64-F67 PolarHBondContact O-N 3.37Å; L64-F67 VanDerWaalsContact O-N 3.13Å; H65-F67 PolarHBondContact O-N 3.2Å
68	G	91.8	Very high	93.1	Very high	49 Å²	49	55.7 Å²	55.7	51%	0.505	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	23.9	175.6	0	0	0	0	0	114.5	N39 L64 H65 K66 D70	N39-G68 PolarHBondContact ND2-O 3.2Å; L64-G68 PolarHBondContact O-N 3.42Å; H65-G68 PolarHBondContact O-N 3.04Å; K66-G68 VanDerWaalsContact C-N 3.3Å; G68-D70 PolarHBondContact O-N 3.49Å
69	A	93.1	Very high	93	Very high	6 Å²	6	55 Å²	55	5%	0.05	27%	0.27	C	S	.	.			trans	-60.9	131.3	168.4	0	0	0	0	0	110.7	P38 N39 L64 L71	P38-A69 HydrophobicContact CB-CB 4.11Å; N39-A69 WeakPolarHBondContact OD1-CA 3.43Å; L64-A69 VanDerWaalsContact C-CB 3.43Å; L64-A69 HydrophobicContact CB-CB 3.79Å; L64-A69 WeakPolarHBondContact O-CB 3.44Å; L64-A69 PolarHBondContact O-N 2.88Å; A69-L71 PolarHBondContact O-N 2.91Å
70	D	91.4	Very high	92.9	Very high	75 Å²	75	50 Å²	50	40%	0.401	25%	0.246	S	C	.	.			trans	-72.8	114.6	174.4	178.4	13	0	0	0	109.6	N39 G68 L72 A73	N39-D70 PolarHBondContact OD1-N 3.27Å; G68-D70 PolarHBondContact O-N 3.49Å; D70-L72 VanDerWaalsContact C-N 3.29Å; D70-L72 WeakPolarHBondContact OD1-CB 3.46Å; D70-L72 PolarHBondContact OD1-N 3.28Å; D70-A73 HydrophobicContact CB-CB 4.12Å; D70-A73 WeakPolarHBondContact O-CB 3.29Å; D70-A73 PolarHBondContact O-N 3.41Å; D70-A73 PolarHBondContact OD1-N 2.72Å; D70-A73 PolarHBondContact OD2-N 3.13Å
71	L	90.3	Very high	92.8	Very high	14 Å²	14	49.9 Å²	49.9	7%	0.073	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-24.6	178.5	-57.7	175.7	0	0	0	112.3	L49 H65 A69 A73 L94 N97 L99	L49-L71 HydrophobicContact CD1-CD2 4.19Å; L49-L71 HydrophobicContact CD2-CB 4.34Å; L49-L71 HydrophobicContact CD2-CD2 3.53Å; L49-L71 HydrophobicContact CD2-CG 4.48Å; H65-L71 HydrophobicContact CB-CD2 4.2Å; A69-L71 PolarHBondContact O-N 2.91Å; L71-A73 VanDerWaalsContact C-N 3.33Å; L71-L94 HydrophobicContact CD2-CD2 4.18Å; L71-N97 HydrophobicContact CD1-CB 3.45Å; L71-N97 VanDerWaalsContact CD1-CB 3.45Å; L71-L99 HydrophobicContact CB-CD1 3.35Å; L71-L99 HydrophobicContact CB-CD2 4.45Å; L71-L99 HydrophobicContact CB-CG 4.49Å; L71-L99 HydrophobicContact CD1-CD1 3.95Å; L71-L99 HydrophobicContact CG-CD1 4.28Å
72	L	90.1	Very high	92.7	Very high	103 Å²	103	50 Å²	50	54%	0.539	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-1.8	179.7	-61.5	179.5	0	0	0	112.7	D70 T74 L99	D70-L72 VanDerWaalsContact C-N 3.29Å; D70-L72 WeakPolarHBondContact OD1-CB 3.46Å; D70-L72 PolarHBondContact OD1-N 3.28Å; L72-T74 PolarHBondContact O-N 3.3Å; L72-L99 HydrophobicContact CD2-CD1 4.02Å; L72-L99 HydrophobicContact CD2-CG 4.16Å
73	A	90.8	Very high	92.4	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.041	23%	0.226	C	C	.	.			trans	-53.9	136.3	175.8	0	0	0	0	0	110.4	T47 H50 D70 L71	T47-A73 HydrophobicContact CG2-CB 4.03Å; H50-A73 PolarHBondContact CE1-O 3.39Å; H50-A73 PolarHBondContact NE2-O 3.03Å; H50-A73 VanDerWaalsContact NE2-O 3.12Å; D70-A73 HydrophobicContact CB-CB 4.12Å; D70-A73 WeakPolarHBondContact O-CB 3.29Å; D70-A73 PolarHBondContact O-N 3.41Å; D70-A73 PolarHBondContact OD1-N 2.72Å; D70-A73 PolarHBondContact OD2-N 3.13Å; L71-A73 VanDerWaalsContact C-N 3.33Å
74	T	93.6	Very high	92	Very high	54 Å²	54	44.6 Å²	44.6	33%	0.331	23%	0.226	S	C	.	.			trans	-113.6	145.4	177.5	52.9	0	0	0	0	111.8	R41 L72 N79 T80	R41-T74 PolarHBondContact NH1-O 3.08Å; L72-T74 PolarHBondContact O-N 3.3Å; T74-N79 CarbonylContact C-O 3.58Å; T74-N79 VanDerWaalsContact CA-O 3.29Å; T74-N79 WeakPolarHBondContact CA-O 3.4Å; T74-T80 HydrophobicContact CG2-CG2 3.83Å
75	D	91.3	Very high	91.6	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.064	23%	0.228	C	C	.	.			trans	-74.5	179.7	166.7	77.3	5.2	0	0	0	111.9	R46 Q77 G78 N79	R46-D75 HydrophobicContact CG-CB 3.86Å; D75-Q77 PolarHBondContact O-N 3.49Å; D75-Q77 VanDerWaalsContact O-N 3.08Å; D75-Q77 WeakPolarHBondContact OD1-CA 3.34Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.28Å; D75-Q77 PolarHBondContact OD1-N 3.31Å; D75-G78 PolarHBondContact O-N 3.12Å; D75-G78 PolarHBondContact OD1-N 2.96Å; D75-N79 PolarHBondContact N-O 3.36Å; D75-N79 WeakPolarHBondContact OD1-CB 3.23Å; D75-N79 PolarHBondContact OD1-N 3.21Å; D75-N79 PolarHBondContact OD1-ND2 3.16Å; D75-N79 WeakPolarHBondContact OD2-CB 3.49Å; D75-N79 PolarHBondContact OD2-ND2 3.15Å
76	Y	92.4	Very high	91	Very high	152 Å²	152	41.9 Å²	41.9	60%	0.596	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-12.8	-179.1	-62.3	-25.7	0	0	0	114.8	N43 R44 G45 H106	N43-Y76 VanDerWaalsContact O-CE2 3.28Å; N43-Y76 WeakPolarHBondContact O-CE2 3.26Å; R44-Y76 VanDerWaalsContact C-CE2 3.44Å; R44-Y76 WeakPolarHBondContact O-CD2 3.33Å; R44-Y76 PolarHBondContact O-N 3.27Å; R44-Y76 VanDerWaalsContact O-N 3.14Å; G45-Y76 VanDerWaalsContact CA-CE1 3.49Å; Y76-H106 PolarHBondContact O-CE1 2.93Å; Y76-H106 PolarHBondContact O-ND1 2.72Å
77	Q	90.1	Very high	90.7	Very high	113 Å²	113	36.9 Å²	36.9	53%	0.528	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	4	174.5	-62.8	-177.8	-26.4	0	0	112.2	D75 N79 H106	D75-Q77 PolarHBondContact O-N 3.49Å; D75-Q77 VanDerWaalsContact O-N 3.08Å; D75-Q77 WeakPolarHBondContact OD1-CA 3.34Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.28Å; D75-Q77 PolarHBondContact OD1-N 3.31Å; Q77-N79 VanDerWaalsContact C-N 3.25Å; Q77-N79 WeakPolarHBondContact CB-ND2 3.29Å; Q77-N79 PolarHBondContact O-N 3.36Å; Q77-N79 PolarHBondContact OE1-ND2 3Å; Q77-H106 VanDerWaalsContact C-ND1 3.25Å; Q77-H106 WeakPolarHBondContact O-CB 3.37Å; Q77-H106 VanDerWaalsContact O-CG 3.28Å; Q77-H106 PolarHBondContact O-N 3.35Å; Q77-H106 PolarHBondContact O-ND1 3.24Å
78	G	90.6	Very high	90.5	Very high	5 Å²	5	35.2 Å²	35.2	5%	0.052	19%	0.191	C	C	.	.	S	Bend	trans	76.6	12.1	-176.1	0	0	0	0	0	113	D75 N105 H106	D75-G78 PolarHBondContact O-N 3.12Å; D75-G78 PolarHBondContact OD1-N 2.96Å; G78-N105 WeakPolarHBondContact O-CA 3.48Å; G78-H106 PolarHBondContact N-CE1 3.42Å; G78-H106 PolarHBondContact N-ND1 2.9Å
79	N	91.6	Very high	90.5	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.011	19%	0.194	C	C	.	.			trans	-77.4	130.8	176.7	-56.9	-53.9	0	0	0	109.1	H50 T74 D75 Q77 H83 L84 N105	H50-N79 PolarHBondContact NE2-O 3.47Å; T74-N79 CarbonylContact C-O 3.58Å; T74-N79 VanDerWaalsContact CA-O 3.29Å; T74-N79 WeakPolarHBondContact CA-O 3.4Å; D75-N79 PolarHBondContact N-O 3.36Å; D75-N79 WeakPolarHBondContact OD1-CB 3.23Å; D75-N79 PolarHBondContact OD1-N 3.21Å; D75-N79 PolarHBondContact OD1-ND2 3.16Å; D75-N79 WeakPolarHBondContact OD2-CB 3.49Å; D75-N79 PolarHBondContact OD2-ND2 3.15Å; Q77-N79 VanDerWaalsContact C-N 3.25Å; Q77-N79 WeakPolarHBondContact CB-ND2 3.29Å; Q77-N79 PolarHBondContact O-N 3.36Å; Q77-N79 PolarHBondContact OE1-ND2 3Å; N79-H83 HydrophobicContact CB-CB 3.76Å; N79-L84 HydrophobicContact CB-CD2 4.03Å; N79-L84 HydrophobicContact CB-CG 4.21Å; N79-N105 WeakPolarHBondContact OD1-CB 3.22Å; N79-N105 PolarHBondContact OD1-ND2 3.06Å
80	T	94.2	Very high	90.4	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.018	19%	0.191	C	C	.	.			trans	-83.2	173.6	164.2	64.1	0	0	0	0	111	T74 L82 H83 I103	T74-T80 HydrophobicContact CG2-CG2 3.83Å; T80-L82 PolarHBondContact O-N 3.29Å; T80-H83 PolarHBondContact N-ND1 3.01Å; T80-H83 VanDerWaalsContact N-ND1 3.18Å; T80-H83 WeakPolarHBondContact O-CB 3.11Å; T80-H83 PolarHBondContact O-N 3.34Å; T80-H83 VanDerWaalsContact O-N 3.07Å; T80-H83 PolarHBondContact OG1-ND1 2.99Å; T80-I103 HydrophobicContact CG2-CD1 4.48Å; T80-I103 HydrophobicContact CG2-CG2 4.29Å
81	A	92.5	Very high	90.4	Very high	1 Å²	1	34 Å²	34	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-54.9	-34.3	173.3	0	0	0	0	0	113.1	L49 A53 H83 L84 C85 L94	L49-A81 HydrophobicContact CD2-CB 3.86Å; L49-A81 HydrophobicContact CG-CB 3.82Å; A53-A81 HydrophobicContact CB-CB 3.99Å; A81-H83 VanDerWaalsContact C-N 3.35Å; A81-H83 PolarHBondContact O-N 2.89Å; A81-L84 PolarHBondContact O-N 3.24Å; A81-C85 PolarHBondContact O-N 3.4Å; A81-C85 VanDerWaalsContact O-N 3.12Å; A81-L94 HydrophobicContact CB-CD1 4.03Å; A81-L94 HydrophobicContact CB-CD2 4.26Å
82	L	92.4	Very high	90.4	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-35	178.5	-171.5	63.6	0	0	0	112.3	T80 L84 C85 I91 L94 V95 L99 I101 P111 L128	T80-L82 PolarHBondContact O-N 3.29Å; L82-L84 PolarHBondContact O-N 3.15Å; L82-C85 PolarHBondContact O-SG 3.41Å; L82-I91 HydrophobicContact CD1-CB 4.42Å; L82-I91 HydrophobicContact CD1-CG1 4.2Å; L82-I91 HydrophobicContact CD1-CG2 4.12Å; L82-L94 HydrophobicContact CB-CD1 4.17Å; L82-L94 HydrophobicContact CD1-CB 4.27Å; L82-L94 HydrophobicContact CD1-CD1 4.17Å; L82-V95 HydrophobicContact CD1-CG2 4.37Å; L82-V95 HydrophobicContact CD2-CG2 4.48Å; L82-L99 HydrophobicContact CB-CD2 4.22Å; L82-I101 HydrophobicContact CD2-CG2 4.33Å; L82-P111 HydrophobicContact CB-CG 4.27Å; L82-P111 HydrophobicContact CD2-CB 4.37Å; L82-P111 HydrophobicContact CD2-CG 3.89Å; L82-P111 HydrophobicContact CG-CB 3.93Å; L82-P111 HydrophobicContact CG-CG 3.8Å; L82-L128 HydrophobicContact CD1-CD2 4.47Å
