A0A077Z9Z4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z9Z4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 230 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	28.6	Very low	42	Very low	241 Å²	241	120.8 Å²	120.8	100%	1.187	69%	0.686	S	S	*	*				0	93.2	0	-79.1	171.7	168.5	0	0	107.8
2	V	31.7	Very low	43.1	Very low	117 Å²	117	115.9 Å²	115.9	71%	0.709	66%	0.656	S	S	*	*			trans	-83.6	124.2	170.1	-178.7	0	0	0	0	105.4	T4	V2-T4 HydrophobicContact CB-CG2 4.37Å; V2-T4 HydrophobicContact CG1-CG2 3.99Å; V2-T4 PolarHBondContact O-N 3.38Å
3	P	34.4	Very low	44.4	Very low	132 Å²	132	119.1 Å²	119.1	86%	0.857	66%	0.658	S	S	*	*			trans	-72.1	82.1	179.9	28.2	-30.8	0	0	0	108.5
4	T	39.5	Very low	45.4	Very low	103 Å²	103	119.6 Å²	119.6	63%	0.632	65%	0.654	S	S	*	*			trans	-87.2	114.1	174.3	45.1	0	0	0	0	107.7	V2	V2-T4 HydrophobicContact CB-CG2 4.37Å; V2-T4 HydrophobicContact CG1-CG2 3.99Å; V2-T4 PolarHBondContact O-N 3.38Å
5	T	43.3	Very low	46.3	Very low	114 Å²	114	114.4 Å²	114.4	70%	0.699	63%	0.633	S	S	*	*	S	Bend	trans	68.6	103.6	169.1	69.9	0	0	0	0	113.1
6	F	40.5	Very low	47.1	Very low	162 Å²	162	113.8 Å²	113.8	71%	0.711	62%	0.622	S	S	*	*				-172.4	14.9	101.1	-111.5	-86.3	0	0	0	116.2	P9	F6-P9 HydrophobicContact CD1-CG 4.37Å; F6-P9 WeakPolarHBondContact O-CD 3.41Å
7	D	39.1	Very low	48.2	Very low	112 Å²	112	113.8 Å²	113.8	60%	0.599	62%	0.62	S	S	*	*	H	α-helix	trans	-86.9	-20.2	-175.2	-66.6	-23.3	0	0	0	114.8	Q10 V11	D7-Q10 PolarHBondContact O-N 3.39Å; D7-Q10 VanDerWaalsContact O-N 3.1Å; D7-V11 HydrophobicContact CB-CG2 4.37Å; D7-V11 WeakPolarHBondContact O-CG2 3.31Å; D7-V11 PolarHBondContact O-N 3.04Å
8	A	47.5	Very low	49.1	Very low	82 Å²	82	116 Å²	116	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-55.2	-44.2	-179.3	0	0	0	0	0	114.8	L12	A8-L12 VanDerWaalsContact O-CB 3.23Å; A8-L12 WeakPolarHBondContact O-CB 3.21Å; A8-L12 PolarHBondContact O-N 3.15Å
9	P	51.9	Low	49.8	Very low	63 Å²	63	111 Å²	111	41%	0.409	60%	0.596	S	S	.	*	H	α-helix	trans	-71.7	-30.6	176.3	27	-33.8	0	0	0	113.2	F6 K13	F6-P9 HydrophobicContact CD1-CG 4.37Å; F6-P9 WeakPolarHBondContact O-CD 3.41Å; P9-K13 WeakPolarHBondContact O-CB 3.44Å; P9-K13 WeakPolarHBondContact O-CG 3.48Å; P9-K13 PolarHBondContact O-N 3.26Å
10	Q	54.6	Low	50.6	Low	116 Å²	116	112.3 Å²	112.3	54%	0.542	59%	0.592	S	S	.	*	H	α-helix	trans	-71.7	-50.1	177	-79.1	-171.4	-13.2	0	0	111	D7 L12 K13 E14	D7-Q10 PolarHBondContact O-N 3.39Å; D7-Q10 VanDerWaalsContact O-N 3.1Å; Q10-L12 PolarHBondContact O-N 3.47Å; Q10-K13 CarbonylContact O-C 3.44Å; Q10-K13 WeakPolarHBondContact O-CA 3.39Å; Q10-K13 WeakPolarHBondContact O-CB 3.44Å; Q10-K13 PolarHBondContact O-N 3.48Å; Q10-E14 WeakPolarHBondContact O-CG 3.48Å; Q10-E14 PolarHBondContact O-N 3.04Å
11	V	50.7	Low	51.3	Low	87 Å²	87	110.7 Å²	110.7	53%	0.527	59%	0.586	S	S	.	*	H	α-helix	trans	-58.8	-38.5	175.4	178	0	0	0	0	110.9	D7 E14 A15	D7-V11 HydrophobicContact CB-CG2 4.37Å; D7-V11 WeakPolarHBondContact O-CG2 3.31Å; D7-V11 PolarHBondContact O-N 3.04Å; V11-E14 PolarHBondContact O-N 2.7Å; V11-A15 WeakPolarHBondContact O-CB 3.38Å; V11-A15 PolarHBondContact O-N 2.85Å
12	L	55.5	Low	53	Low	62 Å²	62	100.7 Å²	100.7	33%	0.325	54%	0.54	S	S	.	.	H	α-helix	trans	-67.7	-36.2	175.1	-171.8	68.3	0	0	0	112.5	A8 Q10 K16 L165 A168	A8-L12 VanDerWaalsContact O-CB 3.23Å; A8-L12 WeakPolarHBondContact O-CB 3.21Å; A8-L12 PolarHBondContact O-N 3.15Å; Q10-L12 PolarHBondContact O-N 3.47Å; L12-K16 HydrophobicContact CG-CD 4.47Å; L12-K16 WeakPolarHBondContact O-CB 3.41Å; L12-K16 WeakPolarHBondContact O-CG 3.46Å; L12-K16 PolarHBondContact O-N 3.22Å; L12-L165 HydrophobicContact CD1-CD2 3.83Å; L12-A168 HydrophobicContact CD1-CB 4.42Å
13	K	59.7	Low	54.6	Low	157 Å²	157	96.7 Å²	96.7	68%	0.683	52%	0.515	S	S	*	.	H	α-helix	trans	-67.8	-45.8	174.2	-82.8	179	179.2	-179	0	111	P9 Q10 K16 L17	P9-K13 WeakPolarHBondContact O-CB 3.44Å; P9-K13 WeakPolarHBondContact O-CG 3.48Å; P9-K13 PolarHBondContact O-N 3.26Å; Q10-K13 CarbonylContact O-C 3.44Å; Q10-K13 WeakPolarHBondContact O-CA 3.39Å; Q10-K13 WeakPolarHBondContact O-CB 3.44Å; Q10-K13 PolarHBondContact O-N 3.48Å; K13-K16 PolarHBondContact O-N 2.92Å; K13-L17 WeakPolarHBondContact O-CB 3.41Å; K13-L17 PolarHBondContact O-N 3.34Å
14	E	58.8	Low	56.1	Low	127 Å²	127	93.3 Å²	93.3	59%	0.593	49%	0.489	S	S	*	.	H	α-helix	trans	-62.6	-46	177.1	-71.5	179.8	179.7	0	0	111.4	Q10 V11 K16 L17 F18	Q10-E14 WeakPolarHBondContact O-CG 3.48Å; Q10-E14 PolarHBondContact O-N 3.04Å; V11-E14 PolarHBondContact O-N 2.7Å; E14-K16 VanDerWaalsContact C-N 3.33Å; E14-K16 PolarHBondContact O-N 2.91Å; E14-L17 PolarHBondContact O-N 3.34Å; E14-F18 VanDerWaalsContact O-CB 3.31Å; E14-F18 WeakPolarHBondContact O-CB 3.02Å; E14-F18 PolarHBondContact O-N 3.34Å
15	A	58.3	Low	57.5	Low	41 Å²	41	92.7 Å²	92.7	34%	0.339	49%	0.485	S	S	.	.	H	α-helix	trans	-61.9	-39.1	175.7	0	0	0	0	0	112.2	V11 N19	V11-A15 WeakPolarHBondContact O-CB 3.38Å; V11-A15 PolarHBondContact O-N 2.85Å; A15-N19 WeakPolarHBondContact O-CB 3.49Å; A15-N19 PolarHBondContact O-N 2.96Å
16	K	59	Low	58.6	Low	105 Å²	105	88 Å²	88	46%	0.457	46%	0.457	S	S	.	.	H	α-helix	trans	-66	-41.5	174.1	-79.5	173.6	-177.7	174	0	112	L12 K13 E14 R20	L12-K16 HydrophobicContact CG-CD 4.47Å; L12-K16 WeakPolarHBondContact O-CB 3.41Å; L12-K16 WeakPolarHBondContact O-CG 3.46Å; L12-K16 PolarHBondContact O-N 3.22Å; K13-K16 PolarHBondContact O-N 2.92Å; E14-K16 VanDerWaalsContact C-N 3.33Å; E14-K16 PolarHBondContact O-N 2.91Å; K16-R20 WeakPolarHBondContact O-CG 2.95Å; K16-R20 PolarHBondContact O-N 3.03Å
17	L	65.7	Low	59.8	Low	113 Å²	113	80.8 Å²	80.8	59%	0.592	43%	0.428	S	S	*	.	H	α-helix	trans	-68.3	-49	179.8	-166.7	79.9	0	0	0	110.6	K13 E14 N19 R20 V21	K13-L17 WeakPolarHBondContact O-CB 3.41Å; K13-L17 PolarHBondContact O-N 3.34Å; E14-L17 PolarHBondContact O-N 3.34Å; L17-N19 VanDerWaalsContact C-N 3.27Å; L17-N19 PolarHBondContact O-N 3.29Å; L17-R20 PolarHBondContact O-N 3.06Å; L17-R20 VanDerWaalsContact O-N 3.09Å; L17-V21 WeakPolarHBondContact O-CG2 3.4Å; L17-V21 PolarHBondContact O-N 2.76Å
18	F	64.4	Low	61.3	Low	154 Å²	154	82.8 Å²	82.8	68%	0.675	43%	0.429	S	S	*	.	H	α-helix	trans	-57	-42.3	175.8	-173.7	-96.2	0	0	0	111.2	E14 V21 S22	E14-F18 VanDerWaalsContact O-CB 3.31Å; E14-F18 WeakPolarHBondContact O-CB 3.02Å; E14-F18 PolarHBondContact O-N 3.34Å; F18-V21 PolarHBondContact O-N 2.77Å; F18-S22 WeakPolarHBondContact O-CB 3.2Å; F18-S22 PolarHBondContact O-N 2.86Å
19	N	63.6	Low	62.3	Low	21 Å²	21	84.9 Å²	84.9	11%	0.112	42%	0.422	C	S	.	.	H	α-helix	trans	-64.4	-42	175.6	-171.9	35.9	0	0	0	112.6	A15 L17 L23 V161	A15-N19 WeakPolarHBondContact O-CB 3.49Å; A15-N19 PolarHBondContact O-N 2.96Å; L17-N19 VanDerWaalsContact C-N 3.27Å; L17-N19 PolarHBondContact O-N 3.29Å; N19-L23 WeakPolarHBondContact O-CB 3.43Å; N19-L23 PolarHBondContact O-N 3.27Å; N19-V161 HydrophobicContact CB-CG1 4.01Å; N19-V161 HydrophobicContact CB-CG2 4.32Å; N19-V161 VanDerWaalsContact ND2-CG1 3.3Å; N19-V161 WeakPolarHBondContact ND2-CG1 3.21Å
20	R	64.6	Low	63.1	Low	137 Å²	137	82 Å²	82	52%	0.517	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-44.8	176.3	-78.5	178.9	176.8	-171.7	-4	111.6	K16 L17 L24 M82	K16-R20 WeakPolarHBondContact O-CG 2.95Å; K16-R20 PolarHBondContact O-N 3.03Å; L17-R20 PolarHBondContact O-N 3.06Å; L17-R20 VanDerWaalsContact O-N 3.09Å; R20-L24 WeakPolarHBondContact O-CB 3.45Å; R20-L24 PolarHBondContact O-N 3.36Å; R20-M82 HydrophobicContact CB-CE 4.19Å; R20-M82 HydrophobicContact CG-CE 4.44Å; R20-M82 HydrophobicContact CG-SD 4.27Å
21	V	66.4	Low	63.8	Low	78 Å²	78	76.8 Å²	76.8	47%	0.473	38%	0.38	S	S	.	.	H	α-helix	trans	-68.6	-47.3	179.5	176.7	0	0	0	0	110.7	L17 F18 L23 L24 V25	L17-V21 WeakPolarHBondContact O-CG2 3.4Å; L17-V21 PolarHBondContact O-N 2.76Å; F18-V21 PolarHBondContact O-N 2.77Å; V21-L23 VanDerWaalsContact C-N 3.34Å; V21-L23 PolarHBondContact O-N 3.23Å; V21-L24 PolarHBondContact O-N 3.37Å; V21-L24 VanDerWaalsContact O-N 3.14Å; V21-V25 HydrophobicContact CG1-CG2 4.22Å; V21-V25 WeakPolarHBondContact O-CG2 3.39Å; V21-V25 PolarHBondContact O-N 3.31Å
22	S	64.2	Low	64.7	Low	31 Å²	31	74.2 Å²	74.2	22%	0.217	37%	0.371	C	S	.	.	H	α-helix	trans	-60.8	-43.2	178.5	-175	0	0	0	0	111.7	F18 L24 A26	F18-S22 WeakPolarHBondContact O-CB 3.2Å; F18-S22 PolarHBondContact O-N 2.86Å; S22-L24 VanDerWaalsContact C-N 3.31Å; S22-L24 PolarHBondContact O-N 3.47Å; S22-A26 WeakPolarHBondContact O-CB 3.44Å; S22-A26 PolarHBondContact O-N 3.13Å
23	L	64.9	Low	65.3	Low	34 Å²	34	73 Å²	73	18%	0.178	37%	0.365	C	S	.	.	H	α-helix	trans	-64	-39.2	175.9	-176.4	69.2	0	0	0	111.4	N19 V21 A27 N89 V158	N19-L23 WeakPolarHBondContact O-CB 3.43Å; N19-L23 PolarHBondContact O-N 3.27Å; V21-L23 VanDerWaalsContact C-N 3.34Å; V21-L23 PolarHBondContact O-N 3.23Å; L23-A27 VanDerWaalsContact O-CB 3.26Å; L23-A27 WeakPolarHBondContact O-CB 3.43Å; L23-A27 PolarHBondContact O-N 3.24Å; L23-N89 WeakPolarHBondContact CD2-ND2 3.36Å; L23-V158 HydrophobicContact CD1-CG2 3.8Å
24	L	66.7	Low	65.8	Low	61 Å²	61	65.6 Å²	65.6	32%	0.319	33%	0.332	S	S	.	.	H	α-helix	trans	-69.7	-46.6	-179.9	-170.2	133.9	0	0	0	111.2	R20 V21 S22 A26 A27 Y28 M82	R20-L24 WeakPolarHBondContact O-CB 3.45Å; R20-L24 PolarHBondContact O-N 3.36Å; V21-L24 PolarHBondContact O-N 3.37Å; V21-L24 VanDerWaalsContact O-N 3.14Å; S22-L24 VanDerWaalsContact C-N 3.31Å; S22-L24 PolarHBondContact O-N 3.47Å; L24-A26 VanDerWaalsContact C-N 3.32Å; L24-A26 PolarHBondContact O-N 2.96Å; L24-A27 PolarHBondContact O-N 3.11Å; L24-Y28 HydrophobicContact CD1-CE2 4.42Å; L24-Y28 HydrophobicContact CD2-CD2 3.63Å; L24-Y28 HydrophobicContact CD2-CE2 3.43Å; L24-Y28 VanDerWaalsContact CD2-CE2 3.43Å; L24-Y28 HydrophobicContact CG-CD2 3.89Å; L24-Y28 HydrophobicContact CG-CE2 3.68Å; L24-Y28 WeakPolarHBondContact O-CD2 3.5Å; L24-Y28 PolarHBondContact O-N 3.01Å; L24-M82 HydrophobicContact CD1-CE 3.53Å
25	V	69	Low	66.3	Low	90 Å²	90	63.2 Å²	63.2	55%	0.545	32%	0.32	S	S	.	.	H	α-helix	trans	-58.3	-45.6	173.9	172.1	0	0	0	0	110.8	V21 A27 Y28 F29	V21-V25 HydrophobicContact CG1-CG2 4.22Å; V21-V25 WeakPolarHBondContact O-CG2 3.39Å; V21-V25 PolarHBondContact O-N 3.31Å; V25-A27 PolarHBondContact O-N 3.12Å; V25-Y28 PolarHBondContact O-N 2.91Å; V25-F29 WeakPolarHBondContact O-CB 3.23Å; V25-F29 PolarHBondContact O-N 3.43Å
26	A	64.9	Low	66.8	Low	14 Å²	14	65.6 Å²	65.6	12%	0.116	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-42	176.9	0	0	0	0	0	112.8	S22 L24 F29 S30 N154	S22-A26 WeakPolarHBondContact O-CB 3.44Å; S22-A26 PolarHBondContact O-N 3.13Å; L24-A26 VanDerWaalsContact C-N 3.32Å; L24-A26 PolarHBondContact O-N 2.96Å; A26-F29 PolarHBondContact O-N 3.38Å; A26-S30 VanDerWaalsContact O-CB 3.28Å; A26-S30 WeakPolarHBondContact O-CB 3.29Å; A26-S30 PolarHBondContact O-N 3.47Å; A26-N154 WeakPolarHBondContact CB-OD1 3.21Å
27	A	66.5	Low	67.2	Low	12 Å²	12	61.6 Å²	61.6	10%	0.099	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-43.3	175.7	0	0	0	0	0	112	L23 L24 V25 F29 S30 T31 V78	L23-A27 VanDerWaalsContact O-CB 3.26Å; L23-A27 WeakPolarHBondContact O-CB 3.43Å; L23-A27 PolarHBondContact O-N 3.24Å; L24-A27 PolarHBondContact O-N 3.11Å; V25-A27 PolarHBondContact O-N 3.12Å; A27-F29 VanDerWaalsContact C-N 3.35Å; A27-F29 PolarHBondContact O-N 2.86Å; A27-S30 PolarHBondContact O-N 3.39Å; A27-T31 VanDerWaalsContact O-CB 3.3Å; A27-T31 WeakPolarHBondContact O-CB 3.5Å; A27-T31 WeakPolarHBondContact O-CG2 3.12Å; A27-T31 PolarHBondContact O-N 3.35Å; A27-T31 PolarHBondContact O-OG1 2.9Å; A27-V78 HydrophobicContact CB-CB 4.44Å; A27-V78 HydrophobicContact CB-CG1 4.24Å; A27-V78 HydrophobicContact CB-CG2 3.69Å
28	Y	69.7	Low	67.1	Low	154 Å²	154	56.2 Å²	56.2	60%	0.604	29%	0.285	S	S	*	.	H	α-helix	trans	-62.1	-42.6	174.8	-87.4	-71.4	0	0	0	111.9	L24 V25 T31 G32	L24-Y28 HydrophobicContact CD1-CE2 4.42Å; L24-Y28 HydrophobicContact CD2-CD2 3.63Å; L24-Y28 HydrophobicContact CD2-CE2 3.43Å; L24-Y28 VanDerWaalsContact CD2-CE2 3.43Å; L24-Y28 HydrophobicContact CG-CD2 3.89Å; L24-Y28 HydrophobicContact CG-CE2 3.68Å; L24-Y28 WeakPolarHBondContact O-CD2 3.5Å; L24-Y28 PolarHBondContact O-N 3.01Å; V25-Y28 PolarHBondContact O-N 2.91Å; Y28-T31 WeakPolarHBondContact CA-OG1 3.27Å; Y28-T31 PolarHBondContact O-OG1 3.42Å; Y28-T31 VanDerWaalsContact O-OG1 3.1Å; Y28-G32 PolarHBondContact O-N 3.44Å
29	F	69.9	Low	67.4	Low	125 Å²	125	53.5 Å²	53.5	55%	0.548	28%	0.277	S	S	.	.	H	α-helix	trans	-65.4	-46.5	177.8	-169.5	-100.4	0	0	0	111.7	V25 A26 A27 G32 L33 V150	V25-F29 WeakPolarHBondContact O-CB 3.23Å; V25-F29 PolarHBondContact O-N 3.43Å; A26-F29 PolarHBondContact O-N 3.38Å; A27-F29 VanDerWaalsContact C-N 3.35Å; A27-F29 PolarHBondContact O-N 2.86Å; F29-G32 PolarHBondContact O-N 3.4Å; F29-L33 HydrophobicContact CD1-CD1 4.27Å; F29-L33 HydrophobicContact CE1-CD1 3.68Å; F29-L33 HydrophobicContact CZ-CD1 3.84Å; F29-L33 WeakPolarHBondContact O-CB 3.19Å; F29-L33 PolarHBondContact O-N 3.46Å; F29-V150 HydrophobicContact CD1-CG1 4.3Å; F29-V150 HydrophobicContact CD1-CG2 4.46Å; F29-V150 HydrophobicContact CE1-CG2 4.19Å
