A0A077ZKL4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKL4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 244 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	38.5	Very low	139 Å²	139	85.6 Å²	85.6	69%	0.685	43%	0.431	S	S	*	.				0	116.8	0	-168.9	172.4	-124.1	0	0	105.2	D5 I6 L9 I49	M1-D5 HydrophobicContact CE-CB 4.34Å; M1-D5 HydrophobicContact CG-CB 3.61Å; M1-D5 HydrophobicContact SD-CB 4.49Å; M1-I6 HydrophobicContact CG-CG1 4.21Å; M1-I6 HydrophobicContact SD-CG1 4.18Å; M1-L9 HydrophobicContact CE-CD1 3.38Å; M1-L9 HydrophobicContact SD-CD1 3.95Å; M1-I49 HydrophobicContact SD-CD1 3.73Å
2	D	38.1	Very low	38.6	Very low	119 Å²	119	90.6 Å²	90.6	64%	0.636	45%	0.448	S	S	*	.			trans	-81.3	154.7	-172	-68.4	-30	0	0	0	109.6	P4 D5 I6	D2-P4 VanDerWaalsContact C-N 3.25Å; D2-P4 VanDerWaalsContact O-N 3.15Å; D2-D5 PolarHBondContact N-OD2 3.47Å; D2-D5 WeakPolarHBondContact O-CA 3.36Å; D2-D5 VanDerWaalsContact O-CB 3.3Å; D2-D5 WeakPolarHBondContact O-CB 3.44Å; D2-D5 PolarHBondContact O-N 2.73Å; D2-I6 PolarHBondContact O-N 3.02Å
3	W	36.9	Very low	38.6	Very low	143 Å²	143	84.8 Å²	84.8	54%	0.542	42%	0.421	S	S	.	.	H	α-helix	trans	-51.4	-34.8	-178	-158.1	-130.3	0	0	0	115	D5 I6 M7 I57	W3-D5 VanDerWaalsContact C-N 3.32Å; W3-D5 PolarHBondContact O-N 3.08Å; W3-I6 HydrophobicContact CE3-CB 4.2Å; W3-I6 HydrophobicContact CE3-CD1 3.82Å; W3-I6 HydrophobicContact CE3-CG2 4.35Å; W3-I6 HydrophobicContact CZ3-CB 4.29Å; W3-I6 HydrophobicContact CZ3-CD1 3.85Å; W3-I6 HydrophobicContact CZ3-CG2 3.95Å; W3-I6 PolarHBondContact O-N 3.02Å; W3-M7 PolarHBondContact O-N 2.72Å; W3-I57 HydrophobicContact CH2-CD1 4.2Å; W3-I57 HydrophobicContact CH2-CG1 3.89Å; W3-I57 HydrophobicContact CZ3-CD1 4.27Å; W3-I57 HydrophobicContact CZ3-CG1 4.29Å
4	P	37.8	Very low	38.4	Very low	85 Å²	85	83.4 Å²	83.4	55%	0.552	42%	0.416	S	S	*	.	H	α-helix	trans	-60.5	-37.6	171.1	-23.6	35.5	0	0	0	113.5	D2 M7 V8	D2-P4 VanDerWaalsContact C-N 3.25Å; D2-P4 VanDerWaalsContact O-N 3.15Å; P4-M7 PolarHBondContact O-N 2.68Å; P4-V8 VanDerWaalsContact O-CG2 3.31Å; P4-V8 WeakPolarHBondContact O-CG2 3.24Å; P4-V8 PolarHBondContact O-N 3.1Å
5	D	37.4	Very low	38.6	Very low	75 Å²	75	84.1 Å²	84.1	40%	0.401	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-39.7	-179.5	-57.4	-36	0	0	0	111.1	M1 D2 W3 M7 V8 L9	M1-D5 HydrophobicContact CE-CB 4.34Å; M1-D5 HydrophobicContact CG-CB 3.61Å; M1-D5 HydrophobicContact SD-CB 4.49Å; D2-D5 PolarHBondContact N-OD2 3.47Å; D2-D5 WeakPolarHBondContact O-CA 3.36Å; D2-D5 VanDerWaalsContact O-CB 3.3Å; D2-D5 WeakPolarHBondContact O-CB 3.44Å; D2-D5 PolarHBondContact O-N 2.73Å; W3-D5 VanDerWaalsContact C-N 3.32Å; W3-D5 PolarHBondContact O-N 3.08Å; D5-M7 VanDerWaalsContact C-N 3.35Å; D5-V8 PolarHBondContact O-N 2.83Å; D5-L9 WeakPolarHBondContact O-CB 3.5Å; D5-L9 PolarHBondContact O-N 2.74Å
6	I	36.8	Very low	38.7	Very low	22 Å²	22	84.1 Å²	84.1	11%	0.113	42%	0.423	C	S	.	.	H	α-helix	trans	-64.7	-42	174.5	-65	174.4	0	0	0	109.9	M1 D2 W3 V8 L9 V10 I49	M1-I6 HydrophobicContact CG-CG1 4.21Å; M1-I6 HydrophobicContact SD-CG1 4.18Å; D2-I6 PolarHBondContact O-N 3.02Å; W3-I6 HydrophobicContact CE3-CB 4.2Å; W3-I6 HydrophobicContact CE3-CD1 3.82Å; W3-I6 HydrophobicContact CE3-CG2 4.35Å; W3-I6 HydrophobicContact CZ3-CB 4.29Å; W3-I6 HydrophobicContact CZ3-CD1 3.85Å; W3-I6 HydrophobicContact CZ3-CG2 3.95Å; W3-I6 PolarHBondContact O-N 3.02Å; I6-V8 PolarHBondContact O-N 3.21Å; I6-L9 PolarHBondContact O-N 2.94Å; I6-V10 HydrophobicContact CG2-CG2 4.32Å; I6-V10 WeakPolarHBondContact O-CB 3.31Å; I6-V10 VanDerWaalsContact O-CG2 3.27Å; I6-V10 WeakPolarHBondContact O-CG2 3.42Å; I6-V10 PolarHBondContact O-N 3.12Å; I6-I49 HydrophobicContact CD1-CG2 3.88Å; I6-I49 HydrophobicContact CG1-CG2 4.16Å
7	M	37.3	Very low	38.7	Very low	83 Å²	83	80 Å²	80	41%	0.409	40%	0.402	S	S	.	.	H	α-helix	trans	-66.2	-35.6	176.6	-82.3	-93.6	69.5	0	0	113.2	W3 P4 D5 V10 K11	W3-M7 PolarHBondContact O-N 2.72Å; P4-M7 PolarHBondContact O-N 2.68Å; D5-M7 VanDerWaalsContact C-N 3.35Å; M7-V10 HydrophobicContact CE-CB 4.06Å; M7-V10 HydrophobicContact CE-CG1 3.99Å; M7-K11 WeakPolarHBondContact O-CB 3.46Å; M7-K11 VanDerWaalsContact O-CG 3.3Å; M7-K11 WeakPolarHBondContact O-CG 3.47Å; M7-K11 PolarHBondContact O-N 3.46Å
8	V	43	Very low	38.5	Very low	88 Å²	88	83.4 Å²	83.4	53%	0.533	42%	0.421	S	S	.	.	H	α-helix	trans	-65.2	-44.8	173.1	168.7	0	0	0	0	110.3	P4 D5 I6 K11 F12	P4-V8 VanDerWaalsContact O-CG2 3.31Å; P4-V8 WeakPolarHBondContact O-CG2 3.24Å; P4-V8 PolarHBondContact O-N 3.1Å; D5-V8 PolarHBondContact O-N 2.83Å; I6-V8 PolarHBondContact O-N 3.21Å; V8-K11 PolarHBondContact O-N 2.57Å; V8-F12 WeakPolarHBondContact O-CB 3.45Å; V8-F12 PolarHBondContact O-N 3.26Å
9	L	37.1	Very low	38.4	Very low	40 Å²	40	85.8 Å²	85.8	21%	0.209	44%	0.435	C	S	.	.	H	α-helix	trans	-64	-40.7	176.7	-97.7	161.6	0	0	0	112.8	M1 D5 I6 F12 S13 L46	M1-L9 HydrophobicContact CE-CD1 3.38Å; M1-L9 HydrophobicContact SD-CD1 3.95Å; D5-L9 WeakPolarHBondContact O-CB 3.5Å; D5-L9 PolarHBondContact O-N 2.74Å; I6-L9 PolarHBondContact O-N 2.94Å; L9-F12 PolarHBondContact O-N 3.24Å; L9-S13 WeakPolarHBondContact O-CB 3.42Å; L9-S13 PolarHBondContact O-N 3.15Å; L9-S13 PolarHBondContact O-OG 2.86Å; L9-L46 HydrophobicContact CB-CD1 3.51Å; L9-L46 HydrophobicContact CD2-CD1 4.23Å; L9-L46 HydrophobicContact CG-CD1 4.39Å
10	V	37.6	Very low	38.3	Very low	8 Å²	8	83.7 Å²	83.7	5%	0.048	43%	0.425	C	S	.	.	H	α-helix	trans	-66.3	-40.1	173.6	170	0	0	0	0	110.9	I6 M7 S13 L14 L46 V64	I6-V10 HydrophobicContact CG2-CG2 4.32Å; I6-V10 WeakPolarHBondContact O-CB 3.31Å; I6-V10 VanDerWaalsContact O-CG2 3.27Å; I6-V10 WeakPolarHBondContact O-CG2 3.42Å; I6-V10 PolarHBondContact O-N 3.12Å; M7-V10 HydrophobicContact CE-CB 4.06Å; M7-V10 HydrophobicContact CE-CG1 3.99Å; V10-S13 PolarHBondContact O-N 3.33Å; V10-L14 HydrophobicContact CG1-CD1 4.04Å; V10-L14 WeakPolarHBondContact O-CB 3.31Å; V10-L14 WeakPolarHBondContact O-CG 3.5Å; V10-L14 PolarHBondContact O-N 3.35Å; V10-L46 HydrophobicContact CG2-CD1 4.07Å; V10-V64 HydrophobicContact CG1-CG1 4.2Å
11	K	41.7	Very low	38.2	Very low	140 Å²	140	84.1 Å²	84.1	61%	0.609	42%	0.424	S	S	*	.	H	α-helix	trans	-64.4	-41.4	173.5	-80.9	179.1	177.6	-178.3	0	112.2	M7 V8 S13 L14 V15	M7-K11 WeakPolarHBondContact O-CB 3.46Å; M7-K11 VanDerWaalsContact O-CG 3.3Å; M7-K11 WeakPolarHBondContact O-CG 3.47Å; M7-K11 PolarHBondContact O-N 3.46Å; V8-K11 PolarHBondContact O-N 2.57Å; K11-S13 VanDerWaalsContact C-N 3.28Å; K11-S13 PolarHBondContact O-N 2.91Å; K11-L14 WeakPolarHBondContact O-CB 3.33Å; K11-L14 PolarHBondContact O-N 2.91Å; K11-V15 WeakPolarHBondContact O-CG2 3.22Å; K11-V15 PolarHBondContact O-N 3.43Å
12	F	39.2	Very low	38	Very low	145 Å²	145	82.6 Å²	82.6	64%	0.636	43%	0.425	S	S	*	.	H	α-helix	trans	-62.1	-41.3	175.8	-133.4	-86.8	0	0	0	110.9	V8 L9 V15 F16	V8-F12 WeakPolarHBondContact O-CB 3.45Å; V8-F12 PolarHBondContact O-N 3.26Å; L9-F12 PolarHBondContact O-N 3.24Å; F12-V15 PolarHBondContact O-N 3.22Å; F12-F16 PolarHBondContact O-N 3.26Å
13	S	39.3	Very low	37.8	Very low	15 Å²	15	83.2 Å²	83.2	11%	0.105	43%	0.428	C	S	.	.	H	α-helix	trans	-68.1	-37.6	176.5	-52.7	0	0	0	0	111.7	L9 V10 K11 F16 L17 L46 S68	L9-S13 WeakPolarHBondContact O-CB 3.42Å; L9-S13 PolarHBondContact O-N 3.15Å; L9-S13 PolarHBondContact O-OG 2.86Å; V10-S13 PolarHBondContact O-N 3.33Å; K11-S13 VanDerWaalsContact C-N 3.28Å; K11-S13 PolarHBondContact O-N 2.91Å; S13-F16 CarbonylContact O-C 3.5Å; S13-F16 PolarHBondContact O-N 3.18Å; S13-L17 VanDerWaalsContact O-CB 3.29Å; S13-L17 WeakPolarHBondContact O-CB 3.45Å; S13-L17 WeakPolarHBondContact O-CG 3.29Å; S13-L17 PolarHBondContact O-N 3.4Å; S13-L46 WeakPolarHBondContact OG-CD2 3.3Å; S13-S68 WeakPolarHBondContact CB-OG 3.42Å
14	L	35	Very low	37.5	Very low	65 Å²	65	83.9 Å²	83.9	34%	0.34	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-40.5	172.5	-85.6	160.6	0	0	0	112.7	V10 K11 F16 L17 L18 V64	V10-L14 HydrophobicContact CG1-CD1 4.04Å; V10-L14 WeakPolarHBondContact O-CB 3.31Å; V10-L14 WeakPolarHBondContact O-CG 3.5Å; V10-L14 PolarHBondContact O-N 3.35Å; K11-L14 WeakPolarHBondContact O-CB 3.33Å; K11-L14 PolarHBondContact O-N 2.91Å; L14-F16 VanDerWaalsContact C-N 3.34Å; L14-L17 PolarHBondContact O-N 2.93Å; L14-L18 WeakPolarHBondContact O-CB 3.41Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.22Å; L14-V64 HydrophobicContact CD1-CG1 4.49Å; L14-V64 HydrophobicContact CD2-CG1 4.07Å; L14-V64 HydrophobicContact CD2-CG2 4.21Å; L14-V64 HydrophobicContact CG-CG1 3.85Å
15	V	41.6	Very low	37	Very low	94 Å²	94	87.4 Å²	87.4	57%	0.57	46%	0.456	S	S	*	.	H	α-helix	trans	-62.3	-44.3	174.3	171.7	0	0	0	0	110.1	K11 F12 L17 L18	K11-V15 WeakPolarHBondContact O-CG2 3.22Å; K11-V15 PolarHBondContact O-N 3.43Å; F12-V15 PolarHBondContact O-N 3.22Å; V15-L17 VanDerWaalsContact C-N 3.27Å; V15-L17 PolarHBondContact O-N 2.88Å; V15-L18 PolarHBondContact O-N 3.09Å
16	F	40.3	Very low	36.7	Very low	85 Å²	85	89.5 Å²	89.5	37%	0.373	47%	0.472	S	S	.	.	H	α-helix	trans	-65.6	-29	174.8	-131.7	-85.7	0	0	0	113.7	F12 S13 L14 T33 L39 K71	F12-F16 PolarHBondContact O-N 3.26Å; S13-F16 CarbonylContact O-C 3.5Å; S13-F16 PolarHBondContact O-N 3.18Å; L14-F16 VanDerWaalsContact C-N 3.34Å; F16-T33 HydrophobicContact CE1-CG2 4.24Å; F16-L39 HydrophobicContact CD1-CD2 4.49Å; F16-L39 HydrophobicContact CD2-CD2 3.73Å; F16-L39 HydrophobicContact CE1-CD1 3.82Å; F16-L39 HydrophobicContact CE1-CD2 4.14Å; F16-L39 HydrophobicContact CE2-CD1 3.62Å; F16-L39 HydrophobicContact CE2-CD2 3.32Å; F16-L39 HydrophobicContact CE2-CG 4.16Å; F16-L39 HydrophobicContact CG-CD2 4.33Å; F16-L39 HydrophobicContact CZ-CD1 3.1Å; F16-L39 HydrophobicContact CZ-CD2 3.59Å; F16-L39 HydrophobicContact CZ-CG 4Å; F16-K71 PolarHBondContact O-NZ 2.96Å
17	L	39.3	Very low	36.2	Very low	14 Å²	14	94.4 Å²	94.4	7%	0.073	51%	0.507	C	S	.	.	H	α-helix	trans	-77.8	-34.6	178.9	-80	173.6	0	0	0	113.1	S13 L14 V15 V64 L67 S68 K71	S13-L17 VanDerWaalsContact O-CB 3.29Å; S13-L17 WeakPolarHBondContact O-CB 3.45Å; S13-L17 WeakPolarHBondContact O-CG 3.29Å; S13-L17 PolarHBondContact O-N 3.4Å; L14-L17 PolarHBondContact O-N 2.93Å; V15-L17 VanDerWaalsContact C-N 3.27Å; V15-L17 PolarHBondContact O-N 2.88Å; L17-V64 HydrophobicContact CD1-CG1 3.82Å; L17-V64 WeakPolarHBondContact CD1-O 3.4Å; L17-L67 HydrophobicContact CD1-CB 4.14Å; L17-L67 HydrophobicContact CD1-CD2 4.05Å; L17-L67 HydrophobicContact CD1-CG 4.35Å; L17-L67 HydrophobicContact CD2-CB 3.92Å; L17-L67 HydrophobicContact CD2-CD2 3.67Å; L17-L67 HydrophobicContact CD2-CG 3.48Å; L17-L67 VanDerWaalsContact CD2-CG 3.48Å; L17-L67 HydrophobicContact CG-CD2 4.37Å; L17-S68 WeakPolarHBondContact CD1-OG 3.4Å; L17-K71 VanDerWaalsContact C-NZ 3.27Å; L17-K71 VanDerWaalsContact CA-NZ 3.32Å; L17-K71 HydrophobicContact CD2-CD 3.81Å; L17-K71 HydrophobicContact CD2-CG 4.02Å; L17-K71 WeakPolarHBondContact O-CE 3.3Å; L17-K71 PolarHBondContact O-NZ 3.04Å
18	L	34.8	Very low	35.7	Very low	142 Å²	142	93.7 Å²	93.7	74%	0.743	52%	0.521	S	S	*	.	H	α-helix	trans	-78.1	-22.8	-175.2	-73.8	167.3	0	0	0	113.9	L14 V15	L14-L18 WeakPolarHBondContact O-CB 3.41Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.22Å; V15-L18 PolarHBondContact O-N 3.09Å
19	D	36.2	Very low	35.1	Very low	129 Å²	129	94.8 Å²	94.8	69%	0.69	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-13.4	-179.7	-86.9	-14.1	0	0	0	114.6
20	D	37.3	Very low	34.9	Very low	42 Å²	42	100.7 Å²	100.7	23%	0.225	56%	0.555	C	S	.	*			trans	-157.6	46.2	-162.5	-117.9	-6.4	0	0	0	116.1	T33 K71	D20-T33 WeakPolarHBondContact OD2-CB 3.44Å; D20-T33 WeakPolarHBondContact OD2-CG2 3.41Å; D20-T33 PolarHBondContact OD2-OG1 3.38Å; D20-K71 VanDerWaalsContact CA-NZ 3.32Å; D20-K71 WeakPolarHBondContact O-CE 3.41Å; D20-K71 PolarHBondContact O-NZ 3.15Å
21	F	35.8	Very low	35	Very low	93 Å²	93	105.2 Å²	105.2	41%	0.408	58%	0.578	S	S	.	*			trans	-101.3	117.6	160	-125.1	-84.6	0	0	0	106	D23 L67 K71	F21-D23 PolarHBondContact O-N 3.38Å; F21-L67 HydrophobicContact CD2-CD1 4.12Å; F21-L67 HydrophobicContact CD2-CD2 4.31Å; F21-L67 HydrophobicContact CD2-CG 4.26Å; F21-L67 HydrophobicContact CE1-CD1 4.49Å; F21-L67 HydrophobicContact CE2-CD1 3.21Å; F21-L67 HydrophobicContact CE2-CD2 4.17Å; F21-L67 HydrophobicContact CE2-CG 3.65Å; F21-L67 HydrophobicContact CZ-CD1 3.44Å; F21-L67 VanDerWaalsContact CZ-CD1 3.44Å; F21-L67 HydrophobicContact CZ-CG 4.37Å; F21-K71 HydrophobicContact CD2-CD 4.37Å; F21-K71 HydrophobicContact CD2-CG 4.25Å; F21-K71 HydrophobicContact CE2-CG 3.9Å
22	P	35.5	Very low	35.2	Very low	108 Å²	108	106.5 Å²	106.5	70%	0.701	58%	0.584	S	S	*	*			trans	-67.9	92.6	169.3	27.3	-28.7	0	0	0	105.9	N24	P22-N24 PolarHBondContact O-N 3.37Å
23	D	33.5	Very low	35.9	Very low	132 Å²	132	102.3 Å²	102.3	71%	0.706	57%	0.57	S	S	*	*			trans	-51.1	116.3	150.2	-86.4	-27.7	0	0	0	104.8	F21 N25	F21-D23 PolarHBondContact O-N 3.38Å; D23-N25 PolarHBondContact O-N 3.22Å
24	N	30.9	Very low	37.1	Very low	156 Å²	156	110 Å²	110	83%	0.834	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.8	89.6	167.1	-73.5	-44.3	0	0	0	107.3	P22	P22-N24 PolarHBondContact O-N 3.37Å
25	N	27.7	Very low	38.7	Very low	160 Å²	160	110.3 Å²	110.3	86%	0.856	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	160	8.5	161.6	-81.2	-17	0	0	0	117.1	D23	D23-N25 PolarHBondContact O-N 3.22Å
26	V	30.5	Very low	40.2	Very low	119 Å²	119	108.8 Å²	108.8	72%	0.721	59%	0.591	S	S	*	*			trans	-110.2	90	171.5	-168.6	0	0	0	0	111.7	G28	V26-G28 PolarHBondContact O-N 2.95Å; V26-G28 VanDerWaalsContact O-N 3.17Å
27	S	27	Very low	41.7	Very low	124 Å²	124	108.3 Å²	108.3	87%	0.867	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	105.9	155	52.8	0	0	0	0	108.6
28	G	26.7	Very low	43.3	Very low	68 Å²	68	113.4 Å²	113.4	70%	0.701	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.2	-9.9	168.9	0	0	0	0	0	120.6	V26	V26-G28 PolarHBondContact O-N 2.95Å; V26-G28 VanDerWaalsContact O-N 3.17Å
29	V	31	Very low	45	Very low	112 Å²	112	109 Å²	109	68%	0.679	60%	0.596	S	S	*	*			trans	-138	101.9	177.4	-169.6	0	0	0	0	109.1	D31	V29-D31 HydrophobicContact CG1-CB 4.25Å; V29-D31 PolarHBondContact O-N 2.82Å
30	E	32.8	Very low	46.7	Very low	164 Å²	164	103.3 Å²	103.3	77%	0.766	57%	0.566	S	S	*	*			trans	-73.9	72.7	161.3	-73.1	-169.9	175.8	0	0	108.1	K32	E30-K32 PolarHBondContact O-N 3.43Å; E30-K32 VanDerWaalsContact O-N 3.08Å; E30-K32 IonicContact OE2-NZ 2.72Å
31	D	38.5	Very low	48.5	Very low	102 Å²	102	106.4 Å²	106.4	55%	0.545	58%	0.579	S	S	.	*			trans	-76.7	92.8	157.5	-98.3	-29.3	0	0	0	106.3	V29 T33	V29-D31 HydrophobicContact CG1-CB 4.25Å; V29-D31 PolarHBondContact O-N 2.82Å; D31-T33 PolarHBondContact O-N 3.17Å
32	K	45.5	Very low	50.3	Low	167 Å²	167	107.5 Å²	107.5	73%	0.726	58%	0.581	S	S	*	*			trans	-69.6	91.9	164.6	-76.8	176.4	-179	159.5	0	105.8	E30 E34	E30-K32 PolarHBondContact O-N 3.43Å; E30-K32 VanDerWaalsContact O-N 3.08Å; E30-K32 IonicContact OE2-NZ 2.72Å; K32-E34 VanDerWaalsContact C-N 3.34Å; K32-E34 PolarHBondContact O-N 3.2Å
33	T	55.6	Low	52.2	Low	57 Å²	57	102.8 Å²	102.8	35%	0.35	55%	0.551	S	S	.	*			trans	-54.5	102	169.1	-11.2	0	0	0	0	107.5	F16 D20 D31	F16-T33 HydrophobicContact CE1-CG2 4.24Å; D20-T33 WeakPolarHBondContact OD2-CB 3.44Å; D20-T33 WeakPolarHBondContact OD2-CG2 3.41Å; D20-T33 PolarHBondContact OD2-OG1 3.38Å; D31-T33 PolarHBondContact O-N 3.17Å
34	E	63.9	Low	54.2	Low	177 Å²	177	97.6 Å²	97.6	83%	0.827	52%	0.524	S	S	*	.			trans	-69.3	138.8	-173.8	-164.6	171.3	-170.3	0	0	109.1	K32 D36	K32-E34 VanDerWaalsContact C-N 3.34Å; K32-E34 PolarHBondContact O-N 3.2Å; E34-D36 PolarHBondContact O-N 3.18Å; E34-D36 VanDerWaalsContact O-N 3.15Å
35	Y	68.5	Low	56.3	Low	72 Å²	72	94.3 Å²	94.3	28%	0.282	50%	0.504	S	S	.	.			trans	-62.3	117.8	179.7	164.7	-105.7	0	0	0	110.4	P37 I40 L76 P77 E80	Y35-P37 HydrophobicContact CE1-CG 3.7Å; Y35-P37 WeakPolarHBondContact OH-CG 3.35Å; Y35-I40 HydrophobicContact CD2-CD1 3.83Å; Y35-I40 HydrophobicContact CE2-CD1 3.52Å; Y35-I40 HydrophobicContact CE2-CG1 4.47Å; Y35-L76 HydrophobicContact CE2-CD1 4.1Å; Y35-P77 HydrophobicContact CD1-CG 3.95Å; Y35-P77 HydrophobicContact CD2-CG 3.88Å; Y35-P77 HydrophobicContact CE1-CG 4Å; Y35-P77 HydrophobicContact CE2-CG 3.9Å; Y35-P77 HydrophobicContact CG-CG 3.89Å; Y35-E80 VanDerWaalsContact OH-CD 3.25Å; Y35-E80 PolarHBondContact OH-OE1 3.24Å; Y35-E80 PolarHBondContact OH-OE2 3.25Å
36	D	73.1	Confident	58.5	Low	62 Å²	62	86.9 Å²	86.9	33%	0.332	46%	0.464	S	S	.	.			trans	-119.2	116	169.2	-176.3	-12.7	0	0	0	109.5	E34 Q38 L39 I40	E34-D36 PolarHBondContact O-N 3.18Å; E34-D36 VanDerWaalsContact O-N 3.15Å; D36-Q38 PolarHBondContact O-N 2.79Å; D36-Q38 VanDerWaalsContact O-N 3.17Å; D36-Q38 WeakPolarHBondContact OD1-CB 3.42Å; D36-Q38 PolarHBondContact OD1-N 2.77Å; D36-L39 HydrophobicContact CB-CB 4.06Å; D36-L39 HydrophobicContact CB-CD1 3.64Å; D36-L39 HydrophobicContact CB-CG 3.96Å; D36-L39 PolarHBondContact O-N 3.19Å; D36-L39 VanDerWaalsContact O-N 3.14Å; D36-I40 PolarHBondContact O-N 3.14Å
37	P	71.4	Confident	60.9	Low	74 Å²	74	81.2 Å²	81.2	48%	0.481	43%	0.43	S	S	.	.	H	α-helix	trans	-54.9	-32.7	176.5	-18.5	24.6	0	0	0	113.5	Y35 H41	Y35-P37 HydrophobicContact CE1-CG 3.7Å; Y35-P37 WeakPolarHBondContact OH-CG 3.35Å; P37-H41 PolarHBondContact O-N 2.97Å; P37-H41 VanDerWaalsContact O-N 3.12Å
38	Q	73.3	Confident	63.3	Low	121 Å²	121	77.5 Å²	77.5	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-70.1	-40.5	-179.8	-63.4	-165.8	4.3	0	0	111.4	D36 I40 H41 Y42	D36-Q38 PolarHBondContact O-N 2.79Å; D36-Q38 VanDerWaalsContact O-N 3.17Å; D36-Q38 WeakPolarHBondContact OD1-CB 3.42Å; D36-Q38 PolarHBondContact OD1-N 2.77Å; Q38-I40 VanDerWaalsContact C-N 3.28Å; Q38-I40 PolarHBondContact O-N 3.41Å; Q38-H41 WeakPolarHBondContact O-CB 3.48Å; Q38-H41 PolarHBondContact O-N 3.14Å; Q38-H41 VanDerWaalsContact O-N 3.15Å; Q38-Y42 HydrophobicContact CB-CD2 4.29Å; Q38-Y42 HydrophobicContact CB-CE2 3.95Å; Q38-Y42 WeakPolarHBondContact O-CD2 3.37Å; Q38-Y42 PolarHBondContact O-N 2.82Å
39	L	69.6	Low	65.6	Low	50 Å²	50	77 Å²	77	26%	0.262	38%	0.384	S	S	.	.	H	α-helix	trans	-60.9	-40.1	178.5	-78.6	168.1	0	0	0	111.7	F16 D36 Y42 A43	F16-L39 HydrophobicContact CD1-CD2 4.49Å; F16-L39 HydrophobicContact CD2-CD2 3.73Å; F16-L39 HydrophobicContact CE1-CD1 3.82Å; F16-L39 HydrophobicContact CE1-CD2 4.14Å; F16-L39 HydrophobicContact CE2-CD1 3.62Å; F16-L39 HydrophobicContact CE2-CD2 3.32Å; F16-L39 HydrophobicContact CE2-CG 4.16Å; F16-L39 HydrophobicContact CG-CD2 4.33Å; F16-L39 HydrophobicContact CZ-CD1 3.1Å; F16-L39 HydrophobicContact CZ-CD2 3.59Å; F16-L39 HydrophobicContact CZ-CG 4Å; D36-L39 HydrophobicContact CB-CB 4.06Å; D36-L39 HydrophobicContact CB-CD1 3.64Å; D36-L39 HydrophobicContact CB-CG 3.96Å; D36-L39 PolarHBondContact O-N 3.19Å; D36-L39 VanDerWaalsContact O-N 3.14Å; L39-Y42 PolarHBondContact O-N 2.76Å; L39-A43 WeakPolarHBondContact O-CB 3.05Å; L39-A43 PolarHBondContact O-N 3.05Å