83	H	90.2	Very high	90.5	Very high	3 Å²	3	33.5 Å²	33.5	1%	0.014	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-25.2	175.5	-72.3	84.8	0	0	0	113.3	N79 T80 A81 I103 N105 S109 L114	N79-H83 HydrophobicContact CB-CB 3.76Å; T80-H83 PolarHBondContact N-ND1 3.01Å; T80-H83 VanDerWaalsContact N-ND1 3.18Å; T80-H83 WeakPolarHBondContact O-CB 3.11Å; T80-H83 PolarHBondContact O-N 3.34Å; T80-H83 VanDerWaalsContact O-N 3.07Å; T80-H83 PolarHBondContact OG1-ND1 2.99Å; A81-H83 VanDerWaalsContact C-N 3.35Å; A81-H83 PolarHBondContact O-N 2.89Å; H83-I103 PolarHBondContact CE1-O 3.37Å; H83-I103 VanDerWaalsContact CE1-O 3.28Å; H83-I103 PolarHBondContact NE2-O 3.19Å; H83-N105 PolarHBondContact NE2-N 3.47Å; H83-S109 PolarHBondContact CD2-O 2.86Å; H83-S109 PolarHBondContact NE2-O 2.94Å; H83-L114 HydrophobicContact CB-CD1 3.86Å
84	L	87.4	Confident	90.5	Very high	19 Å²	19	33.2 Å²	33.2	10%	0.099	17%	0.165	C	C	.	.	H	α-helix	trans	-99	-19.6	-174.6	-59	-174	0	0	0	113.7	H50 A54 N79 A81 L82 R118	H50-L84 HydrophobicContact CB-CD1 3.91Å; A54-L84 HydrophobicContact CB-CB 4.27Å; N79-L84 HydrophobicContact CB-CD2 4.03Å; N79-L84 HydrophobicContact CB-CG 4.21Å; A81-L84 PolarHBondContact O-N 3.24Å; L82-L84 PolarHBondContact O-N 3.15Å; L84-R118 PolarHBondContact O-NH1 3.47Å
85	C	85.9	Confident	90.2	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.041	16%	0.159	C	C	.	.			trans	-73.9	149.2	-177	73.7	0	0	0	0	112.8	A53 A81 L82 I91	A53-C85 HydrophobicContact CB-CB 4.05Å; A53-C85 WeakPolarHBondContact O-CA 3.22Å; A53-C85 WeakPolarHBondContact O-CB 3.34Å; A81-C85 PolarHBondContact O-N 3.4Å; A81-C85 VanDerWaalsContact O-N 3.12Å; L82-C85 PolarHBondContact O-SG 3.41Å; C85-I91 WeakPolarHBondContact SG-CG1 3.45Å
86	G	83.4	Confident	90.1	Very high	7 Å²	7	36.2 Å²	36.2	7%	0.072	19%	0.187	C	C	.	.			trans	-131.2	13.8	177.6	0	0	0	0	0	113.4	N121	G86-N121 PolarHBondContact O-ND2 3.45Å
87	H	87.8	Confident	89.8	Confident	68 Å²	68	32 Å²	32	32%	0.315	18%	0.175	S	C	.	.			trans	-122.5	137.8	-172.1	-58	-92.9	0	0	0	110.3	G56 D89 T90 I91	G56-H87 WeakPolarHBondContact CA-CD2 3.5Å; G56-H87 VanDerWaalsContact CA-CG 3.47Å; G56-H87 PolarHBondContact N-CD2 3.41Å; G56-H87 VanDerWaalsContact N-CD2 3.34Å; H87-D89 PolarHBondContact O-N 3.18Å; H87-T90 HydrophobicContact CB-CG2 4.5Å; H87-T90 PolarHBondContact O-N 2.91Å; H87-T90 PolarHBondContact O-OG1 3.3Å; H87-I91 WeakPolarHBondContact O-CD1 3.48Å; H87-I91 VanDerWaalsContact O-CG1 3.28Å; H87-I91 WeakPolarHBondContact O-CG1 3.49Å; H87-I91 PolarHBondContact O-N 3.33Å; H87-I91 VanDerWaalsContact O-N 3.11Å
88	V	89.9	Confident	89.3	Confident	41 Å²	41	29.5 Å²	29.5	25%	0.248	18%	0.179	C	C	.	.	H	α-helix	trans	-59.6	-47.2	-175.3	177.1	0	0	0	0	110.9	T90 I91 Q92 D123 A124 L127	V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 PolarHBondContact O-N 3.38Å; V88-I91 PolarHBondContact O-N 3.47Å; V88-Q92 WeakPolarHBondContact O-CG 3.49Å; V88-Q92 PolarHBondContact O-N 2.85Å; V88-D123 HydrophobicContact CG2-CB 3.68Å; V88-A124 HydrophobicContact CG2-CB 4.39Å; V88-L127 HydrophobicContact CG1-CD2 3.91Å
89	D	92.1	Very high	89	Confident	103 Å²	103	29.6 Å²	29.6	55%	0.551	18%	0.179	S	C	*	.	H	α-helix	trans	-67.1	-34.9	-175.3	-55	-35.8	0	0	0	112.4	V58 H87 F93	V58-D89 HydrophobicContact CG2-CB 3.47Å; V58-D89 VanDerWaalsContact CG2-CB 3.47Å; H87-D89 PolarHBondContact O-N 3.18Å; D89-F93 WeakPolarHBondContact O-CB 3.21Å; D89-F93 PolarHBondContact O-N 3.03Å
90	T	91.3	Very high	88.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-71.6	-39	175.8	52.7	0	0	0	0	111.1	V58 H87 V88 F93 L94	V58-T90 HydrophobicContact CB-CG2 4.26Å; V58-T90 HydrophobicContact CG2-CG2 3.37Å; H87-T90 HydrophobicContact CB-CG2 4.5Å; H87-T90 PolarHBondContact O-N 2.91Å; H87-T90 PolarHBondContact O-OG1 3.3Å; V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 PolarHBondContact O-N 3.38Å; T90-F93 PolarHBondContact O-N 2.93Å; T90-L94 WeakPolarHBondContact O-CB 3.25Å; T90-L94 VanDerWaalsContact O-CG 3.27Å; T90-L94 WeakPolarHBondContact O-CG 3.36Å; T90-L94 PolarHBondContact O-N 3.4Å
91	I	90.9	Very high	88	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-50.2	174.1	-67.5	162.3	0	0	0	110.1	L82 C85 H87 V88 F93 L94 V95 A124 L127 L128 L131	L82-I91 HydrophobicContact CD1-CB 4.42Å; L82-I91 HydrophobicContact CD1-CG1 4.2Å; L82-I91 HydrophobicContact CD1-CG2 4.12Å; C85-I91 WeakPolarHBondContact SG-CG1 3.45Å; H87-I91 WeakPolarHBondContact O-CD1 3.48Å; H87-I91 VanDerWaalsContact O-CG1 3.28Å; H87-I91 WeakPolarHBondContact O-CG1 3.49Å; H87-I91 PolarHBondContact O-N 3.33Å; H87-I91 VanDerWaalsContact O-N 3.11Å; V88-I91 PolarHBondContact O-N 3.47Å; I91-F93 VanDerWaalsContact C-N 3.31Å; I91-F93 PolarHBondContact O-N 2.87Å; I91-L94 PolarHBondContact O-N 3.46Å; I91-V95 HydrophobicContact CG2-CG2 4.17Å; I91-V95 WeakPolarHBondContact O-CB 3.44Å; I91-V95 VanDerWaalsContact O-CG2 3.31Å; I91-V95 WeakPolarHBondContact O-CG2 3.46Å; I91-V95 PolarHBondContact O-N 3.14Å; I91-A124 HydrophobicContact CD1-CB 3.61Å; I91-L127 HydrophobicContact CB-CD2 3.86Å; I91-L127 HydrophobicContact CG2-CD2 3.53Å; I91-L127 HydrophobicContact CG2-CG 4.29Å; I91-L128 HydrophobicContact CD1-CD1 4.13Å; I91-L128 HydrophobicContact CD1-CG 4.13Å; I91-L128 HydrophobicContact CG2-CD2 3.82Å; I91-L128 HydrophobicContact CG2-CG 4.33Å; I91-L131 HydrophobicContact CG2-CD1 4.27Å
92	Q	90.9	Very high	87.5	Confident	100 Å²	100	40.1 Å²	40.1	47%	0.467	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-43.3	178.2	-72.8	-176.5	8	0	0	111.8	V88 S96 L127	V88-Q92 WeakPolarHBondContact O-CG 3.49Å; V88-Q92 PolarHBondContact O-N 2.85Å; Q92-S96 WeakPolarHBondContact O-CB 2.96Å; Q92-S96 PolarHBondContact O-N 3.26Å; Q92-S96 PolarHBondContact O-OG 3.33Å; Q92-L127 HydrophobicContact CG-CD2 3.71Å
93	F	92.1	Very high	87.2	Confident	6 Å²	6	42 Å²	42	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-59.5	-49.3	175.1	171.6	-104.4	0	0	0	111.8	V58 C61 R62 H65 D89 T90 I91 S96 N97	V58-F93 HydrophobicContact CG1-CB 4.12Å; V58-F93 HydrophobicContact CG1-CG 4.43Å; C61-F93 HydrophobicContact CB-CD1 3.85Å; C61-F93 HydrophobicContact CB-CE1 3.72Å; R62-F93 HydrophobicContact CB-CE2 4.3Å; R62-F93 HydrophobicContact CB-CZ 4.45Å; R62-F93 HydrophobicContact CG-CD2 3.74Å; R62-F93 HydrophobicContact CG-CE2 3.53Å; R62-F93 HydrophobicContact CG-CG 4.4Å; R62-F93 HydrophobicContact CG-CZ 4.05Å; H65-F93 HydrophobicContact CB-CE1 4.48Å; H65-F93 HydrophobicContact CB-CZ 3.84Å; D89-F93 WeakPolarHBondContact O-CB 3.21Å; D89-F93 PolarHBondContact O-N 3.03Å; T90-F93 PolarHBondContact O-N 2.93Å; I91-F93 VanDerWaalsContact C-N 3.31Å; I91-F93 PolarHBondContact O-N 2.87Å; F93-S96 WeakPolarHBondContact CA-OG 3.41Å; F93-S96 PolarHBondContact O-OG 3.28Å; F93-N97 WeakPolarHBondContact CD2-ND2 3.19Å; F93-N97 WeakPolarHBondContact CE2-ND2 3.31Å; F93-N97 PolarHBondContact O-N 2.68Å; F93-N97 PolarHBondContact O-ND2 2.76Å
94	L	89.2	Confident	87.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64	-46.7	-178.1	-71	173.3	0	0	0	111.8	L49 A53 L71 A81 L82 T90 I91 N97 L99	L49-L94 HydrophobicContact CD2-CD2 4.41Å; A53-L94 HydrophobicContact CB-CD1 4.47Å; L71-L94 HydrophobicContact CD2-CD2 4.18Å; A81-L94 HydrophobicContact CB-CD1 4.03Å; A81-L94 HydrophobicContact CB-CD2 4.26Å; L82-L94 HydrophobicContact CB-CD1 4.17Å; L82-L94 HydrophobicContact CD1-CB 4.27Å; L82-L94 HydrophobicContact CD1-CD1 4.17Å; T90-L94 WeakPolarHBondContact O-CB 3.25Å; T90-L94 VanDerWaalsContact O-CG 3.27Å; T90-L94 WeakPolarHBondContact O-CG 3.36Å; T90-L94 PolarHBondContact O-N 3.4Å; I91-L94 PolarHBondContact O-N 3.46Å; L94-N97 CarbonylContact O-C 3.58Å; L94-N97 PolarHBondContact O-N 3.3Å; L94-L99 HydrophobicContact CB-CD2 4.08Å; L94-L99 HydrophobicContact CD2-CD2 4.08Å; L94-L99 HydrophobicContact CG-CD2 4.48Å; L94-L99 WeakPolarHBondContact O-CB 3.44Å; L94-L99 PolarHBondContact O-N 2.91Å
95	V	88.3	Confident	87.1	Confident	36 Å²	36	45 Å²	45	22%	0.218	26%	0.259	C	S	.	.	H	α-helix	trans	-66.3	-41	-179.5	174	0	0	0	0	111.5	L82 I91 N97 G98 I101 L131	L82-V95 HydrophobicContact CD1-CG2 4.37Å; L82-V95 HydrophobicContact CD2-CG2 4.48Å; I91-V95 HydrophobicContact CG2-CG2 4.17Å; I91-V95 WeakPolarHBondContact O-CB 3.44Å; I91-V95 VanDerWaalsContact O-CG2 3.31Å; I91-V95 WeakPolarHBondContact O-CG2 3.46Å; I91-V95 PolarHBondContact O-N 3.14Å; V95-N97 PolarHBondContact O-N 3.09Å; V95-G98 PolarHBondContact O-N 3.24Å; V95-I101 HydrophobicContact CG1-CG2 4.49Å; V95-I101 HydrophobicContact CG2-CG2 3.73Å; V95-L131 HydrophobicContact CG1-CD1 4.23Å; V95-L131 HydrophobicContact CG1-CD2 4.45Å; V95-L131 HydrophobicContact CG2-CD1 4.03Å
96	S	88.3	Confident	87.3	Confident	93 Å²	93	51.1 Å²	51.1	65%	0.65	29%	0.287	S	S	*	.	H	α-helix	trans	-64.4	-21.1	175.7	57.3	0	0	0	0	113.6	Q92 F93 G98	Q92-S96 WeakPolarHBondContact O-CB 2.96Å; Q92-S96 PolarHBondContact O-N 3.26Å; Q92-S96 PolarHBondContact O-OG 3.33Å; F93-S96 WeakPolarHBondContact CA-OG 3.41Å; F93-S96 PolarHBondContact O-OG 3.28Å; S96-G98 VanDerWaalsContact C-N 3.3Å
97	N	87.4	Confident	87.5	Confident	62 Å²	62	56.3 Å²	56.3	33%	0.332	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	19.3	172.7	-71.5	-87.1	0	0	0	112.9	H65 L71 F93 L94 V95	H65-N97 PolarHBondContact NE2-OD1 3.18Å; L71-N97 HydrophobicContact CD1-CB 3.45Å; L71-N97 VanDerWaalsContact CD1-CB 3.45Å; F93-N97 WeakPolarHBondContact CD2-ND2 3.19Å; F93-N97 WeakPolarHBondContact CE2-ND2 3.31Å; F93-N97 PolarHBondContact O-N 2.68Å; F93-N97 PolarHBondContact O-ND2 2.76Å; L94-N97 CarbonylContact O-C 3.58Å; L94-N97 PolarHBondContact O-N 3.3Å; V95-N97 PolarHBondContact O-N 3.09Å
98	G	78.6	Confident	87.5	Confident	61 Å²	61	55.6 Å²	55.6	63%	0.629	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	12.9	168.7	0	0	0	0	0	115.3	V95 S96 K100	V95-G98 PolarHBondContact O-N 3.24Å; S96-G98 VanDerWaalsContact C-N 3.3Å; G98-K100 PolarHBondContact O-N 2.91Å