30	S	69.1	Low	67.5	Low	3 Å²	3	55.4 Å²	55.4	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-46.8	177.8	172.1	0	0	0	0	112.2	A26 A27 L33 Q34	A26-S30 VanDerWaalsContact O-CB 3.28Å; A26-S30 WeakPolarHBondContact O-CB 3.29Å; A26-S30 PolarHBondContact O-N 3.47Å; A27-S30 PolarHBondContact O-N 3.39Å; S30-L33 WeakPolarHBondContact O-CB 3.34Å; S30-L33 PolarHBondContact O-N 3.38Å; S30-Q34 WeakPolarHBondContact O-CG 3.43Å; S30-Q34 PolarHBondContact O-N 3.22Å
31	T	68.3	Low	67.5	Low	7 Å²	7	49.9 Å²	49.9	4%	0.043	27%	0.271	C	S	.	.	H	α-helix	trans	-66.5	-41.8	179.1	53.8	0	0	0	0	111.4	A27 Y28 L33 Q34 F35 L74 L75	A27-T31 VanDerWaalsContact O-CB 3.3Å; A27-T31 WeakPolarHBondContact O-CB 3.5Å; A27-T31 WeakPolarHBondContact O-CG2 3.12Å; A27-T31 PolarHBondContact O-N 3.35Å; A27-T31 PolarHBondContact O-OG1 2.9Å; Y28-T31 WeakPolarHBondContact CA-OG1 3.27Å; Y28-T31 PolarHBondContact O-OG1 3.42Å; Y28-T31 VanDerWaalsContact O-OG1 3.1Å; T31-L33 VanDerWaalsContact C-N 3.31Å; T31-L33 PolarHBondContact O-N 3.48Å; T31-Q34 PolarHBondContact O-N 2.94Å; T31-F35 WeakPolarHBondContact O-CD2 3.49Å; T31-F35 PolarHBondContact O-N 2.87Å; T31-L74 HydrophobicContact CG2-CB 4.04Å; T31-L75 HydrophobicContact CG2-CD1 4.41Å; T31-L75 HydrophobicContact CG2-CD2 3.85Å; T31-L75 HydrophobicContact CG2-CG 3.65Å
32	G	69.8	Low	67.5	Low	32 Å²	32	49.4 Å²	49.4	33%	0.33	27%	0.266	S	S	.	.	H	α-helix	trans	-58.7	-41.7	172.7	0	0	0	0	0	112.6	Y28 F29 T36	Y28-G32 PolarHBondContact O-N 3.44Å; F29-G32 PolarHBondContact O-N 3.4Å; G32-T36 WeakPolarHBondContact O-CB 2.96Å; G32-T36 PolarHBondContact O-N 2.98Å; G32-T36 PolarHBondContact O-OG1 3.03Å
33	L	68	Low	67.6	Low	38 Å²	38	51.5 Å²	51.5	20%	0.199	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-50.8	173.6	-129.5	98.1	0	0	0	110.7	F29 S30 T31 F35 T36 F37 F143	F29-L33 HydrophobicContact CD1-CD1 4.27Å; F29-L33 HydrophobicContact CE1-CD1 3.68Å; F29-L33 HydrophobicContact CZ-CD1 3.84Å; F29-L33 WeakPolarHBondContact O-CB 3.19Å; F29-L33 PolarHBondContact O-N 3.46Å; S30-L33 WeakPolarHBondContact O-CB 3.34Å; S30-L33 PolarHBondContact O-N 3.38Å; T31-L33 VanDerWaalsContact C-N 3.31Å; T31-L33 PolarHBondContact O-N 3.48Å; L33-F35 PolarHBondContact O-N 3.39Å; L33-T36 PolarHBondContact O-N 3.43Å; L33-F37 WeakPolarHBondContact O-CB 3.34Å; L33-F37 PolarHBondContact O-N 3.48Å; L33-F143 HydrophobicContact CB-CE2 3.94Å; L33-F143 HydrophobicContact CB-CZ 4.09Å; L33-F143 HydrophobicContact CD2-CD2 3.92Å; L33-F143 HydrophobicContact CD2-CE2 3.3Å; L33-F143 HydrophobicContact CD2-CZ 3.76Å; L33-F143 HydrophobicContact CG-CD2 4.39Å; L33-F143 HydrophobicContact CG-CE2 3.52Å; L33-F143 HydrophobicContact CG-CZ 4.12Å; L33-F143 VanDerWaalsContact O-CE2 3.23Å; L33-F143 WeakPolarHBondContact O-CE2 3.45Å; L33-F143 VanDerWaalsContact O-CZ 3.23Å; L33-F143 WeakPolarHBondContact O-CZ 3.39Å
34	Q	70.1	Confident	67.5	Low	1 Å²	1	51 Å²	51	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-41.3	-178.8	-72.5	178.6	-12.7	0	0	112.4	S30 T31 F37 A38 A71 D96	S30-Q34 WeakPolarHBondContact O-CG 3.43Å; S30-Q34 PolarHBondContact O-N 3.22Å; T31-Q34 PolarHBondContact O-N 2.94Å; Q34-F37 PolarHBondContact O-N 3.09Å; Q34-A38 WeakPolarHBondContact O-CB 3.48Å; Q34-A38 PolarHBondContact O-N 2.89Å; Q34-A71 HydrophobicContact CB-CB 3.83Å; Q34-A71 VanDerWaalsContact OE1-N 3.1Å; Q34-D96 PolarHBondContact NE2-OD1 3.23Å; Q34-D96 VanDerWaalsContact NE2-OD1 3.13Å; Q34-D96 PolarHBondContact NE2-OD2 3.27Å
35	F	69.6	Low	67.2	Low	77 Å²	77	48.1 Å²	48.1	34%	0.338	26%	0.259	S	S	.	.	H	α-helix	trans	-64.3	-46.5	175	-86.6	-68	0	0	0	112.4	T31 L33 F37 A38 I39 A71 L75	T31-F35 WeakPolarHBondContact O-CD2 3.49Å; T31-F35 PolarHBondContact O-N 2.87Å; L33-F35 PolarHBondContact O-N 3.39Å; F35-F37 PolarHBondContact O-N 3.27Å; F35-A38 PolarHBondContact O-N 2.88Å; F35-I39 WeakPolarHBondContact O-CB 3.22Å; F35-I39 VanDerWaalsContact O-CG1 3.27Å; F35-I39 WeakPolarHBondContact O-CG1 3.26Å; F35-I39 PolarHBondContact O-N 3.47Å; F35-A71 HydrophobicContact CD2-CB 4.24Å; F35-A71 HydrophobicContact CE2-CB 3.97Å; F35-A71 HydrophobicContact CZ-CB 4.31Å; F35-L75 HydrophobicContact CE2-CD1 4.08Å
36	T	68.5	Low	66.9	Low	91 Å²	91	46.5 Å²	46.5	56%	0.558	26%	0.255	S	S	*	.	H	α-helix	trans	-58.2	-38.5	178.3	-55.3	0	0	0	0	110.8	G32 L33 S40	G32-T36 WeakPolarHBondContact O-CB 2.96Å; G32-T36 PolarHBondContact O-N 2.98Å; G32-T36 PolarHBondContact O-OG1 3.03Å; L33-T36 PolarHBondContact O-N 3.43Å; T36-S40 WeakPolarHBondContact O-CB 3.29Å; T36-S40 PolarHBondContact O-N 3.4Å; T36-S40 VanDerWaalsContact O-N 3.08Å; T36-S40 PolarHBondContact O-OG 3.09Å
37	F	66.5	Low	66.8	Low	20 Å²	20	54.2 Å²	54.2	9%	0.088	28%	0.281	C	S	.	.	H	α-helix	trans	-72.2	-46.1	177.6	-169.7	-109.1	0	0	0	114	L33 Q34 F35 I39 S40 F41 T67 A140 F143	L33-F37 WeakPolarHBondContact O-CB 3.34Å; L33-F37 PolarHBondContact O-N 3.48Å; Q34-F37 PolarHBondContact O-N 3.09Å; F35-F37 PolarHBondContact O-N 3.27Å; F37-I39 VanDerWaalsContact C-N 3.29Å; F37-I39 PolarHBondContact O-N 3.2Å; F37-S40 WeakPolarHBondContact O-CA 3.32Å; F37-S40 WeakPolarHBondContact O-CB 3.22Å; F37-S40 PolarHBondContact O-N 3.01Å; F37-F41 AromaticContact CD1-CD2 3.97Å; F37-F41 HydrophobicContact CD1-CD2 3.97Å; F37-F41 HydrophobicContact CD1-CE2 4.32Å; F37-F41 HydrophobicContact CD2-CD2 4.22Å; F37-F41 HydrophobicContact CD2-CE2 4.28Å; F37-F41 AromaticContact CE1-CD2 3.56Å; F37-F41 HydrophobicContact CE1-CD2 3.56Å; F37-F41 AromaticContact CE1-CE2 3.5Å; F37-F41 HydrophobicContact CE1-CE2 3.5Å; F37-F41 VanDerWaalsContact CE1-CE2 3.5Å; F37-F41 HydrophobicContact CE1-CG 4.49Å; F37-F41 HydrophobicContact CE1-CZ 4.33Å; F37-F41 AromaticContact CE2-CD2 3.83Å; F37-F41 HydrophobicContact CE2-CD2 3.83Å; F37-F41 AromaticContact CE2-CE2 3.45Å; F37-F41 HydrophobicContact CE2-CE2 3.45Å; F37-F41 VanDerWaalsContact CE2-CE2 3.45Å; F37-F41 HydrophobicContact CG-CD2 4.32Å; F37-F41 AromaticContact CZ-CD2 3.53Å; F37-F41 HydrophobicContact CZ-CD2 3.53Å; F37-F41 AromaticContact CZ-CE2 3.03Å; F37-F41 HydrophobicContact CZ-CE2 3.03Å; F37-F41 AromaticContact CZ-CZ 3.91Å; F37-F41 HydrophobicContact CZ-CZ 3.91Å; F37-F41 PolarHBondContact O-N 2.94Å; F37-T67 HydrophobicContact CD1-CG2 4.1Å; F37-T67 HydrophobicContact CE1-CG2 4.34Å; F37-A140 HydrophobicContact CE2-CB 4.16Å; F37-A140 HydrophobicContact CZ-CB 3.88Å; F37-F143 HydrophobicContact CB-CD1 3.91Å; F37-F143 HydrophobicContact CB-CD2 3.99Å; F37-F143 HydrophobicContact CB-CE1 3.45Å; F37-F143 VanDerWaalsContact CB-CE1 3.45Å; F37-F143 HydrophobicContact CB-CE2 3.5Å; F37-F143 HydrophobicContact CB-CG 4.17Å; F37-F143 HydrophobicContact CB-CZ 3.24Å; F37-F143 AromaticContact CD1-CD1 3.61Å; F37-F143 HydrophobicContact CD1-CD1 3.61Å; F37-F143 AromaticContact CD1-CE1 3.52Å; F37-F143 HydrophobicContact CD1-CE1 3.52Å; F37-F143 HydrophobicContact CD1-CG 4.41Å; F37-F143 HydrophobicContact CD1-CZ 4.25Å; F37-F143 HydrophobicContact CD2-CB 3.63Å; F37-F143 AromaticContact CD2-CD1 3.17Å; F37-F143 HydrophobicContact CD2-CD1 3.17Å; F37-F143 AromaticContact CD2-CD2 3.56Å; F37-F143 HydrophobicContact CD2-CD2 3.56Å; F37-F143 AromaticContact CD2-CE1 3.68Å; F37-F143 HydrophobicContact CD2-CE1 3.68Å; F37-F143 AromaticContact CD2-CE2 3.98Å; F37-F143 HydrophobicContact CD2-CE2 3.98Å; F37-F143 AromaticContact CD2-CG 3.11Å; F37-F143 HydrophobicContact CD2-CG 3.11Å; F37-F143 HydrophobicContact CD2-CZ 4.07Å; F37-F143 AromaticContact CE1-CD1 3.74Å; F37-F143 HydrophobicContact CE1-CD1 3.74Å; F37-F143 HydrophobicContact CE1-CE1 4.05Å; F37-F143 HydrophobicContact CE2-CB 3.37Å; F37-F143 AromaticContact CE2-CD1 3.32Å; F37-F143 HydrophobicContact CE2-CD1 3.32Å; F37-F143 HydrophobicContact CE2-CD2 4.22Å; F37-F143 HydrophobicContact CE2-CE1 4.19Å; F37-F143 AromaticContact CE2-CG 3.35Å; F37-F143 HydrophobicContact CE2-CG 3.35Å; F37-F143 AromaticContact CG-CD1 3.27Å; F37-F143 HydrophobicContact CG-CD1 3.27Å; F37-F143 AromaticContact CG-CD2 4Å; F37-F143 HydrophobicContact CG-CD2 4Å; F37-F143 AromaticContact CG-CE1 3.26Å; F37-F143 HydrophobicContact CG-CE1 3.26Å; F37-F143 AromaticContact CG-CE2 3.94Å; F37-F143 HydrophobicContact CG-CE2 3.94Å; F37-F143 AromaticContact CG-CG 3.67Å; F37-F143 HydrophobicContact CG-CG 3.67Å; F37-F143 AromaticContact CG-CZ 3.63Å; F37-F143 HydrophobicContact CG-CZ 3.63Å; F37-F143 HydrophobicContact CZ-CB 4.15Å; F37-F143 AromaticContact CZ-CD1 3.55Å; F37-F143 HydrophobicContact CZ-CD1 3.55Å; F37-F143 HydrophobicContact CZ-CE1 4.32Å; F37-F143 HydrophobicContact CZ-CG 4.06Å
38	A	64.7	Low	66.2	Low	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-43.3	177.4	0	0	0	0	0	111.1	Q34 F35 S40 F41 I42 G64 T67 C68	Q34-A38 WeakPolarHBondContact O-CB 3.48Å; Q34-A38 PolarHBondContact O-N 2.89Å; F35-A38 PolarHBondContact O-N 2.88Å; A38-S40 VanDerWaalsContact C-N 3.34Å; A38-S40 PolarHBondContact O-N 2.89Å; A38-F41 PolarHBondContact O-N 2.88Å; A38-I42 WeakPolarHBondContact O-CD1 3.44Å; A38-I42 VanDerWaalsContact O-CG1 3.23Å; A38-I42 WeakPolarHBondContact O-CG1 3.46Å; A38-I42 PolarHBondContact O-N 3.26Å; A38-G64 WeakPolarHBondContact CB-O 3.37Å; A38-T67 WeakPolarHBondContact CB-OG1 3.47Å; A38-C68 HydrophobicContact CB-CB 4.46Å; A38-C68 WeakPolarHBondContact CB-SG 3.35Å
39	I	69.9	Low	65.9	Low	98 Å²	98	52.2 Å²	52.2	50%	0.503	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-44.7	174	-66.5	167.3	0	0	0	110.5	F35 F37 F41 I42 V43	F35-I39 WeakPolarHBondContact O-CB 3.22Å; F35-I39 VanDerWaalsContact O-CG1 3.27Å; F35-I39 WeakPolarHBondContact O-CG1 3.26Å; F35-I39 PolarHBondContact O-N 3.47Å; F37-I39 VanDerWaalsContact C-N 3.29Å; F37-I39 PolarHBondContact O-N 3.2Å; I39-F41 VanDerWaalsContact C-N 3.31Å; I39-F41 PolarHBondContact O-N 3.48Å; I39-I42 PolarHBondContact O-N 3Å; I39-V43 HydrophobicContact CG2-CG2 4.18Å; I39-V43 WeakPolarHBondContact O-CB 3.4Å; I39-V43 VanDerWaalsContact O-CG2 3.29Å; I39-V43 WeakPolarHBondContact O-CG2 3.41Å; I39-V43 PolarHBondContact O-N 3.42Å
40	S	65.8	Low	65.4	Low	61 Å²	61	50.7 Å²	50.7	43%	0.427	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-42.1	177.6	-60.2	0	0	0	0	111.8	T36 F37 A38 M44	T36-S40 WeakPolarHBondContact O-CB 3.29Å; T36-S40 PolarHBondContact O-N 3.4Å; T36-S40 VanDerWaalsContact O-N 3.08Å; T36-S40 PolarHBondContact O-OG 3.09Å; F37-S40 WeakPolarHBondContact O-CA 3.32Å; F37-S40 WeakPolarHBondContact O-CB 3.22Å; F37-S40 PolarHBondContact O-N 3.01Å; A38-S40 VanDerWaalsContact C-N 3.34Å; A38-S40 PolarHBondContact O-N 2.89Å; S40-M44 WeakPolarHBondContact O-CB 3.48Å; S40-M44 PolarHBondContact O-N 3.22Å
41	F	65.5	Low	64.9	Low	20 Å²	20	53.9 Å²	53.9	9%	0.088	31%	0.308	C	S	.	.	H	α-helix	trans	-69.6	-38.6	176.5	-99.1	-97.6	0	0	0	113.3	F37 A38 I39 M44 G45 I63 A140	F37-F41 AromaticContact CD1-CD2 3.97Å; F37-F41 HydrophobicContact CD1-CD2 3.97Å; F37-F41 HydrophobicContact CD1-CE2 4.32Å; F37-F41 HydrophobicContact CD2-CD2 4.22Å; F37-F41 HydrophobicContact CD2-CE2 4.28Å; F37-F41 AromaticContact CE1-CD2 3.56Å; F37-F41 HydrophobicContact CE1-CD2 3.56Å; F37-F41 AromaticContact CE1-CE2 3.5Å; F37-F41 HydrophobicContact CE1-CE2 3.5Å; F37-F41 VanDerWaalsContact CE1-CE2 3.5Å; F37-F41 HydrophobicContact CE1-CG 4.49Å; F37-F41 HydrophobicContact CE1-CZ 4.33Å; F37-F41 AromaticContact CE2-CD2 3.83Å; F37-F41 HydrophobicContact CE2-CD2 3.83Å; F37-F41 AromaticContact CE2-CE2 3.45Å; F37-F41 HydrophobicContact CE2-CE2 3.45Å; F37-F41 VanDerWaalsContact CE2-CE2 3.45Å; F37-F41 HydrophobicContact CG-CD2 4.32Å; F37-F41 AromaticContact CZ-CD2 3.53Å; F37-F41 HydrophobicContact CZ-CD2 3.53Å; F37-F41 AromaticContact CZ-CE2 3.03Å; F37-F41 HydrophobicContact CZ-CE2 3.03Å; F37-F41 AromaticContact CZ-CZ 3.91Å; F37-F41 HydrophobicContact CZ-CZ 3.91Å; F37-F41 PolarHBondContact O-N 2.94Å; A38-F41 PolarHBondContact O-N 2.88Å; I39-F41 VanDerWaalsContact C-N 3.31Å; I39-F41 PolarHBondContact O-N 3.48Å; F41-M44 PolarHBondContact O-N 3.4Å; F41-G45 PolarHBondContact O-N 2.95Å; F41-I63 HydrophobicContact CD1-CB 4.1Å; F41-I63 HydrophobicContact CD1-CG2 3.89Å; F41-I63 HydrophobicContact CE1-CB 4.33Å; F41-I63 HydrophobicContact CE1-CD1 4.24Å; F41-I63 HydrophobicContact CE1-CG2 3.95Å; F41-I63 HydrophobicContact CG-CG2 4.37Å; F41-A140 HydrophobicContact CE2-CB 3.65Å; F41-A140 HydrophobicContact CZ-CB 3.52Å
42	I	65.6	Low	64.2	Low	69 Å²	69	54.8 Å²	54.8	35%	0.354	31%	0.313	S	S	.	.	H	α-helix	trans	-66.4	-49	176.6	-68.7	163.7	0	0	0	110.5	A38 I39 M44 G45 A46	A38-I42 WeakPolarHBondContact O-CD1 3.44Å; A38-I42 VanDerWaalsContact O-CG1 3.23Å; A38-I42 WeakPolarHBondContact O-CG1 3.46Å; A38-I42 PolarHBondContact O-N 3.26Å; I39-I42 PolarHBondContact O-N 3Å; I42-M44 PolarHBondContact O-N 3.49Å; I42-G45 PolarHBondContact O-N 2.93Å; I42-A46 WeakPolarHBondContact O-CB 3.37Å; I42-A46 PolarHBondContact O-N 2.98Å
43	V	66.2	Low	63.5	Low	75 Å²	75	56.6 Å²	56.6	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-60.1	-38.5	176.9	172.8	0	0	0	0	110.3	I39 R47	I39-V43 HydrophobicContact CG2-CG2 4.18Å; I39-V43 WeakPolarHBondContact O-CB 3.4Å; I39-V43 VanDerWaalsContact O-CG2 3.29Å; I39-V43 WeakPolarHBondContact O-CG2 3.41Å; I39-V43 PolarHBondContact O-N 3.42Å; V43-R47 WeakPolarHBondContact O-CG 3.48Å; V43-R47 PolarHBondContact O-N 2.88Å