40	I	72	Confident	67.9	Low	9 Å²	9	71.7 Å²	71.7	5%	0.046	35%	0.352	C	S	.	.	H	α-helix	trans	-65.5	-45	175.4	-59.4	-168.3	0	0	0	110.9	Y35 D36 Q38 Y42 A43 V44 A72 L76 F84	Y35-I40 HydrophobicContact CD2-CD1 3.83Å; Y35-I40 HydrophobicContact CE2-CD1 3.52Å; Y35-I40 HydrophobicContact CE2-CG1 4.47Å; D36-I40 PolarHBondContact O-N 3.14Å; Q38-I40 VanDerWaalsContact C-N 3.28Å; Q38-I40 PolarHBondContact O-N 3.41Å; I40-Y42 VanDerWaalsContact C-N 3.31Å; I40-Y42 PolarHBondContact O-N 3.08Å; I40-A43 PolarHBondContact O-N 3.12Å; I40-V44 HydrophobicContact CG2-CG2 4.46Å; I40-V44 WeakPolarHBondContact O-CG2 3.42Å; I40-V44 PolarHBondContact O-N 3.39Å; I40-A72 HydrophobicContact CB-CB 4.48Å; I40-A72 WeakPolarHBondContact CD1-O 3.3Å; I40-A72 HydrophobicContact CG1-CB 4.13Å; I40-L76 HydrophobicContact CD1-CB 3.95Å; I40-L76 HydrophobicContact CD1-CD1 3.23Å; I40-L76 HydrophobicContact CD1-CG 4.15Å; I40-L76 HydrophobicContact CG2-CD1 4.35Å; I40-F84 HydrophobicContact CG2-CD2 4.46Å; I40-F84 HydrophobicContact CG2-CE1 4.06Å; I40-F84 HydrophobicContact CG2-CE2 3.56Å; I40-F84 HydrophobicContact CG2-CZ 3.29Å
41	H	75.2	Confident	69.9	Low	107 Å²	107	64.5 Å²	64.5	50%	0.495	32%	0.319	S	S	.	.	H	α-helix	trans	-58.3	-43.8	176.6	-177.5	-87.7	0	0	0	111.8	P37 Q38 V44 Q45	P37-H41 PolarHBondContact O-N 2.97Å; P37-H41 VanDerWaalsContact O-N 3.12Å; Q38-H41 WeakPolarHBondContact O-CB 3.48Å; Q38-H41 PolarHBondContact O-N 3.14Å; Q38-H41 VanDerWaalsContact O-N 3.15Å; H41-V44 PolarHBondContact O-N 3.25Å; H41-Q45 PolarHBondContact CE1-NE2 3.15Å; H41-Q45 PolarHBondContact CE1-OE1 2.83Å; H41-Q45 PolarHBondContact ND1-OE1 3.17Å; H41-Q45 WeakPolarHBondContact O-CB 3.38Å; H41-Q45 WeakPolarHBondContact O-CG 3.24Å; H41-Q45 PolarHBondContact O-N 3.43Å
42	Y	74.9	Confident	71.8	Confident	116 Å²	116	64 Å²	64	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-66.4	-44.4	177.5	-70.6	-55.9	0	0	0	112.8	Q38 L39 I40 V44 Q45 L46	Q38-Y42 HydrophobicContact CB-CD2 4.29Å; Q38-Y42 HydrophobicContact CB-CE2 3.95Å; Q38-Y42 WeakPolarHBondContact O-CD2 3.37Å; Q38-Y42 PolarHBondContact O-N 2.82Å; L39-Y42 PolarHBondContact O-N 2.76Å; I40-Y42 VanDerWaalsContact C-N 3.31Å; I40-Y42 PolarHBondContact O-N 3.08Å; Y42-V44 VanDerWaalsContact C-N 3.25Å; Y42-V44 PolarHBondContact O-N 3.34Å; Y42-Q45 PolarHBondContact O-N 3.3Å; Y42-L46 WeakPolarHBondContact O-CB 3.45Å; Y42-L46 PolarHBondContact O-N 3.37Å
43	A	74.9	Confident	73.2	Confident	9 Å²	9	57 Å²	57	7%	0.074	31%	0.305	C	S	.	.	H	α-helix	trans	-58.9	-39.5	177.4	0	0	0	0	0	111.6	L39 I40 C47 L69 A72	L39-A43 WeakPolarHBondContact O-CB 3.05Å; L39-A43 PolarHBondContact O-N 3.05Å; I40-A43 PolarHBondContact O-N 3.12Å; A43-C47 VanDerWaalsContact O-CB 3.3Å; A43-C47 WeakPolarHBondContact O-CB 3.28Å; A43-C47 PolarHBondContact O-N 3.11Å; A43-L69 HydrophobicContact CB-CD1 4.49Å; A43-A72 HydrophobicContact CB-CB 3.55Å
44	V	75.3	Confident	74	Confident	23 Å²	23	59.4 Å²	59.4	14%	0.139	31%	0.307	C	S	.	.	H	α-helix	trans	-69.6	-45.6	177	175.7	0	0	0	0	111.8	I40 H41 Y42 L46 C47 S48 L69 F84 M94	I40-V44 HydrophobicContact CG2-CG2 4.46Å; I40-V44 WeakPolarHBondContact O-CG2 3.42Å; I40-V44 PolarHBondContact O-N 3.39Å; H41-V44 PolarHBondContact O-N 3.25Å; Y42-V44 VanDerWaalsContact C-N 3.25Å; Y42-V44 PolarHBondContact O-N 3.34Å; V44-L46 VanDerWaalsContact C-N 3.35Å; V44-C47 PolarHBondContact O-N 3.4Å; V44-S48 VanDerWaalsContact O-CB 3.29Å; V44-S48 WeakPolarHBondContact O-CB 3.43Å; V44-S48 PolarHBondContact O-N 3.1Å; V44-S48 PolarHBondContact O-OG 3.43Å; V44-L69 HydrophobicContact CG2-CD1 3.75Å; V44-F84 HydrophobicContact CB-CE2 4.44Å; V44-F84 HydrophobicContact CG2-CD2 4.47Å; V44-F84 HydrophobicContact CG2-CE1 4.3Å; V44-F84 HydrophobicContact CG2-CE2 3.17Å; V44-F84 HydrophobicContact CG2-CZ 3.06Å; V44-M94 HydrophobicContact CG1-CE 4.37Å
45	Q	75.2	Confident	74.4	Confident	88 Å²	88	61.2 Å²	61.2	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-46.5	179.1	-79.4	-170.7	-35	0	0	111	H41 Y42 C47 S48 I49	H41-Q45 PolarHBondContact CE1-NE2 3.15Å; H41-Q45 PolarHBondContact CE1-OE1 2.83Å; H41-Q45 PolarHBondContact ND1-OE1 3.17Å; H41-Q45 WeakPolarHBondContact O-CB 3.38Å; H41-Q45 WeakPolarHBondContact O-CG 3.24Å; H41-Q45 PolarHBondContact O-N 3.43Å; Y42-Q45 PolarHBondContact O-N 3.3Å; Q45-C47 PolarHBondContact O-N 3.45Å; Q45-S48 PolarHBondContact O-N 3.35Å; Q45-I49 WeakPolarHBondContact O-CB 3.26Å; Q45-I49 WeakPolarHBondContact O-CD1 3.45Å; Q45-I49 VanDerWaalsContact O-CG1 3.23Å; Q45-I49 WeakPolarHBondContact O-CG1 3.49Å; Q45-I49 PolarHBondContact O-N 3.34Å
46	L	73.6	Confident	74.9	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-56	-53.5	174.9	-178.5	100.1	0	0	0	110.8	L9 V10 S13 Y42 V44 S48 I49 V50 S65	L9-L46 HydrophobicContact CB-CD1 3.51Å; L9-L46 HydrophobicContact CD2-CD1 4.23Å; L9-L46 HydrophobicContact CG-CD1 4.39Å; V10-L46 HydrophobicContact CG2-CD1 4.07Å; S13-L46 WeakPolarHBondContact OG-CD2 3.3Å; Y42-L46 WeakPolarHBondContact O-CB 3.45Å; Y42-L46 PolarHBondContact O-N 3.37Å; V44-L46 VanDerWaalsContact C-N 3.35Å; L46-S48 VanDerWaalsContact C-N 3.28Å; L46-S48 PolarHBondContact O-N 3.39Å; L46-I49 PolarHBondContact O-N 3.08Å; L46-V50 WeakPolarHBondContact O-CB 3.48Å; L46-V50 WeakPolarHBondContact O-CG2 3.3Å; L46-V50 PolarHBondContact O-N 3.34Å; L46-S65 WeakPolarHBondContact CD2-OG 3.39Å
47	C	80.3	Confident	75	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-41.3	-178.9	-161	0	0	0	0	111	A43 V44 Q45 I49 V50 L51 L69 M94	A43-C47 VanDerWaalsContact O-CB 3.3Å; A43-C47 WeakPolarHBondContact O-CB 3.28Å; A43-C47 PolarHBondContact O-N 3.11Å; V44-C47 PolarHBondContact O-N 3.4Å; Q45-C47 PolarHBondContact O-N 3.45Å; C47-I49 PolarHBondContact O-N 2.67Å; C47-V50 PolarHBondContact O-N 3.02Å; C47-L51 VanDerWaalsContact O-CB 3.27Å; C47-L51 WeakPolarHBondContact O-CB 3.42Å; C47-L51 WeakPolarHBondContact O-CG 3.4Å; C47-L51 PolarHBondContact O-N 3.3Å; C47-L69 HydrophobicContact CB-CB 4.33Å; C47-L69 HydrophobicContact CB-CD2 3.93Å; C47-M94 HydrophobicContact CB-SD 4.27Å
48	S	78.1	Confident	75.4	Confident	46 Å²	46	63.7 Å²	63.7	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-60.8	-45.1	176.6	-58	0	0	0	0	112.2	V44 Q45 L46 A52 M94	V44-S48 VanDerWaalsContact O-CB 3.29Å; V44-S48 WeakPolarHBondContact O-CB 3.43Å; V44-S48 PolarHBondContact O-N 3.1Å; V44-S48 PolarHBondContact O-OG 3.43Å; Q45-S48 PolarHBondContact O-N 3.35Å; L46-S48 VanDerWaalsContact C-N 3.28Å; L46-S48 PolarHBondContact O-N 3.39Å; S48-A52 VanDerWaalsContact O-CB 3.23Å; S48-A52 WeakPolarHBondContact O-CB 3.49Å; S48-A52 PolarHBondContact O-N 2.72Å; S48-M94 VanDerWaalsContact OG-CE 3.23Å; S48-M94 WeakPolarHBondContact OG-CE 3.29Å
49	I	75.3	Confident	75.9	Confident	58 Å²	58	61.3 Å²	61.3	30%	0.297	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-46.8	178.8	-69.5	161.4	0	0	0	110.2	M1 I6 Q45 L46 C47 L51 A52 G53	M1-I49 HydrophobicContact SD-CD1 3.73Å; I6-I49 HydrophobicContact CD1-CG2 3.88Å; I6-I49 HydrophobicContact CG1-CG2 4.16Å; Q45-I49 WeakPolarHBondContact O-CB 3.26Å; Q45-I49 WeakPolarHBondContact O-CD1 3.45Å; Q45-I49 VanDerWaalsContact O-CG1 3.23Å; Q45-I49 WeakPolarHBondContact O-CG1 3.49Å; Q45-I49 PolarHBondContact O-N 3.34Å; L46-I49 PolarHBondContact O-N 3.08Å; C47-I49 PolarHBondContact O-N 2.67Å; I49-L51 PolarHBondContact O-N 2.99Å; I49-A52 PolarHBondContact O-N 3.43Å; I49-G53 PolarHBondContact O-N 3.32Å
50	V	77.8	Confident	76.5	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-42.3	-178.8	166.3	0	0	0	0	111.1	L46 C47 G53 R54 I57 V62 S65	L46-V50 WeakPolarHBondContact O-CB 3.48Å; L46-V50 WeakPolarHBondContact O-CG2 3.3Å; L46-V50 PolarHBondContact O-N 3.34Å; C47-V50 PolarHBondContact O-N 3.02Å; V50-G53 CarbonylContact O-C 3.52Å; V50-G53 PolarHBondContact O-N 2.93Å; V50-R54 PolarHBondContact O-N 3.49Å; V50-I57 HydrophobicContact CB-CD1 4.19Å; V50-I57 HydrophobicContact CG1-CD1 4.09Å; V50-I57 HydrophobicContact CG1-CG2 4.14Å; V50-I57 HydrophobicContact CG2-CD1 4.16Å; V50-V62 HydrophobicContact CG1-CB 4.39Å; V50-V62 HydrophobicContact CG1-CG2 3.93Å; V50-S65 WeakPolarHBondContact CG2-OG 3.27Å
51	L	76.3	Confident	76.8	Confident	13 Å²	13	65.7 Å²	65.7	7%	0.068	33%	0.331	C	S	.	.	H	α-helix	trans	-71.3	-34.6	178.2	-66.1	177.9	0	0	0	112.7	C47 I49 G53 R54 V62 M94 L98	C47-L51 VanDerWaalsContact O-CB 3.27Å; C47-L51 WeakPolarHBondContact O-CB 3.42Å; C47-L51 WeakPolarHBondContact O-CG 3.4Å; C47-L51 PolarHBondContact O-N 3.3Å; I49-L51 PolarHBondContact O-N 2.99Å; L51-G53 VanDerWaalsContact C-N 3.29Å; L51-G53 PolarHBondContact O-N 3.38Å; L51-R54 WeakPolarHBondContact O-CB 3.28Å; L51-R54 WeakPolarHBondContact O-CG 3.4Å; L51-R54 PolarHBondContact O-N 3.41Å; L51-V62 HydrophobicContact CD2-CG1 3.9Å; L51-M94 HydrophobicContact CD1-CB 3.71Å; L51-M94 HydrophobicContact CD1-CG 3.63Å; L51-M94 HydrophobicContact CD1-SD 3.96Å; L51-L98 HydrophobicContact CD1-CD1 3.97Å; L51-L98 HydrophobicContact CD2-CD1 3.44Å; L51-L98 VanDerWaalsContact CD2-CD1 3.44Å; L51-L98 HydrophobicContact CD2-CD2 4.05Å; L51-L98 HydrophobicContact CD2-CG 4.3Å; L51-L98 HydrophobicContact CG-CD1 4.36Å
52	A	77.6	Confident	77.1	Confident	91 Å²	91	60.9 Å²	60.9	75%	0.752	31%	0.309	S	S	*	.	H	α-helix	trans	-64.8	-35.8	171.2	0	0	0	0	0	111.8	S48 I49	S48-A52 VanDerWaalsContact O-CB 3.23Å; S48-A52 WeakPolarHBondContact O-CB 3.49Å; S48-A52 PolarHBondContact O-N 2.72Å; I49-A52 PolarHBondContact O-N 3.43Å
53	G	74.7	Confident	77.6	Confident	21 Å²	21	55.9 Å²	55.9	22%	0.216	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-0.3	178.2	0	0	0	0	0	115.2	I49 V50 L51 R55 F56 I57	I49-G53 PolarHBondContact O-N 3.32Å; V50-G53 CarbonylContact O-C 3.52Å; V50-G53 PolarHBondContact O-N 2.93Å; L51-G53 VanDerWaalsContact C-N 3.29Å; L51-G53 PolarHBondContact O-N 3.38Å; G53-R55 PolarHBondContact O-N 2.89Å; G53-F56 PolarHBondContact O-N 3.42Å; G53-I57 WeakPolarHBondContact O-CG1 3.45Å
54	R	73.5	Confident	77.9	Confident	107 Å²	107	57 Å²	57	40%	0.404	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-50.9	-24.9	-163.3	70.7	175.1	177.3	168.4	-6.6	116.7	V50 L51 F56 D101	V50-R54 PolarHBondContact O-N 3.49Å; L51-R54 WeakPolarHBondContact O-CB 3.28Å; L51-R54 WeakPolarHBondContact O-CG 3.4Å; L51-R54 PolarHBondContact O-N 3.41Å; R54-F56 PolarHBondContact O-N 2.97Å; R54-D101 IonicContact NH1-OD2 3.44Å
55	R	72.9	Confident	78.3	Confident	214 Å²	214	55.9 Å²	55.9	81%	0.808	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-66	-21	176.4	-67.4	-175.9	178	178.5	0.1	113.6	G53	G53-R55 PolarHBondContact O-N 2.89Å
56	F	77.5	Confident	78.8	Confident	178 Å²	178	51.7 Å²	51.7	78%	0.781	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-119.2	6.1	-175	-51.8	-71.7	0	0	0	112.2	G53 R54	G53-F56 PolarHBondContact O-N 3.42Å; R54-F56 PolarHBondContact O-N 2.97Å
57	I	74.9	Confident	79.3	Confident	20 Å²	20	52.9 Å²	52.9	10%	0.103	28%	0.276	C	S	.	.	S	Bend	trans	-116.6	141.7	-174.5	-58.3	-169.3	0	0	0	108.7	W3 V50 G53 A61 V62	W3-I57 HydrophobicContact CH2-CD1 4.2Å; W3-I57 HydrophobicContact CH2-CG1 3.89Å; W3-I57 HydrophobicContact CZ3-CD1 4.27Å; W3-I57 HydrophobicContact CZ3-CG1 4.29Å; V50-I57 HydrophobicContact CB-CD1 4.19Å; V50-I57 HydrophobicContact CG1-CD1 4.09Å; V50-I57 HydrophobicContact CG1-CG2 4.14Å; V50-I57 HydrophobicContact CG2-CD1 4.16Å; G53-I57 WeakPolarHBondContact O-CG1 3.45Å; I57-A61 HydrophobicContact CG2-CB 3.38Å; I57-V62 HydrophobicContact CG2-CG2 4.29Å
58	S	81.4	Confident	79.4	Confident	62 Å²	62	53.4 Å²	53.4	43%	0.434	28%	0.28	S	S	.	.			trans	-71.3	152.9	177.2	85.5	0	0	0	0	111.5	E60 A61 V62	S58-E60 WeakPolarHBondContact CB-OE2 3.49Å; S58-E60 PolarHBondContact O-N 2.96Å; S58-E60 PolarHBondContact OG-OE2 3.41Å; S58-A61 PolarHBondContact O-N 3.03Å; S58-A61 VanDerWaalsContact O-N 3.08Å; S58-A61 PolarHBondContact OG-N 3.35Å; S58-V62 PolarHBondContact O-N 3.09Å
59	D	82.2	Confident	79.7	Confident	71 Å²	71	51.2 Å²	51.2	38%	0.38	27%	0.265	S	S	.	.	H	α-helix	trans	-54.7	-35.9	176.6	-77.1	3.5	0	0	0	111.8	A61 V62 C63 S103 V106	D59-A61 PolarHBondContact O-N 3.07Å; D59-V62 PolarHBondContact O-N 3.34Å; D59-C63 WeakPolarHBondContact O-CB 3.17Å; D59-C63 PolarHBondContact O-N 3.47Å; D59-C63 PolarHBondContact O-SG 3.25Å; D59-S103 WeakPolarHBondContact OD2-CB 3.39Å; D59-S103 PolarHBondContact OD2-OG 3.21Å; D59-V106 HydrophobicContact CB-CG2 4.13Å
60	E	82	Confident	80.2	Confident	130 Å²	130	48.7 Å²	48.7	61%	0.607	25%	0.252	S	S	*	.	H	α-helix	trans	-62	-44.2	178.2	-60.1	80	-174.9	0	0	111.8	S58 V62 C63 V64	S58-E60 WeakPolarHBondContact CB-OE2 3.49Å; S58-E60 PolarHBondContact O-N 2.96Å; S58-E60 PolarHBondContact OG-OE2 3.41Å; E60-V62 VanDerWaalsContact C-N 3.32Å; E60-V62 PolarHBondContact O-N 3.41Å; E60-C63 PolarHBondContact O-N 2.93Å; E60-V64 VanDerWaalsContact O-CG2 3.3Å; E60-V64 WeakPolarHBondContact O-CG2 3.5Å; E60-V64 PolarHBondContact O-N 3.2Å
61	A	78.8	Confident	80.2	Confident	21 Å²	21	50 Å²	50	17%	0.174	26%	0.258	C	S	.	.	H	α-helix	trans	-68.1	-34.3	179	0	0	0	0	0	111.9	I57 S58 D59 S65	I57-A61 HydrophobicContact CG2-CB 3.38Å; S58-A61 PolarHBondContact O-N 3.03Å; S58-A61 VanDerWaalsContact O-N 3.08Å; S58-A61 PolarHBondContact OG-N 3.35Å; D59-A61 PolarHBondContact O-N 3.07Å; A61-S65 WeakPolarHBondContact O-CB 3.45Å; A61-S65 PolarHBondContact O-N 3.46Å; A61-S65 VanDerWaalsContact O-N 3.09Å; A61-S65 PolarHBondContact O-OG 3.32Å
62	V	83	Confident	80.5	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-48.8	169.7	178.5	0	0	0	0	110.4	V50 L51 I57 S58 D59 E60 V64 S65 L66 V106	V50-V62 HydrophobicContact CG1-CB 4.39Å; V50-V62 HydrophobicContact CG1-CG2 3.93Å; L51-V62 HydrophobicContact CD2-CG1 3.9Å; I57-V62 HydrophobicContact CG2-CG2 4.29Å; S58-V62 PolarHBondContact O-N 3.09Å; D59-V62 PolarHBondContact O-N 3.34Å; E60-V62 VanDerWaalsContact C-N 3.32Å; E60-V62 PolarHBondContact O-N 3.41Å; V62-V64 PolarHBondContact O-N 2.57Å; V62-S65 PolarHBondContact O-N 2.91Å; V62-L66 HydrophobicContact CG1-CD1 3.88Å; V62-L66 HydrophobicContact CG1-CG 4.37Å; V62-L66 WeakPolarHBondContact O-CG 3.18Å; V62-L66 PolarHBondContact O-N 3.03Å; V62-V106 HydrophobicContact CB-CG2 4.34Å; V62-V106 HydrophobicContact CG1-CG1 3.89Å; V62-V106 HydrophobicContact CG1-CG2 4.13Å
63	C	85.2	Confident	80.8	Confident	11 Å²	11	45.5 Å²	45.5	7%	0.074	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-44.3	179.9	-67.8	0	0	0	0	112.5	D59 E60 S65 L66 L67 Y109	D59-C63 WeakPolarHBondContact O-CB 3.17Å; D59-C63 PolarHBondContact O-N 3.47Å; D59-C63 PolarHBondContact O-SG 3.25Å; E60-C63 PolarHBondContact O-N 2.93Å; C63-S65 VanDerWaalsContact C-N 3.31Å; C63-S65 PolarHBondContact O-N 3.31Å; C63-L66 PolarHBondContact O-N 3.28Å; C63-L67 WeakPolarHBondContact O-CB 3.14Å; C63-L67 PolarHBondContact O-N 3.18Å; C63-Y109 HydrophobicContact CB-CD2 3.57Å; C63-Y109 HydrophobicContact CB-CE2 3.91Å; C63-Y109 HydrophobicContact CB-CG 3.91Å; C63-Y109 WeakPolarHBondContact SG-CD2 3.33Å
64	V	80.3	Confident	81.1	Confident	31 Å²	31	46.5 Å²	46.5	19%	0.188	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-42	175.8	168.6	0	0	0	0	111	V10 L14 L17 E60 V62 L67 S68	V10-V64 HydrophobicContact CG1-CG1 4.2Å; L14-V64 HydrophobicContact CD1-CG1 4.49Å; L14-V64 HydrophobicContact CD2-CG1 4.07Å; L14-V64 HydrophobicContact CD2-CG2 4.21Å; L14-V64 HydrophobicContact CG-CG1 3.85Å; L17-V64 HydrophobicContact CD1-CG1 3.82Å; L17-V64 WeakPolarHBondContact CD1-O 3.4Å; E60-V64 VanDerWaalsContact O-CG2 3.3Å; E60-V64 WeakPolarHBondContact O-CG2 3.5Å; E60-V64 PolarHBondContact O-N 3.2Å; V62-V64 PolarHBondContact O-N 2.57Å; V64-L67 PolarHBondContact O-N 3.25Å; V64-S68 PolarHBondContact O-N 2.73Å; V64-S68 PolarHBondContact O-OG 3.08Å
65	S	83.5	Confident	81.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.8	-41.1	178.7	-56.9	0	0	0	0	112.1	L46 V50 A61 V62 C63 S68 L69	L46-S65 WeakPolarHBondContact CD2-OG 3.39Å; V50-S65 WeakPolarHBondContact CG2-OG 3.27Å; A61-S65 WeakPolarHBondContact O-CB 3.45Å; A61-S65 PolarHBondContact O-N 3.46Å; A61-S65 VanDerWaalsContact O-N 3.09Å; A61-S65 PolarHBondContact O-OG 3.32Å; V62-S65 PolarHBondContact O-N 2.91Å; C63-S65 VanDerWaalsContact C-N 3.31Å; C63-S65 PolarHBondContact O-N 3.31Å; S65-S68 PolarHBondContact O-N 3.39Å; S65-L69 WeakPolarHBondContact O-CB 3.49Å; S65-L69 PolarHBondContact O-N 3.19Å
66	L	86.4	Confident	81.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-39.6	174.8	-72.1	169.5	0	0	0	112.1	V62 C63 S68 L69 A70 V95 L98 V106 A110 T113	V62-L66 HydrophobicContact CG1-CD1 3.88Å; V62-L66 HydrophobicContact CG1-CG 4.37Å; V62-L66 WeakPolarHBondContact O-CG 3.18Å; V62-L66 PolarHBondContact O-N 3.03Å; C63-L66 PolarHBondContact O-N 3.28Å; L66-S68 VanDerWaalsContact C-N 3.33Å; L66-L69 PolarHBondContact O-N 3.3Å; L66-A70 WeakPolarHBondContact O-CB 3.43Å; L66-A70 PolarHBondContact O-N 3.17Å; L66-V95 HydrophobicContact CD2-CG1 4.39Å; L66-V95 HydrophobicContact CD2-CG2 4.02Å; L66-L98 HydrophobicContact CD1-CD1 3.99Å; L66-L98 HydrophobicContact CD2-CD1 3.81Å; L66-L98 HydrophobicContact CG-CD1 4.39Å; L66-V106 HydrophobicContact CD1-CG1 4.17Å; L66-A110 HydrophobicContact CD1-CB 4.22Å; L66-T113 PolarHBondContact O-OG1 2.81Å
67	L	83.7	Confident	82	Confident	28 Å²	28	27.6 Å²	27.6	15%	0.147	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-41.6	176.1	-165.3	65.3	0	0	0	111.3	L17 F21 C63 V64 L69 A70 K71 Y109	L17-L67 HydrophobicContact CD1-CB 4.14Å; L17-L67 HydrophobicContact CD1-CD2 4.05Å; L17-L67 HydrophobicContact CD1-CG 4.35Å; L17-L67 HydrophobicContact CD2-CB 3.92Å; L17-L67 HydrophobicContact CD2-CD2 3.67Å; L17-L67 HydrophobicContact CD2-CG 3.48Å; L17-L67 VanDerWaalsContact CD2-CG 3.48Å; L17-L67 HydrophobicContact CG-CD2 4.37Å; F21-L67 HydrophobicContact CD2-CD1 4.12Å; F21-L67 HydrophobicContact CD2-CD2 4.31Å; F21-L67 HydrophobicContact CD2-CG 4.26Å; F21-L67 HydrophobicContact CE1-CD1 4.49Å; F21-L67 HydrophobicContact CE2-CD1 3.21Å; F21-L67 HydrophobicContact CE2-CD2 4.17Å; F21-L67 HydrophobicContact CE2-CG 3.65Å; F21-L67 HydrophobicContact CZ-CD1 3.44Å; F21-L67 VanDerWaalsContact CZ-CD1 3.44Å; F21-L67 HydrophobicContact CZ-CG 4.37Å; C63-L67 WeakPolarHBondContact O-CB 3.14Å; C63-L67 PolarHBondContact O-N 3.18Å; V64-L67 PolarHBondContact O-N 3.25Å; L67-L69 VanDerWaalsContact C-N 3.31Å; L67-L69 PolarHBondContact O-N 3.14Å; L67-A70 WeakPolarHBondContact O-CB 2.98Å; L67-A70 PolarHBondContact O-N 2.89Å; L67-K71 PolarHBondContact O-N 3.29Å; L67-Y109 HydrophobicContact CB-CD1 4.17Å; L67-Y109 HydrophobicContact CB-CE1 4.31Å; L67-Y109 HydrophobicContact CD1-CD1 3.96Å; L67-Y109 HydrophobicContact CD1-CE1 3.81Å; L67-Y109 HydrophobicContact CD2-CE1 4.29Å; L67-Y109 HydrophobicContact CG-CE1 4.36Å