99	L	83.6	Confident	87.4	Confident	7 Å²	7	54 Å²	54	4%	0.037	32%	0.315	C	S	.	.			trans	-72	122.9	171.7	-96.1	61.6	0	0	0	110.1	L71 L72 L82 L94	L71-L99 HydrophobicContact CB-CD1 3.35Å; L71-L99 HydrophobicContact CB-CD2 4.45Å; L71-L99 HydrophobicContact CB-CG 4.49Å; L71-L99 HydrophobicContact CD1-CD1 3.95Å; L71-L99 HydrophobicContact CG-CD1 4.28Å; L72-L99 HydrophobicContact CD2-CD1 4.02Å; L72-L99 HydrophobicContact CD2-CG 4.16Å; L82-L99 HydrophobicContact CB-CD2 4.22Å; L94-L99 HydrophobicContact CB-CD2 4.08Å; L94-L99 HydrophobicContact CD2-CD2 4.08Å; L94-L99 HydrophobicContact CG-CD2 4.48Å; L94-L99 WeakPolarHBondContact O-CB 3.44Å; L94-L99 PolarHBondContact O-N 2.91Å
100	K	81.7	Confident	87.3	Confident	133 Å²	133	50.3 Å²	50.3	58%	0.578	30%	0.296	S	S	*	.			trans	-67.5	142.2	172.2	-55.6	-175.2	176	-175.3	0	110.3	G98 D102 I103	G98-K100 PolarHBondContact O-N 2.91Å; K100-D102 VanDerWaalsContact CB-OD1 3.23Å; K100-D102 WeakPolarHBondContact CB-OD1 3.24Å; K100-I103 HydrophobicContact CB-CD1 4.21Å; K100-I103 HydrophobicContact CB-CG1 3.89Å; K100-I103 WeakPolarHBondContact O-CD1 3.37Å; K100-I103 VanDerWaalsContact O-CG1 3.29Å; K100-I103 WeakPolarHBondContact O-CG1 3.44Å
101	I	83.4	Confident	87.2	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.021	30%	0.297	C	S	.	.	S	Bend	trans	-85	-18.8	-179.5	64.1	-174.5	0	0	0	112.5	L82 V95 I103 P111 L131 E132 E135	L82-I101 HydrophobicContact CD2-CG2 4.33Å; V95-I101 HydrophobicContact CG1-CG2 4.49Å; V95-I101 HydrophobicContact CG2-CG2 3.73Å; I101-I103 VanDerWaalsContact C-N 3.32Å; I101-I103 PolarHBondContact O-N 2.9Å; I101-P111 WeakPolarHBondContact O-CD 3.44Å; I101-L131 HydrophobicContact CD1-CB 3.66Å; I101-L131 WeakPolarHBondContact CD1-O 3.48Å; I101-L131 HydrophobicContact CG2-CB 4.39Å; I101-L131 HydrophobicContact CG2-CD1 4.31Å; I101-E132 HydrophobicContact CD1-CB 4.3Å; I101-E132 HydrophobicContact CD1-CG 3.82Å; I101-E132 VanDerWaalsContact CD1-N 3.31Å; I101-E132 HydrophobicContact CG1-CG 4.32Å; I101-E135 VanDerWaalsContact CD1-CD 3.41Å; I101-E135 HydrophobicContact CD1-CG 3.99Å; I101-E135 WeakPolarHBondContact CD1-OE2 3.4Å; I101-E135 WeakPolarHBondContact CG1-OE1 3.4Å; I101-E135 VanDerWaalsContact CG1-OE2 3.29Å; I101-E135 WeakPolarHBondContact CG1-OE2 3.43Å
102	D	83.1	Confident	87.2	Confident	91 Å²	91	50.9 Å²	50.9	49%	0.487	30%	0.299	S	S	.	.			trans	-87.9	7.2	-177.5	71.8	-20.1	0	0	0	113.9	K100 C104	K100-D102 VanDerWaalsContact CB-OD1 3.23Å; K100-D102 WeakPolarHBondContact CB-OD1 3.24Å; D102-C104 PolarHBondContact O-N 2.9Å
103	I	85.1	Confident	87	Confident	40 Å²	40	49.2 Å²	49.2	21%	0.205	30%	0.295	C	S	.	.			trans	-63.9	131.9	-179.1	-56.4	170.4	0	0	0	109.2	T80 H83 K100 I101 P111	T80-I103 HydrophobicContact CG2-CD1 4.48Å; T80-I103 HydrophobicContact CG2-CG2 4.29Å; H83-I103 PolarHBondContact CE1-O 3.37Å; H83-I103 VanDerWaalsContact CE1-O 3.28Å; H83-I103 PolarHBondContact NE2-O 3.19Å; K100-I103 HydrophobicContact CB-CD1 4.21Å; K100-I103 HydrophobicContact CB-CG1 3.89Å; K100-I103 WeakPolarHBondContact O-CD1 3.37Å; K100-I103 VanDerWaalsContact O-CG1 3.29Å; K100-I103 WeakPolarHBondContact O-CG1 3.44Å; I101-I103 VanDerWaalsContact C-N 3.32Å; I101-I103 PolarHBondContact O-N 2.9Å; I103-P111 VanDerWaalsContact O-CD 3.25Å; I103-P111 WeakPolarHBondContact O-CD 3.41Å
104	C	88.5	Confident	86.8	Confident	74 Å²	74	49.5 Å²	49.5	50%	0.5	30%	0.297	S	S	.	.			trans	-102.1	136.4	175.7	-71.3	0	0	0	0	111.3	D102	D102-C104 PolarHBondContact O-N 2.9Å
105	N	88	Confident	86.7	Confident	11 Å²	11	49.8 Å²	49.8	6%	0.059	30%	0.299	C	S	.	.			trans	-76.9	-177.6	167.7	73.5	4.9	0	0	0	112.2	G78 N79 H83 N107 G108 S109	G78-N105 WeakPolarHBondContact O-CA 3.48Å; N79-N105 WeakPolarHBondContact OD1-CB 3.22Å; N79-N105 PolarHBondContact OD1-ND2 3.06Å; H83-N105 PolarHBondContact NE2-N 3.47Å; N105-N107 PolarHBondContact O-N 3.38Å; N105-N107 WeakPolarHBondContact OD1-CA 3.35Å; N105-N107 WeakPolarHBondContact OD1-CB 3.34Å; N105-N107 PolarHBondContact OD1-N 3.28Å; N105-G108 PolarHBondContact O-N 3.19Å; N105-G108 PolarHBondContact OD1-N 3.47Å; N105-S109 PolarHBondContact N-O 2.98Å; N105-S109 VanDerWaalsContact N-O 3.15Å; N105-S109 WeakPolarHBondContact OD1-CB 3.44Å; N105-S109 PolarHBondContact OD1-N 3.08Å; N105-S109 PolarHBondContact OD1-O 3.05Å
106	H	90.6	Very high	86.7	Confident	136 Å²	136	53.1 Å²	53.1	63%	0.63	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.1	-179.5	-61.8	163.7	0	0	0	114	Y76 Q77 G78 G108	Y76-H106 PolarHBondContact O-CE1 2.93Å; Y76-H106 PolarHBondContact O-ND1 2.72Å; Q77-H106 VanDerWaalsContact C-ND1 3.25Å; Q77-H106 WeakPolarHBondContact O-CB 3.37Å; Q77-H106 VanDerWaalsContact O-CG 3.28Å; Q77-H106 PolarHBondContact O-N 3.35Å; Q77-H106 PolarHBondContact O-ND1 3.24Å; G78-H106 PolarHBondContact N-CE1 3.42Å; G78-H106 PolarHBondContact N-ND1 2.9Å; H106-G108 VanDerWaalsContact C-N 3.35Å
107	N	86.4	Confident	86.6	Confident	116 Å²	116	56.9 Å²	56.9	62%	0.62	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	9.3	176.9	-61.3	-19.3	0	0	0	112.4	N105 S109	N105-N107 PolarHBondContact O-N 3.38Å; N105-N107 WeakPolarHBondContact OD1-CA 3.35Å; N105-N107 WeakPolarHBondContact OD1-CB 3.34Å; N105-N107 PolarHBondContact OD1-N 3.28Å; N107-S109 PolarHBondContact O-N 3.46Å
108	G	88.4	Confident	86.3	Confident	53 Å²	53	59.9 Å²	59.9	55%	0.546	32%	0.318	S	S	.	.	S	Bend	trans	66.1	18	-176.3	0	0	0	0	0	114	N105 H106	N105-G108 PolarHBondContact O-N 3.19Å; N105-G108 PolarHBondContact OD1-N 3.47Å; H106-G108 VanDerWaalsContact C-N 3.35Å
109	S	87	Confident	86.3	Confident	7 Å²	7	59.8 Å²	59.8	5%	0.049	32%	0.317	C	S	.	.			trans	-93.1	128.8	179.9	-57.9	0	0	0	0	110.2	H83 N105 N107	H83-S109 PolarHBondContact CD2-O 2.86Å; H83-S109 PolarHBondContact NE2-O 2.94Å; N105-S109 PolarHBondContact N-O 2.98Å; N105-S109 VanDerWaalsContact N-O 3.15Å; N105-S109 WeakPolarHBondContact OD1-CB 3.44Å; N105-S109 PolarHBondContact OD1-N 3.08Å; N105-S109 PolarHBondContact OD1-O 3.05Å; N107-S109 PolarHBondContact O-N 3.46Å
110	T	91.1	Very high	86.2	Confident	26 Å²	26	61.1 Å²	61.1	16%	0.16	33%	0.325	C	S	.	.			trans	-78.6	163.2	170.3	67.4	0	0	0	0	111.1	L112 V113 L114	T110-L112 PolarHBondContact O-N 3.48Å; T110-V113 PolarHBondContact O-N 2.77Å; T110-V113 VanDerWaalsContact O-N 3.14Å; T110-V113 WeakPolarHBondContact OG1-CG2 3.47Å; T110-V113 PolarHBondContact OG1-N 3.38Å; T110-L114 PolarHBondContact O-N 2.92Å; T110-L114 VanDerWaalsContact O-N 3.09Å
111	P	88.8	Confident	86.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.013	32%	0.319	C	S	.	.	H	α-helix	trans	-50.5	-41.5	172	-29.2	34.2	0	0	0	113.4	L82 I101 I103 L114 A115	L82-P111 HydrophobicContact CB-CG 4.27Å; L82-P111 HydrophobicContact CD2-CB 4.37Å; L82-P111 HydrophobicContact CD2-CG 3.89Å; L82-P111 HydrophobicContact CG-CB 3.93Å; L82-P111 HydrophobicContact CG-CG 3.8Å; I101-P111 WeakPolarHBondContact O-CD 3.44Å; I103-P111 VanDerWaalsContact O-CD 3.25Å; I103-P111 WeakPolarHBondContact O-CD 3.41Å; P111-L114 PolarHBondContact O-N 3Å; P111-A115 WeakPolarHBondContact O-CB 3.46Å; P111-A115 PolarHBondContact O-N 2.82Å
112	L	89.6	Confident	86.5	Confident	10 Å²	10	66.4 Å²	66.4	5%	0.052	35%	0.352	C	S	.	.	H	α-helix	trans	-63.4	-45	178.3	179.2	62.9	0	0	0	112.2	T110 L114 A115 K116 I125 L128 E129 E132	T110-L112 PolarHBondContact O-N 3.48Å; L112-L114 VanDerWaalsContact C-N 3.3Å; L112-L114 PolarHBondContact O-N 2.86Å; L112-A115 PolarHBondContact O-N 3.22Å; L112-K116 HydrophobicContact CD1-CD 4.38Å; L112-K116 HydrophobicContact CD1-CG 4.4Å; L112-K116 HydrophobicContact CG-CD 4.36Å; L112-K116 WeakPolarHBondContact O-CG 3.29Å; L112-K116 PolarHBondContact O-N 3.39Å; L112-I125 HydrophobicContact CD1-CG2 3.99Å; L112-L128 HydrophobicContact CB-CB 4.34Å; L112-L128 HydrophobicContact CD1-CB 3.77Å; L112-E129 HydrophobicContact CD1-CG 3.8Å; L112-E129 HydrophobicContact CD2-CG 3.92Å; L112-E132 WeakPolarHBondContact CB-OE1 3.42Å; L112-E132 VanDerWaalsContact CD2-CD 3.43Å; L112-E132 WeakPolarHBondContact CD2-OE1 3.37Å; L112-E132 WeakPolarHBondContact CD2-OE2 3.27Å
113	V	88.6	Confident	86.7	Confident	65 Å²	65	66.6 Å²	66.6	39%	0.394	35%	0.353	S	S	.	.	H	α-helix	trans	-60.8	-42.2	178.5	172.1	0	0	0	0	110.6	T110 R117	T110-V113 PolarHBondContact O-N 2.77Å; T110-V113 VanDerWaalsContact O-N 3.14Å; T110-V113 WeakPolarHBondContact OG1-CG2 3.47Å; T110-V113 PolarHBondContact OG1-N 3.38Å; V113-R117 WeakPolarHBondContact O-CB 3.36Å; V113-R117 PolarHBondContact O-N 3.37Å
114	L	87.1	Confident	86.8	Confident	13 Å²	13	64.7 Å²	64.7	7%	0.068	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-41.3	177.1	-68.6	-176.5	0	0	0	112.5	H83 T110 P111 L112 K116 R117 R118	H83-L114 HydrophobicContact CB-CD1 3.86Å; T110-L114 PolarHBondContact O-N 2.92Å; T110-L114 VanDerWaalsContact O-N 3.09Å; P111-L114 PolarHBondContact O-N 3Å; L112-L114 VanDerWaalsContact C-N 3.3Å; L112-L114 PolarHBondContact O-N 2.86Å; L114-K116 VanDerWaalsContact C-N 3.34Å; L114-K116 PolarHBondContact O-N 3.17Å; L114-R117 PolarHBondContact O-N 3.3Å; L114-R118 WeakPolarHBondContact O-CB 3.47Å; L114-R118 VanDerWaalsContact O-CG 3.31Å; L114-R118 WeakPolarHBondContact O-CG 3.37Å; L114-R118 PolarHBondContact O-N 3.07Å