44	M	63.2	Low	62.9	Low	24 Å²	24	63.1 Å²	63.1	12%	0.118	35%	0.346	C	S	.	.	H	α-helix	trans	-71.5	-43.5	177.4	-172.9	-175.6	-51.9	0	0	113	S40 F41 I42 A46 R47 L48 Y136	S40-M44 WeakPolarHBondContact O-CB 3.48Å; S40-M44 PolarHBondContact O-N 3.22Å; F41-M44 PolarHBondContact O-N 3.4Å; I42-M44 PolarHBondContact O-N 3.49Å; M44-A46 PolarHBondContact O-N 3.45Å; M44-R47 CarbonylContact O-C 3.55Å; M44-R47 WeakPolarHBondContact O-CA 3.47Å; M44-R47 PolarHBondContact O-N 2.96Å; M44-L48 HydrophobicContact CG-CD1 3.93Å; M44-L48 WeakPolarHBondContact O-CB 3.21Å; M44-L48 PolarHBondContact O-N 2.81Å; M44-L48 HydrophobicContact SD-CD1 4.49Å; M44-Y136 HydrophobicContact CE-CD1 3.05Å; M44-Y136 HydrophobicContact CE-CD2 3.97Å; M44-Y136 HydrophobicContact CE-CE1 3.59Å; M44-Y136 HydrophobicContact CE-CE2 4.43Å; M44-Y136 HydrophobicContact CE-CG 3.27Å; M44-Y136 HydrophobicContact CG-CD2 4.42Å; M44-Y136 VanDerWaalsContact SD-CB 3.52Å; M44-Y136 HydrophobicContact SD-CD1 4Å; M44-Y136 HydrophobicContact SD-CD2 3.86Å; M44-Y136 HydrophobicContact SD-CG 3.54Å; M44-Y136 VanDerWaalsContact SD-CG 3.54Å
45	G	60.4	Low	62.2	Low	0 Å²	0	70.7 Å²	70.7	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-61.1	-35.8	176.1	0	0	0	0	0	112.2	F41 I42 Q49 S57 S60	F41-G45 PolarHBondContact O-N 2.95Å; I42-G45 PolarHBondContact O-N 2.93Å; G45-Q49 WeakPolarHBondContact O-CB 3.44Å; G45-Q49 PolarHBondContact O-N 2.96Å; G45-S57 PolarHBondContact O-OG 2.96Å; G45-S60 WeakPolarHBondContact CA-OG 3.4Å
46	A	62.9	Low	61.3	Low	55 Å²	55	70.7 Å²	70.7	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-42.4	170.2	0	0	0	0	0	112.2	I42 M44 Q49 A50	I42-A46 WeakPolarHBondContact O-CB 3.37Å; I42-A46 PolarHBondContact O-N 2.98Å; M44-A46 PolarHBondContact O-N 3.45Å; A46-Q49 WeakPolarHBondContact O-CB 3.37Å; A46-Q49 PolarHBondContact O-N 2.81Å; A46-A50 PolarHBondContact O-N 3.39Å
47	R	62.4	Low	60.7	Low	176 Å²	176	66.4 Å²	66.4	66%	0.664	36%	0.363	S	S	*	.	H	α-helix	trans	-66.8	-41.5	175.3	-74.3	-169.8	-179	-163.4	1.6	112.8	V43 M44 Q49 A50 S51	V43-R47 WeakPolarHBondContact O-CG 3.48Å; V43-R47 PolarHBondContact O-N 2.88Å; M44-R47 CarbonylContact O-C 3.55Å; M44-R47 WeakPolarHBondContact O-CA 3.47Å; M44-R47 PolarHBondContact O-N 2.96Å; R47-Q49 VanDerWaalsContact C-N 3.3Å; R47-Q49 PolarHBondContact O-N 2.97Å; R47-A50 WeakPolarHBondContact O-CB 3.45Å; R47-A50 PolarHBondContact O-N 3.28Å; R47-A50 VanDerWaalsContact O-N 3.15Å; R47-S51 PolarHBondContact O-N 2.82Å; R47-S51 PolarHBondContact O-OG 2.88Å
48	L	54.7	Low	60.3	Low	8 Å²	8	69.2 Å²	69.2	4%	0.042	38%	0.384	C	S	.	.	H	α-helix	trans	-63.3	-36.8	174.5	-85.5	155.3	0	0	0	111.5	M44 A50 S51 T52 L133	M44-L48 HydrophobicContact CG-CD1 3.93Å; M44-L48 WeakPolarHBondContact O-CB 3.21Å; M44-L48 PolarHBondContact O-N 2.81Å; M44-L48 HydrophobicContact SD-CD1 4.49Å; L48-A50 PolarHBondContact O-N 2.91Å; L48-S51 PolarHBondContact O-N 3.29Å; L48-S51 PolarHBondContact O-OG 3.16Å; L48-T52 HydrophobicContact CD2-CG2 4.14Å; L48-T52 PolarHBondContact O-N 3.21Å; L48-T52 PolarHBondContact O-OG1 2.98Å; L48-L133 HydrophobicContact CD1-CD1 3.8Å; L48-L133 HydrophobicContact CD2-CD1 4.14Å
49	Q	62.7	Low	60.3	Low	116 Å²	116	70.9 Å²	70.9	54%	0.542	40%	0.401	S	S	.	.	H	α-helix	trans	-59.9	-30.9	174.6	-152.3	169.1	-3.9	0	0	112.5	G45 A46 R47 S57	G45-Q49 WeakPolarHBondContact O-CB 3.44Å; G45-Q49 PolarHBondContact O-N 2.96Å; A46-Q49 WeakPolarHBondContact O-CB 3.37Å; A46-Q49 PolarHBondContact O-N 2.81Å; R47-Q49 VanDerWaalsContact C-N 3.3Å; R47-Q49 PolarHBondContact O-N 2.97Å; Q49-S57 WeakPolarHBondContact CB-OG 3.37Å; Q49-S57 VanDerWaalsContact CG-OG 3.31Å; Q49-S57 WeakPolarHBondContact CG-OG 3.35Å
50	A	60.1	Low	60	Low	93 Å²	93	66.7 Å²	66.7	77%	0.769	38%	0.381	S	S	*	.	H	α-helix	trans	-75.7	-22.4	176.4	0	0	0	0	0	113.1	A46 R47 L48	A46-A50 PolarHBondContact O-N 3.39Å; R47-A50 WeakPolarHBondContact O-CB 3.45Å; R47-A50 PolarHBondContact O-N 3.28Å; R47-A50 VanDerWaalsContact O-N 3.15Å; L48-A50 PolarHBondContact O-N 2.91Å
51	S	58.2	Low	59.9	Low	71 Å²	71	66.3 Å²	66.3	50%	0.497	37%	0.373	S	S	.	.	H	α-helix	trans	-117.6	-16.5	-170.4	53.2	0	0	0	0	116	R47 L48	R47-S51 PolarHBondContact O-N 2.82Å; R47-S51 PolarHBondContact O-OG 2.88Å; L48-S51 PolarHBondContact O-N 3.29Å; L48-S51 PolarHBondContact O-OG 3.16Å
52	T	53.7	Low	60	Low	25 Å²	25	69.2 Å²	69.2	15%	0.153	39%	0.393	C	S	.	.	S	Bend	trans	-139	161.3	-169.3	55.7	0	0	0	0	113.4	L48	L48-T52 HydrophobicContact CD2-CG2 4.14Å; L48-T52 PolarHBondContact O-N 3.21Å; L48-T52 PolarHBondContact O-OG1 2.98Å
53	P	54.4	Low	60.1	Low	71 Å²	71	67.9 Å²	67.9	46%	0.461	39%	0.386	S	S	.	.			trans	-60.4	146.8	177.6	22.1	-33.5	0	0	0	113.6	L55 L56	P53-L55 PolarHBondContact O-N 3.3Å; P53-L56 PolarHBondContact O-N 3.48Å
54	K	56.4	Low	60	Low	175 Å²	175	64.3 Å²	64.3	76%	0.761	36%	0.364	S	S	*	.	H	α-helix	trans	-49.6	-26.3	-166.4	-67.8	-178.3	177.6	177.8	0	116.7	C58	K54-C58 PolarHBondContact O-N 3.48Å
55	L	55.1	Low	60.3	Low	160 Å²	160	67.9 Å²	67.9	84%	0.838	38%	0.383	S	S	*	.	H	α-helix	trans	-66.8	-42.6	-175.9	-94.9	118.9	0	0	0	113.7	P53 C58 G59	P53-L55 PolarHBondContact O-N 3.3Å; L55-C58 PolarHBondContact O-N 3.27Å; L55-G59 PolarHBondContact O-N 3.44Å
56	L	51.4	Low	60.7	Low	76 Å²	76	72 Å²	72	40%	0.398	40%	0.403	S	S	.	.	H	α-helix	trans	-70.4	-34.4	-179.3	-81.6	152.3	0	0	0	112	P53 G59 S60 L133	P53-L56 PolarHBondContact O-N 3.48Å; L56-G59 PolarHBondContact O-N 2.86Å; L56-S60 PolarHBondContact O-N 2.77Å; L56-S60 PolarHBondContact O-OG 3.39Å; L56-L133 HydrophobicContact CD2-CD2 4.05Å
57	S	55.1	Low	60.9	Low	1 Å²	1	69.8 Å²	69.8	1%	0.007	38%	0.384	C	S	.	.	H	α-helix	trans	-65.6	-43.1	175.8	175.3	0	0	0	0	112	G45 Q49 G59 S60 I61	G45-S57 PolarHBondContact O-OG 2.96Å; Q49-S57 WeakPolarHBondContact CB-OG 3.37Å; Q49-S57 VanDerWaalsContact CG-OG 3.31Å; Q49-S57 WeakPolarHBondContact CG-OG 3.35Å; S57-G59 VanDerWaalsContact C-N 3.33Å; S57-G59 PolarHBondContact O-N 3.03Å; S57-S60 PolarHBondContact O-N 3.29Å; S57-S60 PolarHBondContact O-OG 3.01Å; S57-I61 WeakPolarHBondContact O-CG1 3.41Å; S57-I61 PolarHBondContact O-N 3.38Å
58	C	58.9	Low	61.2	Low	79 Å²	79	62.9 Å²	62.9	53%	0.534	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-41.9	176.5	-83.9	0	0	0	0	112.3	K54 L55 S60 I61 V62	K54-C58 PolarHBondContact O-N 3.48Å; L55-C58 PolarHBondContact O-N 3.27Å; C58-S60 PolarHBondContact O-N 3.07Å; C58-I61 PolarHBondContact O-N 3.19Å; C58-V62 WeakPolarHBondContact O-CB 3.45Å; C58-V62 WeakPolarHBondContact O-CG2 3.26Å; C58-V62 PolarHBondContact O-N 3.16Å
59	G	64.2	Low	61.8	Low	35 Å²	35	65.5 Å²	65.5	36%	0.361	38%	0.381	S	S	.	.	H	α-helix	trans	-59.6	-45.7	-179.2	0	0	0	0	0	113.1	L55 L56 S57 V62 I63	L55-G59 PolarHBondContact O-N 3.44Å; L56-G59 PolarHBondContact O-N 2.86Å; S57-G59 VanDerWaalsContact C-N 3.33Å; S57-G59 PolarHBondContact O-N 3.03Å; G59-V62 PolarHBondContact O-N 3.26Å; G59-I63 VanDerWaalsContact O-CG1 3.26Å; G59-I63 WeakPolarHBondContact O-CG1 3.3Å; G59-I63 PolarHBondContact O-N 3.01Å
60	S	63	Low	62	Low	10 Å²	10	60.3 Å²	60.3	7%	0.07	36%	0.358	C	S	.	.	H	α-helix	trans	-66.7	-40	179.2	51.6	0	0	0	0	113.2	G45 L56 S57 C58 I63 G64	G45-S60 WeakPolarHBondContact CA-OG 3.4Å; L56-S60 PolarHBondContact O-N 2.77Å; L56-S60 PolarHBondContact O-OG 3.39Å; S57-S60 PolarHBondContact O-N 3.29Å; S57-S60 PolarHBondContact O-OG 3.01Å; C58-S60 PolarHBondContact O-N 3.07Å; S60-I63 PolarHBondContact O-N 3.08Å; S60-G64 PolarHBondContact O-N 3.05Å
61	I	64.3	Low	62.2	Low	54 Å²	54	55.9 Å²	55.9	28%	0.277	32%	0.321	S	S	.	.	H	α-helix	trans	-63.9	-43	174.7	-64.4	168.7	0	0	0	110.5	S57 C58 G64 L65	S57-I61 WeakPolarHBondContact O-CG1 3.41Å; S57-I61 PolarHBondContact O-N 3.38Å; C58-I61 PolarHBondContact O-N 3.19Å; I61-G64 PolarHBondContact O-N 3.33Å; I61-L65 HydrophobicContact CG2-CD1 4.06Å; I61-L65 HydrophobicContact CG2-CG 4.46Å; I61-L65 WeakPolarHBondContact O-CG 3.23Å; I61-L65 PolarHBondContact O-N 3.27Å
62	V	67.2	Low	62.7	Low	81 Å²	81	55.9 Å²	55.9	49%	0.491	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-44.3	177.2	170.9	0	0	0	0	110.9	C58 G59 G64 L65 M66	C58-V62 WeakPolarHBondContact O-CB 3.45Å; C58-V62 WeakPolarHBondContact O-CG2 3.26Å; C58-V62 PolarHBondContact O-N 3.16Å; G59-V62 PolarHBondContact O-N 3.26Å; V62-G64 VanDerWaalsContact C-N 3.31Å; V62-G64 PolarHBondContact O-N 3.49Å; V62-L65 PolarHBondContact O-N 2.86Å; V62-M66 HydrophobicContact CG1-CG 4.24Å; V62-M66 WeakPolarHBondContact O-CB 3.33Å; V62-M66 VanDerWaalsContact O-CG 3.22Å; V62-M66 WeakPolarHBondContact O-CG 3.48Å; V62-M66 PolarHBondContact O-N 3.4Å
63	I	67.9	Low	63.3	Low	40 Å²	40	60 Å²	60	21%	0.205	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-41.8	175.4	-67.1	163	0	0	0	111	F41 G59 S60 M66 T67 V103	F41-I63 HydrophobicContact CD1-CB 4.1Å; F41-I63 HydrophobicContact CD1-CG2 3.89Å; F41-I63 HydrophobicContact CE1-CB 4.33Å; F41-I63 HydrophobicContact CE1-CD1 4.24Å; F41-I63 HydrophobicContact CE1-CG2 3.95Å; F41-I63 HydrophobicContact CG-CG2 4.37Å; G59-I63 VanDerWaalsContact O-CG1 3.26Å; G59-I63 WeakPolarHBondContact O-CG1 3.3Å; G59-I63 PolarHBondContact O-N 3.01Å; S60-I63 PolarHBondContact O-N 3.08Å; I63-M66 PolarHBondContact O-N 3.12Å; I63-T67 WeakPolarHBondContact O-CG2 3.41Å; I63-T67 PolarHBondContact O-N 3.3Å; I63-T67 PolarHBondContact O-OG1 3.18Å; I63-V103 HydrophobicContact CG2-CG1 3.76Å
64	G	63.7	Low	63.9	Low	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-42.8	174.6	0	0	0	0	0	113	A38 S60 I61 V62 T67 C68	A38-G64 WeakPolarHBondContact CB-O 3.37Å; S60-G64 PolarHBondContact O-N 3.05Å; I61-G64 PolarHBondContact O-N 3.33Å; V62-G64 VanDerWaalsContact C-N 3.31Å; V62-G64 PolarHBondContact O-N 3.49Å; G64-T67 WeakPolarHBondContact CA-OG1 3.31Å; G64-T67 PolarHBondContact O-N 3.45Å; G64-T67 PolarHBondContact O-OG1 3Å; G64-C68 PolarHBondContact O-N 3.15Å
65	L	70.1	Confident	64.4	Low	99 Å²	99	52 Å²	52	52%	0.518	30%	0.3	S	S	.	.	H	α-helix	trans	-68.3	-38.6	177.2	-71.4	170.4	0	0	0	112.5	I61 V62 C68 S69	I61-L65 HydrophobicContact CG2-CD1 4.06Å; I61-L65 HydrophobicContact CG2-CG 4.46Å; I61-L65 WeakPolarHBondContact O-CG 3.23Å; I61-L65 PolarHBondContact O-N 3.27Å; V62-L65 PolarHBondContact O-N 2.86Å; L65-C68 PolarHBondContact O-N 3.45Å; L65-S69 WeakPolarHBondContact O-CB 3.37Å; L65-S69 PolarHBondContact O-N 2.83Å; L65-S69 PolarHBondContact O-OG 2.96Å
66	M	67.5	Low	64.9	Low	86 Å²	86	48.2 Å²	48.2	42%	0.424	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-39.6	177.1	-69.9	-63.5	-70.6	0	0	111.7	V62 I63 S69 S70 L99	V62-M66 HydrophobicContact CG1-CG 4.24Å; V62-M66 WeakPolarHBondContact O-CB 3.33Å; V62-M66 VanDerWaalsContact O-CG 3.22Å; V62-M66 WeakPolarHBondContact O-CG 3.48Å; V62-M66 PolarHBondContact O-N 3.4Å; I63-M66 PolarHBondContact O-N 3.12Å; M66-S69 PolarHBondContact O-N 3.45Å; M66-S70 PolarHBondContact O-N 3.22Å; M66-L99 HydrophobicContact CE-CD1 3.97Å
67	T	68.3	Low	65.5	Low	10 Å²	10	45.2 Å²	45.2	6%	0.061	27%	0.271	C	S	.	.	H	α-helix	trans	-71.7	-35.2	176.3	46.7	0	0	0	0	112.7	F37 A38 I63 G64 S69 S70 A71	F37-T67 HydrophobicContact CD1-CG2 4.1Å; F37-T67 HydrophobicContact CE1-CG2 4.34Å; A38-T67 WeakPolarHBondContact CB-OG1 3.47Å; I63-T67 WeakPolarHBondContact O-CG2 3.41Å; I63-T67 PolarHBondContact O-N 3.3Å; I63-T67 PolarHBondContact O-OG1 3.18Å; G64-T67 WeakPolarHBondContact CA-OG1 3.31Å; G64-T67 PolarHBondContact O-N 3.45Å; G64-T67 PolarHBondContact O-OG1 3Å; T67-S69 VanDerWaalsContact C-N 3.34Å; T67-S70 PolarHBondContact O-OG 2.92Å; T67-A71 PolarHBondContact O-N 2.81Å; T67-A71 VanDerWaalsContact O-N 3.15Å
68	C	67.6	Low	65.8	Low	30 Å²	30	46.2 Å²	46.2	20%	0.203	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-42.9	167.9	-84.5	0	0	0	0	112	A38 G64 L65 S70 A71 V72	A38-C68 HydrophobicContact CB-CB 4.46Å; A38-C68 WeakPolarHBondContact CB-SG 3.35Å; G64-C68 PolarHBondContact O-N 3.15Å; L65-C68 PolarHBondContact O-N 3.45Å; C68-S70 PolarHBondContact O-N 2.91Å; C68-A71 PolarHBondContact O-N 2.85Å; C68-V72 WeakPolarHBondContact O-CG2 3.23Å; C68-V72 PolarHBondContact O-N 3.26Å
69	S	68.6	Low	66	Low	63 Å²	63	51.9 Å²	51.9	44%	0.441	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-40.1	-178.8	-58.3	0	0	0	0	111.5	L65 M66 T67 V72 L73	L65-S69 WeakPolarHBondContact O-CB 3.37Å; L65-S69 PolarHBondContact O-N 2.83Å; L65-S69 PolarHBondContact O-OG 2.96Å; M66-S69 PolarHBondContact O-N 3.45Å; T67-S69 VanDerWaalsContact C-N 3.34Å; S69-V72 PolarHBondContact O-N 3.03Å; S69-L73 VanDerWaalsContact O-CG 3.3Å; S69-L73 WeakPolarHBondContact O-CG 3.45Å; S69-L73 PolarHBondContact O-N 3.17Å
70	S	66.4	Low	65.5	Low	7 Å²	7	56.3 Å²	56.3	5%	0.049	30%	0.298	C	S	.	.	H	α-helix	trans	-66.1	-38.5	176.2	73.4	0	0	0	0	112.3	M66 T67 C68 V72 L73 L74 D96	M66-S70 PolarHBondContact O-N 3.22Å; T67-S70 PolarHBondContact O-OG 2.92Å; C68-S70 PolarHBondContact O-N 2.91Å; S70-V72 PolarHBondContact O-N 3.32Å; S70-L73 PolarHBondContact O-N 2.91Å; S70-L74 PolarHBondContact O-N 3.24Å; S70-D96 VanDerWaalsContact CB-OD1 3.31Å; S70-D96 WeakPolarHBondContact CB-OD1 3.27Å