68	S	81.8	Confident	82.5	Confident	11 Å²	11	30 Å²	30	8%	0.077	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-43.2	177.4	-53.4	0	0	0	0	110.6	S13 L17 V64 S65 L66 A70 K71 A72	S13-S68 WeakPolarHBondContact CB-OG 3.42Å; L17-S68 WeakPolarHBondContact CD1-OG 3.4Å; V64-S68 PolarHBondContact O-N 2.73Å; V64-S68 PolarHBondContact O-OG 3.08Å; S65-S68 PolarHBondContact O-N 3.39Å; L66-S68 VanDerWaalsContact C-N 3.33Å; S68-A70 VanDerWaalsContact C-N 3.34Å; S68-K71 PolarHBondContact O-N 2.74Å; S68-A72 PolarHBondContact O-N 3.03Å; S68-A72 VanDerWaalsContact O-N 3.09Å
69	L	85.3	Confident	82.3	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-39.9	174.2	-172	59.3	0	0	0	111.9	A43 V44 C47 S65 L66 L67 K71 A72 V73 F84 I88 V95 T113	A43-L69 HydrophobicContact CB-CD1 4.49Å; V44-L69 HydrophobicContact CG2-CD1 3.75Å; C47-L69 HydrophobicContact CB-CB 4.33Å; C47-L69 HydrophobicContact CB-CD2 3.93Å; S65-L69 WeakPolarHBondContact O-CB 3.49Å; S65-L69 PolarHBondContact O-N 3.19Å; L66-L69 PolarHBondContact O-N 3.3Å; L67-L69 VanDerWaalsContact C-N 3.31Å; L67-L69 PolarHBondContact O-N 3.14Å; L69-K71 PolarHBondContact O-N 2.97Å; L69-A72 PolarHBondContact O-N 3.1Å; L69-V73 HydrophobicContact CD1-CG2 4.47Å; L69-V73 HydrophobicContact CG-CG2 4.41Å; L69-V73 WeakPolarHBondContact O-CB 3.28Å; L69-V73 WeakPolarHBondContact O-CG2 3.38Å; L69-V73 PolarHBondContact O-N 3.34Å; L69-F84 HydrophobicContact CD1-CZ 4.33Å; L69-I88 HydrophobicContact CD1-CD1 3.77Å; L69-I88 HydrophobicContact CD2-CD1 4.06Å; L69-I88 HydrophobicContact CD2-CG1 4.36Å; L69-I88 HydrophobicContact CD2-CG2 4.12Å; L69-I88 HydrophobicContact CG-CD1 4.14Å; L69-V95 HydrophobicContact CD2-CG2 3.98Å; L69-T113 HydrophobicContact CB-CG2 4.09Å; L69-T113 HydrophobicContact CD2-CG2 3.84Å; L69-T113 HydrophobicContact CG-CG2 3.74Å
70	A	84.6	Confident	81.9	Confident	5 Å²	5	31.4 Å²	31.4	4%	0.041	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-43.3	177.6	0	0	0	0	0	111.8	L66 L67 S68 V73 A74 T113 A116	L66-A70 WeakPolarHBondContact O-CB 3.43Å; L66-A70 PolarHBondContact O-N 3.17Å; L67-A70 WeakPolarHBondContact O-CB 2.98Å; L67-A70 PolarHBondContact O-N 2.89Å; S68-A70 VanDerWaalsContact C-N 3.34Å; A70-V73 PolarHBondContact O-N 3.33Å; A70-A74 WeakPolarHBondContact O-CB 3.05Å; A70-A74 PolarHBondContact O-N 3.39Å; A70-T113 HydrophobicContact CB-CG2 4.48Å; A70-A116 HydrophobicContact CB-CB 4.25Å; A70-A116 WeakPolarHBondContact O-CB 3.49Å
71	K	79.6	Confident	81.5	Confident	28 Å²	28	25.3 Å²	25.3	12%	0.122	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-47.8	174.5	-73.5	-157.4	-177.4	-171.1	0	112.3	F16 L17 D20 F21 L67 S68 L69 V73 A74 V75	F16-K71 PolarHBondContact O-NZ 2.96Å; L17-K71 VanDerWaalsContact C-NZ 3.27Å; L17-K71 VanDerWaalsContact CA-NZ 3.32Å; L17-K71 HydrophobicContact CD2-CD 3.81Å; L17-K71 HydrophobicContact CD2-CG 4.02Å; L17-K71 WeakPolarHBondContact O-CE 3.3Å; L17-K71 PolarHBondContact O-NZ 3.04Å; D20-K71 VanDerWaalsContact CA-NZ 3.32Å; D20-K71 WeakPolarHBondContact O-CE 3.41Å; D20-K71 PolarHBondContact O-NZ 3.15Å; F21-K71 HydrophobicContact CD2-CD 4.37Å; F21-K71 HydrophobicContact CD2-CG 4.25Å; F21-K71 HydrophobicContact CE2-CG 3.9Å; L67-K71 PolarHBondContact O-N 3.29Å; S68-K71 PolarHBondContact O-N 2.74Å; L69-K71 PolarHBondContact O-N 2.97Å; K71-V73 VanDerWaalsContact C-N 3.25Å; K71-V73 PolarHBondContact O-N 3.4Å; K71-A74 WeakPolarHBondContact O-CB 3.32Å; K71-A74 PolarHBondContact O-N 3.34Å; K71-A74 VanDerWaalsContact O-N 3.1Å; K71-V75 PolarHBondContact O-N 3.09Å
72	A	82.1	Confident	81.1	Confident	9 Å²	9	30 Å²	30	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-58.3	-40.3	178	0	0	0	0	0	111.9	I40 A43 S68 L69 V75 L76	I40-A72 HydrophobicContact CB-CB 4.48Å; I40-A72 WeakPolarHBondContact CD1-O 3.3Å; I40-A72 HydrophobicContact CG1-CB 4.13Å; A43-A72 HydrophobicContact CB-CB 3.55Å; S68-A72 PolarHBondContact O-N 3.03Å; S68-A72 VanDerWaalsContact O-N 3.09Å; L69-A72 PolarHBondContact O-N 3.1Å; A72-V75 WeakPolarHBondContact O-CG2 3.46Å; A72-L76 PolarHBondContact O-N 3.45Å
73	V	82.4	Confident	80.5	Confident	2 Å²	2	34 Å²	34	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-42.8	175.1	169	0	0	0	0	111.7	L69 A70 K71 V75 L76 F84 I88 A116 L117	L69-V73 HydrophobicContact CD1-CG2 4.47Å; L69-V73 HydrophobicContact CG-CG2 4.41Å; L69-V73 WeakPolarHBondContact O-CB 3.28Å; L69-V73 WeakPolarHBondContact O-CG2 3.38Å; L69-V73 PolarHBondContact O-N 3.34Å; A70-V73 PolarHBondContact O-N 3.33Å; K71-V73 VanDerWaalsContact C-N 3.25Å; K71-V73 PolarHBondContact O-N 3.4Å; V73-V75 VanDerWaalsContact C-N 3.27Å; V73-V75 PolarHBondContact O-N 3.37Å; V73-L76 VanDerWaalsContact O-CB 3.28Å; V73-L76 WeakPolarHBondContact O-CB 3.4Å; V73-L76 PolarHBondContact O-N 2.94Å; V73-L76 VanDerWaalsContact O-N 3.14Å; V73-F84 HydrophobicContact CG2-CD1 4.36Å; V73-F84 HydrophobicContact CG2-CE1 3.71Å; V73-I88 HydrophobicContact CG2-CD1 4.05Å; V73-A116 HydrophobicContact CB-CB 4.16Å; V73-A116 HydrophobicContact CG1-CB 3.86Å; V73-L117 HydrophobicContact CG1-CD2 3.34Å; V73-L117 HydrophobicContact CG1-CG 3.78Å
74	A	81.7	Confident	79.9	Confident	41 Å²	41	34.7 Å²	34.7	34%	0.339	21%	0.211	S	C	.	.	H	α-helix	trans	-60.8	-36.6	-176.6	0	0	0	0	0	112.4	A70 K71 A116 K121	A70-A74 WeakPolarHBondContact O-CB 3.05Å; A70-A74 PolarHBondContact O-N 3.39Å; K71-A74 WeakPolarHBondContact O-CB 3.32Å; K71-A74 PolarHBondContact O-N 3.34Å; K71-A74 VanDerWaalsContact O-N 3.1Å; A74-A116 HydrophobicContact CB-CB 4.46Å; A74-K121 PolarHBondContact O-NZ 3.05Å
75	V	80.6	Confident	79.7	Confident	50 Å²	50	33.3 Å²	33.3	30%	0.303	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.9	179.8	-57.4	0	0	0	0	114	K71 A72 V73	K71-V75 PolarHBondContact O-N 3.09Å; A72-V75 WeakPolarHBondContact O-CG2 3.46Å; V73-V75 VanDerWaalsContact C-N 3.27Å; V73-V75 PolarHBondContact O-N 3.37Å
76	L	81	Confident	79.5	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.031	23%	0.23	C	C	.	.	S	Bend	trans	-67.5	131.6	-178	-172.1	70.3	0	0	0	111.5	Y35 I40 A72 V73 E80 A81 F84 K121	Y35-L76 HydrophobicContact CE2-CD1 4.1Å; I40-L76 HydrophobicContact CD1-CB 3.95Å; I40-L76 HydrophobicContact CD1-CD1 3.23Å; I40-L76 HydrophobicContact CD1-CG 4.15Å; I40-L76 HydrophobicContact CG2-CD1 4.35Å; A72-L76 PolarHBondContact O-N 3.45Å; V73-L76 VanDerWaalsContact O-CB 3.28Å; V73-L76 WeakPolarHBondContact O-CB 3.4Å; V73-L76 PolarHBondContact O-N 2.94Å; V73-L76 VanDerWaalsContact O-N 3.14Å; L76-E80 HydrophobicContact CD1-CB 4.01Å; L76-E80 HydrophobicContact CG-CB 4.35Å; L76-A81 HydrophobicContact CD2-CB 3.76Å; L76-A81 HydrophobicContact CG-CB 4.3Å; L76-F84 HydrophobicContact CD2-CB 3.85Å; L76-F84 HydrophobicContact CD2-CD1 3.48Å; L76-F84 VanDerWaalsContact CD2-CD1 3.48Å; L76-F84 HydrophobicContact CD2-CE1 4.11Å; L76-F84 HydrophobicContact CD2-CG 3.84Å; L76-K121 PolarHBondContact O-NZ 2.86Å
77	P	82.3	Confident	78.9	Confident	47 Å²	47	47.7 Å²	47.7	31%	0.305	26%	0.26	S	S	.	.			trans	-59.8	140	173.5	-23.5	32.5	0	0	0	111.4	Y35 G79 E80 A81	Y35-P77 HydrophobicContact CD1-CG 3.95Å; Y35-P77 HydrophobicContact CD2-CG 3.88Å; Y35-P77 HydrophobicContact CE1-CG 4Å; Y35-P77 HydrophobicContact CE2-CG 3.9Å; Y35-P77 HydrophobicContact CG-CG 3.89Å; P77-G79 PolarHBondContact O-N 3.16Å; P77-G79 VanDerWaalsContact O-N 3.12Å; P77-E80 PolarHBondContact O-N 2.87Å; P77-A81 PolarHBondContact O-N 3.14Å; P77-A81 VanDerWaalsContact O-N 3.14Å
78	E	83.7	Confident	78.7	Confident	71 Å²	71	46.4 Å²	46.4	33%	0.332	25%	0.254	S	S	.	.	H	α-helix	trans	-57.2	-33.4	-175.8	-65.8	-174.9	175.6	0	0	113.4	E80 K121 S122 H125	E78-E80 VanDerWaalsContact C-N 3.31Å; E78-E80 PolarHBondContact O-N 3.09Å; E78-K121 HydrophobicContact CG-CD 4.13Å; E78-S122 VanDerWaalsContact CD-OG 3.24Å; E78-S122 VanDerWaalsContact OE1-CB 3.31Å; E78-S122 WeakPolarHBondContact OE1-CB 3.47Å; E78-S122 PolarHBondContact OE1-N 2.77Å; E78-S122 PolarHBondContact OE1-OG 2.9Å; E78-S122 VanDerWaalsContact OE1-OG 3.1Å; E78-S122 PolarHBondContact OE2-OG 3.42Å; E78-H125 HydrophobicContact CB-CB 4.41Å; E78-H125 WeakPolarHBondContact CB-ND1 3.43Å; E78-H125 VanDerWaalsContact CD-CB 3.47Å; E78-H125 HydrophobicContact CG-CB 3.97Å; E78-H125 WeakPolarHBondContact OE2-CB 2.99Å
79	G	78.1	Confident	78.4	Confident	73 Å²	73	45.9 Å²	45.9	75%	0.753	25%	0.25	S	S	*	.	H	α-helix	trans	-67.2	-28.8	177.8	0	0	0	0	0	113.8	P77	P77-G79 PolarHBondContact O-N 3.16Å; P77-G79 VanDerWaalsContact O-N 3.12Å
80	E	74.8	Confident	78.2	Confident	88 Å²	88	45.9 Å²	45.9	41%	0.411	25%	0.25	S	S	.	.	H	α-helix	trans	-92.8	-26	-178	-65.5	-173.9	-159.1	0	0	112.6	Y35 L76 P77 E78 K82 S83	Y35-E80 VanDerWaalsContact OH-CD 3.25Å; Y35-E80 PolarHBondContact OH-OE1 3.24Å; Y35-E80 PolarHBondContact OH-OE2 3.25Å; L76-E80 HydrophobicContact CD1-CB 4.01Å; L76-E80 HydrophobicContact CG-CB 4.35Å; P77-E80 PolarHBondContact O-N 2.87Å; E78-E80 VanDerWaalsContact C-N 3.31Å; E78-E80 PolarHBondContact O-N 3.09Å; E80-K82 VanDerWaalsContact C-N 3.27Å; E80-K82 PolarHBondContact O-N 2.96Å; E80-S83 PolarHBondContact O-N 2.95Å; E80-S83 PolarHBondContact O-OG 3.21Å; E80-S83 VanDerWaalsContact O-OG 3.05Å
81	A	73.1	Confident	77.9	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-54.9	-34.1	-179.7	0	0	0	0	0	114.4	L76 P77 S83 F84 I85	L76-A81 HydrophobicContact CD2-CB 3.76Å; L76-A81 HydrophobicContact CG-CB 4.3Å; P77-A81 PolarHBondContact O-N 3.14Å; P77-A81 VanDerWaalsContact O-N 3.14Å; A81-S83 PolarHBondContact O-N 2.97Å; A81-F84 PolarHBondContact O-N 3.32Å; A81-I85 VanDerWaalsContact O-CB 3.29Å; A81-I85 WeakPolarHBondContact O-CB 3.13Å; A81-I85 PolarHBondContact O-N 3.2Å
82	K	70.5	Confident	77.7	Confident	118 Å²	118	52.5 Å²	52.5	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-64.2	-33.1	179	-94.3	-176	-178.2	167.9	0	115.1	E80 F84 I85 D128 M129	E80-K82 VanDerWaalsContact C-N 3.27Å; E80-K82 PolarHBondContact O-N 2.96Å; K82-F84 VanDerWaalsContact C-N 3.32Å; K82-I85 WeakPolarHBondContact O-CG2 3.44Å; K82-D128 VanDerWaalsContact CE-OD2 3.24Å; K82-D128 WeakPolarHBondContact CE-OD2 3.49Å; K82-D128 IonicContact NZ-OD2 3.88Å; K82-D128 PolarHBondContact NZ-OD2 3.39Å; K82-M129 HydrophobicContact CG-CE 3.87Å
83	S	70	Confident	77.4	Confident	91 Å²	91	52.2 Å²	52.2	64%	0.636	29%	0.286	S	S	*	.	H	α-helix	trans	-77.8	-29.3	177.4	72.8	0	0	0	0	111.3	E80 A81	E80-S83 PolarHBondContact O-N 2.95Å; E80-S83 PolarHBondContact O-OG 3.21Å; E80-S83 VanDerWaalsContact O-OG 3.05Å; A81-S83 PolarHBondContact O-N 2.97Å
84	F	72.6	Confident	77.2	Confident	26 Å²	26	53.5 Å²	53.5	11%	0.114	29%	0.292	C	S	.	.	H	α-helix	trans	-82.8	-40.8	-174	-165.4	-113.7	0	0	0	112.4	I40 V44 L69 V73 L76 A81 K82 R86 K87 I88	I40-F84 HydrophobicContact CG2-CD2 4.46Å; I40-F84 HydrophobicContact CG2-CE1 4.06Å; I40-F84 HydrophobicContact CG2-CE2 3.56Å; I40-F84 HydrophobicContact CG2-CZ 3.29Å; V44-F84 HydrophobicContact CB-CE2 4.44Å; V44-F84 HydrophobicContact CG2-CD2 4.47Å; V44-F84 HydrophobicContact CG2-CE1 4.3Å; V44-F84 HydrophobicContact CG2-CE2 3.17Å; V44-F84 HydrophobicContact CG2-CZ 3.06Å; L69-F84 HydrophobicContact CD1-CZ 4.33Å; V73-F84 HydrophobicContact CG2-CD1 4.36Å; V73-F84 HydrophobicContact CG2-CE1 3.71Å; L76-F84 HydrophobicContact CD2-CB 3.85Å; L76-F84 HydrophobicContact CD2-CD1 3.48Å; L76-F84 VanDerWaalsContact CD2-CD1 3.48Å; L76-F84 HydrophobicContact CD2-CE1 4.11Å; L76-F84 HydrophobicContact CD2-CG 3.84Å; A81-F84 PolarHBondContact O-N 3.32Å; K82-F84 VanDerWaalsContact C-N 3.32Å; F84-R86 PolarHBondContact O-N 2.94Å; F84-K87 PolarHBondContact O-N 3.43Å; F84-I88 HydrophobicContact CD1-CD1 3.46Å; F84-I88 VanDerWaalsContact CD1-CD1 3.46Å; F84-I88 HydrophobicContact CE1-CD1 3.06Å; F84-I88 HydrophobicContact CE1-CG1 4.38Å; F84-I88 HydrophobicContact CE2-CD1 4.22Å; F84-I88 HydrophobicContact CG-CD1 4.22Å; F84-I88 HydrophobicContact CZ-CD1 3.5Å; F84-I88 VanDerWaalsContact CZ-CD1 3.5Å; F84-I88 PolarHBondContact O-N 2.84Å
85	I	76.2	Confident	77.3	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.015	28%	0.276	C	S	.	.	H	α-helix	trans	-51.4	-42.6	179.6	-165.7	84.3	0	0	0	111.5	A81 K82 K87 I88 A89 G90 L117 M129 F132	A81-I85 VanDerWaalsContact O-CB 3.29Å; A81-I85 WeakPolarHBondContact O-CB 3.13Å; A81-I85 PolarHBondContact O-N 3.2Å; K82-I85 WeakPolarHBondContact O-CG2 3.44Å; I85-K87 VanDerWaalsContact C-N 3.29Å; I85-K87 PolarHBondContact O-N 3.4Å; I85-I88 PolarHBondContact O-N 3.32Å; I85-A89 HydrophobicContact CD1-CB 4.23Å; I85-A89 HydrophobicContact CG1-CB 4.19Å; I85-A89 WeakPolarHBondContact O-CA 3.26Å; I85-A89 WeakPolarHBondContact O-CB 3.43Å; I85-A89 PolarHBondContact O-N 3.21Å; I85-G90 PolarHBondContact O-N 2.88Å; I85-L117 HydrophobicContact CD1-CB 4.19Å; I85-L117 HydrophobicContact CD1-CD1 3.12Å; I85-L117 HydrophobicContact CD1-CD2 3.21Å; I85-L117 HydrophobicContact CD1-CG 3.61Å; I85-L117 HydrophobicContact CG1-CD1 4.42Å; I85-M129 HydrophobicContact CB-SD 4.29Å; I85-M129 HydrophobicContact CD1-SD 3.42Å; I85-M129 WeakPolarHBondContact CD1-SD 3.39Å; I85-M129 HydrophobicContact CG1-SD 3.82Å; I85-F132 HydrophobicContact CG1-CD1 3.73Å; I85-F132 HydrophobicContact CG1-CE1 3.72Å; I85-F132 HydrophobicContact CG1-CG 4.39Å; I85-F132 HydrophobicContact CG1-CZ 4.36Å; I85-F132 HydrophobicContact CG2-CD1 4.19Å; I85-F132 HydrophobicContact CG2-CD2 4.04Å; I85-F132 HydrophobicContact CG2-CE1 4.1Å; I85-F132 HydrophobicContact CG2-CE2 3.93Å; I85-F132 HydrophobicContact CG2-CG 4.18Å; I85-F132 HydrophobicContact CG2-CZ 3.98Å
86	R	78.2	Confident	77.3	Confident	155 Å²	155	49.3 Å²	49.3	59%	0.585	26%	0.262	S	S	*	.	H	α-helix	trans	-65.7	-33.5	-176.6	178.4	167.3	-89	-149.3	-8.8	112.3	F84 I88 G90 F132 E136	F84-R86 PolarHBondContact O-N 2.94Å; R86-I88 VanDerWaalsContact C-N 3.34Å; R86-G90 WeakPolarHBondContact O-CA 3.3Å; R86-G90 PolarHBondContact O-N 3.25Å; R86-F132 HydrophobicContact CB-CE2 4.13Å; R86-F132 HydrophobicContact CB-CZ 4.11Å; R86-E136 IonicContact CZ-OE1 2.81Å; R86-E136 IonicContact NE-OE1 3.07Å; R86-E136 PolarHBondContact NE-OE1 2.91Å; R86-E136 IonicContact NH2-OE1 3.26Å; R86-E136 PolarHBondContact NH2-OE1 3.18Å
87	K	75.7	Confident	77.2	Confident	146 Å²	146	53.1 Å²	53.1	64%	0.635	28%	0.28	S	S	*	.	H	α-helix	trans	-75.5	-23.7	178.7	-65.6	-179.2	178.9	176.2	0	113.2	F84 I85 G93 M94	F84-K87 PolarHBondContact O-N 3.43Å; I85-K87 VanDerWaalsContact C-N 3.29Å; I85-K87 PolarHBondContact O-N 3.4Å; K87-G93 WeakPolarHBondContact O-CA 3.44Å; K87-M94 PolarHBondContact O-N 3.45Å
88	I	77.7	Confident	77.2	Confident	2 Å²	2	51 Å²	51	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-102.8	-51.3	-174.8	-65	179.5	0	0	0	110.8	L69 V73 F84 I85 R86 G93 M94 V95 T113	L69-I88 HydrophobicContact CD1-CD1 3.77Å; L69-I88 HydrophobicContact CD2-CD1 4.06Å; L69-I88 HydrophobicContact CD2-CG1 4.36Å; L69-I88 HydrophobicContact CD2-CG2 4.12Å; L69-I88 HydrophobicContact CG-CD1 4.14Å; V73-I88 HydrophobicContact CG2-CD1 4.05Å; F84-I88 HydrophobicContact CD1-CD1 3.46Å; F84-I88 VanDerWaalsContact CD1-CD1 3.46Å; F84-I88 HydrophobicContact CE1-CD1 3.06Å; F84-I88 HydrophobicContact CE1-CG1 4.38Å; F84-I88 HydrophobicContact CE2-CD1 4.22Å; F84-I88 HydrophobicContact CG-CD1 4.22Å; F84-I88 HydrophobicContact CZ-CD1 3.5Å; F84-I88 VanDerWaalsContact CZ-CD1 3.5Å; F84-I88 PolarHBondContact O-N 2.84Å; I85-I88 PolarHBondContact O-N 3.32Å; R86-I88 VanDerWaalsContact C-N 3.34Å; I88-G93 CarbonylContact O-C 3.59Å; I88-G93 VanDerWaalsContact O-C 3.31Å; I88-G93 WeakPolarHBondContact O-CA 3.5Å; I88-M94 PolarHBondContact O-N 3.1Å; I88-V95 HydrophobicContact CG2-CB 4Å; I88-V95 HydrophobicContact CG2-CG2 3.48Å; I88-V95 VanDerWaalsContact CG2-CG2 3.48Å; I88-V95 WeakPolarHBondContact O-CB 3.42Å; I88-V95 PolarHBondContact O-N 2.9Å; I88-T113 HydrophobicContact CG2-CG2 4.27Å
89	A	77.4	Confident	76.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-115.6	-2.3	-167.2	0	0	0	0	0	114	I85 F114 L117 F184	I85-A89 HydrophobicContact CD1-CB 4.23Å; I85-A89 HydrophobicContact CG1-CB 4.19Å; I85-A89 WeakPolarHBondContact O-CA 3.26Å; I85-A89 WeakPolarHBondContact O-CB 3.43Å; I85-A89 PolarHBondContact O-N 3.21Å; A89-F114 HydrophobicContact CB-CD2 3.83Å; A89-F114 HydrophobicContact CB-CE2 3.31Å; A89-F114 HydrophobicContact CB-CZ 3.81Å; A89-L117 HydrophobicContact CB-CD1 4.1Å; A89-F184 WeakPolarHBondContact O-CE1 3.47Å
90	G	80.9	Confident	76.3	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.241	C	C	.	.	S	Bend	trans	-72.6	178.3	172	0	0	0	0	0	112.7	I85 R86 D92 G93	I85-G90 PolarHBondContact O-N 2.88Å; R86-G90 WeakPolarHBondContact O-CA 3.3Å; R86-G90 PolarHBondContact O-N 3.25Å; G90-D92 VanDerWaalsContact C-N 3.28Å; G90-D92 PolarHBondContact O-N 3.16Å; G90-G93 VanDerWaalsContact O-CA 3.27Å; G90-G93 WeakPolarHBondContact O-CA 3.29Å; G90-G93 PolarHBondContact O-N 3.39Å
91	T	77.4	Confident	76.1	Confident	33 Å²	33	48 Å²	48	20%	0.202	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-42.2	177.3	11.3	0	0	0	0	113.7	E136 L140 Q180 F184	T91-E136 PolarHBondContact N-OE2 3.47Å; T91-E136 PolarHBondContact OG1-OE2 2.97Å; T91-L140 HydrophobicContact CG2-CD1 3.5Å; T91-L140 HydrophobicContact CG2-CD2 3.36Å; T91-L140 HydrophobicContact CG2-CG 3.48Å; T91-L140 VanDerWaalsContact CG2-CG 3.48Å; T91-Q180 PolarHBondContact O-NE2 2.82Å; T91-F184 HydrophobicContact CG2-CE2 4.23Å
92	D	75.2	Confident	75.7	Confident	138 Å²	138	58.3 Å²	58.3	74%	0.738	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	8.4	174.8	-63.2	-43.6	0	0	0	112.4	G90	G90-D92 VanDerWaalsContact C-N 3.28Å; G90-D92 PolarHBondContact O-N 3.16Å
93	G	76.6	Confident	76.2	Confident	4 Å²	4	53.4 Å²	53.4	4%	0.041	25%	0.252	C	S	.	.			trans	-70.1	138.9	-177.7	0	0	0	0	0	112	K87 I88 G90 V95	K87-G93 WeakPolarHBondContact O-CA 3.44Å; I88-G93 CarbonylContact O-C 3.59Å; I88-G93 VanDerWaalsContact O-C 3.31Å; I88-G93 WeakPolarHBondContact O-CA 3.5Å; G90-G93 VanDerWaalsContact O-CA 3.27Å; G90-G93 WeakPolarHBondContact O-CA 3.29Å; G90-G93 PolarHBondContact O-N 3.39Å; G93-V95 VanDerWaalsContact C-N 3.25Å; G93-V95 PolarHBondContact O-N 2.86Å