115	A	87.8	Confident	86.8	Confident	5 Å²	5	62.4 Å²	62.4	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-57.6	-47	175.8	0	0	0	0	0	111.1	P111 L112 R118 G119 V120 I125 L128	P111-A115 WeakPolarHBondContact O-CB 3.46Å; P111-A115 PolarHBondContact O-N 2.82Å; L112-A115 PolarHBondContact O-N 3.22Å; A115-R118 PolarHBondContact O-N 3.18Å; A115-G119 PolarHBondContact O-N 2.8Å; A115-G119 VanDerWaalsContact O-N 3.12Å; A115-V120 HydrophobicContact CB-CG2 3.58Å; A115-V120 PolarHBondContact O-N 3.31Å; A115-I125 HydrophobicContact CB-CG1 4.08Å; A115-L128 HydrophobicContact CB-CD1 4.1Å
116	K	87.4	Confident	86.8	Confident	106 Å²	106	69.8 Å²	69.8	46%	0.461	35%	0.353	S	S	.	.	H	α-helix	trans	-61.6	-46.3	175	-74.5	179.4	173.8	174.3	0	112.4	L112 L114 R118 G119 I125 E129	L112-K116 HydrophobicContact CD1-CD 4.38Å; L112-K116 HydrophobicContact CD1-CG 4.4Å; L112-K116 HydrophobicContact CG-CD 4.36Å; L112-K116 WeakPolarHBondContact O-CG 3.29Å; L112-K116 PolarHBondContact O-N 3.39Å; L114-K116 VanDerWaalsContact C-N 3.34Å; L114-K116 PolarHBondContact O-N 3.17Å; K116-R118 PolarHBondContact O-N 3.07Å; K116-G119 PolarHBondContact O-N 3.18Å; K116-I125 HydrophobicContact CG-CD1 4.35Å; K116-I125 HydrophobicContact CG-CG2 3.98Å; K116-E129 WeakPolarHBondContact CE-OE1 3.47Å; K116-E129 IonicContact NZ-OE1 2.68Å; K116-E129 PolarHBondContact NZ-OE1 3.12Å
117	R	85.3	Confident	86.7	Confident	173 Å²	173	65.2 Å²	65.2	65%	0.653	33%	0.333	S	S	*	.	H	α-helix	trans	-63	-39.8	180	-173.9	-175.4	-62.3	-177.6	3.2	112.7	V113 L114 G119	V113-R117 WeakPolarHBondContact O-CB 3.36Å; V113-R117 PolarHBondContact O-N 3.37Å; L114-R117 PolarHBondContact O-N 3.3Å; R117-G119 VanDerWaalsContact C-N 3.29Å
118	R	82.3	Confident	86.7	Confident	124 Å²	124	59.8 Å²	59.8	47%	0.468	30%	0.304	S	S	.	.	H	α-helix	trans	-76.2	-17.9	179.8	-71.5	175.9	-176.3	-171.2	3.5	112.8	L84 L114 A115 K116 V120	L84-R118 PolarHBondContact O-NH1 3.47Å; L114-R118 WeakPolarHBondContact O-CB 3.47Å; L114-R118 VanDerWaalsContact O-CG 3.31Å; L114-R118 WeakPolarHBondContact O-CG 3.37Å; L114-R118 PolarHBondContact O-N 3.07Å; A115-R118 PolarHBondContact O-N 3.18Å; K116-R118 PolarHBondContact O-N 3.07Å; R118-V120 HydrophobicContact CB-CG1 3.84Å
119	G	79.4	Confident	86.7	Confident	59 Å²	59	60.4 Å²	60.4	61%	0.608	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	40.1	-173.8	0	0	0	0	0	112.3	A115 K116 R117	A115-G119 PolarHBondContact O-N 2.8Å; A115-G119 VanDerWaalsContact O-N 3.12Å; K116-G119 PolarHBondContact O-N 3.18Å; R117-G119 VanDerWaalsContact C-N 3.29Å
120	V	80.1	Confident	86.5	Confident	35 Å²	35	61.3 Å²	61.3	21%	0.212	30%	0.303	C	S	.	.			trans	-66.6	178.8	176	-56.5	0	0	0	0	111.3	A115 R118 K122 A124 I125	A115-V120 HydrophobicContact CB-CG2 3.58Å; A115-V120 PolarHBondContact O-N 3.31Å; R118-V120 HydrophobicContact CB-CG1 3.84Å; V120-K122 PolarHBondContact O-N 3.18Å; V120-A124 HydrophobicContact CG2-CB 4.46Å; V120-I125 HydrophobicContact CG2-CD1 4.34Å; V120-I125 HydrophobicContact CG2-CG1 4Å
121	N	84.8	Confident	86.1	Confident	85 Å²	85	61.6 Å²	61.6	46%	0.455	30%	0.303	S	S	.	.			trans	-47.3	130.4	-179.7	-66.4	-53.1	0	0	0	112.4	G86 D123 A124 I125	G86-N121 PolarHBondContact O-ND2 3.45Å; N121-D123 PolarHBondContact O-N 3.41Å; N121-A124 HydrophobicContact CB-CB 4.26Å; N121-A124 WeakPolarHBondContact O-CB 3.38Å; N121-A124 PolarHBondContact O-N 3.36Å; N121-I125 PolarHBondContact O-N 2.94Å
122	K	86.6	Confident	85.7	Confident	163 Å²	163	64.5 Å²	64.5	71%	0.709	32%	0.317	S	S	*	.	H	α-helix	trans	-57.1	-34	-179.9	-68	-177.3	179.9	178.6	0	112.2	V120 I125 R126	V120-K122 PolarHBondContact O-N 3.18Å; K122-I125 PolarHBondContact O-N 3.3Å; K122-R126 WeakPolarHBondContact O-CG 3.41Å; K122-R126 PolarHBondContact O-N 3.13Å
123	D	87.6	Confident	85.1	Confident	95 Å²	95	69.2 Å²	69.2	51%	0.508	34%	0.338	S	S	.	.	H	α-helix	trans	-70.1	-34.2	179.6	-56.9	-37.1	0	0	0	112.2	V88 N121 R126 L127	V88-D123 HydrophobicContact CG2-CB 3.68Å; N121-D123 PolarHBondContact O-N 3.41Å; D123-R126 PolarHBondContact O-N 3.43Å; D123-R126 IonicContact OD1-NH1 3.79Å; D123-L127 WeakPolarHBondContact O-CB 3.17Å; D123-L127 PolarHBondContact O-N 3.1Å
124	A	86.7	Confident	84.1	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.008	35%	0.349	C	S	.	.	H	α-helix	trans	-66.8	-40.8	173.5	0	0	0	0	0	111.4	V88 I91 V120 N121 L127 L128	V88-A124 HydrophobicContact CG2-CB 4.39Å; I91-A124 HydrophobicContact CD1-CB 3.61Å; V120-A124 HydrophobicContact CG2-CB 4.46Å; N121-A124 HydrophobicContact CB-CB 4.26Å; N121-A124 WeakPolarHBondContact O-CB 3.38Å; N121-A124 PolarHBondContact O-N 3.36Å; A124-L127 PolarHBondContact O-N 3Å; A124-L128 WeakPolarHBondContact O-CG 3.29Å; A124-L128 PolarHBondContact O-N 3.12Å
125	I	88.6	Confident	83	Confident	26 Å²	26	76.1 Å²	76.1	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-49	175.1	-63.4	172.1	0	0	0	110.2	L112 A115 K116 V120 N121 K122 L127 L128 E129	L112-I125 HydrophobicContact CD1-CG2 3.99Å; A115-I125 HydrophobicContact CB-CG1 4.08Å; K116-I125 HydrophobicContact CG-CD1 4.35Å; K116-I125 HydrophobicContact CG-CG2 3.98Å; V120-I125 HydrophobicContact CG2-CD1 4.34Å; V120-I125 HydrophobicContact CG2-CG1 4Å; N121-I125 PolarHBondContact O-N 2.94Å; K122-I125 PolarHBondContact O-N 3.3Å; I125-L127 VanDerWaalsContact C-N 3.28Å; I125-L127 PolarHBondContact O-N 2.95Å; I125-L128 PolarHBondContact O-N 2.96Å; I125-E129 HydrophobicContact CG2-CG 4.37Å; I125-E129 WeakPolarHBondContact O-CG 3.4Å; I125-E129 PolarHBondContact O-N 3.29Å
126	R	88	Confident	81.5	Confident	165 Å²	165	80.4 Å²	80.4	62%	0.623	39%	0.392	S	S	*	.	H	α-helix	trans	-58.9	-38.7	177.4	-75.6	172.7	174.1	175.3	-6	112.6	K122 D123 G130	K122-R126 WeakPolarHBondContact O-CG 3.41Å; K122-R126 PolarHBondContact O-N 3.13Å; D123-R126 PolarHBondContact O-N 3.43Å; D123-R126 IonicContact OD1-NH1 3.79Å; R126-G130 PolarHBondContact O-N 3.24Å
127	L	88.6	Confident	79.9	Confident	40 Å²	40	80.8 Å²	80.8	21%	0.209	39%	0.393	C	S	.	.	H	α-helix	trans	-63.6	-49.2	176	-179.1	69.3	0	0	0	110.7	V88 I91 Q92 D123 A124 I125 E129 G130 L131	V88-L127 HydrophobicContact CG1-CD2 3.91Å; I91-L127 HydrophobicContact CB-CD2 3.86Å; I91-L127 HydrophobicContact CG2-CD2 3.53Å; I91-L127 HydrophobicContact CG2-CG 4.29Å; Q92-L127 HydrophobicContact CG-CD2 3.71Å; D123-L127 WeakPolarHBondContact O-CB 3.17Å; D123-L127 PolarHBondContact O-N 3.1Å; A124-L127 PolarHBondContact O-N 3Å; I125-L127 VanDerWaalsContact C-N 3.28Å; I125-L127 PolarHBondContact O-N 2.95Å; L127-E129 VanDerWaalsContact C-N 3.35Å; L127-E129 PolarHBondContact O-N 2.87Å; L127-G130 PolarHBondContact O-N 3.13Å; L127-L131 HydrophobicContact CD1-CD1 4.4Å; L127-L131 HydrophobicContact CD1-CG 4.45Å; L127-L131 HydrophobicContact CG-CD1 4.02Å; L127-L131 HydrophobicContact CG-CG 4.45Å; L127-L131 WeakPolarHBondContact O-CB 3.32Å; L127-L131 VanDerWaalsContact O-CG 3.24Å; L127-L131 WeakPolarHBondContact O-CG 3.39Å; L127-L131 PolarHBondContact O-N 3.15Å
128	L	86.8	Confident	78.3	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.016	38%	0.382	C	S	.	.	H	α-helix	trans	-62.3	-40.9	178.7	-72.2	169.8	0	0	0	111.9	L82 I91 L112 A115 A124 I125 L131 E132	L82-L128 HydrophobicContact CD1-CD2 4.47Å; I91-L128 HydrophobicContact CD1-CD1 4.13Å; I91-L128 HydrophobicContact CD1-CG 4.13Å; I91-L128 HydrophobicContact CG2-CD2 3.82Å; I91-L128 HydrophobicContact CG2-CG 4.33Å; L112-L128 HydrophobicContact CB-CB 4.34Å; L112-L128 HydrophobicContact CD1-CB 3.77Å; A115-L128 HydrophobicContact CB-CD1 4.1Å; A124-L128 WeakPolarHBondContact O-CG 3.29Å; A124-L128 PolarHBondContact O-N 3.12Å; I125-L128 PolarHBondContact O-N 2.96Å; L128-L131 PolarHBondContact O-N 2.96Å; L128-E132 PolarHBondContact O-N 3.38Å
129	E	88	Confident	76.5	Confident	66 Å²	66	76.8 Å²	76.8	31%	0.308	40%	0.396	S	S	.	.	H	α-helix	trans	-60.7	-46.6	172.9	-71.4	175.8	157.3	0	0	111.7	L112 K116 I125 L127 L131 E132 E133	L112-E129 HydrophobicContact CD1-CG 3.8Å; L112-E129 HydrophobicContact CD2-CG 3.92Å; K116-E129 WeakPolarHBondContact CE-OE1 3.47Å; K116-E129 IonicContact NZ-OE1 2.68Å; K116-E129 PolarHBondContact NZ-OE1 3.12Å; I125-E129 HydrophobicContact CG2-CG 4.37Å; I125-E129 WeakPolarHBondContact O-CG 3.4Å; I125-E129 PolarHBondContact O-N 3.29Å; L127-E129 VanDerWaalsContact C-N 3.35Å; L127-E129 PolarHBondContact O-N 2.87Å; E129-L131 VanDerWaalsContact C-N 3.29Å; E129-L131 PolarHBondContact O-N 3.47Å; E129-E132 PolarHBondContact O-N 3.49Å; E129-E133 PolarHBondContact O-N 2.94Å
130	G	84.2	Confident	74.8	Confident	26 Å²	26	78.4 Å²	78.4	27%	0.268	39%	0.39	S	S	.	.	H	α-helix	trans	-64.1	-33.6	178	0	0	0	0	0	113.2	R126 L127 Q134	R126-G130 PolarHBondContact O-N 3.24Å; L127-G130 PolarHBondContact O-N 3.13Å; G130-Q134 VanDerWaalsContact O-CG 3.28Å; G130-Q134 WeakPolarHBondContact O-CG 3.28Å; G130-Q134 PolarHBondContact O-N 3.24Å; G130-Q134 VanDerWaalsContact O-N 3.12Å
131	L	81.9	Confident	73.1	Confident	31 Å²	31	85.1 Å²	85.1	16%	0.162	41%	0.412	C	S	.	.	H	α-helix	trans	-70.9	-41.5	175	-69.8	171	0	0	0	111.5	I91 V95 I101 L127 L128 E129 E133 Q134 E135	I91-L131 HydrophobicContact CG2-CD1 4.27Å; V95-L131 HydrophobicContact CG1-CD1 4.23Å; V95-L131 HydrophobicContact CG1-CD2 4.45Å; V95-L131 HydrophobicContact CG2-CD1 4.03Å; I101-L131 HydrophobicContact CD1-CB 3.66Å; I101-L131 WeakPolarHBondContact CD1-O 3.48Å; I101-L131 HydrophobicContact CG2-CB 4.39Å; I101-L131 HydrophobicContact CG2-CD1 4.31Å; L127-L131 HydrophobicContact CD1-CD1 4.4Å; L127-L131 HydrophobicContact CD1-CG 4.45Å; L127-L131 HydrophobicContact CG-CD1 4.02Å; L127-L131 HydrophobicContact CG-CG 4.45Å; L127-L131 WeakPolarHBondContact O-CB 3.32Å; L127-L131 VanDerWaalsContact O-CG 3.24Å; L127-L131 WeakPolarHBondContact O-CG 3.39Å; L127-L131 PolarHBondContact O-N 3.15Å; L128-L131 PolarHBondContact O-N 2.96Å; E129-L131 VanDerWaalsContact C-N 3.29Å; E129-L131 PolarHBondContact O-N 3.47Å; L131-E133 VanDerWaalsContact C-N 3.35Å; L131-E133 PolarHBondContact O-N 2.97Å; L131-Q134 PolarHBondContact O-N 3.11Å; L131-Q134 VanDerWaalsContact O-N 3.16Å; L131-E135 PolarHBondContact O-N 3.49Å