71	A	64.5	Low	65	Low	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.7	-43.1	174	0	0	0	0	0	112.9	Q34 F35 T67 C68 L74 L75	Q34-A71 HydrophobicContact CB-CB 3.83Å; Q34-A71 VanDerWaalsContact OE1-N 3.1Å; F35-A71 HydrophobicContact CD2-CB 4.24Å; F35-A71 HydrophobicContact CE2-CB 3.97Å; F35-A71 HydrophobicContact CZ-CB 4.31Å; T67-A71 PolarHBondContact O-N 2.81Å; T67-A71 VanDerWaalsContact O-N 3.15Å; C68-A71 PolarHBondContact O-N 2.85Å; A71-L74 PolarHBondContact O-N 3.39Å; A71-L75 WeakPolarHBondContact O-CG 3.46Å; A71-L75 PolarHBondContact O-N 3.47Å
72	V	68.4	Low	64.4	Low	72 Å²	72	57.9 Å²	57.9	44%	0.436	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-41.9	175.5	174.8	0	0	0	0	110.6	C68 S69 S70 L74 L75 V76	C68-V72 WeakPolarHBondContact O-CG2 3.23Å; C68-V72 PolarHBondContact O-N 3.26Å; S69-V72 PolarHBondContact O-N 3.03Å; S70-V72 PolarHBondContact O-N 3.32Å; V72-L74 VanDerWaalsContact C-N 3.34Å; V72-L74 PolarHBondContact O-N 2.91Å; V72-L75 PolarHBondContact O-N 3.27Å; V72-V76 HydrophobicContact CG1-CG2 4.14Å; V72-V76 WeakPolarHBondContact O-CB 3.26Å; V72-V76 VanDerWaalsContact O-CG2 3.26Å; V72-V76 WeakPolarHBondContact O-CG2 3.47Å; V72-V76 PolarHBondContact O-N 3.4Å
73	L	67.6	Low	63.4	Low	110 Å²	110	61.4 Å²	61.4	58%	0.576	32%	0.321	S	S	*	.	H	α-helix	trans	-63.1	-38.3	176.8	-72.5	172.4	0	0	0	112.4	S69 S70 G77	S69-L73 VanDerWaalsContact O-CG 3.3Å; S69-L73 WeakPolarHBondContact O-CG 3.45Å; S69-L73 PolarHBondContact O-N 3.17Å; S70-L73 PolarHBondContact O-N 2.91Å; L73-G77 WeakPolarHBondContact O-CA 3.13Å; L73-G77 PolarHBondContact O-N 3.41Å
74	L	65.1	Low	62.3	Low	14 Å²	14	68.6 Å²	68.6	7%	0.073	35%	0.345	C	S	.	.	H	α-helix	trans	-63.7	-47	172.6	-78.6	175.3	0	0	0	111.6	T31 S70 A71 V72 G77 V78 V92 D96	T31-L74 HydrophobicContact CG2-CB 4.04Å; S70-L74 PolarHBondContact O-N 3.24Å; A71-L74 PolarHBondContact O-N 3.39Å; V72-L74 VanDerWaalsContact C-N 3.34Å; V72-L74 PolarHBondContact O-N 2.91Å; L74-G77 PolarHBondContact O-N 3.11Å; L74-V78 WeakPolarHBondContact O-CB 3.23Å; L74-V78 WeakPolarHBondContact O-CG2 3.44Å; L74-V78 PolarHBondContact O-N 2.88Å; L74-V92 HydrophobicContact CD2-CG1 4.13Å; L74-D96 WeakPolarHBondContact CD1-OD2 3.43Å; L74-D96 HydrophobicContact CD2-CB 4.28Å
75	L	66.9	Low	61.8	Low	64 Å²	64	74.9 Å²	74.9	34%	0.335	38%	0.378	S	S	.	.	H	α-helix	trans	-60.7	-47.5	177.4	-75.5	171.3	0	0	0	111.8	T31 F35 A71 V72 V78 Y79	T31-L75 HydrophobicContact CG2-CD1 4.41Å; T31-L75 HydrophobicContact CG2-CD2 3.85Å; T31-L75 HydrophobicContact CG2-CG 3.65Å; F35-L75 HydrophobicContact CE2-CD1 4.08Å; A71-L75 WeakPolarHBondContact O-CG 3.46Å; A71-L75 PolarHBondContact O-N 3.47Å; V72-L75 PolarHBondContact O-N 3.27Å; L75-V78 PolarHBondContact O-N 2.64Å; L75-Y79 VanDerWaalsContact O-CB 3.26Å; L75-Y79 WeakPolarHBondContact O-CB 3.3Å; L75-Y79 PolarHBondContact O-N 3.49Å
76	V	67	Low	61	Low	82 Å²	82	72.1 Å²	72.1	50%	0.497	37%	0.366	S	S	.	.	H	α-helix	trans	-64.7	-42	178	173	0	0	0	0	110.8	V72 Y79 K80	V72-V76 HydrophobicContact CG1-CG2 4.14Å; V72-V76 WeakPolarHBondContact O-CB 3.26Å; V72-V76 VanDerWaalsContact O-CG2 3.26Å; V72-V76 WeakPolarHBondContact O-CG2 3.47Å; V72-V76 PolarHBondContact O-N 3.4Å; V76-Y79 PolarHBondContact O-N 2.83Å; V76-K80 WeakPolarHBondContact O-CB 3.39Å; V76-K80 PolarHBondContact O-N 3.29Å
77	G	63.6	Low	60.4	Low	12 Å²	12	73.5 Å²	73.5	12%	0.124	37%	0.374	C	S	.	.	H	α-helix	trans	-59.1	-50.8	176	0	0	0	0	0	111.5	L73 L74 Y79 K80 S81	L73-G77 WeakPolarHBondContact O-CA 3.13Å; L73-G77 PolarHBondContact O-N 3.41Å; L74-G77 PolarHBondContact O-N 3.11Å; G77-Y79 PolarHBondContact O-N 3.02Å; G77-K80 PolarHBondContact O-N 3.4Å; G77-S81 WeakPolarHBondContact O-CB 3.46Å; G77-S81 PolarHBondContact O-N 3.46Å
78	V	62.1	Low	59.8	Low	23 Å²	23	77.6 Å²	77.6	14%	0.139	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-45.5	178.4	172.7	0	0	0	0	111	A27 L74 L75 S81 M82	A27-V78 HydrophobicContact CB-CB 4.44Å; A27-V78 HydrophobicContact CB-CG1 4.24Å; A27-V78 HydrophobicContact CB-CG2 3.69Å; L74-V78 WeakPolarHBondContact O-CB 3.23Å; L74-V78 WeakPolarHBondContact O-CG2 3.44Å; L74-V78 PolarHBondContact O-N 2.88Å; L75-V78 PolarHBondContact O-N 2.64Å; V78-S81 PolarHBondContact O-N 2.97Å; V78-S81 PolarHBondContact O-OG 3.48Å; V78-M82 PolarHBondContact O-N 3.48Å; V78-M82 VanDerWaalsContact O-N 3.15Å
79	Y	61.6	Low	59.5	Low	198 Å²	198	77 Å²	77	78%	0.776	39%	0.387	S	S	*	.	H	α-helix	trans	-61.6	-46.1	178.2	-169.9	-96.6	0	0	0	112	L75 V76 G77 S81	L75-Y79 VanDerWaalsContact O-CB 3.26Å; L75-Y79 WeakPolarHBondContact O-CB 3.3Å; L75-Y79 PolarHBondContact O-N 3.49Å; V76-Y79 PolarHBondContact O-N 2.83Å; G77-Y79 PolarHBondContact O-N 3.02Å; Y79-S81 VanDerWaalsContact C-N 3.3Å; Y79-S81 PolarHBondContact O-N 3.5Å
80	K	54.7	Low	59.1	Low	128 Å²	128	76.8 Å²	76.8	56%	0.557	38%	0.381	S	S	*	.	H	α-helix	trans	-66.3	-32	175.8	-168.4	174.1	-178.6	174.4	0	112.1	V76 G77 L83 R84	V76-K80 WeakPolarHBondContact O-CB 3.39Å; V76-K80 PolarHBondContact O-N 3.29Å; G77-K80 PolarHBondContact O-N 3.4Å; K80-L83 WeakPolarHBondContact O-CB 3.48Å; K80-L83 PolarHBondContact O-N 2.94Å; K80-L83 VanDerWaalsContact O-N 3.13Å; K80-R84 PolarHBondContact O-N 3.43Å
81	S	51.6	Low	59.1	Low	17 Å²	17	80.6 Å²	80.6	12%	0.119	40%	0.404	C	S	.	.	H	α-helix	trans	-75.5	-26.2	-177.8	83.7	0	0	0	0	115.2	G77 V78 Y79 L83 R84 N89	G77-S81 WeakPolarHBondContact O-CB 3.46Å; G77-S81 PolarHBondContact O-N 3.46Å; V78-S81 PolarHBondContact O-N 2.97Å; V78-S81 PolarHBondContact O-OG 3.48Å; Y79-S81 VanDerWaalsContact C-N 3.3Å; Y79-S81 PolarHBondContact O-N 3.5Å; S81-L83 PolarHBondContact O-N 3.39Å; S81-R84 PolarHBondContact O-N 2.91Å; S81-N89 WeakPolarHBondContact CB-ND2 3.39Å; S81-N89 WeakPolarHBondContact CB-OD1 3.44Å; S81-N89 PolarHBondContact OG-ND2 2.95Å; S81-N89 PolarHBondContact OG-OD1 3.4Å
82	M	52.4	Low	59.1	Low	79 Å²	79	82.7 Å²	82.7	39%	0.389	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-26.8	167.3	-82.2	-78.1	-174.5	0	0	110.3	R20 L24 V78	R20-M82 HydrophobicContact CB-CE 4.19Å; R20-M82 HydrophobicContact CG-CE 4.44Å; R20-M82 HydrophobicContact CG-SD 4.27Å; L24-M82 HydrophobicContact CD1-CE 3.53Å; V78-M82 PolarHBondContact O-N 3.48Å; V78-M82 VanDerWaalsContact O-N 3.15Å
83	L	46.1	Very low	59	Low	156 Å²	156	80.1 Å²	80.1	82%	0.817	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-42.1	175.4	-124.8	84.5	0	0	0	114.7	K80 S81	K80-L83 WeakPolarHBondContact O-CB 3.48Å; K80-L83 PolarHBondContact O-N 2.94Å; K80-L83 VanDerWaalsContact O-N 3.13Å; S81-L83 PolarHBondContact O-N 3.39Å
84	R	45.5	Very low	58.9	Low	191 Å²	191	76.9 Å²	76.9	72%	0.721	39%	0.389	S	S	*	.	S	Bend	trans	-147	122.2	-177.3	-81.4	-174.5	178.1	170.5	-0.5	114.3	K80 S81	K80-R84 PolarHBondContact O-N 3.43Å; S81-R84 PolarHBondContact O-N 2.91Å
85	L	52	Low	59	Low	131 Å²	131	80.1 Å²	80.1	69%	0.686	41%	0.409	S	S	*	.			trans	50.9	122.8	155.8	-102.7	81.9	0	0	0	120.4	L87 Q88	L85-L87 PolarHBondContact O-N 2.91Å; L85-Q88 PolarHBondContact O-N 3.45Å; L85-Q88 VanDerWaalsContact O-N 3.1Å
86	V	54.5	Low	59	Low	42 Å²	42	77.4 Å²	77.4	26%	0.255	40%	0.395	S	S	.	.	H	α-helix	trans	-41	-31.1	165.8	176.4	0	0	0	0	114.8	N89 L90 V158 F162	V86-N89 PolarHBondContact O-N 2.91Å; V86-L90 PolarHBondContact O-N 3.49Å; V86-L90 VanDerWaalsContact O-N 3.13Å; V86-V158 HydrophobicContact CG1-CG1 3.65Å; V86-F162 HydrophobicContact CG1-CB 4.47Å; V86-F162 HydrophobicContact CG1-CD2 4.07Å
87	L	55	Low	58.8	Low	115 Å²	115	75.2 Å²	75.2	60%	0.602	38%	0.38	S	S	*	.	H	α-helix	trans	-65.9	-39	-177.7	-150.3	88.3	0	0	0	112.6	L85 N89 L90 V91	L85-L87 PolarHBondContact O-N 2.91Å; L87-N89 VanDerWaalsContact C-N 3.35Å; L87-L90 PolarHBondContact O-N 2.76Å; L87-V91 PolarHBondContact O-N 3.42Å
88	Q	54.2	Low	59.2	Low	95 Å²	95	80.3 Å²	80.3	44%	0.444	40%	0.403	S	S	.	.	H	α-helix	trans	-66.6	-38.7	176.8	-90.1	-174.3	-20.2	0	0	111.3	L85 L90 V91 V92	L85-Q88 PolarHBondContact O-N 3.45Å; L85-Q88 VanDerWaalsContact O-N 3.1Å; Q88-L90 VanDerWaalsContact C-N 3.26Å; Q88-L90 PolarHBondContact O-N 3.22Å; Q88-V91 PolarHBondContact O-N 3.03Å; Q88-V92 WeakPolarHBondContact O-CG2 3.21Å; Q88-V92 PolarHBondContact O-N 3.26Å
89	N	61	Low	59.4	Low	19 Å²	19	81.9 Å²	81.9	10%	0.102	41%	0.41	C	S	.	.	H	α-helix	trans	-61.2	-37.8	174.7	-74.1	-16.1	0	0	0	112.1	L23 S81 V86 L87 L93	L23-N89 WeakPolarHBondContact CD2-ND2 3.36Å; S81-N89 WeakPolarHBondContact CB-ND2 3.39Å; S81-N89 WeakPolarHBondContact CB-OD1 3.44Å; S81-N89 PolarHBondContact OG-ND2 2.95Å; S81-N89 PolarHBondContact OG-OD1 3.4Å; V86-N89 PolarHBondContact O-N 2.91Å; L87-N89 VanDerWaalsContact C-N 3.35Å; N89-L93 WeakPolarHBondContact O-CB 3.47Å; N89-L93 PolarHBondContact O-N 3.21Å
90	L	61.8	Low	59.7	Low	58 Å²	58	73.1 Å²	73.1	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-68.7	-37.9	-179.6	-150.8	142.1	0	0	0	111.6	V86 L87 Q88 A94 V158 L159	V86-L90 PolarHBondContact O-N 3.49Å; V86-L90 VanDerWaalsContact O-N 3.13Å; L87-L90 PolarHBondContact O-N 2.76Å; Q88-L90 VanDerWaalsContact C-N 3.26Å; Q88-L90 PolarHBondContact O-N 3.22Å; L90-A94 VanDerWaalsContact O-CB 3.29Å; L90-A94 WeakPolarHBondContact O-CB 3.33Å; L90-A94 PolarHBondContact O-N 2.99Å; L90-V158 HydrophobicContact CD1-CG1 4.37Å; L90-L159 HydrophobicContact CD1-CD2 3.94Å; L90-L159 HydrophobicContact CD1-CG 4.35Å
91	V	65.3	Low	60.2	Low	87 Å²	87	69.9 Å²	69.9	53%	0.527	37%	0.368	S	S	.	.	H	α-helix	trans	-67.9	-48.2	174.4	176.7	0	0	0	0	111.5	L87 Q88 L93 A94 V95	L87-V91 PolarHBondContact O-N 3.42Å; Q88-V91 PolarHBondContact O-N 3.03Å; V91-L93 VanDerWaalsContact C-N 3.29Å; V91-L93 PolarHBondContact O-N 3.38Å; V91-A94 PolarHBondContact O-N 2.72Å; V91-V95 HydrophobicContact CG1-CG2 4.46Å; V91-V95 WeakPolarHBondContact O-CG2 3.18Å; V91-V95 PolarHBondContact O-N 2.96Å
92	V	64.4	Low	61	Low	44 Å²	44	71.2 Å²	71.2	27%	0.267	38%	0.38	S	S	.	.	H	α-helix	trans	-60.4	-43	178.7	175.1	0	0	0	0	110.4	L74 Q88 V95 D96	L74-V92 HydrophobicContact CD2-CG1 4.13Å; Q88-V92 WeakPolarHBondContact O-CG2 3.21Å; Q88-V92 PolarHBondContact O-N 3.26Å; V92-V95 PolarHBondContact O-N 3.25Å; V92-D96 WeakPolarHBondContact O-CB 3.39Å; V92-D96 PolarHBondContact O-N 3.25Å
93	L	66.5	Low	61.8	Low	18 Å²	18	68.7 Å²	68.7	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-65.8	-38.1	177.3	-173	58.8	0	0	0	112.3	N89 V91 D96 I97 N154 V155	N89-L93 WeakPolarHBondContact O-CB 3.47Å; N89-L93 PolarHBondContact O-N 3.21Å; V91-L93 VanDerWaalsContact C-N 3.29Å; V91-L93 PolarHBondContact O-N 3.38Å; L93-D96 PolarHBondContact O-N 3.37Å; L93-I97 HydrophobicContact CG-CD1 4.39Å; L93-I97 VanDerWaalsContact O-CG1 3.3Å; L93-I97 WeakPolarHBondContact O-CG1 3.46Å; L93-I97 PolarHBondContact O-N 2.79Å; L93-N154 HydrophobicContact CD2-CB 4.18Å; L93-V155 HydrophobicContact CD2-CB 4.2Å; L93-V155 HydrophobicContact CD2-CG2 3.32Å; L93-V155 HydrophobicContact CG-CG2 3.65Å
94	A	64.7	Low	62.7	Low	41 Å²	41	63.6 Å²	63.6	34%	0.339	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-42.5	175.3	0	0	0	0	0	112.2	L90 V91 D96 I97 I98	L90-A94 VanDerWaalsContact O-CB 3.29Å; L90-A94 WeakPolarHBondContact O-CB 3.33Å; L90-A94 PolarHBondContact O-N 2.99Å; V91-A94 PolarHBondContact O-N 2.72Å; A94-D96 VanDerWaalsContact C-N 3.32Å; A94-D96 PolarHBondContact O-N 2.98Å; A94-I97 PolarHBondContact O-N 3.39Å; A94-I98 VanDerWaalsContact O-CG1 3.3Å; A94-I98 WeakPolarHBondContact O-CG1 3.25Å; A94-I98 PolarHBondContact O-N 3.23Å
95	V	68.5	Low	63.8	Low	82 Å²	82	59 Å²	59	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-62.3	-42.2	175.3	173.1	0	0	0	0	110.6	V91 V92 I98 L99	V91-V95 HydrophobicContact CG1-CG2 4.46Å; V91-V95 WeakPolarHBondContact O-CG2 3.18Å; V91-V95 PolarHBondContact O-N 2.96Å; V92-V95 PolarHBondContact O-N 3.25Å; V95-I98 PolarHBondContact O-N 2.93Å; V95-L99 WeakPolarHBondContact O-CB 3.45Å; V95-L99 PolarHBondContact O-N 2.9Å
96	D	66.5	Low	64.8	Low	7 Å²	7	58.2 Å²	58.2	4%	0.037	33%	0.325	C	S	.	.	H	α-helix	trans	-61.7	-44.6	176.7	-171.4	58.4	0	0	0	111.5	Q34 S70 L74 V92 L93 A94 I98 L99 L100	Q34-D96 PolarHBondContact NE2-OD1 3.23Å; Q34-D96 VanDerWaalsContact NE2-OD1 3.13Å; Q34-D96 PolarHBondContact NE2-OD2 3.27Å; S70-D96 VanDerWaalsContact CB-OD1 3.31Å; S70-D96 WeakPolarHBondContact CB-OD1 3.27Å; L74-D96 WeakPolarHBondContact CD1-OD2 3.43Å; L74-D96 HydrophobicContact CD2-CB 4.28Å; V92-D96 WeakPolarHBondContact O-CB 3.39Å; V92-D96 PolarHBondContact O-N 3.25Å; L93-D96 PolarHBondContact O-N 3.37Å; A94-D96 VanDerWaalsContact C-N 3.32Å; A94-D96 PolarHBondContact O-N 2.98Å; D96-I98 PolarHBondContact O-N 3.39Å; D96-L99 PolarHBondContact O-N 3.49Å; D96-L100 VanDerWaalsContact O-CB 3.25Å; D96-L100 WeakPolarHBondContact O-CB 3.35Å; D96-L100 PolarHBondContact O-N 2.94Å
97	I	63.7	Low	65.3	Low	36 Å²	36	56.9 Å²	56.9	19%	0.185	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-46.7	175.3	-68.3	166.1	0	0	0	111.5	L93 A94 L99 L100 V101 V155	L93-I97 HydrophobicContact CG-CD1 4.39Å; L93-I97 VanDerWaalsContact O-CG1 3.3Å; L93-I97 WeakPolarHBondContact O-CG1 3.46Å; L93-I97 PolarHBondContact O-N 2.79Å; A94-I97 PolarHBondContact O-N 3.39Å; I97-L99 PolarHBondContact O-N 2.86Å; I97-L100 PolarHBondContact O-N 3.39Å; I97-V101 HydrophobicContact CG2-CG2 4.33Å; I97-V101 VanDerWaalsContact O-CG2 3.27Å; I97-V101 WeakPolarHBondContact O-CG2 3.36Å; I97-V101 PolarHBondContact O-N 2.8Å; I97-V155 HydrophobicContact CD1-CG2 3.67Å