94	M	77.4	Confident	76.6	Confident	29 Å²	29	57.3 Å²	57.3	14%	0.143	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-25	-174.7	69.5	-173.1	72.4	0	0	113.9	V44 C47 S48 L51 K87 I88 Q97	V44-M94 HydrophobicContact CG1-CE 4.37Å; C47-M94 HydrophobicContact CB-SD 4.27Å; S48-M94 VanDerWaalsContact OG-CE 3.23Å; S48-M94 WeakPolarHBondContact OG-CE 3.29Å; L51-M94 HydrophobicContact CD1-CB 3.71Å; L51-M94 HydrophobicContact CD1-CG 3.63Å; L51-M94 HydrophobicContact CD1-SD 3.96Å; K87-M94 PolarHBondContact O-N 3.45Å; I88-M94 PolarHBondContact O-N 3.1Å; M94-Q97 WeakPolarHBondContact O-CG 3.48Å; M94-Q97 PolarHBondContact O-NE2 3.28Å
95	V	83.4	Confident	76.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-34.7	-174.3	179.3	0	0	0	0	112.1	L66 L69 I88 G93 Q97 L98 A110 T113	L66-V95 HydrophobicContact CD2-CG1 4.39Å; L66-V95 HydrophobicContact CD2-CG2 4.02Å; L69-V95 HydrophobicContact CD2-CG2 3.98Å; I88-V95 HydrophobicContact CG2-CB 4Å; I88-V95 HydrophobicContact CG2-CG2 3.48Å; I88-V95 VanDerWaalsContact CG2-CG2 3.48Å; I88-V95 WeakPolarHBondContact O-CB 3.42Å; I88-V95 PolarHBondContact O-N 2.9Å; G93-V95 VanDerWaalsContact C-N 3.25Å; G93-V95 PolarHBondContact O-N 2.86Å; V95-Q97 VanDerWaalsContact C-N 3.28Å; V95-Q97 PolarHBondContact O-N 3.44Å; V95-L98 VanDerWaalsContact O-CB 3.31Å; V95-L98 WeakPolarHBondContact O-CB 3.47Å; V95-L98 PolarHBondContact O-N 3.35Å; V95-A110 HydrophobicContact CG1-CB 3.85Å; V95-A110 WeakPolarHBondContact CG1-O 3.48Å; V95-T113 HydrophobicContact CG2-CG2 4.23Å
96	L	82.3	Confident	77.2	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-55.9	-44.4	-176.9	-177.6	68.4	0	0	0	111.9	L98 C99 D183 F184 V187	L96-L98 PolarHBondContact O-N 2.05Å; L96-C99 VanDerWaalsContact O-CB 3.31Å; L96-C99 WeakPolarHBondContact O-CB 3.06Å; L96-C99 PolarHBondContact O-N 3.41Å; L96-D183 HydrophobicContact CD1-CB 3.76Å; L96-D183 HydrophobicContact CG-CB 3.86Å; L96-F184 HydrophobicContact CD1-CD1 3.8Å; L96-F184 HydrophobicContact CD1-CD2 4.37Å; L96-F184 HydrophobicContact CD1-CE1 3.9Å; L96-F184 HydrophobicContact CD1-CE2 4.47Å; L96-F184 HydrophobicContact CD1-CG 4.05Å; L96-F184 HydrophobicContact CD1-CZ 4.25Å; L96-F184 HydrophobicContact CD2-CD1 4.41Å; L96-F184 HydrophobicContact CD2-CD2 3.82Å; L96-F184 HydrophobicContact CD2-CE1 4.02Å; L96-F184 HydrophobicContact CD2-CE2 3.37Å; L96-F184 HydrophobicContact CD2-CG 4.32Å; L96-F184 HydrophobicContact CD2-CZ 3.49Å; L96-F184 VanDerWaalsContact CD2-CZ 3.49Å; L96-F184 HydrophobicContact CG-CZ 4.5Å; L96-V187 HydrophobicContact CD1-CG2 4.35Å
97	Q	78.1	Confident	77.4	Confident	87 Å²	87	56.8 Å²	56.8	41%	0.407	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-62.3	-10.2	178	60.1	174.3	-10.8	0	0	114.9	M94 V95	M94-Q97 WeakPolarHBondContact O-CG 3.48Å; M94-Q97 PolarHBondContact O-NE2 3.28Å; V95-Q97 VanDerWaalsContact C-N 3.28Å; V95-Q97 PolarHBondContact O-N 3.44Å
98	L	81.1	Confident	77.7	Confident	2 Å²	2	54 Å²	54	1%	0.01	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-94.1	-12.3	177.9	-55.2	173.9	0	0	0	112.2	L51 L66 V95 L96 H100 D101 V106 A110	L51-L98 HydrophobicContact CD1-CD1 3.97Å; L51-L98 HydrophobicContact CD2-CD1 3.44Å; L51-L98 VanDerWaalsContact CD2-CD1 3.44Å; L51-L98 HydrophobicContact CD2-CD2 4.05Å; L51-L98 HydrophobicContact CD2-CG 4.3Å; L51-L98 HydrophobicContact CG-CD1 4.36Å; L66-L98 HydrophobicContact CD1-CD1 3.99Å; L66-L98 HydrophobicContact CD2-CD1 3.81Å; L66-L98 HydrophobicContact CG-CD1 4.39Å; V95-L98 VanDerWaalsContact O-CB 3.31Å; V95-L98 WeakPolarHBondContact O-CB 3.47Å; V95-L98 PolarHBondContact O-N 3.35Å; L96-L98 PolarHBondContact O-N 2.05Å; L98-H100 PolarHBondContact O-N 3.2Å; L98-D101 WeakPolarHBondContact O-CB 3.5Å; L98-D101 PolarHBondContact O-N 3Å; L98-D101 VanDerWaalsContact O-N 3.09Å; L98-V106 HydrophobicContact CB-CG1 4.13Å; L98-V106 HydrophobicContact CD1-CG1 4.43Å; L98-V106 HydrophobicContact CD2-CG1 4.25Å; L98-A110 HydrophobicContact CB-CB 3.66Å; L98-A110 HydrophobicContact CD1-CB 4.44Å
99	C	74.1	Confident	78.1	Confident	2 Å²	2	57 Å²	57	1%	0.014	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.5	178.5	-65.4	0	0	0	0	113.4	L96 N107 V187	L96-C99 VanDerWaalsContact O-CB 3.31Å; L96-C99 WeakPolarHBondContact O-CB 3.06Å; L96-C99 PolarHBondContact O-N 3.41Å; C99-N107 PolarHBondContact O-ND2 2.94Å; C99-V187 HydrophobicContact CB-CG2 4.11Å; C99-V187 WeakPolarHBondContact SG-CG2 3.4Å
100	H	70.8	Confident	78.5	Confident	120 Å²	120	57 Å²	57	56%	0.556	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	20.6	171.3	-157.5	-57.8	0	0	0	112.1	L98 D183	L98-H100 PolarHBondContact O-N 3.2Å; H100-D183 WeakPolarHBondContact CB-OD1 3.46Å; H100-D183 IonicContact CG-OD1 3.84Å
101	D	70.6	Confident	78.6	Confident	46 Å²	46	58 Å²	58	25%	0.246	27%	0.269	C	S	.	.			trans	-62	148.1	173.7	-158.5	-72.8	0	0	0	110.9	R54 L98 S103 V106	R54-D101 IonicContact NH1-OD2 3.44Å; L98-D101 WeakPolarHBondContact O-CB 3.5Å; L98-D101 PolarHBondContact O-N 3Å; L98-D101 VanDerWaalsContact O-N 3.09Å; D101-S103 PolarHBondContact O-N 3.38Å; D101-S103 PolarHBondContact OD1-N 3.49Å; D101-V106 HydrophobicContact CB-CB 4.46Å; D101-V106 HydrophobicContact CB-CG1 4.19Å
102	R	64.5	Low	78.9	Confident	221 Å²	221	60.2 Å²	60.2	83%	0.834	28%	0.276	S	S	*	.	S	Bend	trans	-65.6	-26.9	178.3	-69.2	-173	178.6	177.8	3	111.4	K104	R102-K104 PolarHBondContact O-N 3.23Å
103	S	79.4	Confident	79.3	Confident	15 Å²	15	53.7 Å²	53.7	11%	0.105	24%	0.241	C	C	.	.			trans	-78.1	114.1	177	-175.3	0	0	0	0	111.3	D59 D101 F105 V106 N107	D59-S103 WeakPolarHBondContact OD2-CB 3.39Å; D59-S103 PolarHBondContact OD2-OG 3.21Å; D101-S103 PolarHBondContact O-N 3.38Å; D101-S103 PolarHBondContact OD1-N 3.49Å; S103-F105 PolarHBondContact O-N 3.34Å; S103-V106 PolarHBondContact O-N 3.15Å; S103-N107 PolarHBondContact O-N 3.32Å
104	K	80.1	Confident	79.7	Confident	172 Å²	172	53.6 Å²	53.6	75%	0.748	24%	0.239	S	C	*	.	H	α-helix	trans	-56.7	-34.3	174.3	-72.9	-173.7	178.8	-179	0	112.1	R102 I108	R102-K104 PolarHBondContact O-N 3.23Å; K104-I108 WeakPolarHBondContact O-CD1 3.38Å; K104-I108 VanDerWaalsContact O-CG1 3.29Å; K104-I108 WeakPolarHBondContact O-CG1 3.3Å; K104-I108 PolarHBondContact O-N 3.35Å
105	F	77.6	Confident	79.8	Confident	141 Å²	141	52.4 Å²	52.4	62%	0.618	23%	0.234	S	C	*	.	H	α-helix	trans	-67.9	-51.5	178.8	-71	-72.9	0	0	0	110.8	S103 N107 I108 Y109	S103-F105 PolarHBondContact O-N 3.34Å; F105-N107 VanDerWaalsContact C-N 3.25Å; F105-N107 PolarHBondContact O-N 3.46Å; F105-I108 PolarHBondContact O-N 2.91Å; F105-I108 VanDerWaalsContact O-N 3.1Å; F105-Y109 VanDerWaalsContact O-CD2 3.27Å; F105-Y109 WeakPolarHBondContact O-CD2 3.43Å; F105-Y109 PolarHBondContact O-N 3.49Å
106	V	83.8	Confident	79.8	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-57.1	-42.1	178.7	176.3	0	0	0	0	111	D59 V62 L66 L98 D101 S103 I108 Y109 A110	D59-V106 HydrophobicContact CB-CG2 4.13Å; V62-V106 HydrophobicContact CB-CG2 4.34Å; V62-V106 HydrophobicContact CG1-CG1 3.89Å; V62-V106 HydrophobicContact CG1-CG2 4.13Å; L66-V106 HydrophobicContact CD1-CG1 4.17Å; L98-V106 HydrophobicContact CB-CG1 4.13Å; L98-V106 HydrophobicContact CD1-CG1 4.43Å; L98-V106 HydrophobicContact CD2-CG1 4.25Å; D101-V106 HydrophobicContact CB-CB 4.46Å; D101-V106 HydrophobicContact CB-CG1 4.19Å; S103-V106 PolarHBondContact O-N 3.15Å; V106-I108 PolarHBondContact O-N 3.27Å; V106-Y109 PolarHBondContact O-N 2.86Å; V106-A110 VanDerWaalsContact O-CB 3.3Å; V106-A110 WeakPolarHBondContact O-CB 3.27Å; V106-A110 PolarHBondContact O-N 3.47Å
107	N	82.2	Confident	79.8	Confident	30 Å²	30	52.8 Å²	52.8	16%	0.16	24%	0.237	C	C	.	.	H	α-helix	trans	-56.5	-50.6	175.3	-174.1	-55.4	0	0	0	112.4	C99 S103 F105 Y109 A110 F111 Q190	C99-N107 PolarHBondContact O-ND2 2.94Å; S103-N107 PolarHBondContact O-N 3.32Å; F105-N107 VanDerWaalsContact C-N 3.25Å; F105-N107 PolarHBondContact O-N 3.46Å; N107-Y109 VanDerWaalsContact C-N 3.33Å; N107-Y109 PolarHBondContact O-N 3Å; N107-A110 PolarHBondContact O-N 3.32Å; N107-F111 PolarHBondContact O-N 2.59Å; N107-Q190 PolarHBondContact OD1-NE2 3.49Å
108	I	82	Confident	79.8	Confident	88 Å²	88	49 Å²	49	45%	0.451	22%	0.219	S	C	.	.	H	α-helix	trans	-60.2	-43.7	179.7	-69.9	165.4	0	0	0	110.9	K104 F105 V106 F111 K112	K104-I108 WeakPolarHBondContact O-CD1 3.38Å; K104-I108 VanDerWaalsContact O-CG1 3.29Å; K104-I108 WeakPolarHBondContact O-CG1 3.3Å; K104-I108 PolarHBondContact O-N 3.35Å; F105-I108 PolarHBondContact O-N 2.91Å; F105-I108 VanDerWaalsContact O-N 3.1Å; V106-I108 PolarHBondContact O-N 3.27Å; I108-F111 PolarHBondContact O-N 3Å; I108-K112 WeakPolarHBondContact O-CG 3.37Å; I108-K112 PolarHBondContact O-N 3.35Å
109	Y	84.5	Confident	79.6	Confident	64 Å²	64	52.4 Å²	52.4	25%	0.251	23%	0.232	S	C	.	.	H	α-helix	trans	-72	-34.3	180	-78	-81.3	0	0	0	112.6	C63 L67 F105 V106 N107 K112 T113	C63-Y109 HydrophobicContact CB-CD2 3.57Å; C63-Y109 HydrophobicContact CB-CE2 3.91Å; C63-Y109 HydrophobicContact CB-CG 3.91Å; C63-Y109 WeakPolarHBondContact SG-CD2 3.33Å; L67-Y109 HydrophobicContact CB-CD1 4.17Å; L67-Y109 HydrophobicContact CB-CE1 4.31Å; L67-Y109 HydrophobicContact CD1-CD1 3.96Å; L67-Y109 HydrophobicContact CD1-CE1 3.81Å; L67-Y109 HydrophobicContact CD2-CE1 4.29Å; L67-Y109 HydrophobicContact CG-CE1 4.36Å; F105-Y109 VanDerWaalsContact O-CD2 3.27Å; F105-Y109 WeakPolarHBondContact O-CD2 3.43Å; F105-Y109 PolarHBondContact O-N 3.49Å; V106-Y109 PolarHBondContact O-N 2.86Å; N107-Y109 VanDerWaalsContact C-N 3.33Å; N107-Y109 PolarHBondContact O-N 3Å; Y109-K112 HydrophobicContact CD1-CD 4.27Å; Y109-K112 HydrophobicContact CE1-CD 4.46Å; Y109-K112 WeakPolarHBondContact O-CB 3.32Å; Y109-K112 PolarHBondContact O-N 2.97Å; Y109-T113 PolarHBondContact O-N 3.25Å; Y109-T113 PolarHBondContact O-OG1 3.31Å; Y109-T113 VanDerWaalsContact O-OG1 3.05Å
110	A	85.9	Confident	79.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-44.5	172.4	0	0	0	0	0	110.7	L66 V95 L98 V106 N107 K112 T113 F114	L66-A110 HydrophobicContact CD1-CB 4.22Å; V95-A110 HydrophobicContact CG1-CB 3.85Å; V95-A110 WeakPolarHBondContact CG1-O 3.48Å; L98-A110 HydrophobicContact CB-CB 3.66Å; L98-A110 HydrophobicContact CD1-CB 4.44Å; V106-A110 VanDerWaalsContact O-CB 3.3Å; V106-A110 WeakPolarHBondContact O-CB 3.27Å; V106-A110 PolarHBondContact O-N 3.47Å; N107-A110 PolarHBondContact O-N 3.32Å; A110-K112 VanDerWaalsContact C-N 3.34Å; A110-K112 PolarHBondContact O-N 2.75Å; A110-T113 WeakPolarHBondContact O-CB 3.36Å; A110-T113 PolarHBondContact O-N 3.29Å; A110-F114 PolarHBondContact O-N 2.81Å
111	F	83.1	Confident	80.1	Confident	20 Å²	20	52.9 Å²	52.9	9%	0.088	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-41.9	172.8	178.1	-104.6	0	0	0	111.8	N107 I108 T113 F114 S115 Q190 L191 D194	N107-F111 PolarHBondContact O-N 2.59Å; I108-F111 PolarHBondContact O-N 3Å; F111-T113 VanDerWaalsContact C-N 3.33Å; F111-T113 PolarHBondContact O-N 2.85Å; F111-F114 CarbonylContact O-C 3.31Å; F111-F114 WeakPolarHBondContact O-CA 3.48Å; F111-F114 WeakPolarHBondContact O-CB 3.34Å; F111-F114 PolarHBondContact O-N 2.77Å; F111-S115 WeakPolarHBondContact O-CB 3.42Å; F111-S115 PolarHBondContact O-N 3.33Å; F111-S115 PolarHBondContact O-OG 3.36Å; F111-Q190 HydrophobicContact CD1-CB 4.43Å; F111-Q190 HydrophobicContact CD2-CB 3.49Å; F111-Q190 VanDerWaalsContact CD2-CB 3.49Å; F111-Q190 HydrophobicContact CD2-CG 4.26Å; F111-Q190 HydrophobicContact CE1-CB 4.18Å; F111-Q190 HydrophobicContact CE2-CB 3.16Å; F111-Q190 HydrophobicContact CE2-CG 4.36Å; F111-Q190 HydrophobicContact CG-CB 4.12Å; F111-Q190 VanDerWaalsContact CG-OE1 3.31Å; F111-Q190 VanDerWaalsContact CZ-C 3.48Å; F111-Q190 HydrophobicContact CZ-CB 3.55Å; F111-L191 HydrophobicContact CE2-CB 4.47Å; F111-L191 HydrophobicContact CE2-CD2 3.76Å; F111-L191 HydrophobicContact CE2-CG 3.83Å; F111-L191 HydrophobicContact CZ-CD2 3.92Å; F111-L191 HydrophobicContact CZ-CG 4.29Å; F111-D194 HydrophobicContact CZ-CB 4.38Å
112	K	83.6	Confident	80.5	Confident	81 Å²	81	52.5 Å²	52.5	35%	0.352	26%	0.258	S	S	.	.	H	α-helix	trans	-57.5	-46	175.3	-79.8	-175.7	175.4	-171.8	0	111.9	I108 Y109 A110 F114 S115 A116	I108-K112 WeakPolarHBondContact O-CG 3.37Å; I108-K112 PolarHBondContact O-N 3.35Å; Y109-K112 HydrophobicContact CD1-CD 4.27Å; Y109-K112 HydrophobicContact CE1-CD 4.46Å; Y109-K112 WeakPolarHBondContact O-CB 3.32Å; Y109-K112 PolarHBondContact O-N 2.97Å; A110-K112 VanDerWaalsContact C-N 3.34Å; A110-K112 PolarHBondContact O-N 2.75Å; K112-F114 PolarHBondContact O-N 2.96Å; K112-S115 WeakPolarHBondContact CA-OG 3.23Å; K112-S115 PolarHBondContact O-N 3.38Å; K112-S115 PolarHBondContact O-OG 3Å; K112-A116 PolarHBondContact O-N 3.39Å
113	T	85.4	Confident	81.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.4	-40	174.1	-48.7	0	0	0	0	111.6	L66 L69 A70 I88 V95 Y109 A110 F111 A116	L66-T113 PolarHBondContact O-OG1 2.81Å; L69-T113 HydrophobicContact CB-CG2 4.09Å; L69-T113 HydrophobicContact CD2-CG2 3.84Å; L69-T113 HydrophobicContact CG-CG2 3.74Å; A70-T113 HydrophobicContact CB-CG2 4.48Å; I88-T113 HydrophobicContact CG2-CG2 4.27Å; V95-T113 HydrophobicContact CG2-CG2 4.23Å; Y109-T113 PolarHBondContact O-N 3.25Å; Y109-T113 PolarHBondContact O-OG1 3.31Å; Y109-T113 VanDerWaalsContact O-OG1 3.05Å; A110-T113 WeakPolarHBondContact O-CB 3.36Å; A110-T113 PolarHBondContact O-N 3.29Å; F111-T113 VanDerWaalsContact C-N 3.33Å; F111-T113 PolarHBondContact O-N 2.85Å; T113-A116 WeakPolarHBondContact O-CB 3.36Å
114	F	83.5	Confident	81.2	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.009	27%	0.27	C	S	.	.	H	α-helix	trans	-68.1	-44	177.1	-150.8	-71.7	0	0	0	112.2	A89 A110 F111 K112 A116 L117 F118 I133 V187 L191	A89-F114 HydrophobicContact CB-CD2 3.83Å; A89-F114 HydrophobicContact CB-CE2 3.31Å; A89-F114 HydrophobicContact CB-CZ 3.81Å; A110-F114 PolarHBondContact O-N 2.81Å; F111-F114 CarbonylContact O-C 3.31Å; F111-F114 WeakPolarHBondContact O-CA 3.48Å; F111-F114 WeakPolarHBondContact O-CB 3.34Å; F111-F114 PolarHBondContact O-N 2.77Å; K112-F114 PolarHBondContact O-N 2.96Å; F114-A116 VanDerWaalsContact C-N 3.27Å; F114-A116 PolarHBondContact O-N 3.32Å; F114-L117 HydrophobicContact CD1-CD1 4.22Å; F114-L117 HydrophobicContact CE1-CD1 4.4Å; F114-L117 HydrophobicContact CG-CD1 4.4Å; F114-L117 VanDerWaalsContact O-CB 3.27Å; F114-L117 WeakPolarHBondContact O-CB 3.08Å; F114-L117 VanDerWaalsContact O-CD1 3.26Å; F114-L117 WeakPolarHBondContact O-CD1 3.47Å; F114-L117 WeakPolarHBondContact O-CG 3.41Å; F114-L117 PolarHBondContact O-N 2.83Å; F114-F118 AromaticContact CD1-CE2 3.91Å; F114-F118 HydrophobicContact CD1-CE2 3.91Å; F114-F118 AromaticContact CE1-CE2 3.97Å; F114-F118 HydrophobicContact CE1-CE2 3.97Å; F114-F118 HydrophobicContact CE1-CZ 4.32Å; F114-F118 WeakPolarHBondContact O-CD2 3.29Å; F114-F118 WeakPolarHBondContact O-CE2 3.3Å; F114-I133 HydrophobicContact CE1-CD1 3.56Å; F114-I133 HydrophobicContact CE1-CG1 4.24Å; F114-I133 HydrophobicContact CZ-CD1 3.81Å; F114-I133 HydrophobicContact CZ-CG1 3.98Å; F114-V187 HydrophobicContact CD1-CG1 3.4Å; F114-V187 HydrophobicContact CD2-CG1 4.07Å; F114-V187 HydrophobicContact CD2-CG2 4.26Å; F114-V187 HydrophobicContact CE1-CG1 3.38Å; F114-V187 HydrophobicContact CE2-CG1 4.01Å; F114-V187 HydrophobicContact CE2-CG2 4.42Å; F114-V187 HydrophobicContact CG-CG1 3.77Å; F114-V187 HydrophobicContact CZ-CG1 3.7Å; F114-L191 HydrophobicContact CD1-CD1 4.31Å; F114-L191 HydrophobicContact CE1-CD1 4.24Å
115	S	80.7	Confident	81.3	Confident	4 Å²	4	44 Å²	44	3%	0.028	24%	0.236	C	C	.	.	H	α-helix	trans	-66.7	-26.8	178.9	65.9	0	0	0	0	113.2	F111 K112 L117 F118 Y119	F111-S115 WeakPolarHBondContact O-CB 3.42Å; F111-S115 PolarHBondContact O-N 3.33Å; F111-S115 PolarHBondContact O-OG 3.36Å; K112-S115 WeakPolarHBondContact CA-OG 3.23Å; K112-S115 PolarHBondContact O-N 3.38Å; K112-S115 PolarHBondContact O-OG 3Å; S115-L117 PolarHBondContact O-N 3.18Å; S115-L117 VanDerWaalsContact O-N 3.08Å; S115-F118 PolarHBondContact O-N 3.31Å; S115-Y119 WeakPolarHBondContact O-CD2 3.35Å; S115-Y119 PolarHBondContact O-N 3.34Å; S115-Y119 VanDerWaalsContact OG-CE2 3.3Å; S115-Y119 WeakPolarHBondContact OG-CE2 3.39Å
116	A	83.6	Confident	81.3	Confident	6 Å²	6	37.4 Å²	37.4	5%	0.05	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.7	175.2	0	0	0	0	0	113.5	A70 V73 A74 K112 T113 F114 F118	A70-A116 HydrophobicContact CB-CB 4.25Å; A70-A116 WeakPolarHBondContact O-CB 3.49Å; V73-A116 HydrophobicContact CB-CB 4.16Å; V73-A116 HydrophobicContact CG1-CB 3.86Å; A74-A116 HydrophobicContact CB-CB 4.46Å; K112-A116 PolarHBondContact O-N 3.39Å; T113-A116 WeakPolarHBondContact O-CB 3.36Å; F114-A116 VanDerWaalsContact C-N 3.27Å; F114-A116 PolarHBondContact O-N 3.32Å; A116-F118 PolarHBondContact O-N 3.46Å
117	L	81.1	Confident	80.8	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.026	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-16.4	174.7	-63.9	160.2	0	0	0	113.3	V73 I85 A89 F114 S115 H125	V73-L117 HydrophobicContact CG1-CD2 3.34Å; V73-L117 HydrophobicContact CG1-CG 3.78Å; I85-L117 HydrophobicContact CD1-CB 4.19Å; I85-L117 HydrophobicContact CD1-CD1 3.12Å; I85-L117 HydrophobicContact CD1-CD2 3.21Å; I85-L117 HydrophobicContact CD1-CG 3.61Å; I85-L117 HydrophobicContact CG1-CD1 4.42Å; A89-L117 HydrophobicContact CB-CD1 4.1Å; F114-L117 HydrophobicContact CD1-CD1 4.22Å; F114-L117 HydrophobicContact CE1-CD1 4.4Å; F114-L117 HydrophobicContact CG-CD1 4.4Å; F114-L117 VanDerWaalsContact O-CB 3.27Å; F114-L117 WeakPolarHBondContact O-CB 3.08Å; F114-L117 VanDerWaalsContact O-CD1 3.26Å; F114-L117 WeakPolarHBondContact O-CD1 3.47Å; F114-L117 WeakPolarHBondContact O-CG 3.41Å; F114-L117 PolarHBondContact O-N 2.83Å; S115-L117 PolarHBondContact O-N 3.18Å; S115-L117 VanDerWaalsContact O-N 3.08Å; L117-H125 PolarHBondContact O-NE2 3.01Å