132	E	79.8	Confident	71.1	Confident	64 Å²	64	84 Å²	84	30%	0.299	42%	0.421	S	S	.	.	H	α-helix	trans	-60.6	-44	174.1	-76.9	-177.2	-179	0	0	111.2	I101 L112 L128 E129 Q134 E135 V136	I101-E132 HydrophobicContact CD1-CB 4.3Å; I101-E132 HydrophobicContact CD1-CG 3.82Å; I101-E132 VanDerWaalsContact CD1-N 3.31Å; I101-E132 HydrophobicContact CG1-CG 4.32Å; L112-E132 WeakPolarHBondContact CB-OE1 3.42Å; L112-E132 VanDerWaalsContact CD2-CD 3.43Å; L112-E132 WeakPolarHBondContact CD2-OE1 3.37Å; L112-E132 WeakPolarHBondContact CD2-OE2 3.27Å; L128-E132 PolarHBondContact O-N 3.38Å; E129-E132 PolarHBondContact O-N 3.49Å; E132-Q134 VanDerWaalsContact C-N 3.28Å; E132-Q134 PolarHBondContact O-N 3.38Å; E132-E135 PolarHBondContact O-N 2.92Å; E132-V136 WeakPolarHBondContact O-CG2 3.33Å; E132-V136 PolarHBondContact O-N 3.21Å; E132-V136 VanDerWaalsContact O-N 3.08Å
133	E	77	Confident	69.1	Low	108 Å²	108	79.3 Å²	79.3	51%	0.505	41%	0.412	S	S	.	.	H	α-helix	trans	-62.3	-35	175.1	-73.9	-173.4	-159.7	0	0	113.2	E129 L131 K137	E129-E133 PolarHBondContact O-N 2.94Å; L131-E133 VanDerWaalsContact C-N 3.35Å; L131-E133 PolarHBondContact O-N 2.97Å; E133-K137 WeakPolarHBondContact O-CB 3.47Å; E133-K137 VanDerWaalsContact O-CG 3.26Å; E133-K137 WeakPolarHBondContact O-CG 3.43Å; E133-K137 PolarHBondContact O-N 3.36Å; E133-K137 IonicContact OE2-NZ 3.15Å; E133-K137 PolarHBondContact OE2-NZ 2.91Å; E133-K137 VanDerWaalsContact OE2-NZ 3.15Å
134	Q	68.7	Low	67	Low	130 Å²	130	80.3 Å²	80.3	61%	0.607	41%	0.414	S	S	*	.	H	α-helix	trans	-70.8	-36.6	177.7	-78	178.2	27.1	0	0	112.2	G130 L131 E132 K137 G138	G130-Q134 VanDerWaalsContact O-CG 3.28Å; G130-Q134 WeakPolarHBondContact O-CG 3.28Å; G130-Q134 PolarHBondContact O-N 3.24Å; G130-Q134 VanDerWaalsContact O-N 3.12Å; L131-Q134 PolarHBondContact O-N 3.11Å; L131-Q134 VanDerWaalsContact O-N 3.16Å; E132-Q134 VanDerWaalsContact C-N 3.28Å; E132-Q134 PolarHBondContact O-N 3.38Å; Q134-K137 PolarHBondContact O-N 3.42Å; Q134-G138 WeakPolarHBondContact O-CA 3.28Å; Q134-G138 PolarHBondContact O-N 3.4Å
135	E	63.1	Low	65	Low	93 Å²	93	83.4 Å²	83.4	44%	0.435	44%	0.435	S	S	.	.	H	α-helix	trans	-64.8	-43.2	172.6	-72.3	-172.8	165.2	0	0	111.1	I101 L131 E132 K137 G138 F139	I101-E135 VanDerWaalsContact CD1-CD 3.41Å; I101-E135 HydrophobicContact CD1-CG 3.99Å; I101-E135 WeakPolarHBondContact CD1-OE2 3.4Å; I101-E135 WeakPolarHBondContact CG1-OE1 3.4Å; I101-E135 VanDerWaalsContact CG1-OE2 3.29Å; I101-E135 WeakPolarHBondContact CG1-OE2 3.43Å; L131-E135 PolarHBondContact O-N 3.49Å; E132-E135 PolarHBondContact O-N 2.92Å; E135-K137 VanDerWaalsContact C-N 3.33Å; E135-K137 PolarHBondContact O-N 3Å; E135-G138 PolarHBondContact O-N 2.94Å; E135-F139 PolarHBondContact O-N 2.92Å
136	V	57.8	Low	62.8	Low	95 Å²	95	90 Å²	90	58%	0.576	46%	0.462	S	S	*	.	H	α-helix	trans	-62.6	-39.1	175.4	175.5	0	0	0	0	111.5	E132	E132-V136 WeakPolarHBondContact O-CG2 3.33Å; E132-V136 PolarHBondContact O-N 3.21Å; E132-V136 VanDerWaalsContact O-N 3.08Å
137	K	53.4	Low	60.5	Low	114 Å²	114	86.9 Å²	86.9	50%	0.496	46%	0.458	S	S	.	.	H	α-helix	trans	-77.5	-30.3	176.5	-72.8	168.7	-174	158.8	0	113	E133 Q134 E135 F139 N140 R141	E133-K137 WeakPolarHBondContact O-CB 3.47Å; E133-K137 VanDerWaalsContact O-CG 3.26Å; E133-K137 WeakPolarHBondContact O-CG 3.43Å; E133-K137 PolarHBondContact O-N 3.36Å; E133-K137 IonicContact OE2-NZ 3.15Å; E133-K137 PolarHBondContact OE2-NZ 2.91Å; E133-K137 VanDerWaalsContact OE2-NZ 3.15Å; Q134-K137 PolarHBondContact O-N 3.42Å; E135-K137 VanDerWaalsContact C-N 3.33Å; E135-K137 PolarHBondContact O-N 3Å; K137-F139 VanDerWaalsContact C-N 3.31Å; K137-N140 CarbonylContact O-C 3.6Å; K137-N140 PolarHBondContact O-N 2.83Å; K137-N140 VanDerWaalsContact O-N 3.13Å; K137-R141 PolarHBondContact O-N 2.97Å
138	G	51.3	Low	58.5	Low	40 Å²	40	90.6 Å²	90.6	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-65.6	-35.8	174.8	0	0	0	0	0	111.8	Q134 E135 N140 R141 G142	Q134-G138 WeakPolarHBondContact O-CA 3.28Å; Q134-G138 PolarHBondContact O-N 3.4Å; E135-G138 PolarHBondContact O-N 2.94Å; G138-N140 VanDerWaalsContact C-N 3.32Å; G138-N140 PolarHBondContact O-N 3.14Å; G138-R141 PolarHBondContact O-N 3.45Å; G138-G142 PolarHBondContact O-N 3.14Å
139	F	44.4	Very low	56.5	Low	174 Å²	174	95.1 Å²	95.1	76%	0.763	50%	0.502	S	S	*	.	H	α-helix	trans	-60.3	-41.1	168.5	-167.1	-101.6	0	0	0	111.9	E135 K137	E135-F139 PolarHBondContact O-N 2.92Å; K137-F139 VanDerWaalsContact C-N 3.31Å
140	N	44.3	Very low	54.1	Low	92 Å²	92	98.6 Å²	98.6	49%	0.492	52%	0.52	S	S	.	.	H	α-helix	trans	-73.3	-33.5	174.6	-67	-26.5	0	0	0	112.7	K137 G138 H144	K137-N140 CarbonylContact O-C 3.6Å; K137-N140 PolarHBondContact O-N 2.83Å; K137-N140 VanDerWaalsContact O-N 3.13Å; G138-N140 VanDerWaalsContact C-N 3.32Å; G138-N140 PolarHBondContact O-N 3.14Å; N140-H144 PolarHBondContact O-CD2 3.24Å; N140-H144 PolarHBondContact O-N 3.36Å; N140-H144 VanDerWaalsContact O-N 3.16Å
141	R	44.3	Very low	52.1	Low	177 Å²	177	104 Å²	104	67%	0.668	54%	0.538	S	S	*	.	H	α-helix	trans	-76.1	-24.6	176.8	-86.1	-177.7	172.5	177.9	-2.9	113.9	K137 G138 A143 H144 S145	K137-R141 PolarHBondContact O-N 2.97Å; G138-R141 PolarHBondContact O-N 3.45Å; R141-A143 PolarHBondContact O-N 3.2Å; R141-H144 PolarHBondContact O-N 2.88Å; R141-S145 WeakPolarHBondContact O-CA 3.35Å; R141-S145 WeakPolarHBondContact O-CB 3.46Å; R141-S145 PolarHBondContact O-N 3.47Å
142	G	41.6	Very low	50.2	Low	62 Å²	62	109.1 Å²	109.1	64%	0.639	56%	0.563	S	S	*	*	H	α-helix	trans	-61.9	-34	173.1	0	0	0	0	0	112.8	G138	G138-G142 PolarHBondContact O-N 3.14Å
143	A	46.1	Very low	48.6	Very low	64 Å²	64	109.5 Å²	109.5	53%	0.529	58%	0.577	S	S	.	*	H	α-helix	trans	-80.2	-38.2	171.6	0	0	0	0	0	112.5	R141	R141-A143 PolarHBondContact O-N 3.2Å
144	H	42.3	Very low	47.1	Very low	116 Å²	116	110.6 Å²	110.6	54%	0.537	59%	0.586	S	S	.	*	H	α-helix	trans	-84.3	-22.1	-176.8	-79.7	-75.4	0	0	0	115.5	N140 R141 K146 L147 E148	N140-H144 PolarHBondContact O-CD2 3.24Å; N140-H144 PolarHBondContact O-N 3.36Å; N140-H144 VanDerWaalsContact O-N 3.16Å; R141-H144 PolarHBondContact O-N 2.88Å; H144-K146 VanDerWaalsContact C-N 3.35Å; H144-K146 PolarHBondContact O-N 2.84Å; H144-L147 WeakPolarHBondContact O-CB 3.41Å; H144-L147 PolarHBondContact O-N 3.31Å; H144-L147 VanDerWaalsContact O-N 3.12Å; H144-E148 WeakPolarHBondContact O-CB 3.5Å; H144-E148 PolarHBondContact O-N 3.26Å
145	S	44.5	Very low	45.8	Very low	65 Å²	65	107.8 Å²	107.8	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-72.8	-28.6	-177.1	-177.3	0	0	0	0	112.3	R141 L147 T149	R141-S145 WeakPolarHBondContact O-CA 3.35Å; R141-S145 WeakPolarHBondContact O-CB 3.46Å; R141-S145 PolarHBondContact O-N 3.47Å; S145-L147 VanDerWaalsContact C-N 3.33Å; S145-T149 WeakPolarHBondContact O-CB 3.34Å; S145-T149 WeakPolarHBondContact O-CG2 3.35Å; S145-T149 PolarHBondContact O-N 3.14Å; S145-T149 VanDerWaalsContact O-N 3.17Å; S145-T149 PolarHBondContact O-OG1 3.1Å
146	K	41.9	Very low	44.9	Very low	164 Å²	164	111.9 Å²	111.9	71%	0.713	60%	0.6	S	S	*	*	H	α-helix	trans	-76.1	-22.6	170.9	-151.9	173.7	-174.3	-179	0	112.7	H144	H144-K146 VanDerWaalsContact C-N 3.35Å; H144-K146 PolarHBondContact O-N 2.84Å
147	L	41.3	Very low	44.2	Very low	100 Å²	100	112.4 Å²	112.4	52%	0.524	61%	0.608	S	S	.	*	H	α-helix	trans	-83	-38.3	174.2	-73	163.6	0	0	0	111.5	H144 S145 M150 Q151	H144-L147 WeakPolarHBondContact O-CB 3.41Å; H144-L147 PolarHBondContact O-N 3.31Å; H144-L147 VanDerWaalsContact O-N 3.12Å; S145-L147 VanDerWaalsContact C-N 3.33Å; L147-M150 PolarHBondContact O-N 3.49Å; L147-Q151 PolarHBondContact O-N 3.46Å
148	E	45.5	Very low	43.3	Very low	119 Å²	119	110.9 Å²	110.9	56%	0.556	62%	0.617	S	S	*	*	H	α-helix	trans	-75.3	-33.3	-178.5	-143.3	168.5	-163.5	0	0	111.9	H144 M150 Q151 M152	H144-E148 WeakPolarHBondContact O-CB 3.5Å; H144-E148 PolarHBondContact O-N 3.26Å; E148-M150 VanDerWaalsContact C-N 3.29Å; E148-M150 PolarHBondContact O-N 3.17Å; E148-Q151 PolarHBondContact O-N 3.4Å; E148-Q151 VanDerWaalsContact O-N 3.15Å; E148-M152 WeakPolarHBondContact O-CG 3.35Å; E148-M152 PolarHBondContact O-N 3.47Å
149	T	46.1	Very low	42.6	Very low	97 Å²	97	117.6 Å²	117.6	60%	0.595	64%	0.64	S	S	*	*	H	α-helix	trans	-72.2	-19.1	172.1	46.5	0	0	0	0	113.7	S145	S145-T149 WeakPolarHBondContact O-CB 3.34Å; S145-T149 WeakPolarHBondContact O-CG2 3.35Å; S145-T149 PolarHBondContact O-N 3.14Å; S145-T149 VanDerWaalsContact O-N 3.17Å; S145-T149 PolarHBondContact O-OG1 3.1Å
150	M	36.3	Very low	42.4	Very low	140 Å²	140	117.8 Å²	117.8	69%	0.69	64%	0.643	S	S	*	*	H	α-helix	trans	-79.5	-29.1	166.9	-91.2	168.8	127.6	0	0	112	L147 E148	L147-M150 PolarHBondContact O-N 3.49Å; E148-M150 VanDerWaalsContact C-N 3.29Å; E148-M150 PolarHBondContact O-N 3.17Å
151	Q	43.2	Very low	41.9	Very low	139 Å²	139	118.6 Å²	118.6	65%	0.65	66%	0.656	S	S	*	*	H	α-helix	trans	-83.4	-16.5	-173.8	-145.7	157.3	3.5	0	0	114	L147 E148 S155	L147-Q151 PolarHBondContact O-N 3.46Å; E148-Q151 PolarHBondContact O-N 3.4Å; E148-Q151 VanDerWaalsContact O-N 3.15Å; Q151-S155 PolarHBondContact O-OG 2.91Å