98	I	70.9	Confident	65.9	Low	120 Å²	120	54.3 Å²	54.3	62%	0.615	31%	0.305	S	S	*	.	H	α-helix	trans	-62.4	-45	-179.8	-67.5	165	0	0	0	110.5	A94 V95 D96 L100 V101 A102	A94-I98 VanDerWaalsContact O-CG1 3.3Å; A94-I98 WeakPolarHBondContact O-CG1 3.25Å; A94-I98 PolarHBondContact O-N 3.23Å; V95-I98 PolarHBondContact O-N 2.93Å; D96-I98 PolarHBondContact O-N 3.39Å; I98-L100 VanDerWaalsContact C-N 3.3Å; I98-L100 PolarHBondContact O-N 3.44Å; I98-V101 PolarHBondContact O-N 3.44Å; I98-A102 WeakPolarHBondContact O-CB 3.33Å; I98-A102 PolarHBondContact O-N 2.88Å
99	L	67.2	Low	66.7	Low	55 Å²	55	54.6 Å²	54.6	29%	0.288	31%	0.309	S	S	.	.	H	α-helix	trans	-60.4	-43.6	177.5	-163.6	95	0	0	0	110.8	M66 V95 D96 I97 A102 V103	M66-L99 HydrophobicContact CE-CD1 3.97Å; V95-L99 WeakPolarHBondContact O-CB 3.45Å; V95-L99 PolarHBondContact O-N 2.9Å; D96-L99 PolarHBondContact O-N 3.49Å; I97-L99 PolarHBondContact O-N 2.86Å; L99-A102 PolarHBondContact O-N 2.86Å; L99-V103 WeakPolarHBondContact O-CG2 3.36Å; L99-V103 PolarHBondContact O-N 3.22Å
100	L	67.5	Low	66.9	Low	14 Å²	14	55.8 Å²	55.8	7%	0.073	32%	0.321	C	S	.	.	H	α-helix	trans	-69.5	-37.7	-177.6	-150.1	133.7	0	0	0	111.9	D96 I97 I98 V103 F104 A144 S147 T148	D96-L100 VanDerWaalsContact O-CB 3.25Å; D96-L100 WeakPolarHBondContact O-CB 3.35Å; D96-L100 PolarHBondContact O-N 2.94Å; I97-L100 PolarHBondContact O-N 3.39Å; I98-L100 VanDerWaalsContact C-N 3.3Å; I98-L100 PolarHBondContact O-N 3.44Å; L100-V103 PolarHBondContact O-N 3.48Å; L100-F104 WeakPolarHBondContact O-CB 3.44Å; L100-F104 PolarHBondContact O-N 3.34Å; L100-A144 HydrophobicContact CD2-CB 4.17Å; L100-A144 WeakPolarHBondContact CD2-O 3.43Å; L100-S147 WeakPolarHBondContact CD1-OG 3.42Å; L100-T148 HydrophobicContact CD2-CG2 3.4Å
101	V	64.9	Low	67.1	Low	60 Å²	60	54.4 Å²	54.4	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-41.6	171.5	171.9	0	0	0	0	111.1	I97 I98 F104 L105 T148	I97-V101 HydrophobicContact CG2-CG2 4.33Å; I97-V101 VanDerWaalsContact O-CG2 3.27Å; I97-V101 WeakPolarHBondContact O-CG2 3.36Å; I97-V101 PolarHBondContact O-N 2.8Å; I98-V101 PolarHBondContact O-N 3.44Å; V101-F104 WeakPolarHBondContact O-CB 3.44Å; V101-F104 PolarHBondContact O-N 3.39Å; V101-L105 HydrophobicContact CG1-CD1 4.09Å; V101-L105 HydrophobicContact CG1-CG 4.38Å; V101-L105 WeakPolarHBondContact O-CG 3.36Å; V101-L105 PolarHBondContact O-N 3.43Å; V101-T148 HydrophobicContact CG2-CG2 4.19Å
102	A	67.7	Low	67.2	Low	45 Å²	45	54 Å²	54	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-63.2	-44	177.2	0	0	0	0	0	111.9	I98 L99 F104 L105 L106	I98-A102 WeakPolarHBondContact O-CB 3.33Å; I98-A102 PolarHBondContact O-N 2.88Å; L99-A102 PolarHBondContact O-N 2.86Å; A102-F104 VanDerWaalsContact C-N 3.32Å; A102-F104 PolarHBondContact O-N 2.9Å; A102-L105 PolarHBondContact O-N 3.13Å; A102-L106 WeakPolarHBondContact O-CB 3.36Å; A102-L106 WeakPolarHBondContact O-CG 3.17Å; A102-L106 PolarHBondContact O-N 3.5Å
103	V	69.8	Low	67.4	Low	27 Å²	27	57.1 Å²	57.1	16%	0.164	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-40.2	174.8	172.1	0	0	0	0	111.1	I63 L99 L100 L106 A107	I63-V103 HydrophobicContact CG2-CG1 3.76Å; L99-V103 WeakPolarHBondContact O-CG2 3.36Å; L99-V103 PolarHBondContact O-N 3.22Å; L100-V103 PolarHBondContact O-N 3.48Å; V103-L106 PolarHBondContact O-N 2.95Å; V103-A107 WeakPolarHBondContact O-CB 3.41Å; V103-A107 PolarHBondContact O-N 2.91Å
104	F	66	Low	67.4	Low	49 Å²	49	57.3 Å²	57.3	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-47.1	176.3	-179.8	-113.9	0	0	0	112.7	L100 V101 A102 L106 A107 I108 A141 A144	L100-F104 WeakPolarHBondContact O-CB 3.44Å; L100-F104 PolarHBondContact O-N 3.34Å; V101-F104 WeakPolarHBondContact O-CB 3.44Å; V101-F104 PolarHBondContact O-N 3.39Å; A102-F104 VanDerWaalsContact C-N 3.32Å; A102-F104 PolarHBondContact O-N 2.9Å; F104-L106 PolarHBondContact O-N 3.34Å; F104-A107 PolarHBondContact O-N 2.91Å; F104-I108 HydrophobicContact CD1-CD1 3.76Å; F104-I108 HydrophobicContact CD2-CD1 4.39Å; F104-I108 HydrophobicContact CE1-CD1 3.31Å; F104-I108 HydrophobicContact CE1-CG1 4.44Å; F104-I108 HydrophobicContact CE2-CD1 4.04Å; F104-I108 HydrophobicContact CE2-CG1 4.45Å; F104-I108 HydrophobicContact CG-CD1 4.3Å; F104-I108 HydrophobicContact CZ-CD1 3.5Å; F104-I108 HydrophobicContact CZ-CG1 4.36Å; F104-I108 WeakPolarHBondContact O-CG1 3.41Å; F104-I108 PolarHBondContact O-N 2.94Å; F104-A141 HydrophobicContact CD2-CB 4.41Å; F104-A141 HydrophobicContact CE2-CB 3.73Å; F104-A141 WeakPolarHBondContact CE2-O 3.3Å; F104-A144 HydrophobicContact CB-CB 3.97Å; F104-A144 HydrophobicContact CD2-CB 3.43Å; F104-A144 VanDerWaalsContact CD2-CB 3.43Å; F104-A144 HydrophobicContact CE2-CB 4.2Å; F104-A144 HydrophobicContact CG-CB 4.05Å
105	L	68.7	Low	67.6	Low	94 Å²	94	61.3 Å²	61.3	49%	0.492	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-42.5	177.5	-70.4	174.4	0	0	0	111.5	V101 A102 A107 I108 I109	V101-L105 HydrophobicContact CG1-CD1 4.09Å; V101-L105 HydrophobicContact CG1-CG 4.38Å; V101-L105 WeakPolarHBondContact O-CG 3.36Å; V101-L105 PolarHBondContact O-N 3.43Å; A102-L105 PolarHBondContact O-N 3.13Å; L105-A107 VanDerWaalsContact C-N 3.31Å; L105-A107 PolarHBondContact O-N 3.28Å; L105-I108 PolarHBondContact O-N 3.45Å; L105-I109 VanDerWaalsContact O-CG1 3.27Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.49Å
106	L	71.3	Confident	67.6	Low	114 Å²	114	60.8 Å²	60.8	60%	0.597	34%	0.339	S	S	*	.	H	α-helix	trans	-62	-39.3	174.7	-76	169.4	0	0	0	111.9	A102 V103 F104 A110	A102-L106 WeakPolarHBondContact O-CB 3.36Å; A102-L106 WeakPolarHBondContact O-CG 3.17Å; A102-L106 PolarHBondContact O-N 3.5Å; V103-L106 PolarHBondContact O-N 2.95Å; F104-L106 PolarHBondContact O-N 3.34Å; L106-A110 VanDerWaalsContact O-CB 3.32Å; L106-A110 WeakPolarHBondContact O-CB 3.37Å; L106-A110 PolarHBondContact O-N 2.9Å
107	A	66.6	Low	67.6	Low	15 Å²	15	65.9 Å²	65.9	12%	0.124	36%	0.361	C	S	.	.	H	α-helix	trans	-65.4	-41.1	175.4	0	0	0	0	0	112.1	V103 F104 L105 A110 T111	V103-A107 WeakPolarHBondContact O-CB 3.41Å; V103-A107 PolarHBondContact O-N 2.91Å; F104-A107 PolarHBondContact O-N 2.91Å; L105-A107 VanDerWaalsContact C-N 3.31Å; L105-A107 PolarHBondContact O-N 3.28Å; A107-A110 PolarHBondContact O-N 2.93Å; A107-T111 PolarHBondContact O-N 3.41Å; A107-T111 PolarHBondContact O-OG1 2.9Å
108	I	66	Low	67.5	Low	61 Å²	61	65.6 Å²	65.6	31%	0.313	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-48.3	175.4	-70.6	170.9	0	0	0	110.9	F104 L105 A110 T111 C112	F104-I108 HydrophobicContact CD1-CD1 3.76Å; F104-I108 HydrophobicContact CD2-CD1 4.39Å; F104-I108 HydrophobicContact CE1-CD1 3.31Å; F104-I108 HydrophobicContact CE1-CG1 4.44Å; F104-I108 HydrophobicContact CE2-CD1 4.04Å; F104-I108 HydrophobicContact CE2-CG1 4.45Å; F104-I108 HydrophobicContact CG-CD1 4.3Å; F104-I108 HydrophobicContact CZ-CD1 3.5Å; F104-I108 HydrophobicContact CZ-CG1 4.36Å; F104-I108 WeakPolarHBondContact O-CG1 3.41Å; F104-I108 PolarHBondContact O-N 2.94Å; L105-I108 PolarHBondContact O-N 3.45Å; I108-A110 VanDerWaalsContact C-N 3.28Å; I108-A110 PolarHBondContact O-N 3.27Å; I108-T111 VanDerWaalsContact C-OG1 3.27Å; I108-T111 VanDerWaalsContact CA-OG1 3.23Å; I108-T111 WeakPolarHBondContact CA-OG1 3.28Å; I108-T111 PolarHBondContact O-N 3.22Å; I108-T111 VanDerWaalsContact O-N 3.11Å; I108-T111 PolarHBondContact O-OG1 3.41Å; I108-C112 PolarHBondContact O-N 3.1Å; I108-C112 PolarHBondContact O-SG 3.27Å
109	I	71.3	Confident	67.3	Low	100 Å²	100	63.4 Å²	63.4	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-59.4	-44.9	178.7	-66.8	164.4	0	0	0	109.5	L105 T111 C112 E113	L105-I109 VanDerWaalsContact O-CG1 3.27Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.49Å; I109-T111 VanDerWaalsContact C-N 3.34Å; I109-T111 PolarHBondContact O-N 2.86Å; I109-C112 PolarHBondContact O-N 3.34Å; I109-E113 WeakPolarHBondContact O-CG 3.35Å; I109-E113 PolarHBondContact O-N 2.86Å
110	A	65.9	Low	67.3	Low	44 Å²	44	66.7 Å²	66.7	36%	0.364	39%	0.387	S	S	.	.	H	α-helix	trans	-59.3	-42.3	175.4	0	0	0	0	0	112.3	L106 A107 I108 L114	L106-A110 VanDerWaalsContact O-CB 3.32Å; L106-A110 WeakPolarHBondContact O-CB 3.37Å; L106-A110 PolarHBondContact O-N 2.9Å; A107-A110 PolarHBondContact O-N 2.93Å; I108-A110 VanDerWaalsContact C-N 3.28Å; I108-A110 PolarHBondContact O-N 3.27Å; A110-L114 WeakPolarHBondContact O-CB 3.36Å; A110-L114 VanDerWaalsContact O-CD1 3.29Å; A110-L114 WeakPolarHBondContact O-CD1 3.45Å; A110-L114 WeakPolarHBondContact O-CG 3.41Å; A110-L114 PolarHBondContact O-N 3.43Å
111	T	66.7	Low	67.2	Low	29 Å²	29	67.6 Å²	67.6	18%	0.178	39%	0.393	C	S	.	.	H	α-helix	trans	-64.3	-42.1	174.8	37.7	0	0	0	0	113.7	A107 I108 I109 E113 L114 H115 C137	A107-T111 PolarHBondContact O-N 3.41Å; A107-T111 PolarHBondContact O-OG1 2.9Å; I108-T111 VanDerWaalsContact C-OG1 3.27Å; I108-T111 VanDerWaalsContact CA-OG1 3.23Å; I108-T111 WeakPolarHBondContact CA-OG1 3.28Å; I108-T111 PolarHBondContact O-N 3.22Å; I108-T111 VanDerWaalsContact O-N 3.11Å; I108-T111 PolarHBondContact O-OG1 3.41Å; I109-T111 VanDerWaalsContact C-N 3.34Å; I109-T111 PolarHBondContact O-N 2.86Å; T111-E113 VanDerWaalsContact C-N 3.33Å; T111-E113 PolarHBondContact O-N 2.89Å; T111-L114 PolarHBondContact O-N 3.45Å; T111-H115 WeakPolarHBondContact O-CB 3.26Å; T111-H115 PolarHBondContact O-N 3.5Å; T111-C137 HydrophobicContact CG2-CB 2.91Å
112	C	67.2	Low	67.6	Low	78 Å²	78	70.9 Å²	70.9	53%	0.527	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-44.5	-179.6	-69.1	0	0	0	0	110.6	I108 I109 H115 S116	I108-C112 PolarHBondContact O-N 3.1Å; I108-C112 PolarHBondContact O-SG 3.27Å; I109-C112 PolarHBondContact O-N 3.34Å; C112-H115 PolarHBondContact O-N 2.89Å; C112-S116 WeakPolarHBondContact O-CB 3.49Å; C112-S116 PolarHBondContact O-N 2.89Å
113	E	67.8	Low	68	Low	110 Å²	110	71.4 Å²	71.4	51%	0.514	41%	0.414	S	S	.	.	H	α-helix	trans	-62.8	-45	175.2	-69	-63.9	156.4	0	0	111.4	I109 T111 H115 S116 F117	I109-E113 WeakPolarHBondContact O-CG 3.35Å; I109-E113 PolarHBondContact O-N 2.86Å; T111-E113 VanDerWaalsContact C-N 3.33Å; T111-E113 PolarHBondContact O-N 2.89Å; E113-H115 VanDerWaalsContact C-N 3.35Å; E113-H115 PolarHBondContact O-N 2.82Å; E113-S116 WeakPolarHBondContact O-CB 3.2Å; E113-S116 PolarHBondContact O-N 3.05Å; E113-F117 WeakPolarHBondContact O-CD2 3.2Å; E113-F117 PolarHBondContact O-N 3.22Å
114	L	66.9	Low	68.3	Low	22 Å²	22	78 Å²	78	12%	0.115	44%	0.443	C	S	.	.	H	α-helix	trans	-62.7	-39.9	177.6	-77.2	161.5	0	0	0	112.8	A110 T111 S116 F117 A118 L133	A110-L114 WeakPolarHBondContact O-CB 3.36Å; A110-L114 VanDerWaalsContact O-CD1 3.29Å; A110-L114 WeakPolarHBondContact O-CD1 3.45Å; A110-L114 WeakPolarHBondContact O-CG 3.41Å; A110-L114 PolarHBondContact O-N 3.43Å; T111-L114 PolarHBondContact O-N 3.45Å; L114-S116 VanDerWaalsContact C-N 3.34Å; L114-F117 PolarHBondContact O-N 2.9Å; L114-A118 WeakPolarHBondContact O-CB 3.16Å; L114-A118 PolarHBondContact O-N 2.89Å; L114-L133 HydrophobicContact CD1-CD2 3.31Å; L114-L133 HydrophobicContact CD1-CG 3.66Å; L114-L133 HydrophobicContact CD2-CD2 3.6Å; L114-L133 HydrophobicContact CG-CD2 4.1Å
115	H	67.5	Low	68.6	Low	126 Å²	126	85.5 Å²	85.5	58%	0.583	47%	0.47	S	S	*	.	H	α-helix	trans	-69.7	-34.7	179.2	-149.6	-53.6	0	0	0	111.6	T111 C112 E113 A118	T111-H115 WeakPolarHBondContact O-CB 3.26Å; T111-H115 PolarHBondContact O-N 3.5Å; C112-H115 PolarHBondContact O-N 2.89Å; E113-H115 VanDerWaalsContact C-N 3.35Å; E113-H115 PolarHBondContact O-N 2.82Å; H115-A118 PolarHBondContact O-N 3.37Å
116	S	68.8	Low	68.5	Low	70 Å²	70	86.6 Å²	86.6	49%	0.49	47%	0.468	S	S	.	.	H	α-helix	trans	-63.4	-45.5	169.8	-175.7	0	0	0	0	111.2	C112 E113 L114 A118	C112-S116 WeakPolarHBondContact O-CB 3.49Å; C112-S116 PolarHBondContact O-N 2.89Å; E113-S116 WeakPolarHBondContact O-CB 3.2Å; E113-S116 PolarHBondContact O-N 3.05Å; L114-S116 VanDerWaalsContact C-N 3.34Å; S116-A118 PolarHBondContact O-N 3.39Å
117	F	66.2	Low	68.5	Low	114 Å²	114	86.2 Å²	86.2	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-64.6	-37.2	175.5	-94	-79.5	0	0	0	113.1	E113 L114 G119 M120 V121	E113-F117 WeakPolarHBondContact O-CD2 3.2Å; E113-F117 PolarHBondContact O-N 3.22Å; L114-F117 PolarHBondContact O-N 2.9Å; F117-G119 PolarHBondContact O-N 2.9Å; F117-G119 VanDerWaalsContact O-N 3.16Å; F117-M120 HydrophobicContact CD1-CE 4.34Å; F117-M120 PolarHBondContact O-N 3.13Å; F117-V121 WeakPolarHBondContact O-CG2 3.5Å; F117-V121 PolarHBondContact O-N 3.03Å
118	A	62.1	Low	68.9	Low	30 Å²	30	92.2 Å²	92.2	25%	0.248	49%	0.487	C	S	.	.	H	α-helix	trans	-54.6	-36.7	-178.8	0	0	0	0	0	112.9	L114 H115 S116 M120 I130	L114-A118 WeakPolarHBondContact O-CB 3.16Å; L114-A118 PolarHBondContact O-N 2.89Å; H115-A118 PolarHBondContact O-N 3.37Å; S116-A118 PolarHBondContact O-N 3.39Å; A118-M120 VanDerWaalsContact C-N 3.28Å; A118-M120 PolarHBondContact O-N 3.31Å; A118-I130 HydrophobicContact CB-CG2 3.63Å