118	F	78.8	Confident	80.8	Confident	6 Å²	6	39.2 Å²	39.2	3%	0.026	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-26.3	-174	-58.1	-88	0	0	0	112.4	F114 S115 A116 G120 V126 M129 I133 L191 L197 F202	F114-F118 AromaticContact CD1-CE2 3.91Å; F114-F118 HydrophobicContact CD1-CE2 3.91Å; F114-F118 AromaticContact CE1-CE2 3.97Å; F114-F118 HydrophobicContact CE1-CE2 3.97Å; F114-F118 HydrophobicContact CE1-CZ 4.32Å; F114-F118 WeakPolarHBondContact O-CD2 3.29Å; F114-F118 WeakPolarHBondContact O-CE2 3.3Å; S115-F118 PolarHBondContact O-N 3.31Å; A116-F118 PolarHBondContact O-N 3.46Å; F118-G120 PolarHBondContact O-N 3.09Å; F118-V126 HydrophobicContact CD1-CG1 4.04Å; F118-V126 HydrophobicContact CD1-CG2 4.37Å; F118-M129 HydrophobicContact CD1-CB 4.38Å; F118-M129 HydrophobicContact CE1-CB 3.7Å; F118-M129 HydrophobicContact CZ-CB 4.05Å; F118-I133 HydrophobicContact CZ-CD1 3.88Å; F118-L191 HydrophobicContact CD2-CD2 3.79Å; F118-L191 HydrophobicContact CE2-CD1 3.7Å; F118-L191 HydrophobicContact CE2-CD2 3.72Å; F118-L191 HydrophobicContact CE2-CG 4.39Å; F118-L191 HydrophobicContact CZ-CD1 3.75Å; F118-L191 HydrophobicContact CZ-CD2 4.48Å; F118-L197 HydrophobicContact CB-CD1 4.26Å; F118-L197 HydrophobicContact CB-CD2 3.46Å; F118-L197 VanDerWaalsContact CB-CD2 3.46Å; F118-F202 HydrophobicContact CB-CE2 4.11Å; F118-F202 AromaticContact CD1-CE2 3.58Å; F118-F202 HydrophobicContact CD1-CE2 3.58Å; F118-F202 AromaticContact CD1-CZ 3.71Å; F118-F202 HydrophobicContact CD1-CZ 3.71Å; F118-F202 HydrophobicContact CD2-CZ 4.47Å; F118-F202 HydrophobicContact CE1-CE2 4.16Å; F118-F202 AromaticContact CE1-CZ 3.88Å; F118-F202 HydrophobicContact CE1-CZ 3.88Å; F118-F202 AromaticContact CG-CE2 3.92Å; F118-F202 HydrophobicContact CG-CE2 3.92Å; F118-F202 HydrophobicContact CG-CZ 4.02Å; F118-F202 HydrophobicContact CZ-CZ 4.34Å
119	Y	77.5	Confident	80.6	Confident	74 Å²	74	35.1 Å²	35.1	29%	0.29	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	130.5	-176.1	-69.3	-51.4	0	0	0	113.3	S115 K121 D194 S196 L197	S115-Y119 WeakPolarHBondContact O-CD2 3.35Å; S115-Y119 PolarHBondContact O-N 3.34Å; S115-Y119 VanDerWaalsContact OG-CE2 3.3Å; S115-Y119 WeakPolarHBondContact OG-CE2 3.39Å; Y119-K121 WeakPolarHBondContact O-CG 3.38Å; Y119-K121 PolarHBondContact O-N 3.39Å; Y119-K121 VanDerWaalsContact O-N 3.17Å; Y119-D194 VanDerWaalsContact OH-CG 3.26Å; Y119-D194 PolarHBondContact OH-OD1 3.07Å; Y119-D194 PolarHBondContact OH-OD2 2.98Å; Y119-S196 WeakPolarHBondContact CE1-OG 3.27Å; Y119-S196 VanDerWaalsContact CZ-OG 3.23Å; Y119-S196 PolarHBondContact OH-OG 3.49Å; Y119-L197 HydrophobicContact CD1-CD2 3.46Å; Y119-L197 VanDerWaalsContact CD1-CD2 3.46Å; Y119-L197 HydrophobicContact CD1-CG 4.31Å; Y119-L197 HydrophobicContact CE1-CD1 4.49Å; Y119-L197 HydrophobicContact CE1-CD2 3.24Å; Y119-L197 HydrophobicContact CE1-CG 3.58Å; Y119-L197 HydrophobicContact CG-CD2 4.27Å
120	G	74.7	Confident	80.2	Confident	89 Å²	89	32.4 Å²	32.4	92%	0.918	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.4	14.3	176	0	0	0	0	0	114.4	F118	F118-G120 PolarHBondContact O-N 3.09Å
121	K	78.7	Confident	79.8	Confident	43 Å²	43	38.9 Å²	38.9	19%	0.187	21%	0.214	C	C	.	.			trans	-96.9	158.3	-179.8	-54.2	-56.7	177.4	-176.3	0	111.9	A74 L76 E78 Y119 H125 V126	A74-K121 PolarHBondContact O-NZ 3.05Å; L76-K121 PolarHBondContact O-NZ 2.86Å; E78-K121 HydrophobicContact CG-CD 4.13Å; Y119-K121 WeakPolarHBondContact O-CG 3.38Å; Y119-K121 PolarHBondContact O-N 3.39Å; Y119-K121 VanDerWaalsContact O-N 3.17Å; K121-H125 HydrophobicContact CB-CB 4.08Å; K121-V126 HydrophobicContact CB-CG2 4.41Å
122	S	79.7	Confident	79.9	Confident	38 Å²	38	39.4 Å²	39.4	27%	0.266	22%	0.217	S	C	.	.			trans	-62.2	151.4	175.3	71.7	0	0	0	0	111.6	E78 T124 H125 V126	E78-S122 VanDerWaalsContact CD-OG 3.24Å; E78-S122 VanDerWaalsContact OE1-CB 3.31Å; E78-S122 WeakPolarHBondContact OE1-CB 3.47Å; E78-S122 PolarHBondContact OE1-N 2.77Å; E78-S122 PolarHBondContact OE1-OG 2.9Å; E78-S122 VanDerWaalsContact OE1-OG 3.1Å; E78-S122 PolarHBondContact OE2-OG 3.42Å; S122-T124 PolarHBondContact O-N 2.97Å; S122-T124 PolarHBondContact OG-OG1 3.36Å; S122-H125 WeakPolarHBondContact O-CB 3.49Å; S122-H125 PolarHBondContact O-N 3.32Å; S122-H125 VanDerWaalsContact OG-CB 3.31Å; S122-H125 WeakPolarHBondContact OG-CB 3.43Å; S122-H125 PolarHBondContact OG-N 3.43Å; S122-H125 VanDerWaalsContact OG-N 3.08Å; S122-V126 PolarHBondContact O-N 2.88Å
123	E	76.7	Confident	79.6	Confident	120 Å²	120	35.9 Å²	35.9	56%	0.561	20%	0.201	S	C	*	.	H	α-helix	trans	-57.5	-34.4	175.3	-72.1	-168.4	158.7	0	0	112.2	A127 S201	E123-A127 WeakPolarHBondContact O-CB 3.13Å; E123-A127 PolarHBondContact O-N 2.71Å; E123-S201 WeakPolarHBondContact CB-OG 3.47Å
124	T	81.2	Confident	79.1	Confident	100 Å²	100	36.5 Å²	36.5	61%	0.613	21%	0.205	S	C	*	.	H	α-helix	trans	-63.2	-42.9	174.6	37.6	0	0	0	0	112.1	S122 A127 D128	S122-T124 PolarHBondContact O-N 2.97Å; S122-T124 PolarHBondContact OG-OG1 3.36Å; T124-A127 PolarHBondContact O-N 3.25Å; T124-D128 PolarHBondContact O-N 2.81Å
125	H	83.5	Confident	79.1	Confident	10 Å²	10	40.5 Å²	40.5	5%	0.046	23%	0.226	C	C	.	.	H	α-helix	trans	-66.7	-46.4	176.9	-176.2	79.4	0	0	0	111.6	E78 L117 K121 S122 A127 D128 M129	E78-H125 HydrophobicContact CB-CB 4.41Å; E78-H125 WeakPolarHBondContact CB-ND1 3.43Å; E78-H125 VanDerWaalsContact CD-CB 3.47Å; E78-H125 HydrophobicContact CG-CB 3.97Å; E78-H125 WeakPolarHBondContact OE2-CB 2.99Å; L117-H125 PolarHBondContact O-NE2 3.01Å; K121-H125 HydrophobicContact CB-CB 4.08Å; S122-H125 WeakPolarHBondContact O-CB 3.49Å; S122-H125 PolarHBondContact O-N 3.32Å; S122-H125 VanDerWaalsContact OG-CB 3.31Å; S122-H125 WeakPolarHBondContact OG-CB 3.43Å; S122-H125 PolarHBondContact OG-N 3.43Å; S122-H125 VanDerWaalsContact OG-N 3.08Å; H125-A127 VanDerWaalsContact C-N 3.3Å; H125-A127 PolarHBondContact O-N 3.16Å; H125-D128 WeakPolarHBondContact O-CB 3.5Å; H125-D128 PolarHBondContact O-N 2.98Å; H125-D128 VanDerWaalsContact O-N 3.09Å; H125-M129 WeakPolarHBondContact NE2-CG 3.31Å; H125-M129 WeakPolarHBondContact O-CG 3.49Å; H125-M129 PolarHBondContact O-N 3.34Å
126	V	77.6	Confident	79.2	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-56	-47.3	175.6	169.3	0	0	0	0	110.5	F118 K121 S122 D128 M129 C130 F202	F118-V126 HydrophobicContact CD1-CG1 4.04Å; F118-V126 HydrophobicContact CD1-CG2 4.37Å; K121-V126 HydrophobicContact CB-CG2 4.41Å; S122-V126 PolarHBondContact O-N 2.88Å; V126-D128 VanDerWaalsContact C-N 3.3Å; V126-D128 PolarHBondContact O-N 3.1Å; V126-M129 PolarHBondContact O-N 3.07Å; V126-C130 PolarHBondContact O-N 3.04Å; V126-C130 PolarHBondContact O-SG 2.91Å; V126-F202 HydrophobicContact CG1-CD2 4.1Å; V126-F202 HydrophobicContact CG1-CE2 4.15Å
127	A	73.6	Confident	78.7	Confident	25 Å²	25	40.4 Å²	40.4	21%	0.207	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-40.2	177.2	0	0	0	0	0	112.3	E123 T124 H125 C130 R131	E123-A127 WeakPolarHBondContact O-CB 3.13Å; E123-A127 PolarHBondContact O-N 2.71Å; T124-A127 PolarHBondContact O-N 3.25Å; H125-A127 VanDerWaalsContact C-N 3.3Å; H125-A127 PolarHBondContact O-N 3.16Å; A127-C130 PolarHBondContact O-N 3.2Å; A127-R131 WeakPolarHBondContact O-CG 3.46Å; A127-R131 PolarHBondContact O-N 3.02Å
128	D	81.8	Confident	78.5	Confident	45 Å²	45	44.5 Å²	44.5	24%	0.241	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-39.4	176	-85	-0.2	0	0	0	112.8	K82 T124 H125 V126 R131 F132	K82-D128 VanDerWaalsContact CE-OD2 3.24Å; K82-D128 WeakPolarHBondContact CE-OD2 3.49Å; K82-D128 IonicContact NZ-OD2 3.88Å; K82-D128 PolarHBondContact NZ-OD2 3.39Å; T124-D128 PolarHBondContact O-N 2.81Å; H125-D128 WeakPolarHBondContact O-CB 3.5Å; H125-D128 PolarHBondContact O-N 2.98Å; H125-D128 VanDerWaalsContact O-N 3.09Å; V126-D128 VanDerWaalsContact C-N 3.3Å; V126-D128 PolarHBondContact O-N 3.1Å; D128-R131 PolarHBondContact O-N 2.87Å; D128-R131 IonicContact OD1-CZ 3.93Å; D128-R131 IonicContact OD1-NH1 2.73Å; D128-R131 PolarHBondContact OD1-NH1 3.36Å; D128-F132 WeakPolarHBondContact O-CB 3.4Å; D128-F132 PolarHBondContact O-N 3.39Å
129	M	78	Confident	78.6	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-67.2	-39.7	175.3	-65.7	-54.2	98.2	0	0	111.5	K82 I85 F118 H125 V126 F132 I133	K82-M129 HydrophobicContact CG-CE 3.87Å; I85-M129 HydrophobicContact CB-SD 4.29Å; I85-M129 HydrophobicContact CD1-SD 3.42Å; I85-M129 WeakPolarHBondContact CD1-SD 3.39Å; I85-M129 HydrophobicContact CG1-SD 3.82Å; F118-M129 HydrophobicContact CD1-CB 4.38Å; F118-M129 HydrophobicContact CE1-CB 3.7Å; F118-M129 HydrophobicContact CZ-CB 4.05Å; H125-M129 WeakPolarHBondContact NE2-CG 3.31Å; H125-M129 WeakPolarHBondContact O-CG 3.49Å; H125-M129 PolarHBondContact O-N 3.34Å; V126-M129 PolarHBondContact O-N 3.07Å; M129-F132 WeakPolarHBondContact O-CB 3.43Å; M129-F132 PolarHBondContact O-N 2.87Å; M129-I133 WeakPolarHBondContact O-CG1 3.45Å; M129-I133 PolarHBondContact O-N 3.33Å; M129-I133 VanDerWaalsContact O-N 3.09Å
130	C	75.8	Confident	78.4	Confident	7 Å²	7	43.3 Å²	43.3	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-42.3	173	-64.3	0	0	0	0	111.9	V126 A127 F132 I133 I134 A205	V126-C130 PolarHBondContact O-N 3.04Å; V126-C130 PolarHBondContact O-SG 2.91Å; A127-C130 PolarHBondContact O-N 3.2Å; C130-F132 VanDerWaalsContact C-N 3.34Å; C130-I133 PolarHBondContact O-N 3.24Å; C130-I134 WeakPolarHBondContact O-CD1 3.34Å; C130-I134 VanDerWaalsContact O-CG1 3.24Å; C130-I134 WeakPolarHBondContact O-CG1 3.39Å; C130-I134 PolarHBondContact O-N 3.47Å; C130-A205 HydrophobicContact CB-CB 3.89Å; C130-A205 VanDerWaalsContact SG-CB 3.54Å
131	R	78.4	Confident	78.3	Confident	137 Å²	137	41 Å²	41	52%	0.517	22%	0.215	S	C	.	.	H	α-helix	trans	-60.5	-44.5	174.5	-75.6	175.7	-167	126.1	2.8	111.4	A127 D128 I133 I134 D135	A127-R131 WeakPolarHBondContact O-CG 3.46Å; A127-R131 PolarHBondContact O-N 3.02Å; D128-R131 PolarHBondContact O-N 2.87Å; D128-R131 IonicContact OD1-CZ 3.93Å; D128-R131 IonicContact OD1-NH1 2.73Å; D128-R131 PolarHBondContact OD1-NH1 3.36Å; R131-I133 VanDerWaalsContact C-N 3.34Å; R131-I133 PolarHBondContact O-N 3.44Å; R131-I134 PolarHBondContact O-N 3.4Å; R131-D135 WeakPolarHBondContact O-CB 3.31Å; R131-D135 VanDerWaalsContact O-CG 3.28Å; R131-D135 PolarHBondContact O-N 3.37Å
132	F	83.7	Confident	78	Confident	31 Å²	31	42.8 Å²	42.8	14%	0.136	23%	0.23	C	C	.	.	H	α-helix	trans	-54.1	-50.2	176	171.7	-96.1	0	0	0	111.6	I85 R86 D128 M129 C130 I134 D135 E136	I85-F132 HydrophobicContact CG1-CD1 3.73Å; I85-F132 HydrophobicContact CG1-CE1 3.72Å; I85-F132 HydrophobicContact CG1-CG 4.39Å; I85-F132 HydrophobicContact CG1-CZ 4.36Å; I85-F132 HydrophobicContact CG2-CD1 4.19Å; I85-F132 HydrophobicContact CG2-CD2 4.04Å; I85-F132 HydrophobicContact CG2-CE1 4.1Å; I85-F132 HydrophobicContact CG2-CE2 3.93Å; I85-F132 HydrophobicContact CG2-CG 4.18Å; I85-F132 HydrophobicContact CG2-CZ 3.98Å; R86-F132 HydrophobicContact CB-CE2 4.13Å; R86-F132 HydrophobicContact CB-CZ 4.11Å; D128-F132 WeakPolarHBondContact O-CB 3.4Å; D128-F132 PolarHBondContact O-N 3.39Å; M129-F132 WeakPolarHBondContact O-CB 3.43Å; M129-F132 PolarHBondContact O-N 2.87Å; C130-F132 VanDerWaalsContact C-N 3.34Å; F132-I134 VanDerWaalsContact C-N 3.34Å; F132-I134 PolarHBondContact O-N 3.3Å; F132-D135 PolarHBondContact O-N 3.23Å; F132-E136 HydrophobicContact CD1-CG 4.37Å; F132-E136 HydrophobicContact CD2-CG 4.4Å; F132-E136 HydrophobicContact CE1-CG 3.89Å; F132-E136 HydrophobicContact CE2-CG 3.93Å; F132-E136 WeakPolarHBondContact CE2-OE1 3.44Å; F132-E136 HydrophobicContact CZ-CG 3.63Å; F132-E136 VanDerWaalsContact O-CG 3.3Å; F132-E136 WeakPolarHBondContact O-CG 3.37Å; F132-E136 PolarHBondContact O-N 3.01Å
133	I	78.3	Confident	77.7	Confident	7 Å²	7	44.5 Å²	44.5	4%	0.036	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-45	178.3	-66.1	163.1	0	0	0	111.2	F114 F118 M129 C130 R131 D135 E136 I137 F184 L191	F114-I133 HydrophobicContact CE1-CD1 3.56Å; F114-I133 HydrophobicContact CE1-CG1 4.24Å; F114-I133 HydrophobicContact CZ-CD1 3.81Å; F114-I133 HydrophobicContact CZ-CG1 3.98Å; F118-I133 HydrophobicContact CZ-CD1 3.88Å; M129-I133 WeakPolarHBondContact O-CG1 3.45Å; M129-I133 PolarHBondContact O-N 3.33Å; M129-I133 VanDerWaalsContact O-N 3.09Å; C130-I133 PolarHBondContact O-N 3.24Å; R131-I133 VanDerWaalsContact C-N 3.34Å; R131-I133 PolarHBondContact O-N 3.44Å; I133-D135 VanDerWaalsContact C-N 3.29Å; I133-D135 PolarHBondContact O-N 2.84Å; I133-E136 PolarHBondContact O-N 3.13Å; I133-I137 HydrophobicContact CG2-CD1 3.91Å; I133-I137 VanDerWaalsContact O-CG1 3.3Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 2.69Å; I133-F184 HydrophobicContact CG2-CD1 3.81Å; I133-F184 HydrophobicContact CG2-CE1 4.25Å; I133-L191 HydrophobicContact CD1-CD1 4.42Å
134	I	75.3	Confident	77.4	Confident	13 Å²	13	40.3 Å²	40.3	7%	0.067	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-41.2	179	-69.6	161.7	0	0	0	110.9	C130 R131 F132 I137 K138 T208 Y212	C130-I134 WeakPolarHBondContact O-CD1 3.34Å; C130-I134 VanDerWaalsContact O-CG1 3.24Å; C130-I134 WeakPolarHBondContact O-CG1 3.39Å; C130-I134 PolarHBondContact O-N 3.47Å; R131-I134 PolarHBondContact O-N 3.4Å; F132-I134 VanDerWaalsContact C-N 3.34Å; F132-I134 PolarHBondContact O-N 3.3Å; I134-I137 PolarHBondContact O-N 2.96Å; I134-K138 HydrophobicContact CG2-CD 4.2Å; I134-K138 HydrophobicContact CG2-CG 4.48Å; I134-K138 WeakPolarHBondContact O-CB 3.19Å; I134-K138 VanDerWaalsContact O-CG 3.3Å; I134-K138 WeakPolarHBondContact O-CG 3.3Å; I134-K138 PolarHBondContact O-N 3.5Å; I134-T208 HydrophobicContact CB-CG2 4.5Å; I134-T208 HydrophobicContact CD1-CG2 3.64Å; I134-T208 HydrophobicContact CG1-CG2 3.69Å; I134-T208 HydrophobicContact CG2-CG2 3.99Å; I134-Y212 HydrophobicContact CG2-CE2 4.43Å
135	D	81.8	Confident	76.7	Confident	86 Å²	86	37.3 Å²	37.3	46%	0.46	21%	0.206	S	C	.	.	H	α-helix	trans	-71.8	-34.6	-178.7	-68.2	-21.4	0	0	0	111.7	R131 F132 I133 K138 A139	R131-D135 WeakPolarHBondContact O-CB 3.31Å; R131-D135 VanDerWaalsContact O-CG 3.28Å; R131-D135 PolarHBondContact O-N 3.37Å; F132-D135 PolarHBondContact O-N 3.23Å; I133-D135 VanDerWaalsContact C-N 3.29Å; I133-D135 PolarHBondContact O-N 2.84Å; D135-K138 PolarHBondContact O-N 3.49Å; D135-K138 IonicContact OD1-NZ 3.79Å; D135-K138 PolarHBondContact OD1-NZ 2.99Å; D135-A139 WeakPolarHBondContact O-CB 3.44Å; D135-A139 PolarHBondContact O-N 3.11Å
136	E	83	Confident	76	Confident	7 Å²	7	41.1 Å²	41.1	3%	0.033	23%	0.226	C	C	.	.	H	α-helix	trans	-64	-44.8	170.7	-66.4	-78	141.7	0	0	111.4	R86 T91 F132 I133 K138 A139 L140 F184	R86-E136 IonicContact CZ-OE1 2.81Å; R86-E136 IonicContact NE-OE1 3.07Å; R86-E136 PolarHBondContact NE-OE1 2.91Å; R86-E136 IonicContact NH2-OE1 3.26Å; R86-E136 PolarHBondContact NH2-OE1 3.18Å; T91-E136 PolarHBondContact N-OE2 3.47Å; T91-E136 PolarHBondContact OG1-OE2 2.97Å; F132-E136 HydrophobicContact CD1-CG 4.37Å; F132-E136 HydrophobicContact CD2-CG 4.4Å; F132-E136 HydrophobicContact CE1-CG 3.89Å; F132-E136 HydrophobicContact CE2-CG 3.93Å; F132-E136 WeakPolarHBondContact CE2-OE1 3.44Å; F132-E136 HydrophobicContact CZ-CG 3.63Å; F132-E136 VanDerWaalsContact O-CG 3.3Å; F132-E136 WeakPolarHBondContact O-CG 3.37Å; F132-E136 PolarHBondContact O-N 3.01Å; I133-E136 PolarHBondContact O-N 3.13Å; E136-K138 PolarHBondContact O-N 3.45Å; E136-A139 PolarHBondContact O-N 3.11Å; E136-L140 WeakPolarHBondContact O-CG 3.48Å; E136-L140 PolarHBondContact O-N 3.25Å; E136-F184 HydrophobicContact CB-CE1 4.41Å; E136-F184 HydrophobicContact CB-CE2 3.89Å; E136-F184 HydrophobicContact CB-CZ 3.64Å; E136-F184 HydrophobicContact CG-CZ 4.25Å
137	I	74.1	Confident	75.3	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-45.5	174.2	-65.1	166	0	0	0	110.7	I133 I134 A139 L140 V141 F184 Y212	I133-I137 HydrophobicContact CG2-CD1 3.91Å; I133-I137 VanDerWaalsContact O-CG1 3.3Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 2.69Å; I134-I137 PolarHBondContact O-N 2.96Å; I137-A139 VanDerWaalsContact C-N 3.32Å; I137-A139 PolarHBondContact O-N 3.15Å; I137-L140 WeakPolarHBondContact O-CB 3.48Å; I137-L140 PolarHBondContact O-N 3.35Å; I137-V141 HydrophobicContact CG2-CG2 4.23Å; I137-V141 VanDerWaalsContact O-CG2 3.32Å; I137-V141 WeakPolarHBondContact O-CG2 3.16Å; I137-V141 PolarHBondContact O-N 3.33Å; I137-F184 HydrophobicContact CD1-CB 3.9Å; I137-F184 HydrophobicContact CD1-CG 4.4Å; I137-F184 HydrophobicContact CG1-CB 3.69Å; I137-F184 HydrophobicContact CG1-CD2 4.02Å; I137-F184 HydrophobicContact CG1-CG 3.86Å; I137-Y212 HydrophobicContact CG2-CD1 3.98Å; I137-Y212 HydrophobicContact CG2-CD2 4.09Å; I137-Y212 HydrophobicContact CG2-CE1 4.26Å; I137-Y212 HydrophobicContact CG2-CE2 4.34Å; I137-Y212 HydrophobicContact CG2-CG 3.92Å
138	K	75.7	Confident	74.7	Confident	90 Å²	90	46.9 Å²	46.9	39%	0.391	25%	0.245	S	C	.	.	H	α-helix	trans	-59.6	-43.2	177.6	-78.9	172.9	-173	163	0	112	I134 D135 E136 L140 V141 T142 Y212	I134-K138 HydrophobicContact CG2-CD 4.2Å; I134-K138 HydrophobicContact CG2-CG 4.48Å; I134-K138 WeakPolarHBondContact O-CB 3.19Å; I134-K138 VanDerWaalsContact O-CG 3.3Å; I134-K138 WeakPolarHBondContact O-CG 3.3Å; I134-K138 PolarHBondContact O-N 3.5Å; D135-K138 PolarHBondContact O-N 3.49Å; D135-K138 IonicContact OD1-NZ 3.79Å; D135-K138 PolarHBondContact OD1-NZ 2.99Å; E136-K138 PolarHBondContact O-N 3.45Å; K138-L140 VanDerWaalsContact C-N 3.34Å; K138-V141 PolarHBondContact O-N 3.25Å; K138-T142 WeakPolarHBondContact O-CB 3.36Å; K138-T142 PolarHBondContact O-N 3.44Å; K138-T142 PolarHBondContact O-OG1 3.37Å; K138-Y212 WeakPolarHBondContact CG-OH 3.31Å
139	A	80.7	Confident	73.4	Confident	49 Å²	49	47.8 Å²	47.8	41%	0.405	26%	0.255	S	S	.	.	H	α-helix	trans	-60.2	-46.9	177.9	0	0	0	0	0	110.6	D135 E136 I137 T142 I143	D135-A139 WeakPolarHBondContact O-CB 3.44Å; D135-A139 PolarHBondContact O-N 3.11Å; E136-A139 PolarHBondContact O-N 3.11Å; I137-A139 VanDerWaalsContact C-N 3.32Å; I137-A139 PolarHBondContact O-N 3.15Å; A139-T142 PolarHBondContact O-N 3.28Å; A139-I143 VanDerWaalsContact O-CG1 3.28Å; A139-I143 WeakPolarHBondContact O-CG1 3.31Å; A139-I143 PolarHBondContact O-N 3.38Å
140	L	74.1	Confident	72.1	Confident	7 Å²	7	53.1 Å²	53.1	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-46.6	175.7	-73.8	177.3	0	0	0	113	T91 E136 I137 K138 T142 I143 L144 I177 Q180 I181 F184	T91-L140 HydrophobicContact CG2-CD1 3.5Å; T91-L140 HydrophobicContact CG2-CD2 3.36Å; T91-L140 HydrophobicContact CG2-CG 3.48Å; T91-L140 VanDerWaalsContact CG2-CG 3.48Å; E136-L140 WeakPolarHBondContact O-CG 3.48Å; E136-L140 PolarHBondContact O-N 3.25Å; I137-L140 WeakPolarHBondContact O-CB 3.48Å; I137-L140 PolarHBondContact O-N 3.35Å; K138-L140 VanDerWaalsContact C-N 3.34Å; L140-T142 VanDerWaalsContact C-N 3.3Å; L140-T142 PolarHBondContact O-N 2.92Å; L140-I143 PolarHBondContact O-N 3.08Å; L140-L144 WeakPolarHBondContact O-CB 3.47Å; L140-L144 PolarHBondContact O-N 3.41Å; L140-I177 HydrophobicContact CB-CG2 4.36Å; L140-I177 HydrophobicContact CD2-CG1 4.33Å; L140-I177 HydrophobicContact CD2-CG2 4.2Å; L140-Q180 HydrophobicContact CD1-CB 3.68Å; L140-Q180 HydrophobicContact CD2-CB 4.44Å; L140-I181 HydrophobicContact CB-CD1 4.04Å; L140-I181 HydrophobicContact CB-CG1 3.67Å; L140-I181 HydrophobicContact CD1-CG1 3.76Å; L140-I181 HydrophobicContact CG-CG1 4.35Å; L140-F184 HydrophobicContact CD1-CD2 4.04Å; L140-F184 HydrophobicContact CD1-CE2 4.09Å