152	M	41.5	Very low	41.6	Very low	139 Å²	139	119.1 Å²	119.1	69%	0.685	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-13.6	173.2	-61.8	-59.1	-127.3	0	0	113.8	E148	E148-M152 WeakPolarHBondContact O-CG 3.35Å; E148-M152 PolarHBondContact O-N 3.47Å
153	A	46.3	Very low	41.4	Very low	71 Å²	71	121 Å²	121	59%	0.587	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-28	175.2	0	0	0	0	0	112.7
154	D	44.7	Very low	40.9	Very low	132 Å²	132	125 Å²	125	71%	0.706	68%	0.68	S	S	*	*	S	Bend	trans	-96.3	-5.8	-177.1	-79.1	-10.3	0	0	0	114.2
155	S	42.9	Very low	40.5	Very low	71 Å²	71	127.1 Å²	127.1	50%	0.497	70%	0.695	S	S	.	*	S	Bend	trans	-98.3	-9.6	-177.9	47.3	0	0	0	0	114.7	Q151	Q151-S155 PolarHBondContact O-OG 2.91Å
156	E	43	Very low	40	Very low	179 Å²	179	131.1 Å²	131.1	84%	0.836	71%	0.711	S	S	*	*	S	Bend	trans	-91.6	-9.3	-179.8	-139.8	171.6	-161.1	0	0	113.4
157	S	43.6	Very low	40.4	Very low	106 Å²	106	128 Å²	128	74%	0.741	71%	0.708	S	S	*	*	S	Bend	trans	-106.3	9.4	-178.8	69.1	0	0	0	0	115.6
158	A	34.6	Very low	39.8	Very low	82 Å²	82	130.7 Å²	130.7	68%	0.678	72%	0.723	S	S	*	*			trans	-134.6	27.4	-177.2	0	0	0	0	0	114.4	E160	A158-E160 VanDerWaalsContact C-N 3.32Å
159	M	36.8	Very low	39.7	Very low	181 Å²	181	132.1 Å²	132.1	89%	0.892	73%	0.733	S	S	*	*			trans	-96.7	45.8	167.1	-121.4	-166.1	90.5	0	0	111.4
160	E	40.5	Very low	39.4	Very low	178 Å²	178	136.1 Å²	136.1	83%	0.832	75%	0.745	S	S	*	*			trans	-142.3	128	168.6	-114.9	163.8	-166.8	0	0	111.3	A158	A158-E160 VanDerWaalsContact C-N 3.32Å
161	S	32.3	Very low	39.8	Very low	109 Å²	109	134.6 Å²	134.6	76%	0.762	75%	0.748	S	S	*	*			trans	80.8	87	170.9	69	0	0	0	0	118.9
162	H	39	Very low	39.7	Very low	188 Å²	188	130.3 Å²	130.3	87%	0.87	73%	0.733	S	S	*	*				36.8	131.8	119.5	-72.9	-88.4	0	0	0	120.7
163	S	37.5	Very low	39.8	Very low	101 Å²	101	131.7 Å²	131.7	71%	0.706	74%	0.738	S	S	*	*			trans	86.5	107.5	148.6	-86.9	0	0	0	0	119.7
164	L	34.7	Very low	40.1	Very low	147 Å²	147	130.7 Å²	130.7	77%	0.77	74%	0.735	S	S	*	*			trans	69.9	116.2	131.4	-58.1	176.8	0	0	0	119.7
165	L	34.7	Very low	40.3	Very low	161 Å²	161	129.6 Å²	129.6	84%	0.843	73%	0.733	S	S	*	*			trans	57	106.6	136.8	-67.8	157.4	0	0	0	118.3
166	N	33.6	Very low	40.3	Very low	149 Å²	149	131.2 Å²	131.2	80%	0.797	74%	0.735	S	S	*	*			trans	-27.2	150.3	145.7	-155.1	31.7	0	0	0	112.7
167	P	50.6	Low	40.7	Very low	100 Å²	100	125.6 Å²	125.6	65%	0.649	72%	0.716	S	S	*	*			cis	-148.1	140.1	28.6	37.4	-14.8	0	0	0	117.3
168	N	28.4	Very low	41	Very low	156 Å²	156	124 Å²	124	83%	0.834	71%	0.705	S	S	*	*			trans	-163	127.7	140.8	-105.8	-35.3	0	0	0	112.4
169	L	43	Very low	41.7	Very low	148 Å²	148	126.1 Å²	126.1	78%	0.775	70%	0.699	S	S	*	*			trans	-86.6	102.2	-170.4	-163	83.2	0	0	0	108.5
170	Q	40.9	Very low	42.7	Very low	181 Å²	181	125.6 Å²	125.6	85%	0.846	69%	0.687	S	S	*	*			trans	-152.2	17.4	174.9	-116.6	139.8	23.1	0	0	117.7
171	S	44.2	Very low	43.5	Very low	109 Å²	109	120.9 Å²	120.9	76%	0.762	67%	0.671	S	S	*	*	S	Bend	trans	-128.8	8.1	176.1	61	0	0	0	0	115.6
172	S	41.1	Very low	44.7	Very low	48 Å²	48	119.7 Å²	119.7	34%	0.336	66%	0.659	S	S	.	*			trans	-83.4	-13.5	-177	60.8	0	0	0	0	114.9	G174 L176	S172-G174 PolarHBondContact O-N 3.45Å; S172-L176 VanDerWaalsContact O-CB 3.29Å; S172-L176 WeakPolarHBondContact O-CB 3.35Å; S172-L176 VanDerWaalsContact O-CG 3.23Å; S172-L176 WeakPolarHBondContact O-CG 3.49Å; S172-L176 PolarHBondContact O-N 3.47Å; S172-L176 VanDerWaalsContact O-N 3.16Å
173	E	43.5	Very low	45.5	Very low	168 Å²	168	117.9 Å²	117.9	79%	0.785	64%	0.644	S	S	*	*	H	α-helix	trans	-68.6	-31.1	-173.1	-70.5	-94.5	138.1	0	0	113.2	S177	E173-S177 VanDerWaalsContact O-CB 3.32Å; E173-S177 WeakPolarHBondContact O-CB 3.39Å; E173-S177 PolarHBondContact O-N 3.27Å; E173-S177 PolarHBondContact O-OG 2.89Å
174	G	52.1	Low	46.1	Very low	50 Å²	50	117.7 Å²	117.7	52%	0.515	63%	0.633	S	S	.	*	H	α-helix	trans	-78.8	-37	-178.9	0	0	0	0	0	114.4	S172 S177 S178	S172-G174 PolarHBondContact O-N 3.45Å; G174-S177 PolarHBondContact O-OG 3.04Å; G174-S178 PolarHBondContact O-N 3.41Å
175	V	50.6	Low	47.2	Very low	110 Å²	110	117.4 Å²	117.4	67%	0.667	63%	0.627	S	S	*	*	H	α-helix	trans	-81.3	-36.9	-178.1	-171.8	0	0	0	0	110.6	F179	V175-F179 VanDerWaalsContact O-CB 3.25Å; V175-F179 WeakPolarHBondContact O-CB 3.39Å; V175-F179 PolarHBondContact O-N 3.38Å
176	L	42.5	Very low	48	Very low	104 Å²	104	115.6 Å²	115.6	55%	0.545	61%	0.613	S	S	.	*	H	α-helix	trans	-73.1	-28.6	177.1	-66.7	176.1	0	0	0	113.1	S172 R180	S172-L176 VanDerWaalsContact O-CB 3.29Å; S172-L176 WeakPolarHBondContact O-CB 3.35Å; S172-L176 VanDerWaalsContact O-CG 3.23Å; S172-L176 WeakPolarHBondContact O-CG 3.49Å; S172-L176 PolarHBondContact O-N 3.47Å; S172-L176 VanDerWaalsContact O-N 3.16Å; L176-R180 WeakPolarHBondContact O-CB 3.37Å; L176-R180 PolarHBondContact O-N 3.24Å
177	S	51.3	Low	49	Very low	61 Å²	61	112.2 Å²	112.2	43%	0.427	60%	0.598	S	S	.	*	H	α-helix	trans	-70.3	-46.3	173.3	50	0	0	0	0	111.4	E173 G174 F179 R180 T181	E173-S177 VanDerWaalsContact O-CB 3.32Å; E173-S177 WeakPolarHBondContact O-CB 3.39Å; E173-S177 PolarHBondContact O-N 3.27Å; E173-S177 PolarHBondContact O-OG 2.89Å; G174-S177 PolarHBondContact O-OG 3.04Å; S177-F179 VanDerWaalsContact C-N 3.35Å; S177-F179 PolarHBondContact O-N 3.01Å; S177-R180 PolarHBondContact O-N 3.32Å; S177-T181 WeakPolarHBondContact O-CG2 3.37Å; S177-T181 PolarHBondContact O-N 2.91Å; S177-T181 PolarHBondContact O-OG1 3.26Å
178	S	48.8	Very low	49.3	Very low	74 Å²	74	114 Å²	114	52%	0.517	60%	0.597	S	S	.	*	H	α-helix	trans	-66	-35.7	177.5	-152.1	0	0	0	0	112.8	G174 T181 T182	G174-S178 PolarHBondContact O-N 3.41Å; S178-T181 PolarHBondContact O-OG1 3.12Å; S178-T182 WeakPolarHBondContact O-CB 3.29Å; S178-T182 PolarHBondContact O-N 3.25Å; S178-T182 PolarHBondContact O-OG1 2.84Å
179	F	49.7	Very low	50.6	Low	125 Å²	125	110.7 Å²	110.7	55%	0.548	58%	0.58	S	S	.	*	H	α-helix	trans	-68	-42.7	172	-176.6	-98.8	0	0	0	111.7	V175 S177 W183	V175-F179 VanDerWaalsContact O-CB 3.25Å; V175-F179 WeakPolarHBondContact O-CB 3.39Å; V175-F179 PolarHBondContact O-N 3.38Å; S177-F179 VanDerWaalsContact C-N 3.35Å; S177-F179 PolarHBondContact O-N 3.01Å; F179-W183 HydrophobicContact CE1-CE3 4.41Å; F179-W183 HydrophobicContact CE2-CE3 4.22Å; F179-W183 HydrophobicContact CZ-CD2 4.35Å; F179-W183 AromaticContact CZ-CE3 3.77Å; F179-W183 HydrophobicContact CZ-CE3 3.77Å; F179-W183 HydrophobicContact CZ-CZ3 4.2Å; F179-W183 WeakPolarHBondContact O-CB 3.31Å; F179-W183 PolarHBondContact O-N 3.26Å
180	R	57.6	Low	51.3	Low	170 Å²	170	108.6 Å²	108.6	64%	0.642	57%	0.569	S	S	*	*	H	α-helix	trans	-65.4	-41.1	179.6	177.9	-178.8	-66.4	-103.5	1.9	112.3	L176 S177 Q184	L176-R180 WeakPolarHBondContact O-CB 3.37Å; L176-R180 PolarHBondContact O-N 3.24Å; S177-R180 PolarHBondContact O-N 3.32Å; R180-Q184 VanDerWaalsContact CG-OE1 3.27Å; R180-Q184 VanDerWaalsContact O-CB 3.31Å; R180-Q184 WeakPolarHBondContact O-CB 3.38Å; R180-Q184 WeakPolarHBondContact O-CG 3.11Å; R180-Q184 PolarHBondContact O-N 3.44Å
181	T	58.1	Low	52.5	Low	80 Å²	80	102 Å²	102	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-65.7	-46.2	177.9	51.9	0	0	0	0	111.5	S177 S178 W183 Q184 E185	S177-T181 WeakPolarHBondContact O-CG2 3.37Å; S177-T181 PolarHBondContact O-N 2.91Å; S177-T181 PolarHBondContact O-OG1 3.26Å; S178-T181 PolarHBondContact O-OG1 3.12Å; T181-W183 VanDerWaalsContact C-N 3.34Å; T181-W183 PolarHBondContact O-N 2.95Å; T181-Q184 PolarHBondContact O-N 3.48Å; T181-E185 PolarHBondContact O-N 3.34Å
182	T	57.7	Low	53.6	Low	84 Å²	84	102.2 Å²	102.2	52%	0.515	54%	0.536	S	S	.	.	H	α-helix	trans	-67.5	-35.5	-179.6	-45.1	0	0	0	0	112	S178 F186	S178-T182 WeakPolarHBondContact O-CB 3.29Å; S178-T182 PolarHBondContact O-N 3.25Å; S178-T182 PolarHBondContact O-OG1 2.84Å; T182-F186 PolarHBondContact O-N 3.45Å
183	W	54.7	Low	54.8	Low	149 Å²	149	108.2 Å²	108.2	56%	0.564	55%	0.551	S	S	*	*	H	α-helix	trans	-74.2	-34	175.5	-164.1	-85.8	0	0	0	112.5	F179 T181 F186 V187	F179-W183 HydrophobicContact CE1-CE3 4.41Å; F179-W183 HydrophobicContact CE2-CE3 4.22Å; F179-W183 HydrophobicContact CZ-CD2 4.35Å; F179-W183 AromaticContact CZ-CE3 3.77Å; F179-W183 HydrophobicContact CZ-CE3 3.77Å; F179-W183 HydrophobicContact CZ-CZ3 4.2Å; F179-W183 WeakPolarHBondContact O-CB 3.31Å; F179-W183 PolarHBondContact O-N 3.26Å; T181-W183 VanDerWaalsContact C-N 3.34Å; T181-W183 PolarHBondContact O-N 2.95Å; W183-F186 PolarHBondContact O-N 3.27Å; W183-V187 HydrophobicContact CG-CG2 4.48Å; W183-V187 WeakPolarHBondContact O-CB 3.42Å; W183-V187 VanDerWaalsContact O-CG2 3.24Å; W183-V187 WeakPolarHBondContact O-CG2 3.37Å; W183-V187 PolarHBondContact O-N 2.93Å
184	Q	51.4	Low	56.4	Low	98 Å²	98	109.8 Å²	109.8	46%	0.458	55%	0.55	S	S	.	*	H	α-helix	trans	-67.3	-41.1	173.4	-84	-177.8	-95.4	0	0	112.1	R180 T181 F186 V187 E188	R180-Q184 VanDerWaalsContact CG-OE1 3.27Å; R180-Q184 VanDerWaalsContact O-CB 3.31Å; R180-Q184 WeakPolarHBondContact O-CB 3.38Å; R180-Q184 WeakPolarHBondContact O-CG 3.11Å; R180-Q184 PolarHBondContact O-N 3.44Å; T181-Q184 PolarHBondContact O-N 3.48Å; Q184-F186 VanDerWaalsContact C-N 3.32Å; Q184-F186 PolarHBondContact O-N 2.82Å; Q184-V187 PolarHBondContact O-N 3.04Å; Q184-E188 WeakPolarHBondContact O-CB 3.29Å; Q184-E188 WeakPolarHBondContact O-CG 3.36Å; Q184-E188 PolarHBondContact O-N 3.08Å
185	E	57.1	Low	57.5	Low	141 Å²	141	111.6 Å²	111.6	66%	0.659	55%	0.551	S	S	*	*	H	α-helix	trans	-60.5	-42.2	173.3	-75.2	-179.2	168.7	0	0	111.8	T181 D189	T181-E185 PolarHBondContact O-N 3.34Å; E185-D189 PolarHBondContact O-N 3.11Å