119	G	66.5	Low	69.1	Low	74 Å²	74	90.7 Å²	90.7	76%	0.763	48%	0.482	S	S	*	.	H	α-helix	trans	-69.9	-23.4	177.1	0	0	0	0	0	113.9	F117	F117-G119 PolarHBondContact O-N 2.9Å; F117-G119 VanDerWaalsContact O-N 3.16Å
120	M	67	Low	69	Low	125 Å²	125	86.4 Å²	86.4	62%	0.616	46%	0.46	S	S	*	.	H	α-helix	trans	-92.8	-21.3	-177.6	-65.6	-168.7	-89.7	0	0	113.5	F117 A118	F117-M120 HydrophobicContact CD1-CE 4.34Å; F117-M120 PolarHBondContact O-N 3.13Å; A118-M120 VanDerWaalsContact C-N 3.28Å; A118-M120 PolarHBondContact O-N 3.31Å
121	V	66.9	Low	69.4	Low	32 Å²	32	88.3 Å²	88.3	19%	0.194	47%	0.467	C	S	.	.			trans	-84.2	122.8	-174.7	-170.7	0	0	0	0	112	F117 Y126 K127 I130	F117-V121 WeakPolarHBondContact O-CG2 3.5Å; F117-V121 PolarHBondContact O-N 3.03Å; V121-Y126 HydrophobicContact CG1-CD1 4.4Å; V121-Y126 HydrophobicContact CG1-CG 3.97Å; V121-K127 WeakPolarHBondContact O-CE 2.91Å; V121-I130 HydrophobicContact CB-CD1 4.4Å; V121-I130 HydrophobicContact CG2-CD1 3.87Å
122	T	73.8	Confident	69.7	Low	129 Å²	129	90.9 Å²	90.9	79%	0.791	48%	0.48	S	S	*	.			trans	-86.6	-23.7	178	50.7	0	0	0	0	113.7	E124	T122-E124 PolarHBondContact O-N 3.27Å
123	S	74.6	Confident	69.9	Low	56 Å²	56	88 Å²	88	39%	0.392	46%	0.459	S	S	.	.			trans	-73.9	123	-178	178	0	0	0	0	112.1	R125 Y126 K127	S123-R125 VanDerWaalsContact C-N 3.32Å; S123-R125 PolarHBondContact O-N 3.15Å; S123-Y126 PolarHBondContact O-N 2.77Å; S123-Y126 VanDerWaalsContact O-N 3.12Å; S123-K127 PolarHBondContact O-N 3.43Å
124	E	76.9	Confident	70	Confident	166 Å²	166	83.7 Å²	83.7	78%	0.776	44%	0.44	S	S	*	.	H	α-helix	trans	-57.1	-41.6	-179.9	-72.8	-168.5	155	0	0	113	T122 Y126 K127 E128	T122-E124 PolarHBondContact O-N 3.27Å; E124-Y126 VanDerWaalsContact C-N 3.26Å; E124-Y126 PolarHBondContact O-N 2.89Å; E124-K127 WeakPolarHBondContact O-CB 3.39Å; E124-K127 PolarHBondContact O-N 3.2Å; E124-K127 VanDerWaalsContact O-N 3.11Å; E124-E128 PolarHBondContact O-N 3.49Å
125	R	72.2	Confident	70.4	Confident	207 Å²	207	85.8 Å²	85.8	78%	0.781	45%	0.454	S	S	*	.	H	α-helix	trans	-61.1	-36.9	178.2	-70.2	-172.6	-178.2	179.9	1.3	112.5	S123 S129	S123-R125 VanDerWaalsContact C-N 3.32Å; S123-R125 PolarHBondContact O-N 3.15Å; R125-S129 WeakPolarHBondContact O-CB 3.09Å; R125-S129 PolarHBondContact O-N 3.5Å; R125-S129 VanDerWaalsContact O-N 3.13Å; R125-S129 PolarHBondContact O-OG 2.73Å
126	Y	66.9	Low	70.4	Confident	116 Å²	116	83 Å²	83	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-72.9	-39	176	-106.4	-90.5	0	0	0	111.3	V121 S123 E124 E128 S129 I130	V121-Y126 HydrophobicContact CG1-CD1 4.4Å; V121-Y126 HydrophobicContact CG1-CG 3.97Å; S123-Y126 PolarHBondContact O-N 2.77Å; S123-Y126 VanDerWaalsContact O-N 3.12Å; E124-Y126 VanDerWaalsContact C-N 3.26Å; E124-Y126 PolarHBondContact O-N 2.89Å; Y126-E128 VanDerWaalsContact C-N 3.34Å; Y126-E128 PolarHBondContact O-N 3.14Å; Y126-S129 PolarHBondContact O-N 2.92Å; Y126-I130 HydrophobicContact CD1-CD1 4.39Å; Y126-I130 WeakPolarHBondContact O-CB 3.42Å; Y126-I130 WeakPolarHBondContact O-CG1 3.27Å; Y126-I130 PolarHBondContact O-N 3.16Å
127	K	71.5	Confident	70.3	Confident	107 Å²	107	80.5 Å²	80.5	47%	0.465	42%	0.421	S	S	.	.	H	α-helix	trans	-58.4	-46.6	175	-73.7	-175.2	179.1	-179.5	0	111.4	V121 S123 E124 I130 T131	V121-K127 WeakPolarHBondContact O-CE 2.91Å; S123-K127 PolarHBondContact O-N 3.43Å; E124-K127 WeakPolarHBondContact O-CB 3.39Å; E124-K127 PolarHBondContact O-N 3.2Å; E124-K127 VanDerWaalsContact O-N 3.11Å; K127-I130 PolarHBondContact O-N 2.85Å; K127-T131 PolarHBondContact O-N 3.38Å; K127-T131 PolarHBondContact O-OG1 2.97Å
128	E	75.3	Confident	70.6	Confident	140 Å²	140	80.5 Å²	80.5	65%	0.654	42%	0.422	S	S	*	.	H	α-helix	trans	-63.2	-41.1	177.5	-168.1	178.6	-170.9	0	0	112.1	E124 Y126 I130 T131 L132	E124-E128 PolarHBondContact O-N 3.49Å; Y126-E128 VanDerWaalsContact C-N 3.34Å; Y126-E128 PolarHBondContact O-N 3.14Å; E128-I130 VanDerWaalsContact C-N 3.34Å; E128-I130 PolarHBondContact O-N 2.85Å; E128-T131 WeakPolarHBondContact CA-OG1 3.35Å; E128-T131 PolarHBondContact O-OG1 3.2Å; E128-T131 VanDerWaalsContact O-OG1 3.09Å; E128-L132 WeakPolarHBondContact O-CB 3.29Å; E128-L132 PolarHBondContact O-N 2.94Å
129	S	69.3	Low	71	Confident	29 Å²	29	85.5 Å²	85.5	20%	0.203	44%	0.439	C	S	.	.	H	α-helix	trans	-64.7	-38.4	175.7	-59.4	0	0	0	0	112.1	R125 Y126 L133	R125-S129 WeakPolarHBondContact O-CB 3.09Å; R125-S129 PolarHBondContact O-N 3.5Å; R125-S129 VanDerWaalsContact O-N 3.13Å; R125-S129 PolarHBondContact O-OG 2.73Å; Y126-S129 PolarHBondContact O-N 2.92Å; S129-L133 WeakPolarHBondContact O-CB 3.3Å; S129-L133 PolarHBondContact O-N 2.99Å
130	I	69.3	Low	71	Confident	11 Å²	11	82.2 Å²	82.2	6%	0.056	40%	0.404	C	S	.	.	H	α-helix	trans	-71.6	-46.9	178.4	-66.8	165.5	0	0	0	110.8	A118 V121 Y126 K127 E128 L132 L133 T134	A118-I130 HydrophobicContact CB-CG2 3.63Å; V121-I130 HydrophobicContact CB-CD1 4.4Å; V121-I130 HydrophobicContact CG2-CD1 3.87Å; Y126-I130 HydrophobicContact CD1-CD1 4.39Å; Y126-I130 WeakPolarHBondContact O-CB 3.42Å; Y126-I130 WeakPolarHBondContact O-CG1 3.27Å; Y126-I130 PolarHBondContact O-N 3.16Å; K127-I130 PolarHBondContact O-N 2.85Å; E128-I130 VanDerWaalsContact C-N 3.34Å; E128-I130 PolarHBondContact O-N 2.85Å; I130-L132 VanDerWaalsContact C-N 3.31Å; I130-L132 PolarHBondContact O-N 2.9Å; I130-L133 CarbonylContact O-C 3.59Å; I130-L133 WeakPolarHBondContact O-CA 3.3Å; I130-L133 WeakPolarHBondContact O-CB 3.34Å; I130-L133 PolarHBondContact O-N 2.99Å; I130-L133 VanDerWaalsContact O-N 3.09Å; I130-T134 PolarHBondContact O-N 2.91Å; I130-T134 PolarHBondContact O-OG1 3.34Å
131	T	74.6	Confident	71	Confident	83 Å²	83	77.4 Å²	77.4	51%	0.509	39%	0.385	S	S	.	.	H	α-helix	trans	-61.6	-40.2	177.1	40.4	0	0	0	0	112	K127 E128 L133 T134 T135	K127-T131 PolarHBondContact O-N 3.38Å; K127-T131 PolarHBondContact O-OG1 2.97Å; E128-T131 WeakPolarHBondContact CA-OG1 3.35Å; E128-T131 PolarHBondContact O-OG1 3.2Å; E128-T131 VanDerWaalsContact O-OG1 3.09Å; T131-L133 VanDerWaalsContact C-N 3.32Å; T131-L133 PolarHBondContact O-N 3.35Å; T131-T134 PolarHBondContact O-N 3.29Å; T131-T135 WeakPolarHBondContact O-CG2 3.2Å; T131-T135 PolarHBondContact O-N 3.18Å; T131-T135 PolarHBondContact O-OG1 3.14Å
132	L	73.4	Confident	71.3	Confident	84 Å²	84	81.1 Å²	81.1	44%	0.44	40%	0.402	S	S	.	.	H	α-helix	trans	-59.6	-45.5	173.1	-171.2	133.3	0	0	0	110.4	E128 I130 T135 Y136	E128-L132 WeakPolarHBondContact O-CB 3.29Å; E128-L132 PolarHBondContact O-N 2.94Å; I130-L132 VanDerWaalsContact C-N 3.31Å; I130-L132 PolarHBondContact O-N 2.9Å; L132-T135 PolarHBondContact O-OG1 3.4Å; L132-Y136 HydrophobicContact CD1-CE2 4.41Å; L132-Y136 HydrophobicContact CD2-CD2 3.79Å; L132-Y136 HydrophobicContact CD2-CE2 3.46Å; L132-Y136 VanDerWaalsContact CD2-CE2 3.46Å; L132-Y136 HydrophobicContact CG-CD2 4.04Å; L132-Y136 HydrophobicContact CG-CE2 3.61Å; L132-Y136 WeakPolarHBondContact O-CD2 3.2Å; L132-Y136 PolarHBondContact O-N 3.38Å
133	L	69.7	Low	71.1	Confident	17 Å²	17	76.4 Å²	76.4	9%	0.089	37%	0.371	C	S	.	.	H	α-helix	trans	-63.9	-40.4	176.1	-170.7	57.9	0	0	0	113	L48 L56 L114 S129 I130 T131 Y136 C137	L48-L133 HydrophobicContact CD1-CD1 3.8Å; L48-L133 HydrophobicContact CD2-CD1 4.14Å; L56-L133 HydrophobicContact CD2-CD2 4.05Å; L114-L133 HydrophobicContact CD1-CD2 3.31Å; L114-L133 HydrophobicContact CD1-CG 3.66Å; L114-L133 HydrophobicContact CD2-CD2 3.6Å; L114-L133 HydrophobicContact CG-CD2 4.1Å; S129-L133 WeakPolarHBondContact O-CB 3.3Å; S129-L133 PolarHBondContact O-N 2.99Å; I130-L133 CarbonylContact O-C 3.59Å; I130-L133 WeakPolarHBondContact O-CA 3.3Å; I130-L133 WeakPolarHBondContact O-CB 3.34Å; I130-L133 PolarHBondContact O-N 2.99Å; I130-L133 VanDerWaalsContact O-N 3.09Å; T131-L133 VanDerWaalsContact C-N 3.32Å; T131-L133 PolarHBondContact O-N 3.35Å; L133-Y136 PolarHBondContact O-N 3.43Å; L133-C137 PolarHBondContact O-N 2.98Å; L133-C137 PolarHBondContact O-SG 2.99Å; L133-C137 VanDerWaalsContact O-SG 3.4Å
134	T	71.3	Confident	70.7	Confident	19 Å²	19	74.1 Å²	74.1	12%	0.117	36%	0.355	C	S	.	.	H	α-helix	trans	-62	-51	177.6	-50.7	0	0	0	0	111.6	I130 T131 Y136 C137 E138	I130-T134 PolarHBondContact O-N 2.91Å; I130-T134 PolarHBondContact O-OG1 3.34Å; T131-T134 PolarHBondContact O-N 3.29Å; T134-Y136 PolarHBondContact O-N 3.49Å; T134-C137 PolarHBondContact O-N 3.23Å; T134-C137 VanDerWaalsContact O-N 3.12Å; T134-E138 WeakPolarHBondContact O-CG 3.14Å; T134-E138 PolarHBondContact O-N 2.93Å
135	T	74.2	Confident	70.4	Confident	67 Å²	67	69.1 Å²	69.1	41%	0.411	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-30.7	177.9	57	0	0	0	0	112.4	T131 L132 K139	T131-T135 WeakPolarHBondContact O-CG2 3.2Å; T131-T135 PolarHBondContact O-N 3.18Å; T131-T135 PolarHBondContact O-OG1 3.14Å; L132-T135 PolarHBondContact O-OG1 3.4Å; T135-K139 WeakPolarHBondContact O-CG 3.12Å; T135-K139 PolarHBondContact O-N 2.82Å; T135-K139 VanDerWaalsContact O-N 3.16Å
136	Y	67.6	Low	70.3	Confident	67 Å²	67	62.5 Å²	62.5	26%	0.263	32%	0.321	S	S	.	.	H	α-helix	trans	-75.9	-40.4	175.2	-80	-55.8	0	0	0	113.5	M44 L132 L133 T134 E138 K139 A140	M44-Y136 HydrophobicContact CE-CD1 3.05Å; M44-Y136 HydrophobicContact CE-CD2 3.97Å; M44-Y136 HydrophobicContact CE-CE1 3.59Å; M44-Y136 HydrophobicContact CE-CE2 4.43Å; M44-Y136 HydrophobicContact CE-CG 3.27Å; M44-Y136 HydrophobicContact CG-CD2 4.42Å; M44-Y136 VanDerWaalsContact SD-CB 3.52Å; M44-Y136 HydrophobicContact SD-CD1 4Å; M44-Y136 HydrophobicContact SD-CD2 3.86Å; M44-Y136 HydrophobicContact SD-CG 3.54Å; M44-Y136 VanDerWaalsContact SD-CG 3.54Å; L132-Y136 HydrophobicContact CD1-CE2 4.41Å; L132-Y136 HydrophobicContact CD2-CD2 3.79Å; L132-Y136 HydrophobicContact CD2-CE2 3.46Å; L132-Y136 VanDerWaalsContact CD2-CE2 3.46Å; L132-Y136 HydrophobicContact CG-CD2 4.04Å; L132-Y136 HydrophobicContact CG-CE2 3.61Å; L132-Y136 WeakPolarHBondContact O-CD2 3.2Å; L132-Y136 PolarHBondContact O-N 3.38Å; L133-Y136 PolarHBondContact O-N 3.43Å; T134-Y136 PolarHBondContact O-N 3.49Å; Y136-E138 VanDerWaalsContact C-N 3.26Å; Y136-E138 PolarHBondContact O-N 3.01Å; Y136-K139 HydrophobicContact CD1-CD 4.33Å; Y136-K139 CarbonylContact O-C 3.56Å; Y136-K139 WeakPolarHBondContact O-CB 3.33Å; Y136-K139 PolarHBondContact O-N 3.49Å; Y136-A140 WeakPolarHBondContact O-CB 3.45Å; Y136-A140 PolarHBondContact O-N 2.91Å
137	C	67.6	Low	70.3	Confident	18 Å²	18	57 Å²	57	12%	0.122	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-31.5	173.4	-69.6	0	0	0	0	112.2	T111 L133 T134 A140 A141	T111-C137 HydrophobicContact CG2-CB 2.91Å; L133-C137 PolarHBondContact O-N 2.98Å; L133-C137 PolarHBondContact O-SG 2.99Å; L133-C137 VanDerWaalsContact O-SG 3.4Å; T134-C137 PolarHBondContact O-N 3.23Å; T134-C137 VanDerWaalsContact O-N 3.12Å; C137-A140 CarbonylContact O-C 3.57Å; C137-A140 WeakPolarHBondContact O-CB 3.43Å; C137-A140 PolarHBondContact O-N 3.37Å; C137-A141 WeakPolarHBondContact O-CB 3.49Å; C137-A141 PolarHBondContact O-N 3.19Å
138	E	71.5	Confident	70.2	Confident	113 Å²	113	53.5 Å²	53.5	53%	0.528	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-46.1	168.9	-73.6	176.1	173.6	0	0	111.4	T134 Y136 A140 A141 I142	T134-E138 WeakPolarHBondContact O-CG 3.14Å; T134-E138 PolarHBondContact O-N 2.93Å; Y136-E138 VanDerWaalsContact C-N 3.26Å; Y136-E138 PolarHBondContact O-N 3.01Å; E138-A140 VanDerWaalsContact C-N 3.27Å; E138-A140 PolarHBondContact O-N 3.37Å; E138-A141 WeakPolarHBondContact O-CB 3.37Å; E138-A141 PolarHBondContact O-N 2.98Å; E138-I142 WeakPolarHBondContact O-CG1 3.32Å; E138-I142 PolarHBondContact O-N 3.44Å
139	K	70.8	Confident	69.9	Low	135 Å²	135	49.6 Å²	49.6	59%	0.587	28%	0.279	S	S	*	.	H	α-helix	trans	-61.2	-37.5	173.1	-72	178.8	179.9	179.5	0	112.1	T135 Y136 I142 F143	T135-K139 WeakPolarHBondContact O-CG 3.12Å; T135-K139 PolarHBondContact O-N 2.82Å; T135-K139 VanDerWaalsContact O-N 3.16Å; Y136-K139 HydrophobicContact CD1-CD 4.33Å; Y136-K139 CarbonylContact O-C 3.56Å; Y136-K139 WeakPolarHBondContact O-CB 3.33Å; Y136-K139 PolarHBondContact O-N 3.49Å; K139-I142 PolarHBondContact O-N 3.46Å; K139-F143 WeakPolarHBondContact O-CB 3.4Å; K139-F143 PolarHBondContact O-N 3.26Å
140	A	66.7	Low	69.9	Low	5 Å²	5	49.9 Å²	49.9	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-65.4	-41.1	175.6	0	0	0	0	0	112.7	F37 F41 Y136 C137 E138 F143 A144	F37-A140 HydrophobicContact CE2-CB 4.16Å; F37-A140 HydrophobicContact CZ-CB 3.88Å; F41-A140 HydrophobicContact CE2-CB 3.65Å; F41-A140 HydrophobicContact CZ-CB 3.52Å; Y136-A140 WeakPolarHBondContact O-CB 3.45Å; Y136-A140 PolarHBondContact O-N 2.91Å; C137-A140 CarbonylContact O-C 3.57Å; C137-A140 WeakPolarHBondContact O-CB 3.43Å; C137-A140 PolarHBondContact O-N 3.37Å; E138-A140 VanDerWaalsContact C-N 3.27Å; E138-A140 PolarHBondContact O-N 3.37Å; A140-F143 PolarHBondContact O-N 3.24Å; A140-A144 WeakPolarHBondContact O-CB 3.44Å; A140-A144 PolarHBondContact O-N 2.93Å