141	V	72.6	Confident	70.7	Confident	40 Å²	40	54.7 Å²	54.7	24%	0.242	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-36.9	178.5	172.3	0	0	0	0	111.2	I137 K138 L144 G145 I181	I137-V141 HydrophobicContact CG2-CG2 4.23Å; I137-V141 VanDerWaalsContact O-CG2 3.32Å; I137-V141 WeakPolarHBondContact O-CG2 3.16Å; I137-V141 PolarHBondContact O-N 3.33Å; K138-V141 PolarHBondContact O-N 3.25Å; V141-L144 WeakPolarHBondContact O-CB 3.27Å; V141-L144 PolarHBondContact O-N 3.15Å; V141-G145 PolarHBondContact O-N 2.86Å; V141-I181 HydrophobicContact CG2-CD1 4.09Å
142	T	73	Confident	68.9	Low	80 Å²	80	50.7 Å²	50.7	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-64.7	-47.8	176.4	-55.3	0	0	0	0	110.4	K138 A139 L140 L144 G145 D146	K138-T142 WeakPolarHBondContact O-CB 3.36Å; K138-T142 PolarHBondContact O-N 3.44Å; K138-T142 PolarHBondContact O-OG1 3.37Å; A139-T142 PolarHBondContact O-N 3.28Å; L140-T142 VanDerWaalsContact C-N 3.3Å; L140-T142 PolarHBondContact O-N 2.92Å; T142-L144 VanDerWaalsContact C-N 3.26Å; T142-L144 PolarHBondContact O-N 3.42Å; T142-G145 PolarHBondContact O-N 3.48Å; T142-G145 VanDerWaalsContact O-N 3.1Å; T142-D146 VanDerWaalsContact O-CG 3.31Å; T142-D146 PolarHBondContact O-N 2.98Å
143	I	73.8	Confident	66.9	Low	74 Å²	74	54.3 Å²	54.3	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-58.4	-42.4	175.8	-63.8	161	0	0	0	110.5	A139 L140 D146 Y147 I177	A139-I143 VanDerWaalsContact O-CG1 3.28Å; A139-I143 WeakPolarHBondContact O-CG1 3.31Å; A139-I143 PolarHBondContact O-N 3.38Å; L140-I143 PolarHBondContact O-N 3.08Å; I143-D146 PolarHBondContact O-N 2.84Å; I143-Y147 HydrophobicContact CG2-CD2 3.99Å; I143-Y147 HydrophobicContact CG2-CE2 4.16Å; I143-Y147 WeakPolarHBondContact O-CD2 3.42Å; I143-Y147 PolarHBondContact O-N 3.01Å; I143-I177 HydrophobicContact CB-CD1 4.35Å; I143-I177 HydrophobicContact CG2-CD1 3.51Å
144	L	68.6	Low	65.1	Low	32 Å²	32	60.3 Å²	60.3	17%	0.168	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-45.1	176.8	-167.6	76.1	0	0	0	111.4	L140 V141 T142 Y147 F148 L174 I177 I181	L140-L144 WeakPolarHBondContact O-CB 3.47Å; L140-L144 PolarHBondContact O-N 3.41Å; V141-L144 WeakPolarHBondContact O-CB 3.27Å; V141-L144 PolarHBondContact O-N 3.15Å; T142-L144 VanDerWaalsContact C-N 3.26Å; T142-L144 PolarHBondContact O-N 3.42Å; L144-Y147 PolarHBondContact O-N 3.01Å; L144-F148 HydrophobicContact CD1-CE2 4.03Å; L144-F148 HydrophobicContact CD1-CZ 4.47Å; L144-F148 HydrophobicContact CD2-CE2 3.97Å; L144-F148 HydrophobicContact CG-CD2 4.12Å; L144-F148 HydrophobicContact CG-CE2 3.58Å; L144-F148 HydrophobicContact CG-CZ 4.47Å; L144-F148 WeakPolarHBondContact O-CD2 3.49Å; L144-F148 PolarHBondContact O-N 2.86Å; L144-F148 VanDerWaalsContact O-N 3.16Å; L144-L174 HydrophobicContact CD1-CD2 3.71Å; L144-I177 HydrophobicContact CB-CG2 4.19Å; L144-I177 HydrophobicContact CD1-CG2 4.05Å; L144-I181 HydrophobicContact CD2-CD1 4.42Å
145	G	66.8	Low	63.5	Low	37 Å²	37	63.1 Å²	63.1	38%	0.381	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-43.4	176	0	0	0	0	0	113.3	V141 T142 Y147 F148 S149	V141-G145 PolarHBondContact O-N 2.86Å; T142-G145 PolarHBondContact O-N 3.48Å; T142-G145 VanDerWaalsContact O-N 3.1Å; G145-Y147 VanDerWaalsContact C-N 3.32Å; G145-Y147 PolarHBondContact O-N 3.25Å; G145-F148 PolarHBondContact O-N 3.01Å; G145-S149 PolarHBondContact O-N 2.89Å; G145-S149 PolarHBondContact O-OG 3.03Å
146	D	68.3	Low	61.5	Low	90 Å²	90	64 Å²	64	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-43.9	176.3	-69.4	-17.8	0	0	0	110.5	T142 I143 F148 S149 V150	T142-D146 VanDerWaalsContact O-CG 3.31Å; T142-D146 PolarHBondContact O-N 2.98Å; I143-D146 PolarHBondContact O-N 2.84Å; D146-F148 VanDerWaalsContact C-N 3.34Å; D146-F148 PolarHBondContact O-N 3.02Å; D146-S149 WeakPolarHBondContact CA-OG 3.23Å; D146-S149 PolarHBondContact O-N 3.47Å; D146-S149 PolarHBondContact O-OG 3.43Å; D146-V150 VanDerWaalsContact O-CG2 3.3Å; D146-V150 WeakPolarHBondContact O-CG2 3.42Å; D146-V150 PolarHBondContact O-N 2.89Å
147	Y	64.5	Low	59.4	Low	71 Å²	71	67.7 Å²	67.7	28%	0.278	41%	0.414	S	S	.	.	H	α-helix	trans	-59	-43.1	174.9	-101.4	-84.4	0	0	0	112.9	I143 L144 G145 S151 R170 L174	I143-Y147 HydrophobicContact CG2-CD2 3.99Å; I143-Y147 HydrophobicContact CG2-CE2 4.16Å; I143-Y147 WeakPolarHBondContact O-CD2 3.42Å; I143-Y147 PolarHBondContact O-N 3.01Å; L144-Y147 PolarHBondContact O-N 3.01Å; G145-Y147 VanDerWaalsContact C-N 3.32Å; G145-Y147 PolarHBondContact O-N 3.25Å; Y147-S151 PolarHBondContact O-N 3.06Å; Y147-S151 PolarHBondContact O-OG 3.26Å; Y147-R170 HydrophobicContact CE1-CB 4.39Å; Y147-R170 HydrophobicContact CE1-CG 4.32Å; Y147-L174 HydrophobicContact CD1-CD1 4.32Å; Y147-L174 HydrophobicContact CD1-CD2 4.15Å; Y147-L174 HydrophobicContact CD1-CG 4.21Å; Y147-L174 HydrophobicContact CD2-CD2 4.33Å; Y147-L174 HydrophobicContact CG-CD2 3.83Å; Y147-L174 HydrophobicContact CG-CG 4.37Å
148	F	60	Low	57.8	Low	78 Å²	78	74.5 Å²	74.5	34%	0.342	46%	0.456	S	S	.	.	H	α-helix	trans	-67.7	-38	178.1	-71.9	-58.9	0	0	0	112.3	L144 G145 D146 S151 S152 F164	L144-F148 HydrophobicContact CD1-CE2 4.03Å; L144-F148 HydrophobicContact CD1-CZ 4.47Å; L144-F148 HydrophobicContact CD2-CE2 3.97Å; L144-F148 HydrophobicContact CG-CD2 4.12Å; L144-F148 HydrophobicContact CG-CE2 3.58Å; L144-F148 HydrophobicContact CG-CZ 4.47Å; L144-F148 WeakPolarHBondContact O-CD2 3.49Å; L144-F148 PolarHBondContact O-N 2.86Å; L144-F148 VanDerWaalsContact O-N 3.16Å; G145-F148 PolarHBondContact O-N 3.01Å; D146-F148 VanDerWaalsContact C-N 3.34Å; D146-F148 PolarHBondContact O-N 3.02Å; F148-S151 PolarHBondContact O-N 2.65Å; F148-S152 PolarHBondContact O-N 3.27Å; F148-F164 AromaticContact CD1-CZ 3.77Å; F148-F164 HydrophobicContact CD1-CZ 3.77Å; F148-F164 HydrophobicContact CE1-CE2 4.28Å; F148-F164 AromaticContact CE1-CZ 3.64Å; F148-F164 HydrophobicContact CE1-CZ 3.64Å
149	S	55.4	Low	55.9	Low	65 Å²	65	72 Å²	72	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-73.1	-36.8	-179.5	61.7	0	0	0	0	114	G145 D146 S151 S152	G145-S149 PolarHBondContact O-N 2.89Å; G145-S149 PolarHBondContact O-OG 3.03Å; D146-S149 WeakPolarHBondContact CA-OG 3.23Å; D146-S149 PolarHBondContact O-N 3.47Å; D146-S149 PolarHBondContact O-OG 3.43Å; S149-S151 PolarHBondContact O-N 3.24Å; S149-S152 PolarHBondContact O-N 3.4Å; S149-S152 PolarHBondContact O-OG 3.02Å; S149-S152 VanDerWaalsContact O-OG 3.09Å
150	V	50.1	Low	53.6	Low	113 Å²	113	74.5 Å²	74.5	69%	0.685	46%	0.459	S	S	*	.	H	α-helix	trans	-66.2	-26.1	173.5	176.6	0	0	0	0	111.5	D146 S152	D146-V150 VanDerWaalsContact O-CG2 3.3Å; D146-V150 WeakPolarHBondContact O-CG2 3.42Å; D146-V150 PolarHBondContact O-N 2.89Å; V150-S152 VanDerWaalsContact C-N 3.34Å
151	S	45.6	Very low	51.8	Low	40 Å²	40	78.7 Å²	78.7	28%	0.28	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.1	178.9	-50	0	0	0	0	113.1	Y147 F148 S149	Y147-S151 PolarHBondContact O-N 3.06Å; Y147-S151 PolarHBondContact O-OG 3.26Å; F148-S151 PolarHBondContact O-N 2.65Å; S149-S151 PolarHBondContact O-N 3.24Å
152	S	40.6	Very low	50.3	Low	53 Å²	53	79.9 Å²	79.9	37%	0.371	50%	0.495	S	S	.	.			trans	-102	70.3	177.5	72	0	0	0	0	110.7	F148 S149 V150 D154	F148-S152 PolarHBondContact O-N 3.27Å; S149-S152 PolarHBondContact O-N 3.4Å; S149-S152 PolarHBondContact O-OG 3.02Å; S149-S152 VanDerWaalsContact O-OG 3.09Å; V150-S152 VanDerWaalsContact C-N 3.34Å; S152-D154 PolarHBondContact O-N 2.94Å
153	S	41.7	Very low	48.6	Very low	108 Å²	108	81 Å²	81	76%	0.755	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-11.7	169.1	51.2	0	0	0	0	113.2
154	D	40.5	Very low	47.1	Very low	132 Å²	132	80.7 Å²	80.7	71%	0.706	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	13.3	-173.1	-70.2	-20.3	0	0	0	115.3	S152 L156	S152-D154 PolarHBondContact O-N 2.94Å; D154-L156 HydrophobicContact CB-CG 4.48Å; D154-L156 PolarHBondContact O-N 3.05Å; D154-L156 VanDerWaalsContact O-N 3.1Å
155	G	43.1	Very low	45.8	Very low	73 Å²	73	88 Å²	88	75%	0.753	53%	0.534	S	S	*	.			trans	63.6	19.9	173.1	0	0	0	0	0	115
156	L	39.3	Very low	44.9	Very low	103 Å²	103	87.2 Å²	87.2	54%	0.539	52%	0.523	S	S	.	.			trans	-80.4	138.6	177.2	-62.5	171.2	0	0	0	110.5	D154 E160	D154-L156 HydrophobicContact CB-CG 4.48Å; D154-L156 PolarHBondContact O-N 3.05Å; D154-L156 VanDerWaalsContact O-N 3.1Å; L156-E160 WeakPolarHBondContact CD2-OE2 3.45Å
157	P	38.9	Very low	44.1	Very low	85 Å²	85	89.1 Å²	89.1	55%	0.552	53%	0.533	S	S	*	.			trans	-64.4	148.8	-175.7	25	-31.6	0	0	0	111.8	G159 E160	P157-G159 PolarHBondContact O-N 3.28Å; P157-E160 PolarHBondContact O-N 2.85Å; P157-E160 VanDerWaalsContact O-N 3.16Å
158	V	39.6	Very low	43.6	Very low	145 Å²	145	93.8 Å²	93.8	88%	0.879	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	106.2	171.4	-179.3	0	0	0	0	108.5
159	G	37	Very low	43.3	Very low	37 Å²	37	94 Å²	94	38%	0.381	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	132	-9.8	-176	0	0	0	0	0	115.7	P157 L226	P157-G159 PolarHBondContact O-N 3.28Å; G159-L226 WeakPolarHBondContact O-CD2 3.42Å
160	E	31.8	Very low	43.4	Very low	102 Å²	102	97 Å²	97	48%	0.477	57%	0.57	S	S	.	*	S	Bend	trans	-95.7	148.2	167.8	-73.3	-172.7	168.7	0	0	111.4	L156 P157 V162	L156-E160 WeakPolarHBondContact CD2-OE2 3.45Å; P157-E160 PolarHBondContact O-N 2.85Å; P157-E160 VanDerWaalsContact O-N 3.16Å; E160-V162 PolarHBondContact O-N 2.83Å
161	S	37.7	Very low	44	Very low	95 Å²	95	95.9 Å²	95.9	66%	0.664	56%	0.56	S	S	*	*			trans	-57.1	90.5	-169.8	54.9	0	0	0	0	112.8	C163	S161-C163 PolarHBondContact O-N 2.99Å
162	V	39.8	Very low	45	Very low	64 Å²	64	98.1 Å²	98.1	39%	0.388	57%	0.574	S	S	.	*			trans	-70	98.4	166.8	-177.3	0	0	0	0	107.1	E160 F164	E160-V162 PolarHBondContact O-N 2.83Å; V162-F164 HydrophobicContact CB-CE2 4.34Å; V162-F164 HydrophobicContact CG1-CD2 4.47Å; V162-F164 HydrophobicContact CG1-CE1 4.43Å; V162-F164 HydrophobicContact CG1-CE2 4.28Å; V162-F164 HydrophobicContact CG1-CZ 4.26Å; V162-F164 WeakPolarHBondContact O-CD2 3.49Å; V162-F164 PolarHBondContact O-N 2.89Å
163	C	38.6	Very low	46.3	Very low	103 Å²	103	97.2 Å²	97.2	70%	0.696	57%	0.57	S	S	*	*			trans	-66.3	98.2	167	-75.9	0	0	0	0	108.1	S161 H165	S161-C163 PolarHBondContact O-N 2.99Å; C163-H165 PolarHBondContact O-N 2.75Å
164	F	40.8	Very low	47.6	Very low	69 Å²	69	92.8 Å²	92.8	30%	0.303	54%	0.538	S	S	.	.			trans	-63	97.7	173	-73.3	-84.3	0	0	0	109.8	F148 V162 S166 L174	F148-F164 AromaticContact CD1-CZ 3.77Å; F148-F164 HydrophobicContact CD1-CZ 3.77Å; F148-F164 HydrophobicContact CE1-CE2 4.28Å; F148-F164 AromaticContact CE1-CZ 3.64Å; F148-F164 HydrophobicContact CE1-CZ 3.64Å; V162-F164 HydrophobicContact CB-CE2 4.34Å; V162-F164 HydrophobicContact CG1-CD2 4.47Å; V162-F164 HydrophobicContact CG1-CE1 4.43Å; V162-F164 HydrophobicContact CG1-CE2 4.28Å; V162-F164 HydrophobicContact CG1-CZ 4.26Å; V162-F164 WeakPolarHBondContact O-CD2 3.49Å; V162-F164 PolarHBondContact O-N 2.89Å; F164-S166 PolarHBondContact O-N 3.36Å; F164-L174 HydrophobicContact CD1-CD1 4.46Å; F164-L174 HydrophobicContact CE1-CD1 4.06Å; F164-L174 HydrophobicContact CZ-CD1 4.47Å
165	H	42.9	Very low	49	Very low	184 Å²	184	93.4 Å²	93.4	85%	0.852	53%	0.534	S	S	*	.			trans	-76.2	70.2	155.7	-73.3	4.2	0	0	0	107.8	C163	C163-H165 PolarHBondContact O-N 2.75Å
166	S	46.2	Very low	50.6	Low	21 Å²	21	97.4 Å²	97.4	15%	0.147	53%	0.527	C	S	.	.			trans	-116.8	123.9	179.3	95	0	0	0	0	108.5	F164 Q168 L171	F164-S166 PolarHBondContact O-N 3.36Å; S166-Q168 PolarHBondContact O-N 3.33Å; S166-L171 WeakPolarHBondContact OG-CG 3.19Å
167	D	53.1	Low	52.1	Low	131 Å²	131	93.2 Å²	93.2	70%	0.701	50%	0.504	S	S	*	.			trans	-40.8	139	162.3	-87.8	-35.7	0	0	0	109.4	S169 R170	D167-S169 PolarHBondContact O-N 2.91Å; D167-R170 PolarHBondContact O-N 2.77Å
168	Q	53.5	Low	53.7	Low	169 Å²	169	92 Å²	92	79%	0.79	49%	0.491	S	S	*	.	H	α-helix	trans	-47.3	-28.2	-175	-138.5	160.9	-3.2	0	0	113.3	S166 C172	S166-Q168 PolarHBondContact O-N 3.33Å; Q168-C172 PolarHBondContact O-N 3.35Å; Q168-C172 VanDerWaalsContact O-N 3.11Å; Q168-C172 PolarHBondContact O-SG 2.98Å; Q168-C172 VanDerWaalsContact O-SG 3.37Å
169	S	53.7	Low	55.5	Low	81 Å²	81	88.1 Å²	88.1	57%	0.566	47%	0.468	S	S	*	.	H	α-helix	trans	-59.7	-40.9	173.1	56.7	0	0	0	0	114.3	D167 C172 A173	D167-S169 PolarHBondContact O-N 2.91Å; S169-C172 PolarHBondContact O-N 3.21Å; S169-A173 PolarHBondContact O-N 3.36Å
170	R	57.5	Low	57.4	Low	129 Å²	129	87.4 Å²	87.4	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-71.9	-40.2	179.8	-75.1	-175.2	173.9	-166.1	-0.7	112.1	Y147 D167 C172 A173 L174	Y147-R170 HydrophobicContact CE1-CB 4.39Å; Y147-R170 HydrophobicContact CE1-CG 4.32Å; D167-R170 PolarHBondContact O-N 2.77Å; R170-C172 VanDerWaalsContact C-N 3.34Å; R170-A173 PolarHBondContact O-N 2.91Å; R170-L174 PolarHBondContact O-N 3.45Å
171	L	62.6	Low	59.2	Low	89 Å²	89	82.9 Å²	82.9	47%	0.466	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-41.9	172.5	-93	157.4	0	0	0	111.8	S166 A173 L174 K175	S166-L171 WeakPolarHBondContact OG-CG 3.19Å; L171-A173 VanDerWaalsContact C-N 3.34Å; L171-A173 PolarHBondContact O-N 3.28Å; L171-L174 PolarHBondContact O-N 2.9Å; L171-K175 WeakPolarHBondContact O-CB 3.38Å; L171-K175 PolarHBondContact O-N 3.3Å
172	C	65.2	Low	60.9	Low	87 Å²	87	81.2 Å²	81.2	59%	0.588	42%	0.417	S	S	*	.	H	α-helix	trans	-61.8	-40.3	174.1	-75.9	0	0	0	0	112.4	Q168 S169 R170 K175 R176	Q168-C172 PolarHBondContact O-N 3.35Å; Q168-C172 VanDerWaalsContact O-N 3.11Å; Q168-C172 PolarHBondContact O-SG 2.98Å; Q168-C172 VanDerWaalsContact O-SG 3.37Å; S169-C172 PolarHBondContact O-N 3.21Å; R170-C172 VanDerWaalsContact C-N 3.34Å; C172-K175 PolarHBondContact O-N 2.83Å; C172-R176 WeakPolarHBondContact O-CB 3.34Å; C172-R176 PolarHBondContact O-N 2.91Å
173	A	67.9	Low	62.8	Low	34 Å²	34	78.3 Å²	78.3	28%	0.281	40%	0.4	S	S	.	.	H	α-helix	trans	-64.5	-44.8	176.9	0	0	0	0	0	112	S169 R170 L171 K175 R176 I177	S169-A173 PolarHBondContact O-N 3.36Å; R170-A173 PolarHBondContact O-N 2.91Å; L171-A173 VanDerWaalsContact C-N 3.34Å; L171-A173 PolarHBondContact O-N 3.28Å; A173-K175 PolarHBondContact O-N 2.84Å; A173-R176 WeakPolarHBondContact O-CB 3.14Å; A173-R176 PolarHBondContact O-N 3.36Å; A173-I177 WeakPolarHBondContact O-CG1 3.29Å; A173-I177 PolarHBondContact O-N 3.5Å
174	L	69.1	Low	64.5	Low	16 Å²	16	73.4 Å²	73.4	8%	0.084	37%	0.366	C	S	.	.	H	α-helix	trans	-60.8	-45.1	176.2	-78.9	169.3	0	0	0	112.1	L144 Y147 F164 R170 L171 R176 I177 E178	L144-L174 HydrophobicContact CD1-CD2 3.71Å; Y147-L174 HydrophobicContact CD1-CD1 4.32Å; Y147-L174 HydrophobicContact CD1-CD2 4.15Å; Y147-L174 HydrophobicContact CD1-CG 4.21Å; Y147-L174 HydrophobicContact CD2-CD2 4.33Å; Y147-L174 HydrophobicContact CG-CD2 3.83Å; Y147-L174 HydrophobicContact CG-CG 4.37Å; F164-L174 HydrophobicContact CD1-CD1 4.46Å; F164-L174 HydrophobicContact CE1-CD1 4.06Å; F164-L174 HydrophobicContact CZ-CD1 4.47Å; R170-L174 PolarHBondContact O-N 3.45Å; L171-L174 PolarHBondContact O-N 2.9Å; L174-R176 VanDerWaalsContact C-N 3.29Å; L174-R176 PolarHBondContact O-N 2.82Å; L174-I177 PolarHBondContact O-N 3.25Å; L174-E178 PolarHBondContact O-N 2.83Å
175	K	71.5	Confident	66	Low	144 Å²	144	70.7 Å²	70.7	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-65.9	-33.7	178.6	-163.7	160.9	-175.5	171.8	0	112.1	L171 C172 A173 E178 V179	L171-K175 WeakPolarHBondContact O-CB 3.38Å; L171-K175 PolarHBondContact O-N 3.3Å; C172-K175 PolarHBondContact O-N 2.83Å; A173-K175 PolarHBondContact O-N 2.84Å; K175-E178 PolarHBondContact O-N 2.72Å; K175-V179 WeakPolarHBondContact O-CG2 3.39Å; K175-V179 PolarHBondContact O-N 3.46Å
176	R	76	Confident	67.6	Low	158 Å²	158	64 Å²	64	60%	0.596	33%	0.327	S	S	*	.	H	α-helix	trans	-64.4	-45.7	173.2	-173.6	179.1	-172.1	171.6	0.6	111.7	C172 A173 L174 E178 V179 Q180	C172-R176 WeakPolarHBondContact O-CB 3.34Å; C172-R176 PolarHBondContact O-N 2.91Å; A173-R176 WeakPolarHBondContact O-CB 3.14Å; A173-R176 PolarHBondContact O-N 3.36Å; L174-R176 VanDerWaalsContact C-N 3.29Å; L174-R176 PolarHBondContact O-N 2.82Å; R176-E178 VanDerWaalsContact C-N 3.33Å; R176-E178 PolarHBondContact O-N 2.94Å; R176-V179 PolarHBondContact O-N 3.07Å; R176-Q180 WeakPolarHBondContact O-CG 3.24Å; R176-Q180 PolarHBondContact O-N 3.39Å
177	I	71.3	Confident	69	Low	14 Å²	14	63 Å²	63	7%	0.072	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-46.2	176.5	-70.4	162.8	0	0	0	110.3	L140 I143 L144 A173 L174 V179 Q180 I181	L140-I177 HydrophobicContact CB-CG2 4.36Å; L140-I177 HydrophobicContact CD2-CG1 4.33Å; L140-I177 HydrophobicContact CD2-CG2 4.2Å; I143-I177 HydrophobicContact CB-CD1 4.35Å; I143-I177 HydrophobicContact CG2-CD1 3.51Å; L144-I177 HydrophobicContact CB-CG2 4.19Å; L144-I177 HydrophobicContact CD1-CG2 4.05Å; A173-I177 WeakPolarHBondContact O-CG1 3.29Å; A173-I177 PolarHBondContact O-N 3.5Å; L174-I177 PolarHBondContact O-N 3.25Å; I177-V179 PolarHBondContact O-N 2.94Å; I177-Q180 PolarHBondContact O-N 3.35Å; I177-I181 HydrophobicContact CG2-CD1 3.9Å; I177-I181 HydrophobicContact CG2-CG1 4.47Å; I177-I181 VanDerWaalsContact O-CG1 3.31Å; I177-I181 WeakPolarHBondContact O-CG1 3.43Å; I177-I181 PolarHBondContact O-N 3.2Å
178	E	71.5	Confident	69.9	Low	59 Å²	59	57 Å²	57	28%	0.276	29%	0.288	S	S	.	.	H	α-helix	trans	-57.2	-48.2	177.9	-174.8	175.4	171.3	0	0	111.8	L174 K175 R176 Q180 I181 L182 R223	L174-E178 PolarHBondContact O-N 2.83Å; K175-E178 PolarHBondContact O-N 2.72Å; R176-E178 VanDerWaalsContact C-N 3.33Å; R176-E178 PolarHBondContact O-N 2.94Å; E178-Q180 PolarHBondContact O-N 3.35Å; E178-I181 PolarHBondContact O-N 2.94Å; E178-L182 WeakPolarHBondContact O-CG 3.5Å; E178-L182 PolarHBondContact O-N 3.2Å; E178-L182 VanDerWaalsContact O-N 3.11Å; E178-R223 IonicContact OE1-CZ 3.47Å; E178-R223 IonicContact OE1-NH1 3.82Å; E178-R223 PolarHBondContact OE1-NH1 2.94Å; E178-R223 IonicContact OE2-CZ 2.82Å; E178-R223 IonicContact OE2-NH1 2.6Å; E178-R223 PolarHBondContact OE2-NH1 2.6Å; E178-R223 IonicContact OE2-NH2 3.52Å; E178-R223 PolarHBondContact OE2-NH2 3.11Å; E178-R223 VanDerWaalsContact OE2-NH2 3.07Å
179	V	77.4	Confident	70.7	Confident	65 Å²	65	53.6 Å²	53.6	39%	0.394	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-44.6	176.9	171.8	0	0	0	0	111.5	K175 R176 I177 I181 L182 D183	K175-V179 WeakPolarHBondContact O-CG2 3.39Å; K175-V179 PolarHBondContact O-N 3.46Å; R176-V179 PolarHBondContact O-N 3.07Å; I177-V179 PolarHBondContact O-N 2.94Å; V179-I181 VanDerWaalsContact C-N 3.3Å; V179-I181 PolarHBondContact O-N 2.97Å; V179-L182 WeakPolarHBondContact O-CB 3.42Å; V179-L182 PolarHBondContact O-N 3.41Å; V179-L182 VanDerWaalsContact O-N 3.11Å; V179-D183 VanDerWaalsContact O-CG 3.25Å; V179-D183 PolarHBondContact O-N 3.26Å