186	F	51.4	Low	59	Low	122 Å²	122	109.9 Å²	109.9	54%	0.535	54%	0.538	S	S	.	.	H	α-helix	trans	-66.6	-42.9	177.5	-178.2	-106.1	0	0	0	112.9	T182 W183 Q184 D189 L190	T182-F186 PolarHBondContact O-N 3.45Å; W183-F186 PolarHBondContact O-N 3.27Å; Q184-F186 VanDerWaalsContact C-N 3.32Å; Q184-F186 PolarHBondContact O-N 2.82Å; F186-D189 PolarHBondContact O-N 3.34Å; F186-L190 HydrophobicContact CD1-CD1 3.82Å; F186-L190 HydrophobicContact CD2-CD1 4.39Å; F186-L190 HydrophobicContact CE1-CD1 3.42Å; F186-L190 VanDerWaalsContact CE1-CD1 3.42Å; F186-L190 HydrophobicContact CE2-CD1 4.03Å; F186-L190 HydrophobicContact CG-CD1 4.3Å; F186-L190 HydrophobicContact CZ-CD1 3.54Å; F186-L190 WeakPolarHBondContact O-CD1 3.45Å; F186-L190 PolarHBondContact O-N 3.38Å
187	V	54.5	Low	60.9	Low	79 Å²	79	110.9 Å²	110.9	48%	0.479	54%	0.543	S	S	.	.	H	α-helix	trans	-72.8	-32.7	-178.7	170.2	0	0	0	0	112.3	W183 Q184 D189	W183-V187 HydrophobicContact CG-CG2 4.48Å; W183-V187 WeakPolarHBondContact O-CB 3.42Å; W183-V187 VanDerWaalsContact O-CG2 3.24Å; W183-V187 WeakPolarHBondContact O-CG2 3.37Å; W183-V187 PolarHBondContact O-N 2.93Å; Q184-V187 PolarHBondContact O-N 3.04Å; V187-D189 VanDerWaalsContact C-N 3.35Å
188	E	56.3	Low	62.5	Low	137 Å²	137	113.2 Å²	113.2	64%	0.64	55%	0.55	S	S	*	.	H	α-helix	trans	-67.8	-34.2	173.6	-74.4	-173.7	177.1	0	0	112	Q184 F192	Q184-E188 WeakPolarHBondContact O-CB 3.29Å; Q184-E188 WeakPolarHBondContact O-CG 3.36Å; Q184-E188 PolarHBondContact O-N 3.08Å; E188-F192 VanDerWaalsContact O-CB 3.24Å; E188-F192 WeakPolarHBondContact O-CB 3.33Å; E188-F192 PolarHBondContact O-N 3.18Å
189	D	56.3	Low	64.3	Low	87 Å²	87	114.6 Å²	114.6	47%	0.465	55%	0.551	S	S	.	*	H	α-helix	trans	-70.2	-35.7	179	-118.1	-15	0	0	0	113.4	E185 F186 V187 G191 F192 W193	E185-D189 PolarHBondContact O-N 3.11Å; F186-D189 PolarHBondContact O-N 3.34Å; V187-D189 VanDerWaalsContact C-N 3.35Å; D189-G191 VanDerWaalsContact C-N 3.31Å; D189-G191 PolarHBondContact O-N 3.43Å; D189-F192 PolarHBondContact O-N 3.04Å; D189-W193 PolarHBondContact O-N 2.96Å; D189-W193 PolarHBondContact OD1-NE1 2.84Å; D189-W193 VanDerWaalsContact OD1-NE1 3.11Å
190	L	58.3	Low	66.1	Low	104 Å²	104	112.3 Å²	112.3	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-69.3	-25.7	-179.9	-86.9	139.3	0	0	0	114	F186	F186-L190 HydrophobicContact CD1-CD1 3.82Å; F186-L190 HydrophobicContact CD2-CD1 4.39Å; F186-L190 HydrophobicContact CE1-CD1 3.42Å; F186-L190 VanDerWaalsContact CE1-CD1 3.42Å; F186-L190 HydrophobicContact CE2-CD1 4.03Å; F186-L190 HydrophobicContact CG-CD1 4.3Å; F186-L190 HydrophobicContact CZ-CD1 3.54Å; F186-L190 WeakPolarHBondContact O-CD1 3.45Å; F186-L190 PolarHBondContact O-N 3.38Å
191	G	65.6	Low	67.6	Low	41 Å²	41	107.7 Å²	107.7	42%	0.423	54%	0.538	S	S	.	.	H	α-helix	trans	-89.2	-38.2	173.3	0	0	0	0	0	113	D189 W193 R194 V195	D189-G191 VanDerWaalsContact C-N 3.31Å; D189-G191 PolarHBondContact O-N 3.43Å; G191-W193 PolarHBondContact O-N 3.06Å; G191-R194 PolarHBondContact O-N 2.87Å; G191-V195 WeakPolarHBondContact O-CG2 3.44Å; G191-V195 PolarHBondContact O-N 2.67Å
192	F	66.9	Low	69.1	Low	115 Å²	115	108 Å²	108	50%	0.504	54%	0.536	S	S	.	.	H	α-helix	trans	-60.3	-44.9	180	178.6	-104.3	0	0	0	112	E188 D189 R194 V195 L196	E188-F192 VanDerWaalsContact O-CB 3.24Å; E188-F192 WeakPolarHBondContact O-CB 3.33Å; E188-F192 PolarHBondContact O-N 3.18Å; D189-F192 PolarHBondContact O-N 3.04Å; F192-R194 VanDerWaalsContact C-N 3.32Å; F192-R194 PolarHBondContact O-N 3.31Å; F192-V195 PolarHBondContact O-N 2.76Å; F192-L196 HydrophobicContact CE1-CB 4.44Å; F192-L196 HydrophobicContact CE1-CD1 4.43Å; F192-L196 HydrophobicContact CE1-CD2 3.9Å; F192-L196 HydrophobicContact CE1-CG 4.49Å; F192-L196 HydrophobicContact CZ-CD1 4.13Å; F192-L196 HydrophobicContact CZ-CD2 4.42Å; F192-L196 WeakPolarHBondContact O-CB 3.33Å; F192-L196 PolarHBondContact O-N 2.98Å
193	W	67	Low	70.6	Confident	173 Å²	173	106.6 Å²	106.6	66%	0.655	53%	0.532	S	S	*	.	H	α-helix	trans	-67.3	-32.2	-176.9	-78.1	58.4	0	0	0	113.4	D189 G191 L197	D189-W193 PolarHBondContact O-N 2.96Å; D189-W193 PolarHBondContact OD1-NE1 2.84Å; D189-W193 VanDerWaalsContact OD1-NE1 3.11Å; G191-W193 PolarHBondContact O-N 3.06Å; W193-L197 VanDerWaalsContact O-CB 3.24Å; W193-L197 WeakPolarHBondContact O-CB 3.34Å; W193-L197 PolarHBondContact O-N 3.08Å
194	R	76.1	Confident	72.2	Confident	202 Å²	202	104.9 Å²	104.9	76%	0.762	53%	0.533	S	S	*	.	H	α-helix	trans	-69.7	-42.3	175.1	-69.7	-176.4	172.8	-137.7	-0.9	111.3	G191 F192 L198	G191-R194 PolarHBondContact O-N 2.87Å; F192-R194 VanDerWaalsContact C-N 3.32Å; F192-R194 PolarHBondContact O-N 3.31Å; R194-L198 WeakPolarHBondContact O-CB 3.46Å; R194-L198 PolarHBondContact O-N 2.65Å; R194-L198 VanDerWaalsContact O-N 3.1Å
195	V	76	Confident	73.9	Confident	87 Å²	87	105.4 Å²	105.4	53%	0.527	54%	0.539	S	S	.	.	H	α-helix	trans	-69.3	-40.6	176.2	176.6	0	0	0	0	110.8	G191 F192 L198 L199	G191-V195 WeakPolarHBondContact O-CG2 3.44Å; G191-V195 PolarHBondContact O-N 2.67Å; F192-V195 PolarHBondContact O-N 2.76Å; V195-L198 PolarHBondContact O-N 3.25Å; V195-L199 HydrophobicContact CG1-CD1 3.88Å; V195-L199 HydrophobicContact CG1-CG 4.2Å; V195-L199 WeakPolarHBondContact O-CB 3.13Å; V195-L199 VanDerWaalsContact O-CG 3.25Å; V195-L199 WeakPolarHBondContact O-CG 3.36Å; V195-L199 PolarHBondContact O-N 3.5Å
196	L	81.5	Confident	75.3	Confident	75 Å²	75	102 Å²	102	39%	0.393	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-47	176.5	-174.1	72.4	0	0	0	111.1	F192 L198 L199 V200	F192-L196 HydrophobicContact CE1-CB 4.44Å; F192-L196 HydrophobicContact CE1-CD1 4.43Å; F192-L196 HydrophobicContact CE1-CD2 3.9Å; F192-L196 HydrophobicContact CE1-CG 4.49Å; F192-L196 HydrophobicContact CZ-CD1 4.13Å; F192-L196 HydrophobicContact CZ-CD2 4.42Å; F192-L196 WeakPolarHBondContact O-CB 3.33Å; F192-L196 PolarHBondContact O-N 2.98Å; L196-L198 VanDerWaalsContact C-N 3.33Å; L196-L198 PolarHBondContact O-N 3.33Å; L196-L199 PolarHBondContact O-N 3.18Å; L196-V200 WeakPolarHBondContact O-CB 3.12Å; L196-V200 VanDerWaalsContact O-CG2 3.22Å; L196-V200 WeakPolarHBondContact O-CG2 3.5Å; L196-V200 PolarHBondContact O-N 2.93Å
197	L	82.5	Confident	77	Confident	125 Å²	125	101.7 Å²	101.7	65%	0.654	53%	0.534	S	S	*	.	H	α-helix	trans	-65.4	-38.5	178.8	-164.9	133.2	0	0	0	111.6	W193 V200 V201	W193-L197 VanDerWaalsContact O-CB 3.24Å; W193-L197 WeakPolarHBondContact O-CB 3.34Å; W193-L197 PolarHBondContact O-N 3.08Å; L197-V200 PolarHBondContact O-N 3.27Å; L197-V201 VanDerWaalsContact O-CG2 3.25Å; L197-V201 WeakPolarHBondContact O-CG2 3.37Å; L197-V201 PolarHBondContact O-N 3.04Å
198	L	85.3	Confident	78.4	Confident	109 Å²	109	99.9 Å²	99.9	57%	0.571	53%	0.531	S	S	*	.	H	α-helix	trans	-69.2	-40.2	176.8	-145.4	157.8	0	0	0	111.6	R194 V195 L196 V201 I202	R194-L198 WeakPolarHBondContact O-CB 3.46Å; R194-L198 PolarHBondContact O-N 2.65Å; R194-L198 VanDerWaalsContact O-N 3.1Å; V195-L198 PolarHBondContact O-N 3.25Å; L196-L198 VanDerWaalsContact C-N 3.33Å; L196-L198 PolarHBondContact O-N 3.33Å; L198-V201 PolarHBondContact O-N 3.39Å; L198-I202 HydrophobicContact CD2-CD1 3.48Å; L198-I202 VanDerWaalsContact CD2-CD1 3.48Å; L198-I202 HydrophobicContact CD2-CG1 4.13Å; L198-I202 VanDerWaalsContact O-CG1 3.29Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 3.08Å
199	L	85.4	Confident	79.5	Confident	104 Å²	104	98.6 Å²	98.6	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-65.9	-39.7	174	-74.3	176.1	0	0	0	112.3	V195 L196 V201 I202 A203	V195-L199 HydrophobicContact CG1-CD1 3.88Å; V195-L199 HydrophobicContact CG1-CG 4.2Å; V195-L199 WeakPolarHBondContact O-CB 3.13Å; V195-L199 VanDerWaalsContact O-CG 3.25Å; V195-L199 WeakPolarHBondContact O-CG 3.36Å; V195-L199 PolarHBondContact O-N 3.5Å; L196-L199 PolarHBondContact O-N 3.18Å; L199-V201 VanDerWaalsContact C-N 3.35Å; L199-I202 PolarHBondContact O-N 3.4Å; L199-A203 VanDerWaalsContact O-CB 3.31Å; L199-A203 WeakPolarHBondContact O-CB 3.5Å; L199-A203 PolarHBondContact O-N 3.07Å
200	V	88.8	Confident	80.5	Confident	77 Å²	77	96.8 Å²	96.8	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-43.4	174.4	167.7	0	0	0	0	110.7	L196 L197 A203 L204	L196-V200 WeakPolarHBondContact O-CB 3.12Å; L196-V200 VanDerWaalsContact O-CG2 3.22Å; L196-V200 WeakPolarHBondContact O-CG2 3.5Å; L196-V200 PolarHBondContact O-N 2.93Å; L197-V200 PolarHBondContact O-N 3.27Å; V200-A203 PolarHBondContact O-N 3.36Å; V200-L204 HydrophobicContact CG1-CD1 4.09Å; V200-L204 VanDerWaalsContact O-CG 3.3Å; V200-L204 WeakPolarHBondContact O-CG 3.32Å; V200-L204 PolarHBondContact O-N 3.21Å
201	V	88.6	Confident	81.6	Confident	72 Å²	72	98.7 Å²	98.7	44%	0.436	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-44.3	176.4	170.4	0	0	0	0	111.5	L197 L198 L199 L204 L205	L197-V201 VanDerWaalsContact O-CG2 3.25Å; L197-V201 WeakPolarHBondContact O-CG2 3.37Å; L197-V201 PolarHBondContact O-N 3.04Å; L198-V201 PolarHBondContact O-N 3.39Å; L199-V201 VanDerWaalsContact C-N 3.35Å; V201-L204 PolarHBondContact O-N 3.26Å; V201-L205 HydrophobicContact CG1-CD1 4.06Å; V201-L205 WeakPolarHBondContact O-CG 2.87Å; V201-L205 PolarHBondContact O-N 3.14Å
202	I	88.6	Confident	82.2	Confident	88 Å²	88	106.3 Å²	106.3	45%	0.451	54%	0.543	S	S	.	.	H	α-helix	trans	-63.3	-42.5	176.7	-68.6	166.7	0	0	0	110.9	L198 L199 L204 L205 S206	L198-I202 HydrophobicContact CD2-CD1 3.48Å; L198-I202 VanDerWaalsContact CD2-CD1 3.48Å; L198-I202 HydrophobicContact CD2-CG1 4.13Å; L198-I202 VanDerWaalsContact O-CG1 3.29Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 3.08Å; L199-I202 PolarHBondContact O-N 3.4Å; I202-L204 PolarHBondContact O-N 3.31Å; I202-L205 PolarHBondContact O-N 3.14Å; I202-S206 WeakPolarHBondContact O-CB 3.43Å; I202-S206 PolarHBondContact O-N 2.94Å; I202-S206 PolarHBondContact O-OG 3.42Å