141	A	67.1	Low	69.9	Low	25 Å²	25	49.4 Å²	49.4	21%	0.207	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-46.9	175.5	0	0	0	0	0	111.1	F104 C137 E138 F143 A144 C145	F104-A141 HydrophobicContact CD2-CB 4.41Å; F104-A141 HydrophobicContact CE2-CB 3.73Å; F104-A141 WeakPolarHBondContact CE2-O 3.3Å; C137-A141 WeakPolarHBondContact O-CB 3.49Å; C137-A141 PolarHBondContact O-N 3.19Å; E138-A141 WeakPolarHBondContact O-CB 3.37Å; E138-A141 PolarHBondContact O-N 2.98Å; A141-F143 VanDerWaalsContact C-N 3.3Å; A141-F143 PolarHBondContact O-N 2.98Å; A141-A144 PolarHBondContact O-N 2.99Å; A141-C145 WeakPolarHBondContact O-CB 3.18Å; A141-C145 PolarHBondContact O-N 3.12Å; A141-C145 PolarHBondContact O-SG 3.5Å
142	I	73.9	Confident	69.5	Low	110 Å²	110	49.1 Å²	49.1	56%	0.564	28%	0.275	S	S	*	.	H	α-helix	trans	-59.6	-42.9	175.9	-66.2	165.6	0	0	0	110.8	E138 K139 C145 T146	E138-I142 WeakPolarHBondContact O-CG1 3.32Å; E138-I142 PolarHBondContact O-N 3.44Å; K139-I142 PolarHBondContact O-N 3.46Å; I142-C145 PolarHBondContact O-N 2.84Å; I142-T146 WeakPolarHBondContact O-CG2 3.3Å; I142-T146 PolarHBondContact O-N 2.95Å; I142-T146 PolarHBondContact O-OG1 3.27Å; I142-T146 VanDerWaalsContact O-OG1 3.05Å
143	F	68	Low	69.4	Low	30 Å²	30	51.5 Å²	51.5	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-47.8	176.1	177	-90.5	0	0	0	112.1	L33 F37 K139 A140 A141 C145 T146 S147	L33-F143 HydrophobicContact CB-CE2 3.94Å; L33-F143 HydrophobicContact CB-CZ 4.09Å; L33-F143 HydrophobicContact CD2-CD2 3.92Å; L33-F143 HydrophobicContact CD2-CE2 3.3Å; L33-F143 HydrophobicContact CD2-CZ 3.76Å; L33-F143 HydrophobicContact CG-CD2 4.39Å; L33-F143 HydrophobicContact CG-CE2 3.52Å; L33-F143 HydrophobicContact CG-CZ 4.12Å; L33-F143 VanDerWaalsContact O-CE2 3.23Å; L33-F143 WeakPolarHBondContact O-CE2 3.45Å; L33-F143 VanDerWaalsContact O-CZ 3.23Å; L33-F143 WeakPolarHBondContact O-CZ 3.39Å; F37-F143 HydrophobicContact CB-CD1 3.91Å; F37-F143 HydrophobicContact CB-CD2 3.99Å; F37-F143 HydrophobicContact CB-CE1 3.45Å; F37-F143 VanDerWaalsContact CB-CE1 3.45Å; F37-F143 HydrophobicContact CB-CE2 3.5Å; F37-F143 HydrophobicContact CB-CG 4.17Å; F37-F143 HydrophobicContact CB-CZ 3.24Å; F37-F143 AromaticContact CD1-CD1 3.61Å; F37-F143 HydrophobicContact CD1-CD1 3.61Å; F37-F143 AromaticContact CD1-CE1 3.52Å; F37-F143 HydrophobicContact CD1-CE1 3.52Å; F37-F143 HydrophobicContact CD1-CG 4.41Å; F37-F143 HydrophobicContact CD1-CZ 4.25Å; F37-F143 HydrophobicContact CD2-CB 3.63Å; F37-F143 AromaticContact CD2-CD1 3.17Å; F37-F143 HydrophobicContact CD2-CD1 3.17Å; F37-F143 AromaticContact CD2-CD2 3.56Å; F37-F143 HydrophobicContact CD2-CD2 3.56Å; F37-F143 AromaticContact CD2-CE1 3.68Å; F37-F143 HydrophobicContact CD2-CE1 3.68Å; F37-F143 AromaticContact CD2-CE2 3.98Å; F37-F143 HydrophobicContact CD2-CE2 3.98Å; F37-F143 AromaticContact CD2-CG 3.11Å; F37-F143 HydrophobicContact CD2-CG 3.11Å; F37-F143 HydrophobicContact CD2-CZ 4.07Å; F37-F143 AromaticContact CE1-CD1 3.74Å; F37-F143 HydrophobicContact CE1-CD1 3.74Å; F37-F143 HydrophobicContact CE1-CE1 4.05Å; F37-F143 HydrophobicContact CE2-CB 3.37Å; F37-F143 AromaticContact CE2-CD1 3.32Å; F37-F143 HydrophobicContact CE2-CD1 3.32Å; F37-F143 HydrophobicContact CE2-CD2 4.22Å; F37-F143 HydrophobicContact CE2-CE1 4.19Å; F37-F143 AromaticContact CE2-CG 3.35Å; F37-F143 HydrophobicContact CE2-CG 3.35Å; F37-F143 AromaticContact CG-CD1 3.27Å; F37-F143 HydrophobicContact CG-CD1 3.27Å; F37-F143 AromaticContact CG-CD2 4Å; F37-F143 HydrophobicContact CG-CD2 4Å; F37-F143 AromaticContact CG-CE1 3.26Å; F37-F143 HydrophobicContact CG-CE1 3.26Å; F37-F143 AromaticContact CG-CE2 3.94Å; F37-F143 HydrophobicContact CG-CE2 3.94Å; F37-F143 AromaticContact CG-CG 3.67Å; F37-F143 HydrophobicContact CG-CG 3.67Å; F37-F143 AromaticContact CG-CZ 3.63Å; F37-F143 HydrophobicContact CG-CZ 3.63Å; F37-F143 HydrophobicContact CZ-CB 4.15Å; F37-F143 AromaticContact CZ-CD1 3.55Å; F37-F143 HydrophobicContact CZ-CD1 3.55Å; F37-F143 HydrophobicContact CZ-CE1 4.32Å; F37-F143 HydrophobicContact CZ-CG 4.06Å; K139-F143 WeakPolarHBondContact O-CB 3.4Å; K139-F143 PolarHBondContact O-N 3.26Å; A140-F143 PolarHBondContact O-N 3.24Å; A141-F143 VanDerWaalsContact C-N 3.3Å; A141-F143 PolarHBondContact O-N 2.98Å; F143-C145 VanDerWaalsContact C-N 3.28Å; F143-C145 PolarHBondContact O-N 3.33Å; F143-T146 WeakPolarHBondContact CA-OG1 3.41Å; F143-T146 PolarHBondContact O-N 3.1Å; F143-T146 PolarHBondContact O-OG1 2.9Å; F143-S147 WeakPolarHBondContact O-CB 3.29Å; F143-S147 PolarHBondContact O-N 3.41Å
144	A	67.1	Low	69.2	Low	8 Å²	8	51.4 Å²	51.4	7%	0.066	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-38.5	178.7	0	0	0	0	0	111.7	L100 F104 A140 A141 T148	L100-A144 HydrophobicContact CD2-CB 4.17Å; L100-A144 WeakPolarHBondContact CD2-O 3.43Å; F104-A144 HydrophobicContact CB-CB 3.97Å; F104-A144 HydrophobicContact CD2-CB 3.43Å; F104-A144 VanDerWaalsContact CD2-CB 3.43Å; F104-A144 HydrophobicContact CE2-CB 4.2Å; F104-A144 HydrophobicContact CG-CB 4.05Å; A140-A144 WeakPolarHBondContact O-CB 3.44Å; A140-A144 PolarHBondContact O-N 2.93Å; A141-A144 PolarHBondContact O-N 2.99Å; A144-T148 WeakPolarHBondContact O-CB 3.48Å; A144-T148 WeakPolarHBondContact O-CG2 3.46Å; A144-T148 PolarHBondContact O-N 3.34Å; A144-T148 PolarHBondContact O-OG1 2.99Å
145	C	70.5	Confident	69.1	Low	60 Å²	60	52 Å²	52	41%	0.405	29%	0.285	S	S	.	.	H	α-helix	trans	-62.7	-46.3	172.8	-73	0	0	0	0	112.6	A141 I142 F143 T148 A149	A141-C145 WeakPolarHBondContact O-CB 3.18Å; A141-C145 PolarHBondContact O-N 3.12Å; A141-C145 PolarHBondContact O-SG 3.5Å; I142-C145 PolarHBondContact O-N 2.84Å; F143-C145 VanDerWaalsContact C-N 3.28Å; F143-C145 PolarHBondContact O-N 3.33Å; C145-T148 WeakPolarHBondContact CA-OG1 3.32Å; C145-T148 PolarHBondContact O-OG1 2.79Å; C145-A149 WeakPolarHBondContact O-CB 3.49Å; C145-A149 PolarHBondContact O-N 2.95Å
146	T	70.6	Confident	68.8	Low	69 Å²	69	51.9 Å²	51.9	42%	0.423	28%	0.284	S	S	.	.	H	α-helix	trans	-67	-41.3	178.2	50.6	0	0	0	0	111.9	I142 F143 A149 V150	I142-T146 WeakPolarHBondContact O-CG2 3.3Å; I142-T146 PolarHBondContact O-N 2.95Å; I142-T146 PolarHBondContact O-OG1 3.27Å; I142-T146 VanDerWaalsContact O-OG1 3.05Å; F143-T146 WeakPolarHBondContact CA-OG1 3.41Å; F143-T146 PolarHBondContact O-N 3.1Å; F143-T146 PolarHBondContact O-OG1 2.9Å; T146-A149 PolarHBondContact O-N 3.13Å; T146-V150 WeakPolarHBondContact O-CG2 3.31Å; T146-V150 PolarHBondContact O-N 3.26Å
147	S	66.9	Low	68.9	Low	1 Å²	1	50.8 Å²	50.8	1%	0.007	28%	0.282	C	S	.	.	H	α-helix	trans	-66.9	-42.8	177	-171.9	0	0	0	0	112.2	L100 F143 A149 V150 S151	L100-S147 WeakPolarHBondContact CD1-OG 3.42Å; F143-S147 WeakPolarHBondContact O-CB 3.29Å; F143-S147 PolarHBondContact O-N 3.41Å; S147-A149 VanDerWaalsContact C-N 3.34Å; S147-A149 PolarHBondContact O-N 3.09Å; S147-V150 PolarHBondContact O-N 3.4Å; S147-S151 WeakPolarHBondContact O-CB 3.33Å; S147-S151 PolarHBondContact O-N 3.02Å; S147-S151 PolarHBondContact O-OG 3.27Å; S147-S151 VanDerWaalsContact O-OG 3.14Å
148	T	68.4	Low	68.8	Low	32 Å²	32	50.3 Å²	50.3	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-42.7	173.6	42.8	0	0	0	0	111.3	L100 V101 A144 C145 V150 S151 V152	L100-T148 HydrophobicContact CD2-CG2 3.4Å; V101-T148 HydrophobicContact CG2-CG2 4.19Å; A144-T148 WeakPolarHBondContact O-CB 3.48Å; A144-T148 WeakPolarHBondContact O-CG2 3.46Å; A144-T148 PolarHBondContact O-N 3.34Å; A144-T148 PolarHBondContact O-OG1 2.99Å; C145-T148 WeakPolarHBondContact CA-OG1 3.32Å; C145-T148 PolarHBondContact O-OG1 2.79Å; T148-V150 PolarHBondContact O-N 2.94Å; T148-S151 PolarHBondContact O-N 3.39Å; T148-V152 WeakPolarHBondContact O-CB 3.41Å; T148-V152 VanDerWaalsContact O-CG2 3.3Å; T148-V152 WeakPolarHBondContact O-CG2 3.44Å; T148-V152 PolarHBondContact O-N 3.01Å
149	A	68.8	Low	68.4	Low	59 Å²	59	48.5 Å²	48.5	49%	0.488	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-44.5	177	0	0	0	0	0	112.1	C145 T146 S147 V152 F153	C145-A149 WeakPolarHBondContact O-CB 3.49Å; C145-A149 PolarHBondContact O-N 2.95Å; T146-A149 PolarHBondContact O-N 3.13Å; S147-A149 VanDerWaalsContact C-N 3.34Å; S147-A149 PolarHBondContact O-N 3.09Å; A149-V152 PolarHBondContact O-N 2.86Å; A149-F153 WeakPolarHBondContact O-CB 3.32Å; A149-F153 PolarHBondContact O-N 3.38Å
150	V	71	Confident	68.1	Low	35 Å²	35	50.5 Å²	50.5	21%	0.212	28%	0.276	C	S	.	.	H	α-helix	trans	-62.1	-45.2	174.8	172.3	0	0	0	0	110.9	F29 T146 S147 T148 V152 F153 N154	F29-V150 HydrophobicContact CD1-CG1 4.3Å; F29-V150 HydrophobicContact CD1-CG2 4.46Å; F29-V150 HydrophobicContact CE1-CG2 4.19Å; T146-V150 WeakPolarHBondContact O-CG2 3.31Å; T146-V150 PolarHBondContact O-N 3.26Å; S147-V150 PolarHBondContact O-N 3.4Å; T148-V150 PolarHBondContact O-N 2.94Å; V150-V152 PolarHBondContact O-N 3.47Å; V150-F153 PolarHBondContact O-N 3.31Å; V150-N154 PolarHBondContact O-N 3.04Å; V150-N154 PolarHBondContact O-ND2 2.88Å
151	S	67.8	Low	67.9	Low	1 Å²	1	51.8 Å²	51.8	1%	0.007	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-41.7	178.5	-64.3	0	0	0	0	112.3	S147 T148 N154 V155	S147-S151 WeakPolarHBondContact O-CB 3.33Å; S147-S151 PolarHBondContact O-N 3.02Å; S147-S151 PolarHBondContact O-OG 3.27Å; S147-S151 VanDerWaalsContact O-OG 3.14Å; T148-S151 PolarHBondContact O-N 3.39Å; S151-N154 WeakPolarHBondContact O-CB 3.31Å; S151-N154 PolarHBondContact O-N 3.32Å; S151-V155 WeakPolarHBondContact O-CG2 3.43Å; S151-V155 PolarHBondContact O-N 3.3Å
152	V	67.7	Low	67.7	Low	77 Å²	77	55 Å²	55	47%	0.467	29%	0.293	S	S	.	.	H	α-helix	trans	-63.9	-44.2	175.2	171.1	0	0	0	0	111	T148 A149 V150 N154 V155 V156	T148-V152 WeakPolarHBondContact O-CB 3.41Å; T148-V152 VanDerWaalsContact O-CG2 3.3Å; T148-V152 WeakPolarHBondContact O-CG2 3.44Å; T148-V152 PolarHBondContact O-N 3.01Å; A149-V152 PolarHBondContact O-N 2.86Å; V150-V152 PolarHBondContact O-N 3.47Å; V152-N154 PolarHBondContact O-N 2.81Å; V152-V155 WeakPolarHBondContact O-CB 3.43Å; V152-V155 PolarHBondContact O-N 2.98Å; V152-V155 VanDerWaalsContact O-N 3.12Å; V152-V156 WeakPolarHBondContact O-CG2 3.45Å; V152-V156 PolarHBondContact O-N 2.85Å
153	F	70.2	Confident	67.3	Low	133 Å²	133	55 Å²	55	58%	0.583	29%	0.292	S	S	*	.	H	α-helix	trans	-57.8	-40.2	175.5	-174.6	-104.6	0	0	0	111.5	A149 V150 V156 I157	A149-F153 WeakPolarHBondContact O-CB 3.32Å; A149-F153 PolarHBondContact O-N 3.38Å; V150-F153 PolarHBondContact O-N 3.31Å; F153-V156 PolarHBondContact O-N 3.45Å; F153-I157 HydrophobicContact CD1-CD1 3.72Å; F153-I157 HydrophobicContact CE1-CD1 3.3Å; F153-I157 HydrophobicContact CE1-CG1 4.25Å; F153-I157 HydrophobicContact CZ-CD1 3.85Å; F153-I157 HydrophobicContact CZ-CG1 4.47Å; F153-I157 PolarHBondContact O-N 3.01Å
154	N	66.2	Low	67.2	Low	16 Å²	16	57.9 Å²	57.9	9%	0.086	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-41.5	175	-66.9	-24	0	0	0	112.7	A26 L93 V150 S151 V152 V156 I157 V158	A26-N154 WeakPolarHBondContact CB-OD1 3.21Å; L93-N154 HydrophobicContact CD2-CB 4.18Å; V150-N154 PolarHBondContact O-N 3.04Å; V150-N154 PolarHBondContact O-ND2 2.88Å; S151-N154 WeakPolarHBondContact O-CB 3.31Å; S151-N154 PolarHBondContact O-N 3.32Å; V152-N154 PolarHBondContact O-N 2.81Å; N154-V156 VanDerWaalsContact C-N 3.28Å; N154-V156 PolarHBondContact O-N 3.47Å; N154-I157 PolarHBondContact O-N 2.79Å; N154-V158 WeakPolarHBondContact O-CB 3.22Å; N154-V158 VanDerWaalsContact O-CG2 3.29Å; N154-V158 WeakPolarHBondContact O-CG2 3.43Å; N154-V158 PolarHBondContact O-N 2.82Å
155	V	68.3	Low	66.9	Low	32 Å²	32	59.5 Å²	59.5	19%	0.194	32%	0.319	C	S	.	.	H	α-helix	trans	-57.6	-44.2	173.8	173.8	0	0	0	0	110.3	L93 I97 S151 V152 V158 L159	L93-V155 HydrophobicContact CD2-CB 4.2Å; L93-V155 HydrophobicContact CD2-CG2 3.32Å; L93-V155 HydrophobicContact CG-CG2 3.65Å; I97-V155 HydrophobicContact CD1-CG2 3.67Å; S151-V155 WeakPolarHBondContact O-CG2 3.43Å; S151-V155 PolarHBondContact O-N 3.3Å; V152-V155 WeakPolarHBondContact O-CB 3.43Å; V152-V155 PolarHBondContact O-N 2.98Å; V152-V155 VanDerWaalsContact O-N 3.12Å; V155-V158 PolarHBondContact O-N 2.93Å; V155-L159 HydrophobicContact CG1-CD1 3.68Å; V155-L159 HydrophobicContact CG1-CG 4.2Å; V155-L159 VanDerWaalsContact O-CB 3.31Å; V155-L159 WeakPolarHBondContact O-CB 3.32Å; V155-L159 VanDerWaalsContact O-CG 3.32Å; V155-L159 WeakPolarHBondContact O-CG 3.39Å; V155-L159 PolarHBondContact O-N 2.82Å
156	V	69.1	Low	66.7	Low	63 Å²	63	62.9 Å²	62.9	38%	0.382	32%	0.323	S	S	.	.	H	α-helix	trans	-63.8	-43.7	179.8	175	0	0	0	0	111.6	V152 F153 N154 L159 R160	V152-V156 WeakPolarHBondContact O-CG2 3.45Å; V152-V156 PolarHBondContact O-N 2.85Å; F153-V156 PolarHBondContact O-N 3.45Å; N154-V156 VanDerWaalsContact C-N 3.28Å; N154-V156 PolarHBondContact O-N 3.47Å; V156-L159 PolarHBondContact O-N 3.45Å; V156-R160 HydrophobicContact CG1-CG 4.5Å; V156-R160 WeakPolarHBondContact O-CB 3.36Å; V156-R160 WeakPolarHBondContact O-CG 3.26Å; V156-R160 PolarHBondContact O-N 3.28Å