180	Q	76.5	Confident	71.7	Confident	22 Å²	22	52 Å²	52	10%	0.103	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-37.3	179.3	-73.4	170.5	-43.4	0	0	112.5	T91 L140 R176 I177 E178 D183 F184	T91-Q180 PolarHBondContact O-NE2 2.82Å; L140-Q180 HydrophobicContact CD1-CB 3.68Å; L140-Q180 HydrophobicContact CD2-CB 4.44Å; R176-Q180 WeakPolarHBondContact O-CG 3.24Å; R176-Q180 PolarHBondContact O-N 3.39Å; I177-Q180 PolarHBondContact O-N 3.35Å; E178-Q180 PolarHBondContact O-N 3.35Å; Q180-D183 PolarHBondContact O-N 3.35Å; Q180-F184 VanDerWaalsContact O-CD2 3.29Å; Q180-F184 WeakPolarHBondContact O-CD2 3.39Å; Q180-F184 PolarHBondContact O-N 3.39Å; Q180-F184 VanDerWaalsContact O-N 3.15Å
181	I	71	Confident	72.2	Confident	6 Å²	6	46.1 Å²	46.1	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-44.8	174.5	-68	170.5	0	0	0	110.2	L140 V141 L144 I177 E178 V179 F184 I185 I216	L140-I181 HydrophobicContact CB-CD1 4.04Å; L140-I181 HydrophobicContact CB-CG1 3.67Å; L140-I181 HydrophobicContact CD1-CG1 3.76Å; L140-I181 HydrophobicContact CG-CG1 4.35Å; V141-I181 HydrophobicContact CG2-CD1 4.09Å; L144-I181 HydrophobicContact CD2-CD1 4.42Å; I177-I181 HydrophobicContact CG2-CD1 3.9Å; I177-I181 HydrophobicContact CG2-CG1 4.47Å; I177-I181 VanDerWaalsContact O-CG1 3.31Å; I177-I181 WeakPolarHBondContact O-CG1 3.43Å; I177-I181 PolarHBondContact O-N 3.2Å; E178-I181 PolarHBondContact O-N 2.94Å; V179-I181 VanDerWaalsContact C-N 3.3Å; V179-I181 PolarHBondContact O-N 2.97Å; I181-F184 PolarHBondContact O-N 3.36Å; I181-I185 HydrophobicContact CG2-CD1 4.13Å; I181-I185 WeakPolarHBondContact O-CG1 3.39Å; I181-I185 PolarHBondContact O-N 3.07Å; I181-I185 VanDerWaalsContact O-N 3.15Å; I181-I216 HydrophobicContact CG2-CD1 3.24Å; I181-I216 HydrophobicContact CG2-CG1 4.16Å
182	L	73.3	Confident	72.2	Confident	60 Å²	60	44.4 Å²	44.4	31%	0.314	23%	0.226	S	C	.	.	H	α-helix	trans	-63.5	-40.9	177.5	-68.2	171.7	0	0	0	111.9	E178 V179 F184 I185 V186 I216	E178-L182 WeakPolarHBondContact O-CG 3.5Å; E178-L182 PolarHBondContact O-N 3.2Å; E178-L182 VanDerWaalsContact O-N 3.11Å; V179-L182 WeakPolarHBondContact O-CB 3.42Å; V179-L182 PolarHBondContact O-N 3.41Å; V179-L182 VanDerWaalsContact O-N 3.11Å; L182-F184 VanDerWaalsContact C-N 3.33Å; L182-F184 PolarHBondContact O-N 3.38Å; L182-I185 WeakPolarHBondContact O-CB 3.3Å; L182-I185 PolarHBondContact O-N 3.37Å; L182-I185 VanDerWaalsContact O-N 3.08Å; L182-V186 WeakPolarHBondContact O-CG2 3.23Å; L182-V186 PolarHBondContact O-N 2.85Å; L182-I216 HydrophobicContact CD2-CG2 4.38Å
183	D	79.1	Confident	72.3	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-57.1	-47	176.4	-68.2	-20.2	0	0	0	111	L96 H100 V179 Q180 I185 V186 V187	L96-D183 HydrophobicContact CD1-CB 3.76Å; L96-D183 HydrophobicContact CG-CB 3.86Å; H100-D183 WeakPolarHBondContact CB-OD1 3.46Å; H100-D183 IonicContact CG-OD1 3.84Å; V179-D183 VanDerWaalsContact O-CG 3.25Å; V179-D183 PolarHBondContact O-N 3.26Å; Q180-D183 PolarHBondContact O-N 3.35Å; D183-I185 VanDerWaalsContact C-N 3.29Å; D183-I185 PolarHBondContact O-N 2.79Å; D183-V186 PolarHBondContact O-N 2.83Å; D183-V187 WeakPolarHBondContact O-CG2 3.39Å; D183-V187 PolarHBondContact O-N 2.94Å
184	F	75.4	Confident	72.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-36.2	176.1	-85.5	-59.9	0	0	0	112.9	A89 T91 L96 I133 E136 I137 L140 Q180 I181 L182 V187 C188	A89-F184 WeakPolarHBondContact O-CE1 3.47Å; T91-F184 HydrophobicContact CG2-CE2 4.23Å; L96-F184 HydrophobicContact CD1-CD1 3.8Å; L96-F184 HydrophobicContact CD1-CD2 4.37Å; L96-F184 HydrophobicContact CD1-CE1 3.9Å; L96-F184 HydrophobicContact CD1-CE2 4.47Å; L96-F184 HydrophobicContact CD1-CG 4.05Å; L96-F184 HydrophobicContact CD1-CZ 4.25Å; L96-F184 HydrophobicContact CD2-CD1 4.41Å; L96-F184 HydrophobicContact CD2-CD2 3.82Å; L96-F184 HydrophobicContact CD2-CE1 4.02Å; L96-F184 HydrophobicContact CD2-CE2 3.37Å; L96-F184 HydrophobicContact CD2-CG 4.32Å; L96-F184 HydrophobicContact CD2-CZ 3.49Å; L96-F184 VanDerWaalsContact CD2-CZ 3.49Å; L96-F184 HydrophobicContact CG-CZ 4.5Å; I133-F184 HydrophobicContact CG2-CD1 3.81Å; I133-F184 HydrophobicContact CG2-CE1 4.25Å; E136-F184 HydrophobicContact CB-CE1 4.41Å; E136-F184 HydrophobicContact CB-CE2 3.89Å; E136-F184 HydrophobicContact CB-CZ 3.64Å; E136-F184 HydrophobicContact CG-CZ 4.25Å; I137-F184 HydrophobicContact CD1-CB 3.9Å; I137-F184 HydrophobicContact CD1-CG 4.4Å; I137-F184 HydrophobicContact CG1-CB 3.69Å; I137-F184 HydrophobicContact CG1-CD2 4.02Å; I137-F184 HydrophobicContact CG1-CG 3.86Å; L140-F184 HydrophobicContact CD1-CD2 4.04Å; L140-F184 HydrophobicContact CD1-CE2 4.09Å; Q180-F184 VanDerWaalsContact O-CD2 3.29Å; Q180-F184 WeakPolarHBondContact O-CD2 3.39Å; Q180-F184 PolarHBondContact O-N 3.39Å; Q180-F184 VanDerWaalsContact O-N 3.15Å; I181-F184 PolarHBondContact O-N 3.36Å; L182-F184 VanDerWaalsContact C-N 3.33Å; L182-F184 PolarHBondContact O-N 3.38Å; F184-V187 PolarHBondContact O-N 3.24Å; F184-C188 WeakPolarHBondContact O-CB 2.87Å; F184-C188 PolarHBondContact O-N 2.6Å; F184-C188 PolarHBondContact O-SG 2.81Å; F184-C188 VanDerWaalsContact O-SG 3.41Å
185	I	71.7	Confident	71.9	Confident	11 Å²	11	55.2 Å²	55.2	6%	0.056	26%	0.261	C	S	.	.	H	α-helix	trans	-68.8	-41.2	177.6	-71.3	167.5	0	0	0	111.2	I181 L182 D183 V187 C188 K189 E213 I216	I181-I185 HydrophobicContact CG2-CD1 4.13Å; I181-I185 WeakPolarHBondContact O-CG1 3.39Å; I181-I185 PolarHBondContact O-N 3.07Å; I181-I185 VanDerWaalsContact O-N 3.15Å; L182-I185 WeakPolarHBondContact O-CB 3.3Å; L182-I185 PolarHBondContact O-N 3.37Å; L182-I185 VanDerWaalsContact O-N 3.08Å; D183-I185 VanDerWaalsContact C-N 3.29Å; D183-I185 PolarHBondContact O-N 2.79Å; I185-V187 VanDerWaalsContact C-N 3.31Å; I185-V187 PolarHBondContact O-N 3.01Å; I185-C188 WeakPolarHBondContact O-CB 3.35Å; I185-C188 PolarHBondContact O-N 3.21Å; I185-K189 HydrophobicContact CG2-CD 4.32Å; I185-K189 HydrophobicContact CG2-CG 4.48Å; I185-K189 WeakPolarHBondContact O-CB 3.47Å; I185-K189 WeakPolarHBondContact O-CG 3.42Å; I185-K189 PolarHBondContact O-N 2.89Å; I185-E213 HydrophobicContact CG2-CG 4.48Å; I185-I216 HydrophobicContact CD1-CD1 3.09Å; I185-I216 HydrophobicContact CD1-CG1 4.49Å; I185-I216 HydrophobicContact CG1-CD1 4.47Å
186	V	75.9	Confident	71.4	Confident	44 Å²	44	52 Å²	52	27%	0.267	26%	0.256	S	S	.	.	H	α-helix	trans	-57.9	-48.2	173.9	170.9	0	0	0	0	110	L182 D183 C188 K189 Q190	L182-V186 WeakPolarHBondContact O-CG2 3.23Å; L182-V186 PolarHBondContact O-N 2.85Å; D183-V186 PolarHBondContact O-N 2.83Å; V186-C188 PolarHBondContact O-N 2.98Å; V186-K189 PolarHBondContact O-N 3.01Å; V186-Q190 HydrophobicContact CG1-CG 4.41Å; V186-Q190 WeakPolarHBondContact O-CB 3.37Å; V186-Q190 WeakPolarHBondContact O-CG 3.41Å; V186-Q190 PolarHBondContact O-N 3.06Å
187	V	76.7	Confident	70.5	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-50.1	176.4	170.2	0	0	0	0	111.1	L96 C99 F114 D183 F184 I185 K189 Q190 L191	L96-V187 HydrophobicContact CD1-CG2 4.35Å; C99-V187 HydrophobicContact CB-CG2 4.11Å; C99-V187 WeakPolarHBondContact SG-CG2 3.4Å; F114-V187 HydrophobicContact CD1-CG1 3.4Å; F114-V187 HydrophobicContact CD2-CG1 4.07Å; F114-V187 HydrophobicContact CD2-CG2 4.26Å; F114-V187 HydrophobicContact CE1-CG1 3.38Å; F114-V187 HydrophobicContact CE2-CG1 4.01Å; F114-V187 HydrophobicContact CE2-CG2 4.42Å; F114-V187 HydrophobicContact CG-CG1 3.77Å; F114-V187 HydrophobicContact CZ-CG1 3.7Å; D183-V187 WeakPolarHBondContact O-CG2 3.39Å; D183-V187 PolarHBondContact O-N 2.94Å; F184-V187 PolarHBondContact O-N 3.24Å; I185-V187 VanDerWaalsContact C-N 3.31Å; I185-V187 PolarHBondContact O-N 3.01Å; V187-K189 VanDerWaalsContact C-N 3.31Å; V187-K189 PolarHBondContact O-N 3.41Å; V187-Q190 PolarHBondContact O-N 3.35Å; V187-L191 HydrophobicContact CG1-CD1 3.83Å; V187-L191 HydrophobicContact CG1-CG 4.18Å; V187-L191 WeakPolarHBondContact O-CB 3.47Å; V187-L191 VanDerWaalsContact O-CG 3.29Å; V187-L191 WeakPolarHBondContact O-CG 3.32Å; V187-L191 PolarHBondContact O-N 2.97Å
188	C	72.1	Confident	69.5	Low	6 Å²	6	51.5 Å²	51.5	4%	0.041	27%	0.266	C	S	.	.	H	α-helix	trans	-53.2	-47.9	176	-82.2	0	0	0	0	112.1	F184 I185 V186 L191 V192 C209	F184-C188 WeakPolarHBondContact O-CB 2.87Å; F184-C188 PolarHBondContact O-N 2.6Å; F184-C188 PolarHBondContact O-SG 2.81Å; F184-C188 VanDerWaalsContact O-SG 3.41Å; I185-C188 WeakPolarHBondContact O-CB 3.35Å; I185-C188 PolarHBondContact O-N 3.21Å; V186-C188 PolarHBondContact O-N 2.98Å; C188-L191 PolarHBondContact O-N 2.89Å; C188-V192 VanDerWaalsContact O-CG2 3.26Å; C188-V192 WeakPolarHBondContact O-CG2 3.42Å; C188-V192 PolarHBondContact O-N 3.07Å; C188-C209 HydrophobicContact CB-CB 3.35Å; C188-C209 WeakPolarHBondContact CB-SG 3.27Å; C188-C209 WeakPolarHBondContact SG-CB 3.45Å; C188-C209 CovalentContact SG-SG 2.05Å; C188-C209 PolarHBondContact SG-SG 2.76Å
189	K	70.5	Confident	68.4	Low	97 Å²	97	50.5 Å²	50.5	42%	0.422	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-49.3	179.6	-78	179.9	176.9	-178.5	0	111	I185 V186 V187 L191 V192 T193 E213	I185-K189 HydrophobicContact CG2-CD 4.32Å; I185-K189 HydrophobicContact CG2-CG 4.48Å; I185-K189 WeakPolarHBondContact O-CB 3.47Å; I185-K189 WeakPolarHBondContact O-CG 3.42Å; I185-K189 PolarHBondContact O-N 2.89Å; V186-K189 PolarHBondContact O-N 3.01Å; V187-K189 VanDerWaalsContact C-N 3.31Å; V187-K189 PolarHBondContact O-N 3.41Å; K189-L191 VanDerWaalsContact C-N 3.35Å; K189-L191 PolarHBondContact O-N 3.26Å; K189-V192 PolarHBondContact O-N 3.23Å; K189-T193 WeakPolarHBondContact O-CG2 3.09Å; K189-T193 PolarHBondContact O-N 3.37Å; K189-T193 PolarHBondContact O-OG1 2.84Å; K189-E213 WeakPolarHBondContact CE-OE1 3.33Å; K189-E213 WeakPolarHBondContact CE-OE2 3.41Å; K189-E213 IonicContact NZ-OE1 3.96Å; K189-E213 PolarHBondContact NZ-OE1 3.29Å; K189-E213 IonicContact NZ-OE2 2.89Å
190	Q	73.8	Confident	66.7	Low	47 Å²	47	54 Å²	54	22%	0.22	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-44.8	-179.8	-72.5	176.7	-31.7	0	0	111	N107 F111 V186 V187 V192 T193 D194	N107-Q190 PolarHBondContact OD1-NE2 3.49Å; F111-Q190 HydrophobicContact CD1-CB 4.43Å; F111-Q190 HydrophobicContact CD2-CB 3.49Å; F111-Q190 VanDerWaalsContact CD2-CB 3.49Å; F111-Q190 HydrophobicContact CD2-CG 4.26Å; F111-Q190 HydrophobicContact CE1-CB 4.18Å; F111-Q190 HydrophobicContact CE2-CB 3.16Å; F111-Q190 HydrophobicContact CE2-CG 4.36Å; F111-Q190 HydrophobicContact CG-CB 4.12Å; F111-Q190 VanDerWaalsContact CG-OE1 3.31Å; F111-Q190 VanDerWaalsContact CZ-C 3.48Å; F111-Q190 HydrophobicContact CZ-CB 3.55Å; V186-Q190 HydrophobicContact CG1-CG 4.41Å; V186-Q190 WeakPolarHBondContact O-CB 3.37Å; V186-Q190 WeakPolarHBondContact O-CG 3.41Å; V186-Q190 PolarHBondContact O-N 3.06Å; V187-Q190 PolarHBondContact O-N 3.35Å; Q190-V192 VanDerWaalsContact C-N 3.32Å; Q190-V192 PolarHBondContact O-N 2.79Å; Q190-T193 WeakPolarHBondContact CA-OG1 3.33Å; Q190-T193 PolarHBondContact O-N 3.11Å; Q190-T193 VanDerWaalsContact O-N 3.13Å; Q190-T193 PolarHBondContact O-OG1 3.48Å; Q190-D194 PolarHBondContact O-N 3Å
191	L	67.9	Low	65.2	Low	6 Å²	6	54 Å²	54	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-39.4	176.3	-68	171.2	0	0	0	112.3	F111 F114 F118 I133 V187 C188 K189 T193 D194 L197 F202	F111-L191 HydrophobicContact CE2-CB 4.47Å; F111-L191 HydrophobicContact CE2-CD2 3.76Å; F111-L191 HydrophobicContact CE2-CG 3.83Å; F111-L191 HydrophobicContact CZ-CD2 3.92Å; F111-L191 HydrophobicContact CZ-CG 4.29Å; F114-L191 HydrophobicContact CD1-CD1 4.31Å; F114-L191 HydrophobicContact CE1-CD1 4.24Å; F118-L191 HydrophobicContact CD2-CD2 3.79Å; F118-L191 HydrophobicContact CE2-CD1 3.7Å; F118-L191 HydrophobicContact CE2-CD2 3.72Å; F118-L191 HydrophobicContact CE2-CG 4.39Å; F118-L191 HydrophobicContact CZ-CD1 3.75Å; F118-L191 HydrophobicContact CZ-CD2 4.48Å; I133-L191 HydrophobicContact CD1-CD1 4.42Å; V187-L191 HydrophobicContact CG1-CD1 3.83Å; V187-L191 HydrophobicContact CG1-CG 4.18Å; V187-L191 WeakPolarHBondContact O-CB 3.47Å; V187-L191 VanDerWaalsContact O-CG 3.29Å; V187-L191 WeakPolarHBondContact O-CG 3.32Å; V187-L191 PolarHBondContact O-N 2.97Å; C188-L191 PolarHBondContact O-N 2.89Å; K189-L191 VanDerWaalsContact C-N 3.35Å; K189-L191 PolarHBondContact O-N 3.26Å; L191-T193 VanDerWaalsContact C-N 3.32Å; L191-T193 PolarHBondContact O-N 3.27Å; L191-D194 PolarHBondContact O-N 3.01Å; L191-L197 HydrophobicContact CD2-CD1 3.7Å; L191-F202 HydrophobicContact CB-CE1 3.43Å; L191-F202 VanDerWaalsContact CB-CE1 3.43Å; L191-F202 HydrophobicContact CB-CZ 3.76Å; L191-F202 HydrophobicContact CD1-CE1 4.17Å; L191-F202 HydrophobicContact CD1-CZ 4.09Å; L191-F202 HydrophobicContact CD2-CZ 4.08Å; L191-F202 HydrophobicContact CG-CE1 4.27Å; L191-F202 HydrophobicContact CG-CZ 4.19Å
192	V	63.3	Low	64.1	Low	53 Å²	53	54.6 Å²	54.6	32%	0.321	29%	0.286	S	S	.	.	H	α-helix	trans	-67	-33.6	176.6	168.7	0	0	0	0	112.2	C188 K189 Q190 K206	C188-V192 VanDerWaalsContact O-CG2 3.26Å; C188-V192 WeakPolarHBondContact O-CG2 3.42Å; C188-V192 PolarHBondContact O-N 3.07Å; K189-V192 PolarHBondContact O-N 3.23Å; Q190-V192 VanDerWaalsContact C-N 3.32Å; Q190-V192 PolarHBondContact O-N 2.79Å; V192-K206 HydrophobicContact CG1-CD 3.84Å; V192-K206 HydrophobicContact CG1-CG 3.89Å; V192-K206 HydrophobicContact CG2-CB 3.88Å; V192-K206 HydrophobicContact CG2-CG 3.97Å
193	T	67.7	Low	62.8	Low	106 Å²	106	57 Å²	57	65%	0.65	30%	0.299	S	S	*	.	H	α-helix	trans	-82.4	-14.8	177.7	55.9	0	0	0	0	113.6	K189 Q190 L191 R195	K189-T193 WeakPolarHBondContact O-CG2 3.09Å; K189-T193 PolarHBondContact O-N 3.37Å; K189-T193 PolarHBondContact O-OG1 2.84Å; Q190-T193 WeakPolarHBondContact CA-OG1 3.33Å; Q190-T193 PolarHBondContact O-N 3.11Å; Q190-T193 VanDerWaalsContact O-N 3.13Å; Q190-T193 PolarHBondContact O-OG1 3.48Å; L191-T193 VanDerWaalsContact C-N 3.32Å; L191-T193 PolarHBondContact O-N 3.27Å; T193-R195 PolarHBondContact O-N 3.19Å; T193-R195 VanDerWaalsContact O-N 3.15Å
194	D	65.5	Low	61	Low	41 Å²	41	65 Å²	65	22%	0.219	33%	0.33	C	S	.	.			trans	-74.3	106.4	-178.3	-159.6	-36	0	0	0	111	F111 Y119 Q190 L191 S196 L197	F111-D194 HydrophobicContact CZ-CB 4.38Å; Y119-D194 VanDerWaalsContact OH-CG 3.26Å; Y119-D194 PolarHBondContact OH-OD1 3.07Å; Y119-D194 PolarHBondContact OH-OD2 2.98Å; Q190-D194 PolarHBondContact O-N 3Å; L191-D194 PolarHBondContact O-N 3.01Å; D194-S196 PolarHBondContact O-N 3.39Å; D194-S196 WeakPolarHBondContact OD1-CB 3.29Å; D194-S196 PolarHBondContact OD1-N 2.99Å; D194-S196 PolarHBondContact OD1-OG 3.48Å; D194-L197 HydrophobicContact CB-CD1 4.15Å; D194-L197 HydrophobicContact CB-CG 4.44Å; D194-L197 PolarHBondContact O-N 3.48Å
195	R	61.4	Low	59.5	Low	216 Å²	216	65.5 Å²	65.5	82%	0.815	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-67	-18.7	-177.2	-64.4	-174	179.3	-174.8	-0	113.3	T193 L197 N198	T193-R195 PolarHBondContact O-N 3.19Å; T193-R195 VanDerWaalsContact O-N 3.15Å; R195-L197 PolarHBondContact O-N 2.73Å; R195-N198 VanDerWaalsContact O-CG 3.3Å; R195-N198 PolarHBondContact O-ND2 3.09Å
196	S	60.8	Low	58.3	Low	76 Å²	76	69.8 Å²	69.8	53%	0.531	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-78.2	-10.7	179.3	63.4	0	0	0	0	112.8	Y119 D194	Y119-S196 WeakPolarHBondContact CE1-OG 3.27Å; Y119-S196 VanDerWaalsContact CZ-OG 3.23Å; Y119-S196 PolarHBondContact OH-OG 3.49Å; D194-S196 PolarHBondContact O-N 3.39Å; D194-S196 WeakPolarHBondContact OD1-CB 3.29Å; D194-S196 PolarHBondContact OD1-N 2.99Å; D194-S196 PolarHBondContact OD1-OG 3.48Å
197	L	57.3	Low	57	Low	12 Å²	12	71.2 Å²	71.2	6%	0.063	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-98.1	29.2	177.9	-66.9	174.9	0	0	0	114.2	F118 Y119 L191 D194 R195 S199 F202	F118-L197 HydrophobicContact CB-CD1 4.26Å; F118-L197 HydrophobicContact CB-CD2 3.46Å; F118-L197 VanDerWaalsContact CB-CD2 3.46Å; Y119-L197 HydrophobicContact CD1-CD2 3.46Å; Y119-L197 VanDerWaalsContact CD1-CD2 3.46Å; Y119-L197 HydrophobicContact CD1-CG 4.31Å; Y119-L197 HydrophobicContact CE1-CD1 4.49Å; Y119-L197 HydrophobicContact CE1-CD2 3.24Å; Y119-L197 HydrophobicContact CE1-CG 3.58Å; Y119-L197 HydrophobicContact CG-CD2 4.27Å; L191-L197 HydrophobicContact CD2-CD1 3.7Å; D194-L197 HydrophobicContact CB-CD1 4.15Å; D194-L197 HydrophobicContact CB-CG 4.44Å; D194-L197 PolarHBondContact O-N 3.48Å; R195-L197 PolarHBondContact O-N 2.73Å; L197-S199 PolarHBondContact O-N 3.17Å; L197-F202 HydrophobicContact CB-CD2 3.96Å; L197-F202 HydrophobicContact CB-CE2 3.9Å; L197-F202 HydrophobicContact CD1-CE2 3.76Å; L197-F202 HydrophobicContact CD1-CZ 3.77Å; L197-F202 HydrophobicContact CD2-CE2 4.27Å; L197-F202 HydrophobicContact CG-CE2 4.2Å
198	N	50.4	Low	55.5	Low	151 Å²	151	72.2 Å²	72.2	81%	0.807	37%	0.37	S	S	*	.			trans	-63.6	46.8	-176	-90.6	-12.7	0	0	0	116	R195	R195-N198 VanDerWaalsContact O-CG 3.3Å; R195-N198 PolarHBondContact O-ND2 3.09Å
199	S	49.1	Very low	54.2	Low	38 Å²	38	72.6 Å²	72.6	27%	0.266	37%	0.372	S	S	.	.			trans	-99	144.1	172	60.9	0	0	0	0	111.1	L197 S201 F202	L197-S199 PolarHBondContact O-N 3.17Å; S199-S201 PolarHBondContact O-N 3.4Å; S199-S201 VanDerWaalsContact O-N 3.15Å; S199-F202 WeakPolarHBondContact O-CB 3.45Å; S199-F202 PolarHBondContact O-N 3.28Å; S199-F202 VanDerWaalsContact O-N 3.08Å
200	L	41.8	Very low	53.2	Low	137 Å²	137	71.2 Å²	71.2	72%	0.717	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-29.4	-175.6	-122.7	126.5	0	0	0	112.7	F202 L203	L200-F202 PolarHBondContact O-N 3.48Å; L200-L203 PolarHBondContact O-N 3.1Å
201	S	44.2	Very low	52.1	Low	23 Å²	23	78.2 Å²	78.2	16%	0.161	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.3	176.5	-44.8	0	0	0	0	113.7	E123 S199 L203 Y204	E123-S201 WeakPolarHBondContact CB-OG 3.47Å; S199-S201 PolarHBondContact O-N 3.4Å; S199-S201 VanDerWaalsContact O-N 3.15Å; S201-L203 VanDerWaalsContact C-N 3.31Å; S201-L203 PolarHBondContact O-N 3.31Å; S201-Y204 PolarHBondContact O-N 3.04Å