203	A	90.6	Very high	82.6	Confident	53 Å²	53	106.3 Å²	106.3	44%	0.438	55%	0.552	S	S	.	*	H	α-helix	trans	-61	-45.6	178	0	0	0	0	0	111.3	L199 V200 L205 S206 L207	L199-A203 VanDerWaalsContact O-CB 3.31Å; L199-A203 WeakPolarHBondContact O-CB 3.5Å; L199-A203 PolarHBondContact O-N 3.07Å; V200-A203 PolarHBondContact O-N 3.36Å; A203-L205 PolarHBondContact O-N 3.15Å; A203-S206 PolarHBondContact O-N 3.37Å; A203-S206 PolarHBondContact O-OG 2.97Å; A203-L207 WeakPolarHBondContact O-CB 3.33Å; A203-L207 PolarHBondContact O-N 3.02Å
204	L	88.9	Confident	82.7	Confident	113 Å²	113	102.2 Å²	102.2	59%	0.592	55%	0.55	S	S	*	*	H	α-helix	trans	-64.4	-39.6	177.2	-69.7	173	0	0	0	112.6	V200 V201 I202 L207 G208	V200-L204 HydrophobicContact CG1-CD1 4.09Å; V200-L204 VanDerWaalsContact O-CG 3.3Å; V200-L204 WeakPolarHBondContact O-CG 3.32Å; V200-L204 PolarHBondContact O-N 3.21Å; V201-L204 PolarHBondContact O-N 3.26Å; I202-L204 PolarHBondContact O-N 3.31Å; L204-L207 PolarHBondContact O-N 3.42Å; L204-G208 PolarHBondContact O-N 3.34Å
205	L	86.3	Confident	82.1	Confident	110 Å²	110	95.4 Å²	95.4	58%	0.576	54%	0.543	S	S	*	.	H	α-helix	trans	-64.7	-44.5	174.5	-74.3	170.2	0	0	0	111.5	V201 I202 A203 L207 G208 I209	V201-L205 HydrophobicContact CG1-CD1 4.06Å; V201-L205 WeakPolarHBondContact O-CG 2.87Å; V201-L205 PolarHBondContact O-N 3.14Å; I202-L205 PolarHBondContact O-N 3.14Å; A203-L205 PolarHBondContact O-N 3.15Å; L205-L207 VanDerWaalsContact C-N 3.33Å; L205-L207 PolarHBondContact O-N 3.48Å; L205-G208 PolarHBondContact O-N 3.18Å; L205-I209 WeakPolarHBondContact O-CD1 3.28Å; L205-I209 VanDerWaalsContact O-CG1 3.22Å; L205-I209 WeakPolarHBondContact O-CG1 3.32Å; L205-I209 PolarHBondContact O-N 3.4Å
206	S	87	Confident	81.3	Confident	68 Å²	68	95.4 Å²	95.4	48%	0.476	54%	0.543	S	S	.	.	H	α-helix	trans	-63.6	-38.7	177.3	73.9	0	0	0	0	112.3	I202 A203 I209 A210	I202-S206 WeakPolarHBondContact O-CB 3.43Å; I202-S206 PolarHBondContact O-N 2.94Å; I202-S206 PolarHBondContact O-OG 3.42Å; A203-S206 PolarHBondContact O-N 3.37Å; A203-S206 PolarHBondContact O-OG 2.97Å; S206-I209 PolarHBondContact O-N 3.46Å; S206-A210 WeakPolarHBondContact O-CB 3.43Å; S206-A210 PolarHBondContact O-N 3.44Å
207	L	85.9	Confident	79.7	Confident	116 Å²	116	98.4 Å²	98.4	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-68.9	-39.6	177.1	-170	66	0	0	0	111.2	A203 L204 L205 A210 Y211	A203-L207 WeakPolarHBondContact O-CB 3.33Å; A203-L207 PolarHBondContact O-N 3.02Å; L204-L207 PolarHBondContact O-N 3.42Å; L205-L207 VanDerWaalsContact C-N 3.33Å; L205-L207 PolarHBondContact O-N 3.48Å; L207-A210 PolarHBondContact O-N 2.84Å; L207-Y211 VanDerWaalsContact O-CB 3.24Å; L207-Y211 WeakPolarHBondContact O-CB 3.44Å; L207-Y211 PolarHBondContact O-N 2.73Å
208	G	84	Confident	78.1	Confident	42 Å²	42	98.2 Å²	98.2	43%	0.433	57%	0.565	S	S	.	*	H	α-helix	trans	-63.2	-41.7	174	0	0	0	0	0	112.7	L204 L205 Y211 Y212	L204-G208 PolarHBondContact O-N 3.34Å; L205-G208 PolarHBondContact O-N 3.18Å; G208-Y211 PolarHBondContact O-N 3.1Å; G208-Y212 VanDerWaalsContact O-CB 3.31Å; G208-Y212 WeakPolarHBondContact O-CB 3.28Å; G208-Y212 PolarHBondContact O-N 3.44Å
209	I	80.3	Confident	76.1	Confident	109 Å²	109	102.2 Å²	102.2	56%	0.559	58%	0.578	S	S	*	*	H	α-helix	trans	-67.3	-43.9	175.6	-63.6	158.7	0	0	0	110.5	L205 S206 Y211 Y212 V213	L205-I209 WeakPolarHBondContact O-CD1 3.28Å; L205-I209 VanDerWaalsContact O-CG1 3.22Å; L205-I209 WeakPolarHBondContact O-CG1 3.32Å; L205-I209 PolarHBondContact O-N 3.4Å; S206-I209 PolarHBondContact O-N 3.46Å; I209-Y211 VanDerWaalsContact C-N 3.31Å; I209-Y211 PolarHBondContact O-N 3.17Å; I209-Y212 PolarHBondContact O-N 3.21Å; I209-V213 HydrophobicContact CG2-CG2 4.3Å; I209-V213 WeakPolarHBondContact O-CB 3.32Å; I209-V213 VanDerWaalsContact O-CG2 3.29Å; I209-V213 WeakPolarHBondContact O-CG2 3.22Å; I209-V213 PolarHBondContact O-N 3.03Å
210	A	77.2	Confident	74.2	Confident	50 Å²	50	102.1 Å²	102.1	41%	0.413	59%	0.586	S	S	.	*	H	α-helix	trans	-61.6	-39.7	175.7	0	0	0	0	0	111.9	S206 L207 S214	S206-A210 WeakPolarHBondContact O-CB 3.43Å; S206-A210 PolarHBondContact O-N 3.44Å; L207-A210 PolarHBondContact O-N 2.84Å; A210-S214 VanDerWaalsContact O-CB 3.24Å; A210-S214 WeakPolarHBondContact O-CB 3.45Å; A210-S214 PolarHBondContact O-N 3.26Å; A210-S214 PolarHBondContact O-OG 3.46Å
211	Y	81	Confident	72.2	Confident	144 Å²	144	103.4 Å²	103.4	57%	0.565	60%	0.598	S	S	*	*	H	α-helix	trans	-67.1	-39.8	175.9	-167.1	-91.2	0	0	0	112	L207 G208 I209 S214	L207-Y211 VanDerWaalsContact O-CB 3.24Å; L207-Y211 WeakPolarHBondContact O-CB 3.44Å; L207-Y211 PolarHBondContact O-N 2.73Å; G208-Y211 PolarHBondContact O-N 3.1Å; I209-Y211 VanDerWaalsContact C-N 3.31Å; I209-Y211 PolarHBondContact O-N 3.17Å; Y211-S214 PolarHBondContact O-N 3.09Å
212	Y	77.6	Confident	70	Confident	201 Å²	201	104.7 Å²	104.7	79%	0.788	61%	0.611	S	S	*	*	H	α-helix	trans	-64.4	-45	174.9	-179.5	-99.9	0	0	0	112.3	G208 I209 G215	G208-Y212 VanDerWaalsContact O-CB 3.31Å; G208-Y212 WeakPolarHBondContact O-CB 3.28Å; G208-Y212 PolarHBondContact O-N 3.44Å; I209-Y212 PolarHBondContact O-N 3.21Å; Y212-G215 PolarHBondContact O-N 2.92Å
213	V	75.8	Confident	67.9	Low	114 Å²	114	108.8 Å²	108.8	69%	0.691	63%	0.628	S	S	*	*	H	α-helix	trans	-71.8	-29.8	179.2	173.8	0	0	0	0	112	I209 G215	I209-V213 HydrophobicContact CG2-CG2 4.3Å; I209-V213 WeakPolarHBondContact O-CB 3.32Å; I209-V213 VanDerWaalsContact O-CG2 3.29Å; I209-V213 WeakPolarHBondContact O-CG2 3.22Å; I209-V213 PolarHBondContact O-N 3.03Å; V213-G215 PolarHBondContact O-N 3.01Å
214	S	69.4	Low	65.9	Low	88 Å²	88	113.6 Å²	113.6	62%	0.615	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	0.1	177.5	-59	0	0	0	0	114	A210 Y211 V216	A210-S214 VanDerWaalsContact O-CB 3.24Å; A210-S214 WeakPolarHBondContact O-CB 3.45Å; A210-S214 PolarHBondContact O-N 3.26Å; A210-S214 PolarHBondContact O-OG 3.46Å; Y211-S214 PolarHBondContact O-N 3.09Å; S214-V216 PolarHBondContact O-N 2.97Å
215	G	63.7	Low	63.9	Low	58 Å²	58	116.8 Å²	116.8	60%	0.598	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.7	21.8	164.5	0	0	0	0	0	116.2	Y212 V213 L217	Y212-G215 PolarHBondContact O-N 2.92Å; V213-G215 PolarHBondContact O-N 3.01Å; G215-L217 PolarHBondContact O-N 3.05Å
216	V	59.3	Low	62.2	Low	87 Å²	87	119.2 Å²	119.2	53%	0.527	67%	0.67	S	S	.	*			trans	-88.1	56	-180	-166.9	0	0	0	0	111.4	S214	S214-V216 PolarHBondContact O-N 2.97Å
217	L	47.5	Very low	60.6	Low	138 Å²	138	121.6 Å²	121.6	72%	0.723	68%	0.681	S	S	*	*	S	Bend	trans	-127.8	124.1	152.9	-87.7	168.2	0	0	0	106.9	G215 F219	G215-L217 PolarHBondContact O-N 3.05Å; L217-F219 PolarHBondContact O-N 2.93Å
218	P	48.2	Very low	58.9	Low	122 Å²	122	127.6 Å²	127.6	79%	0.792	71%	0.706	S	S	*	*			trans	-66.1	104.1	171.9	27.6	-30.1	0	0	0	107.6	S220	P218-S220 VanDerWaalsContact C-N 3.25Å; P218-S220 PolarHBondContact O-N 2.94Å
219	F	44.7	Very low	57.7	Low	193 Å²	193	131.9 Å²	131.9	85%	0.846	72%	0.719	S	S	*	*			trans	-61.1	96.8	158.3	-92.4	-90.1	0	0	0	106.7	L217 S221	L217-F219 PolarHBondContact O-N 2.93Å; F219-S221 PolarHBondContact O-N 3.42Å; F219-S221 PolarHBondContact O-OG 2.99Å
220	S	45.3	Very low	56.5	Low	102 Å²	102	133.1 Å²	133.1	71%	0.713	73%	0.728	S	S	*	*			trans	-61.8	88.1	160.7	174.3	0	0	0	0	107.2	P218 S222	P218-S220 VanDerWaalsContact C-N 3.25Å; P218-S220 PolarHBondContact O-N 2.94Å; S220-S222 PolarHBondContact O-N 3.33Å; S220-S222 PolarHBondContact OG-OG 3.27Å
221	S	45.7	Very low	55.3	Low	103 Å²	103	137.7 Å²	137.7	72%	0.72	75%	0.745	S	S	*	*			trans	-72.7	82.3	166.6	28.1	0	0	0	0	107.3	F219 Q223	F219-S221 PolarHBondContact O-N 3.42Å; F219-S221 PolarHBondContact O-OG 2.99Å; S221-Q223 PolarHBondContact O-N 3.41Å
222	S	43.4	Very low	53.8	Low	100 Å²	100	137.3 Å²	137.3	70%	0.699	76%	0.756	S	S	*	*			trans	-75.3	75.7	164	-48.9	0	0	0	0	107.8	S220 L224	S220-S222 PolarHBondContact O-N 3.33Å; S220-S222 PolarHBondContact OG-OG 3.27Å; S222-L224 PolarHBondContact O-N 3.15Å
223	Q	45	Very low	52.3	Low	174 Å²	174	133.3 Å²	133.3	81%	0.813	75%	0.754	S	S	*	*			trans	-63.3	126.1	164.1	-80.7	-150.3	-22.8	0	0	108.5	S221 E225	S221-Q223 PolarHBondContact O-N 3.41Å; Q223-E225 PolarHBondContact O-N 2.97Å
224	L	47.6	Very low	50.8	Low	153 Å²	153	134.6 Å²	134.6	80%	0.801	76%	0.758	S	S	*	*			trans	-63.8	109	159.9	-92.4	95.9	0	0	0	108.1	S222 L226	S222-L224 PolarHBondContact O-N 3.15Å; L224-L226 PolarHBondContact O-N 2.94Å
225	E	48.2	Very low	49.4	Very low	181 Å²	181	137.9 Å²	137.9	85%	0.846	77%	0.768	S	S	*	*			trans	-70	107.1	156.9	-79.6	-172.3	153.7	0	0	108.5	Q223	Q223-E225 PolarHBondContact O-N 2.97Å
226	L	50.5	Low	48.3	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	78%	0.781	S	S	*	*			trans	-88	100.8	161.5	-90.6	157	0	0	0	107.7	L224	L224-L226 PolarHBondContact O-N 2.94Å
227	V	52.9	Low	47.4	Very low	118 Å²	118	148.8 Å²	148.8	72%	0.715	80%	0.802	S	S	*	*			trans	-95.6	98.1	159.1	176.7	0	0	0	0	107
228	H	50.2	Low	47.4	Very low	242 Å²	242	149.8 Å²	149.8	100%	1.12	81%	0.81	S	S	*	*				-178.2	0	110.1	-128.3	-60.5	0	0	0	112.1

Retrieved 228 of 228 residues in 172.9 ms (Link to these results)

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