202	F	48.2	Very low	51.1	Low	19 Å²	19	79.8 Å²	79.8	8%	0.083	40%	0.404	C	S	.	.	H	α-helix	trans	-69.7	-26.1	-178.6	-113.7	-75.1	0	0	0	113.7	F118 V126 L191 L197 S199 L200 Y204 A205 K206	F118-F202 HydrophobicContact CB-CE2 4.11Å; F118-F202 AromaticContact CD1-CE2 3.58Å; F118-F202 HydrophobicContact CD1-CE2 3.58Å; F118-F202 AromaticContact CD1-CZ 3.71Å; F118-F202 HydrophobicContact CD1-CZ 3.71Å; F118-F202 HydrophobicContact CD2-CZ 4.47Å; F118-F202 HydrophobicContact CE1-CE2 4.16Å; F118-F202 AromaticContact CE1-CZ 3.88Å; F118-F202 HydrophobicContact CE1-CZ 3.88Å; F118-F202 AromaticContact CG-CE2 3.92Å; F118-F202 HydrophobicContact CG-CE2 3.92Å; F118-F202 HydrophobicContact CG-CZ 4.02Å; F118-F202 HydrophobicContact CZ-CZ 4.34Å; V126-F202 HydrophobicContact CG1-CD2 4.1Å; V126-F202 HydrophobicContact CG1-CE2 4.15Å; L191-F202 HydrophobicContact CB-CE1 3.43Å; L191-F202 VanDerWaalsContact CB-CE1 3.43Å; L191-F202 HydrophobicContact CB-CZ 3.76Å; L191-F202 HydrophobicContact CD1-CE1 4.17Å; L191-F202 HydrophobicContact CD1-CZ 4.09Å; L191-F202 HydrophobicContact CD2-CZ 4.08Å; L191-F202 HydrophobicContact CG-CE1 4.27Å; L191-F202 HydrophobicContact CG-CZ 4.19Å; L197-F202 HydrophobicContact CB-CD2 3.96Å; L197-F202 HydrophobicContact CB-CE2 3.9Å; L197-F202 HydrophobicContact CD1-CE2 3.76Å; L197-F202 HydrophobicContact CD1-CZ 3.77Å; L197-F202 HydrophobicContact CD2-CE2 4.27Å; L197-F202 HydrophobicContact CG-CE2 4.2Å; S199-F202 WeakPolarHBondContact O-CB 3.45Å; S199-F202 PolarHBondContact O-N 3.28Å; S199-F202 VanDerWaalsContact O-N 3.08Å; L200-F202 PolarHBondContact O-N 3.48Å; F202-Y204 PolarHBondContact O-N 3.28Å; F202-A205 PolarHBondContact O-N 3.05Å; F202-K206 PolarHBondContact O-N 3.22Å
203	L	45.8	Very low	50.3	Low	111 Å²	111	79.2 Å²	79.2	58%	0.581	40%	0.398	S	S	*	.	H	α-helix	trans	-64.6	-27.9	177.8	-77.7	158.9	0	0	0	112.4	L200 S201 K206 S207	L200-L203 PolarHBondContact O-N 3.1Å; S201-L203 VanDerWaalsContact C-N 3.31Å; S201-L203 PolarHBondContact O-N 3.31Å; L203-K206 HydrophobicContact CD2-CD 4.35Å; L203-K206 WeakPolarHBondContact O-CB 3.3Å; L203-S207 PolarHBondContact O-N 3.18Å
204	Y	42.6	Very low	49.6	Very low	172 Å²	172	81.5 Å²	81.5	68%	0.675	40%	0.399	S	S	*	.	H	α-helix	trans	-75.4	-41.6	177.4	-166.7	-94.2	0	0	0	112.3	S201 F202 K206 S207 T208	S201-Y204 PolarHBondContact O-N 3.04Å; F202-Y204 PolarHBondContact O-N 3.28Å; Y204-K206 VanDerWaalsContact C-N 3.29Å; Y204-K206 PolarHBondContact O-N 2.85Å; Y204-S207 PolarHBondContact O-N 3.45Å; Y204-S207 PolarHBondContact O-OG 3.38Å; Y204-T208 PolarHBondContact O-N 3.01Å; Y204-T208 PolarHBondContact O-OG1 3.25Å; Y204-T208 VanDerWaalsContact O-OG1 3.11Å
205	A	43.1	Very low	48.6	Very low	9 Å²	9	83.9 Å²	83.9	7%	0.074	41%	0.411	C	S	.	.	H	α-helix	trans	-60.6	-40.9	172.7	0	0	0	0	0	111.2	C130 F202 S207 T208 C209	C130-A205 HydrophobicContact CB-CB 3.89Å; C130-A205 VanDerWaalsContact SG-CB 3.54Å; F202-A205 PolarHBondContact O-N 3.05Å; A205-S207 PolarHBondContact O-N 3.48Å; A205-T208 PolarHBondContact O-N 3.49Å; A205-T208 VanDerWaalsContact O-N 3.1Å; A205-C209 PolarHBondContact O-N 3.37Å; A205-C209 PolarHBondContact O-SG 3.44Å
206	K	47.2	Very low	47.9	Very low	102 Å²	102	75.4 Å²	75.4	44%	0.443	38%	0.382	S	S	.	.	H	α-helix	trans	-53.4	-47.5	174.9	-174.5	178.2	-176.9	175	0	112.6	V192 F202 L203 Y204 T208 C210	V192-K206 HydrophobicContact CG1-CD 3.84Å; V192-K206 HydrophobicContact CG1-CG 3.89Å; V192-K206 HydrophobicContact CG2-CB 3.88Å; V192-K206 HydrophobicContact CG2-CG 3.97Å; F202-K206 PolarHBondContact O-N 3.22Å; L203-K206 HydrophobicContact CD2-CD 4.35Å; L203-K206 WeakPolarHBondContact O-CB 3.3Å; Y204-K206 VanDerWaalsContact C-N 3.29Å; Y204-K206 PolarHBondContact O-N 2.85Å; K206-T208 VanDerWaalsContact C-N 3.28Å; K206-T208 PolarHBondContact O-N 2.93Å; K206-C210 WeakPolarHBondContact O-CB 3.45Å; K206-C210 PolarHBondContact O-N 3.09Å
207	S	47.6	Very low	47.3	Very low	74 Å²	74	76.7 Å²	76.7	52%	0.517	38%	0.379	S	S	.	.	H	α-helix	trans	-65.3	-35	-179.7	100.5	0	0	0	0	112.1	L203 Y204 A205 R211	L203-S207 PolarHBondContact O-N 3.18Å; Y204-S207 PolarHBondContact O-N 3.45Å; Y204-S207 PolarHBondContact O-OG 3.38Å; A205-S207 PolarHBondContact O-N 3.48Å; S207-R211 PolarHBondContact O-N 2.87Å
208	T	45.1	Very low	46.7	Very low	21 Å²	21	78.3 Å²	78.3	13%	0.129	40%	0.399	C	S	.	.	H	α-helix	trans	-77.4	-44.2	-175.1	-47.9	0	0	0	0	111.7	I134 Y204 A205 K206 R211 Y212	I134-T208 HydrophobicContact CB-CG2 4.5Å; I134-T208 HydrophobicContact CD1-CG2 3.64Å; I134-T208 HydrophobicContact CG1-CG2 3.69Å; I134-T208 HydrophobicContact CG2-CG2 3.99Å; Y204-T208 PolarHBondContact O-N 3.01Å; Y204-T208 PolarHBondContact O-OG1 3.25Å; Y204-T208 VanDerWaalsContact O-OG1 3.11Å; A205-T208 PolarHBondContact O-N 3.49Å; A205-T208 VanDerWaalsContact O-N 3.1Å; K206-T208 VanDerWaalsContact C-N 3.28Å; K206-T208 PolarHBondContact O-N 2.93Å; T208-R211 WeakPolarHBondContact O-CB 3.42Å; T208-R211 PolarHBondContact O-N 3.5Å; T208-R211 VanDerWaalsContact O-N 3.14Å; T208-Y212 HydrophobicContact CG2-CD2 4.15Å; T208-Y212 HydrophobicContact CG2-CE2 3.76Å; T208-Y212 VanDerWaalsContact O-CD2 3.28Å; T208-Y212 WeakPolarHBondContact O-CD2 3.38Å; T208-Y212 PolarHBondContact O-N 3.27Å
209	C	45.8	Very low	46.4	Very low	13 Å²	13	74.6 Å²	74.6	9%	0.088	38%	0.379	C	S	.	.	H	α-helix	trans	-65.9	-39.2	176.6	-55.1	0	0	0	0	111.7	C188 A205 R211 Y212 E213	C188-C209 HydrophobicContact CB-CB 3.35Å; C188-C209 WeakPolarHBondContact CB-SG 3.27Å; C188-C209 WeakPolarHBondContact SG-CB 3.45Å; C188-C209 CovalentContact SG-SG 2.05Å; C188-C209 PolarHBondContact SG-SG 2.76Å; A205-C209 PolarHBondContact O-N 3.37Å; A205-C209 PolarHBondContact O-SG 3.44Å; C209-R211 PolarHBondContact O-N 3.31Å; C209-Y212 PolarHBondContact O-N 3.32Å; C209-Y212 VanDerWaalsContact O-N 3.16Å; C209-E213 PolarHBondContact O-N 3.5Å
210	C	47.9	Very low	46.1	Very low	68 Å²	68	78.2 Å²	78.2	46%	0.459	39%	0.391	S	S	.	.	H	α-helix	trans	-57	-35.1	172	-111.1	0	0	0	0	112.7	K206 K214	K206-C210 WeakPolarHBondContact O-CB 3.45Å; K206-C210 PolarHBondContact O-N 3.09Å; C210-K214 PolarHBondContact O-N 3.19Å
211	R	52.1	Low	45.8	Very low	195 Å²	195	74.4 Å²	74.4	74%	0.736	38%	0.38	S	S	*	.	H	α-helix	trans	-70.2	-37.6	179.4	-165.2	176.5	-179.1	177	-0.6	111.9	S207 T208 C209 L215	S207-R211 PolarHBondContact O-N 2.87Å; T208-R211 WeakPolarHBondContact O-CB 3.42Å; T208-R211 PolarHBondContact O-N 3.5Å; T208-R211 VanDerWaalsContact O-N 3.14Å; C209-R211 PolarHBondContact O-N 3.31Å; R211-L215 PolarHBondContact O-N 2.89Å
212	Y	46.1	Very low	45.2	Very low	38 Å²	38	75.6 Å²	75.6	15%	0.149	39%	0.388	C	S	.	.	H	α-helix	trans	-75.3	-37	176.8	-75.6	-68.1	0	0	0	113	I134 I137 K138 T208 C209 K214 L215 I216	I134-Y212 HydrophobicContact CG2-CE2 4.43Å; I137-Y212 HydrophobicContact CG2-CD1 3.98Å; I137-Y212 HydrophobicContact CG2-CD2 4.09Å; I137-Y212 HydrophobicContact CG2-CE1 4.26Å; I137-Y212 HydrophobicContact CG2-CE2 4.34Å; I137-Y212 HydrophobicContact CG2-CG 3.92Å; K138-Y212 WeakPolarHBondContact CG-OH 3.31Å; T208-Y212 HydrophobicContact CG2-CD2 4.15Å; T208-Y212 HydrophobicContact CG2-CE2 3.76Å; T208-Y212 VanDerWaalsContact O-CD2 3.28Å; T208-Y212 WeakPolarHBondContact O-CD2 3.38Å; T208-Y212 PolarHBondContact O-N 3.27Å; C209-Y212 PolarHBondContact O-N 3.32Å; C209-Y212 VanDerWaalsContact O-N 3.16Å; Y212-K214 PolarHBondContact O-N 2.85Å; Y212-L215 WeakPolarHBondContact O-CA 3.45Å; Y212-L215 VanDerWaalsContact O-CB 3.3Å; Y212-L215 WeakPolarHBondContact O-CB 3.48Å; Y212-L215 PolarHBondContact O-N 3.42Å; Y212-I216 WeakPolarHBondContact O-CD1 3.48Å; Y212-I216 PolarHBondContact O-N 2.98Å
213	E	46.9	Very low	44.6	Very low	42 Å²	42	80.6 Å²	80.6	20%	0.196	41%	0.406	C	S	.	.	H	α-helix	trans	-56.6	-49.2	174.9	-174.9	175.9	-177.9	0	0	111.4	I185 K189 C209 L215 I216 E217	I185-E213 HydrophobicContact CG2-CG 4.48Å; K189-E213 WeakPolarHBondContact CE-OE1 3.33Å; K189-E213 WeakPolarHBondContact CE-OE2 3.41Å; K189-E213 IonicContact NZ-OE1 3.96Å; K189-E213 PolarHBondContact NZ-OE1 3.29Å; K189-E213 IonicContact NZ-OE2 2.89Å; C209-E213 PolarHBondContact O-N 3.5Å; E213-L215 PolarHBondContact O-N 3.45Å; E213-I216 PolarHBondContact O-N 2.77Å; E213-I216 VanDerWaalsContact O-N 3.07Å; E213-E217 HydrophobicContact CG-CG 4.48Å; E213-E217 WeakPolarHBondContact O-CG 3.3Å; E213-E217 PolarHBondContact O-N 2.9Å
214	K	52.5	Low	44.1	Very low	153 Å²	153	79.6 Å²	79.6	67%	0.665	41%	0.408	S	S	*	.	H	α-helix	trans	-59.3	-31.4	174.7	-73.7	-173	176.6	-172.4	0	113.6	C210 Y212 I216 G218	C210-K214 PolarHBondContact O-N 3.19Å; Y212-K214 PolarHBondContact O-N 2.85Å; K214-I216 VanDerWaalsContact C-N 3.34Å; K214-G218 PolarHBondContact O-N 3.05Å
215	L	45.5	Very low	43.8	Very low	92 Å²	92	76.3 Å²	76.3	48%	0.482	41%	0.41	S	S	.	.	H	α-helix	trans	-72.7	-31.9	-179.8	-148.1	141.2	0	0	0	111.1	R211 Y212 E213 N219	R211-L215 PolarHBondContact O-N 2.89Å; Y212-L215 WeakPolarHBondContact O-CA 3.45Å; Y212-L215 VanDerWaalsContact O-CB 3.3Å; Y212-L215 WeakPolarHBondContact O-CB 3.48Å; Y212-L215 PolarHBondContact O-N 3.42Å; E213-L215 PolarHBondContact O-N 3.45Å; L215-N219 PolarHBondContact O-N 3.46Å
216	I	45.2	Very low	43.2	Very low	37 Å²	37	79.2 Å²	79.2	19%	0.19	42%	0.424	C	S	.	.	H	α-helix	trans	-82.5	-43.8	176.8	-68.3	150.3	0	0	0	111.4	I181 L182 I185 Y212 E213 K214 G218 N219 E220	I181-I216 HydrophobicContact CG2-CD1 3.24Å; I181-I216 HydrophobicContact CG2-CG1 4.16Å; L182-I216 HydrophobicContact CD2-CG2 4.38Å; I185-I216 HydrophobicContact CD1-CD1 3.09Å; I185-I216 HydrophobicContact CD1-CG1 4.49Å; I185-I216 HydrophobicContact CG1-CD1 4.47Å; Y212-I216 WeakPolarHBondContact O-CD1 3.48Å; Y212-I216 PolarHBondContact O-N 2.98Å; E213-I216 PolarHBondContact O-N 2.77Å; E213-I216 VanDerWaalsContact O-N 3.07Å; K214-I216 VanDerWaalsContact C-N 3.34Å; I216-G218 VanDerWaalsContact C-N 3.27Å; I216-G218 PolarHBondContact O-N 3.4Å; I216-N219 CarbonylContact O-C 3.46Å; I216-N219 WeakPolarHBondContact O-CA 3.24Å; I216-N219 WeakPolarHBondContact O-CB 3.45Å; I216-N219 PolarHBondContact O-N 3.11Å; I216-E220 PolarHBondContact O-N 2.81Å
217	E	49.6	Very low	42.3	Very low	104 Å²	104	78.8 Å²	78.8	49%	0.486	43%	0.43	S	S	.	.	H	α-helix	trans	-59.4	-40.2	173.2	-71.9	-179.5	159.3	0	0	111.3	E213 N219 E220 A221	E213-E217 HydrophobicContact CG-CG 4.48Å; E213-E217 WeakPolarHBondContact O-CG 3.3Å; E213-E217 PolarHBondContact O-N 2.9Å; E217-N219 VanDerWaalsContact C-N 3.26Å; E217-N219 PolarHBondContact O-N 3.33Å; E217-E220 PolarHBondContact O-N 3.32Å; E217-A221 PolarHBondContact O-N 3.32Å
218	G	43.7	Very low	41.5	Very low	45 Å²	45	79.4 Å²	79.4	46%	0.464	43%	0.432	S	S	.	.	H	α-helix	trans	-61.1	-34.2	172.5	0	0	0	0	0	113	K214 I216 C222	K214-G218 PolarHBondContact O-N 3.05Å; I216-G218 VanDerWaalsContact C-N 3.27Å; I216-G218 PolarHBondContact O-N 3.4Å; G218-C222 PolarHBondContact O-N 2.85Å
219	N	43.6	Very low	41	Very low	73 Å²	73	85 Å²	85	39%	0.39	47%	0.472	S	S	.	.	H	α-helix	trans	-76.4	-33.4	174.6	-102	-13.8	0	0	0	113	L215 I216 E217 C222 R223	L215-N219 PolarHBondContact O-N 3.46Å; I216-N219 CarbonylContact O-C 3.46Å; I216-N219 WeakPolarHBondContact O-CA 3.24Å; I216-N219 WeakPolarHBondContact O-CB 3.45Å; I216-N219 PolarHBondContact O-N 3.11Å; E217-N219 VanDerWaalsContact C-N 3.26Å; E217-N219 PolarHBondContact O-N 3.33Å; N219-C222 WeakPolarHBondContact O-CB 3.48Å; N219-C222 PolarHBondContact O-N 3.43Å; N219-R223 PolarHBondContact O-N 3.39Å
220	E	43.7	Very low	40.3	Very low	114 Å²	114	88.8 Å²	88.8	53%	0.533	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-39.9	171.7	-93.3	-169.8	146.9	0	0	112.1	I216 E217 C222 R223 S224	I216-E220 PolarHBondContact O-N 2.81Å; E217-E220 PolarHBondContact O-N 3.32Å; E220-C222 PolarHBondContact O-N 3.33Å; E220-R223 PolarHBondContact O-N 3.27Å; E220-S224 WeakPolarHBondContact O-CB 3.39Å; E220-S224 PolarHBondContact O-N 3.19Å; E220-S224 PolarHBondContact O-OG 3.49Å
221	A	34.7	Very low	39.7	Very low	58 Å²	58	89.2 Å²	89.2	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-60.8	-37.3	171.4	0	0	0	0	0	111.3	E217 S224 S225	E217-A221 PolarHBondContact O-N 3.32Å; A221-S224 WeakPolarHBondContact CA-OG 3.46Å; A221-S224 PolarHBondContact O-OG 3.29Å; A221-S224 VanDerWaalsContact O-OG 3.11Å; A221-S225 PolarHBondContact O-N 3.3Å; A221-S225 PolarHBondContact O-OG 3.47Å
222	C	31.3	Very low	38.6	Very low	47 Å²	47	85.8 Å²	85.8	32%	0.318	51%	0.513	S	S	.	.	H	α-helix	trans	-67.6	-43.3	173.8	-146.4	0	0	0	0	111.7	G218 N219 E220 S225 L226	G218-C222 PolarHBondContact O-N 2.85Å; N219-C222 WeakPolarHBondContact O-CB 3.48Å; N219-C222 PolarHBondContact O-N 3.43Å; E220-C222 PolarHBondContact O-N 3.33Å; C222-S225 WeakPolarHBondContact O-CB 3.44Å; C222-S225 PolarHBondContact O-N 2.84Å; C222-L226 WeakPolarHBondContact O-CD1 3.08Å; C222-L226 PolarHBondContact O-N 3.08Å
223	R	36.2	Very low	37.7	Very low	125 Å²	125	86.9 Å²	86.9	47%	0.472	54%	0.536	S	S	.	.	H	α-helix	trans	-65.7	-41.3	177.7	-102.7	-174.5	174.8	-179.1	5.4	113.8	E178 N219 E220 S225 L226 V227	E178-R223 IonicContact OE1-CZ 3.47Å; E178-R223 IonicContact OE1-NH1 3.82Å; E178-R223 PolarHBondContact OE1-NH1 2.94Å; E178-R223 IonicContact OE2-CZ 2.82Å; E178-R223 IonicContact OE2-NH1 2.6Å; E178-R223 PolarHBondContact OE2-NH1 2.6Å; E178-R223 IonicContact OE2-NH2 3.52Å; E178-R223 PolarHBondContact OE2-NH2 3.11Å; E178-R223 VanDerWaalsContact OE2-NH2 3.07Å; N219-R223 PolarHBondContact O-N 3.39Å; E220-R223 PolarHBondContact O-N 3.27Å; R223-S225 PolarHBondContact O-N 2.81Å; R223-L226 WeakPolarHBondContact O-CB 3.46Å; R223-L226 PolarHBondContact O-N 3.48Å; R223-V227 PolarHBondContact O-N 3.23Å
224	S	36.6	Very low	36.9	Very low	89 Å²	89	90.7 Å²	90.7	62%	0.622	57%	0.566	S	S	*	*	H	α-helix	trans	-67.2	-22.2	178.2	45.8	0	0	0	0	112.8	E220 A221 L226	E220-S224 WeakPolarHBondContact O-CB 3.39Å; E220-S224 PolarHBondContact O-N 3.19Å; E220-S224 PolarHBondContact O-OG 3.49Å; A221-S224 WeakPolarHBondContact CA-OG 3.46Å; A221-S224 PolarHBondContact O-OG 3.29Å; A221-S224 VanDerWaalsContact O-OG 3.11Å; S224-L226 VanDerWaalsContact C-N 3.31Å
225	S	35.1	Very low	35.7	Very low	104 Å²	104	89.4 Å²	89.4	73%	0.727	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-16.3	170.6	-50.1	0	0	0	0	113.3	A221 C222 R223	A221-S225 PolarHBondContact O-N 3.3Å; A221-S225 PolarHBondContact O-OG 3.47Å; C222-S225 WeakPolarHBondContact O-CB 3.44Å; C222-S225 PolarHBondContact O-N 2.84Å; R223-S225 PolarHBondContact O-N 2.81Å
226	L	31.6	Very low	34.9	Very low	69 Å²	69	87.9 Å²	87.9	36%	0.361	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.6	-12.7	-170.5	-88.7	161.8	0	0	0	114.4	G159 C222 R223 S224 P228	G159-L226 WeakPolarHBondContact O-CD2 3.42Å; C222-L226 WeakPolarHBondContact O-CD1 3.08Å; C222-L226 PolarHBondContact O-N 3.08Å; R223-L226 WeakPolarHBondContact O-CB 3.46Å; R223-L226 PolarHBondContact O-N 3.48Å; S224-L226 VanDerWaalsContact C-N 3.31Å; L226-P228 VanDerWaalsContact O-CD 3.24Å; L226-P228 WeakPolarHBondContact O-CD 3.11Å
227	V	28.6	Very low	34.3	Very low	94 Å²	94	89.7 Å²	89.7	57%	0.57	60%	0.6	S	S	*	*	S	Bend	trans	-94.3	106.2	176.3	-177.6	0	0	0	0	109	R223 S229 A231	R223-V227 PolarHBondContact O-N 3.23Å; V227-S229 PolarHBondContact O-N 3.28Å; V227-A231 HydrophobicContact CG1-CB 4.31Å
228	P	29.2	Very low	33.3	Very low	87 Å²	87	90.7 Å²	90.7	57%	0.565	61%	0.609	S	S	*	*			trans	-62.6	140.7	167.2	27.8	-32.4	0	0	0	108.3	L226 S230 A231	L226-P228 VanDerWaalsContact O-CD 3.24Å; L226-P228 WeakPolarHBondContact O-CD 3.11Å; P228-S230 PolarHBondContact O-N 2.7Å; P228-A231 PolarHBondContact O-N 3.46Å
229	S	34.9	Very low	32.7	Very low	138 Å²	138	93.4 Å²	93.4	97%	0.965	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	13.2	-175.9	-27.3	0	0	0	0	115.3	V227	V227-S229 PolarHBondContact O-N 3.28Å
230	S	32.6	Very low	31.9	Very low	92 Å²	92	93.2 Å²	93.2	64%	0.643	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	7.2	-175.6	55	0	0	0	0	114.5	P228 S232	P228-S230 PolarHBondContact O-N 2.7Å; S230-S232 PolarHBondContact O-N 3.3Å
231	A	35.3	Very low	31	Very low	78 Å²	78	91.4 Å²	91.4	65%	0.645	64%	0.639	S	S	*	*			trans	-78.5	52.3	168.6	0	0	0	0	0	112.3	V227 P228 G233	V227-A231 HydrophobicContact CG1-CB 4.31Å; P228-A231 PolarHBondContact O-N 3.46Å; A231-G233 VanDerWaalsContact C-N 3.29Å; A231-G233 PolarHBondContact O-N 2.7Å; A231-G233 VanDerWaalsContact O-N 3.1Å
232	S	28.6	Very low	30.5	Very low	122 Å²	122	91.9 Å²	91.9	85%	0.853	65%	0.651	S	S	*	*			trans	-77.3	82.2	163.9	57.6	0	0	0	0	108.3	S230	S230-S232 PolarHBondContact O-N 3.3Å
233	G	26.9	Very low	30.3	Very low	61 Å²	61	101.6 Å²	101.6	63%	0.629	68%	0.681	S	S	*	*			trans	-179.1	46.4	-172.4	0	0	0	0	0	115.7	A231 P235	A231-G233 VanDerWaalsContact C-N 3.29Å; A231-G233 PolarHBondContact O-N 2.7Å; A231-G233 VanDerWaalsContact O-N 3.1Å; G233-P235 VanDerWaalsContact O-CD 3.27Å; G233-P235 WeakPolarHBondContact O-CD 3.27Å
234	C	28.9	Very low	30.3	Very low	123 Å²	123	104.9 Å²	104.9	83%	0.831	72%	0.723	S	S	*	*			trans	-97.7	95	153	-82.5	0	0	0	0	107.8	G236	C234-G236 PolarHBondContact O-N 2.93Å
235	P	28	Very low	29.9	Very low	125 Å²	125	105.7 Å²	105.7	81%	0.812	73%	0.728	S	S	*	*			trans	-70.3	122.3	162.3	29.9	-27.9	0	0	0	107.6	G233	G233-P235 VanDerWaalsContact O-CD 3.27Å; G233-P235 WeakPolarHBondContact O-CD 3.27Å
236	G	29.1	Very low	29.7	Very low	60 Å²	60	105.8 Å²	105.8	62%	0.619	73%	0.728	S	S	*	*			trans	75.4	58.1	161.9	0	0	0	0	0	116.3	C234 D238	C234-G236 PolarHBondContact O-N 2.93Å; G236-D238 PolarHBondContact O-N 3.1Å
237	A	31.3	Very low	29.6	Very low	75 Å²	75	107.8 Å²	107.8	62%	0.62	75%	0.748	S	S	*	*			trans	-79.3	68.4	132.2	0	0	0	0	0	107.5	C239	A237-C239 PolarHBondContact O-N 3.4Å
238	D	29.9	Very low	29.6	Very low	125 Å²	125	108.6 Å²	108.6	67%	0.668	76%	0.759	S	S	*	*			trans	-70.4	62.7	158.9	-81.5	-33.5	0	0	0	108.4	G236 G240	G236-D238 PolarHBondContact O-N 3.1Å; D238-G240 PolarHBondContact O-N 2.83Å
239	C	31	Very low	29.7	Very low	102 Å²	102	110 Å²	110	69%	0.689	77%	0.771	S	S	*	*	S	Bend	trans	-93.9	60.7	162	-43.2	0	0	0	0	106.6	A237	A237-C239 PolarHBondContact O-N 3.4Å
240	G	26.2	Very low	29.3	Very low	70 Å²	70	108.1 Å²	108.1	72%	0.722	76%	0.758	S	S	*	*	S	Bend	trans	138.2	20.8	169.7	0	0	0	0	0	119.6	D238	D238-G240 PolarHBondContact O-N 2.83Å
241	A	25.2	Very low	29.1	Very low	75 Å²	75	109.3 Å²	109.3	62%	0.62	77%	0.766	S	S	*	*			trans	-148.7	104.7	167.1	0	0	0	0	0	110.1
242	G	24.6	Very low	28.6	Very low	69 Å²	69	111.7 Å²	111.7	71%	0.711	78%	0.775	S	S	*	*			trans	152.7	51.3	178.4	0	0	0	0	0	115.1
243	W	27.1	Very low	28.6	Very low	251 Å²	251	110.8 Å²	110.8	95%	0.951	77%	0.769	S	S	*	*			trans	-133.4	90.7	156.3	-68.1	66.9	0	0	0	105.7
244	S	34.7	Very low	28.7	Very low	194 Å²	194	115.4 Å²	115.4	100%	1.357	78%	0.782	S	S	*	*			trans	-71.4	0	161	50.8	0	0	0	0	110.3

Retrieved 244 of 244 residues in 1885.5 ms (Link to these results)

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