157	I	68.2	Low	66.4	Low	44 Å²	44	63.3 Å²	63.3	23%	0.226	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-48.9	176.1	-69	172.6	0	0	0	110.4	F153 N154 L159 R160 V161	F153-I157 HydrophobicContact CD1-CD1 3.72Å; F153-I157 HydrophobicContact CE1-CD1 3.3Å; F153-I157 HydrophobicContact CE1-CG1 4.25Å; F153-I157 HydrophobicContact CZ-CD1 3.85Å; F153-I157 HydrophobicContact CZ-CG1 4.47Å; F153-I157 PolarHBondContact O-N 3.01Å; N154-I157 PolarHBondContact O-N 2.79Å; I157-L159 VanDerWaalsContact C-N 3.32Å; I157-L159 PolarHBondContact O-N 3.17Å; I157-R160 PolarHBondContact O-N 3.39Å; I157-V161 WeakPolarHBondContact O-CG2 3.34Å; I157-V161 PolarHBondContact O-N 3.05Å
158	V	65.7	Low	66.1	Low	8 Å²	8	65.1 Å²	65.1	5%	0.048	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-42.3	-179.7	173.2	0	0	0	0	111.1	L23 V86 L90 N154 V155 V161 F162	L23-V158 HydrophobicContact CD1-CG2 3.8Å; V86-V158 HydrophobicContact CG1-CG1 3.65Å; L90-V158 HydrophobicContact CD1-CG1 4.37Å; N154-V158 WeakPolarHBondContact O-CB 3.22Å; N154-V158 VanDerWaalsContact O-CG2 3.29Å; N154-V158 WeakPolarHBondContact O-CG2 3.43Å; N154-V158 PolarHBondContact O-N 2.82Å; V155-V158 PolarHBondContact O-N 2.93Å; V158-V161 PolarHBondContact O-N 3.38Å; V158-F162 WeakPolarHBondContact O-CB 3.35Å; V158-F162 PolarHBondContact O-N 3.45Å
159	L	63.7	Low	65.6	Low	76 Å²	76	73.1 Å²	73.1	40%	0.398	37%	0.365	S	S	.	.	H	α-helix	trans	-64.5	-45.3	175.8	-79.1	172.2	0	0	0	112.2	L90 V155 V156 I157 V161 F162 M163	L90-L159 HydrophobicContact CD1-CD2 3.94Å; L90-L159 HydrophobicContact CD1-CG 4.35Å; V155-L159 HydrophobicContact CG1-CD1 3.68Å; V155-L159 HydrophobicContact CG1-CG 4.2Å; V155-L159 VanDerWaalsContact O-CB 3.31Å; V155-L159 WeakPolarHBondContact O-CB 3.32Å; V155-L159 VanDerWaalsContact O-CG 3.32Å; V155-L159 WeakPolarHBondContact O-CG 3.39Å; V155-L159 PolarHBondContact O-N 2.82Å; V156-L159 PolarHBondContact O-N 3.45Å; I157-L159 VanDerWaalsContact C-N 3.32Å; I157-L159 PolarHBondContact O-N 3.17Å; L159-V161 VanDerWaalsContact C-N 3.33Å; L159-V161 PolarHBondContact O-N 2.83Å; L159-F162 WeakPolarHBondContact O-CB 3.4Å; L159-F162 PolarHBondContact O-N 3.31Å; L159-M163 WeakPolarHBondContact O-CG 3.41Å; L159-M163 PolarHBondContact O-N 2.93Å
160	R	64.2	Low	65.2	Low	177 Å²	177	75.4 Å²	75.4	67%	0.668	36%	0.363	S	S	*	.	H	α-helix	trans	-59.4	-45	176.6	-80.2	-172.2	179.7	-160.7	1.6	111.2	V156 I157 F162 M163 V164	V156-R160 HydrophobicContact CG1-CG 4.5Å; V156-R160 WeakPolarHBondContact O-CB 3.36Å; V156-R160 WeakPolarHBondContact O-CG 3.26Å; V156-R160 PolarHBondContact O-N 3.28Å; I157-R160 PolarHBondContact O-N 3.39Å; R160-F162 VanDerWaalsContact C-N 3.35Å; R160-M163 WeakPolarHBondContact O-CB 3.45Å; R160-M163 PolarHBondContact O-N 2.88Å; R160-V164 WeakPolarHBondContact O-CG2 3.48Å; R160-V164 PolarHBondContact O-N 2.84Å
161	V	61.8	Low	64.6	Low	32 Å²	32	76.5 Å²	76.5	19%	0.194	38%	0.377	C	S	.	.	H	α-helix	trans	-68.1	-37.6	177.3	179.3	0	0	0	0	111.4	N19 I157 V158 L159 M163 V164 L165	N19-V161 HydrophobicContact CB-CG1 4.01Å; N19-V161 HydrophobicContact CB-CG2 4.32Å; N19-V161 VanDerWaalsContact ND2-CG1 3.3Å; N19-V161 WeakPolarHBondContact ND2-CG1 3.21Å; I157-V161 WeakPolarHBondContact O-CG2 3.34Å; I157-V161 PolarHBondContact O-N 3.05Å; V158-V161 PolarHBondContact O-N 3.38Å; L159-V161 VanDerWaalsContact C-N 3.33Å; L159-V161 PolarHBondContact O-N 2.83Å; V161-M163 VanDerWaalsContact C-N 3.31Å; V161-M163 PolarHBondContact O-N 3.1Å; V161-V164 PolarHBondContact O-N 3.2Å; V161-L165 HydrophobicContact CG1-CD1 3.93Å; V161-L165 HydrophobicContact CG1-CG 4.12Å; V161-L165 WeakPolarHBondContact O-CB 3.26Å; V161-L165 VanDerWaalsContact O-CG 3.32Å; V161-L165 WeakPolarHBondContact O-CG 3.39Å; V161-L165 PolarHBondContact O-N 3.28Å
162	F	64.1	Low	64	Low	91 Å²	91	78.4 Å²	78.4	40%	0.399	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-41.9	173.5	-176.2	-97.2	0	0	0	111.7	V86 V158 L159 R160 L165 R166	V86-F162 HydrophobicContact CG1-CB 4.47Å; V86-F162 HydrophobicContact CG1-CD2 4.07Å; V158-F162 WeakPolarHBondContact O-CB 3.35Å; V158-F162 PolarHBondContact O-N 3.45Å; L159-F162 WeakPolarHBondContact O-CB 3.4Å; L159-F162 PolarHBondContact O-N 3.31Å; R160-F162 VanDerWaalsContact C-N 3.35Å; F162-L165 PolarHBondContact O-N 3.27Å; F162-R166 VanDerWaalsContact O-CB 3.26Å; F162-R166 WeakPolarHBondContact O-CB 3.42Å; F162-R166 PolarHBondContact O-N 3.44Å
163	M	65.6	Low	63.2	Low	110 Å²	110	81.1 Å²	81.1	54%	0.542	40%	0.397	S	S	.	.	H	α-helix	trans	-61.4	-49.3	173.5	-74.1	-179.9	49.5	0	0	111.6	L159 R160 V161 L165 R166 D167	L159-M163 WeakPolarHBondContact O-CG 3.41Å; L159-M163 PolarHBondContact O-N 2.93Å; R160-M163 WeakPolarHBondContact O-CB 3.45Å; R160-M163 PolarHBondContact O-N 2.88Å; V161-M163 VanDerWaalsContact C-N 3.31Å; V161-M163 PolarHBondContact O-N 3.1Å; M163-L165 VanDerWaalsContact C-N 3.34Å; M163-L165 PolarHBondContact O-N 2.84Å; M163-R166 WeakPolarHBondContact O-CB 3.18Å; M163-R166 PolarHBondContact O-N 2.85Å; M163-R166 VanDerWaalsContact O-N 3.09Å; M163-D167 WeakPolarHBondContact O-CB 3.23Å; M163-D167 VanDerWaalsContact O-CG 3.29Å; M163-D167 PolarHBondContact O-N 3.27Å
164	V	65.2	Low	62.5	Low	91 Å²	91	79.8 Å²	79.8	55%	0.552	40%	0.397	S	S	*	.	H	α-helix	trans	-59.7	-42.7	177.4	173	0	0	0	0	111.5	R160 V161 D167 A168	R160-V164 WeakPolarHBondContact O-CG2 3.48Å; R160-V164 PolarHBondContact O-N 2.84Å; V161-V164 PolarHBondContact O-N 3.2Å; V164-D167 PolarHBondContact O-N 3.07Å; V164-A168 VanDerWaalsContact O-CB 3.28Å; V164-A168 WeakPolarHBondContact O-CB 3.46Å; V164-A168 PolarHBondContact O-N 2.83Å
165	L	61.2	Low	61.7	Low	42 Å²	42	84.8 Å²	84.8	22%	0.22	42%	0.418	C	S	.	.	H	α-helix	trans	-67.2	-35.7	175.7	-73.5	173.7	0	0	0	112.3	L12 V161 F162 M163 R169	L12-L165 HydrophobicContact CD1-CD2 3.83Å; V161-L165 HydrophobicContact CG1-CD1 3.93Å; V161-L165 HydrophobicContact CG1-CG 4.12Å; V161-L165 WeakPolarHBondContact O-CB 3.26Å; V161-L165 VanDerWaalsContact O-CG 3.32Å; V161-L165 WeakPolarHBondContact O-CG 3.39Å; V161-L165 PolarHBondContact O-N 3.28Å; F162-L165 PolarHBondContact O-N 3.27Å; M163-L165 VanDerWaalsContact C-N 3.34Å; M163-L165 PolarHBondContact O-N 2.84Å; L165-R169 WeakPolarHBondContact O-CB 3.28Å; L165-R169 WeakPolarHBondContact O-CG 3.49Å; L165-R169 PolarHBondContact O-N 2.84Å
166	R	65.4	Low	60.3	Low	131 Å²	131	91.4 Å²	91.4	49%	0.494	44%	0.439	S	S	.	.	H	α-helix	trans	-65.3	-45	175.3	-169.9	-179	95.1	158.3	3.3	110.4	F162 M163 R169 K170	F162-R166 VanDerWaalsContact O-CB 3.26Å; F162-R166 WeakPolarHBondContact O-CB 3.42Å; F162-R166 PolarHBondContact O-N 3.44Å; M163-R166 WeakPolarHBondContact O-CB 3.18Å; M163-R166 PolarHBondContact O-N 2.85Å; M163-R166 VanDerWaalsContact O-N 3.09Å; R166-R169 PolarHBondContact O-N 3.29Å; R166-K170 WeakPolarHBondContact O-CG 3.37Å; R166-K170 PolarHBondContact O-N 3.22Å
167	D	64.5	Low	59.2	Low	79 Å²	79	94 Å²	94	42%	0.422	45%	0.449	S	S	.	.	H	α-helix	trans	-70.4	-39	-179.4	-65.2	-20	0	0	0	110.8	M163 V164 R169 K170 A171	M163-D167 WeakPolarHBondContact O-CB 3.23Å; M163-D167 VanDerWaalsContact O-CG 3.29Å; M163-D167 PolarHBondContact O-N 3.27Å; V164-D167 PolarHBondContact O-N 3.07Å; D167-R169 VanDerWaalsContact C-N 3.34Å; D167-R169 PolarHBondContact O-N 2.83Å; D167-K170 PolarHBondContact O-N 3.43Å; D167-A171 WeakPolarHBondContact O-CB 3.35Å; D167-A171 PolarHBondContact O-N 3.41Å
168	A	60.6	Low	58.2	Low	39 Å²	39	94.8 Å²	94.8	32%	0.322	46%	0.462	S	S	.	.	H	α-helix	trans	-61.9	-38.8	170.5	0	0	0	0	0	112.5	L12 V164 A172	L12-A168 HydrophobicContact CD1-CB 4.42Å; V164-A168 VanDerWaalsContact O-CB 3.28Å; V164-A168 WeakPolarHBondContact O-CB 3.46Å; V164-A168 PolarHBondContact O-N 2.83Å; A168-A172 VanDerWaalsContact O-CB 3.26Å; A168-A172 WeakPolarHBondContact O-CB 3.41Å; A168-A172 PolarHBondContact O-N 3.09Å
169	R	59.5	Low	57.2	Low	200 Å²	200	97.9 Å²	97.9	76%	0.755	48%	0.481	S	S	*	.	H	α-helix	trans	-67.5	-39.4	173.5	-82.4	-175.7	179.8	-179	0.5	112.5	L165 R166 D167 K173	L165-R169 WeakPolarHBondContact O-CB 3.28Å; L165-R169 WeakPolarHBondContact O-CG 3.49Å; L165-R169 PolarHBondContact O-N 2.84Å; R166-R169 PolarHBondContact O-N 3.29Å; D167-R169 VanDerWaalsContact C-N 3.34Å; D167-R169 PolarHBondContact O-N 2.83Å; R169-K173 WeakPolarHBondContact O-CB 3.33Å; R169-K173 PolarHBondContact O-N 3.44Å
170	K	59.9	Low	56.1	Low	106 Å²	106	98.4 Å²	98.4	46%	0.461	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-46.7	174.3	-75.9	-178	177.3	-172.7	0	110.8	R166 D167 A172 K173 N174	R166-K170 WeakPolarHBondContact O-CG 3.37Å; R166-K170 PolarHBondContact O-N 3.22Å; D167-K170 PolarHBondContact O-N 3.43Å; K170-A172 VanDerWaalsContact C-N 3.35Å; K170-A172 PolarHBondContact O-N 2.81Å; K170-K173 PolarHBondContact O-N 3.38Å; K170-N174 WeakPolarHBondContact O-CB 3.44Å; K170-N174 PolarHBondContact O-N 3.28Å; K170-N174 PolarHBondContact O-OD1 3.22Å
171	A	57.2	Low	55.2	Low	59 Å²	59	94.2 Å²	94.2	49%	0.488	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-44.4	175.9	0	0	0	0	0	111.4	D167 N174 F175	D167-A171 WeakPolarHBondContact O-CB 3.35Å; D167-A171 PolarHBondContact O-N 3.41Å; A171-N174 PolarHBondContact O-N 2.89Å; A171-F175 WeakPolarHBondContact O-CB 3.45Å; A171-F175 PolarHBondContact O-N 3.46Å
172	A	55.6	Low	54.5	Low	40 Å²	40	93.9 Å²	93.9	33%	0.331	48%	0.483	S	S	.	.	H	α-helix	trans	-62.2	-47.6	173.8	0	0	0	0	0	111.3	A168 K170 N174 F175 W176	A168-A172 VanDerWaalsContact O-CB 3.26Å; A168-A172 WeakPolarHBondContact O-CB 3.41Å; A168-A172 PolarHBondContact O-N 3.09Å; K170-A172 VanDerWaalsContact C-N 3.35Å; K170-A172 PolarHBondContact O-N 2.81Å; A172-N174 VanDerWaalsContact C-N 3.27Å; A172-N174 PolarHBondContact O-N 2.83Å; A172-F175 CarbonylContact O-C 3.57Å; A172-F175 WeakPolarHBondContact O-CB 3.45Å; A172-F175 PolarHBondContact O-N 2.63Å; A172-F175 VanDerWaalsContact O-N 3.11Å; A172-W176 WeakPolarHBondContact O-CB 3.48Å; A172-W176 PolarHBondContact O-N 2.78Å
173	K	50.8	Low	53.8	Low	134 Å²	134	94.5 Å²	94.5	58%	0.583	50%	0.496	S	S	*	.	H	α-helix	trans	-59.2	-40.6	178.4	-164.7	-174.7	-177	-171.6	0	111.3	R169 K170 M177	R169-K173 WeakPolarHBondContact O-CB 3.33Å; R169-K173 PolarHBondContact O-N 3.44Å; K170-K173 PolarHBondContact O-N 3.38Å; K173-M177 HydrophobicContact CD-CE 4.03Å; K173-M177 VanDerWaalsContact CE-CE 3.5Å; K173-M177 HydrophobicContact CG-CE 3.99Å; K173-M177 WeakPolarHBondContact O-CB 3.33Å; K173-M177 VanDerWaalsContact O-CG 3.3Å; K173-M177 WeakPolarHBondContact O-CG 3.44Å; K173-M177 PolarHBondContact O-N 2.81Å
174	N	55.2	Low	53.2	Low	106 Å²	106	92 Å²	92	57%	0.567	49%	0.489	S	S	*	.	H	α-helix	trans	-66.7	-41.7	175.3	-65.9	-3.1	0	0	0	111.4	K170 A171 A172 M177 A178	K170-N174 WeakPolarHBondContact O-CB 3.44Å; K170-N174 PolarHBondContact O-N 3.28Å; K170-N174 PolarHBondContact O-OD1 3.22Å; A171-N174 PolarHBondContact O-N 2.89Å; A172-N174 VanDerWaalsContact C-N 3.27Å; A172-N174 PolarHBondContact O-N 2.83Å; N174-M177 PolarHBondContact O-N 3.33Å; N174-A178 PolarHBondContact O-N 2.92Å
175	F	49.7	Very low	52.4	Low	120 Å²	120	92.2 Å²	92.2	53%	0.526	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-46.7	175	-177.7	-94.5	0	0	0	111.7	A171 A172 M177 A178 T179	A171-F175 WeakPolarHBondContact O-CB 3.45Å; A171-F175 PolarHBondContact O-N 3.46Å; A172-F175 CarbonylContact O-C 3.57Å; A172-F175 WeakPolarHBondContact O-CB 3.45Å; A172-F175 PolarHBondContact O-N 2.63Å; A172-F175 VanDerWaalsContact O-N 3.11Å; F175-M177 VanDerWaalsContact C-N 3.34Å; F175-M177 PolarHBondContact O-N 2.76Å; F175-A178 CarbonylContact O-C 3.59Å; F175-A178 WeakPolarHBondContact O-CA 3.45Å; F175-A178 WeakPolarHBondContact O-CB 3.38Å; F175-A178 PolarHBondContact O-N 2.99Å; F175-T179 WeakPolarHBondContact CD1-OG1 3.4Å; F175-T179 HydrophobicContact CE1-CG2 3.88Å; F175-T179 WeakPolarHBondContact CE1-OG1 3.39Å; F175-T179 HydrophobicContact CZ-CG2 3.87Å; F175-T179 PolarHBondContact O-N 3.48Å; F175-T179 PolarHBondContact O-OG1 3.37Å
176	W	40.2	Very low	51.7	Low	172 Å²	172	93.2 Å²	93.2	65%	0.652	50%	0.5	S	S	*	.	H	α-helix	trans	-64	-36.6	175.8	-77.1	103.9	0	0	0	111.9	A172 A178 T179 V180	A172-W176 WeakPolarHBondContact O-CB 3.48Å; A172-W176 PolarHBondContact O-N 2.78Å; W176-A178 PolarHBondContact O-N 3.11Å; W176-T179 WeakPolarHBondContact CA-OG1 3.3Å; W176-T179 PolarHBondContact O-N 3.47Å; W176-V180 HydrophobicContact CE3-CG2 4.5Å; W176-V180 WeakPolarHBondContact O-CB 3.46Å; W176-V180 WeakPolarHBondContact O-CG2 3.47Å; W176-V180 PolarHBondContact O-N 3.29Å
177	M	44.9	Very low	51.2	Low	117 Å²	117	95.9 Å²	95.9	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-64.5	-29.8	170	-75	-167.1	-158.1	0	0	112.3	K173 N174 F175	K173-M177 HydrophobicContact CD-CE 4.03Å; K173-M177 VanDerWaalsContact CE-CE 3.5Å; K173-M177 HydrophobicContact CG-CE 3.99Å; K173-M177 WeakPolarHBondContact O-CB 3.33Å; K173-M177 VanDerWaalsContact O-CG 3.3Å; K173-M177 WeakPolarHBondContact O-CG 3.44Å; K173-M177 PolarHBondContact O-N 2.81Å; N174-M177 PolarHBondContact O-N 3.33Å; F175-M177 VanDerWaalsContact C-N 3.34Å; F175-M177 PolarHBondContact O-N 2.76Å
178	A	47.5	Very low	50.2	Low	61 Å²	61	94.9 Å²	94.9	50%	0.504	52%	0.521	S	S	.	.	H	α-helix	trans	-81.9	-27.2	174.2	0	0	0	0	0	113.6	N174 F175 W176	N174-A178 PolarHBondContact O-N 2.92Å; F175-A178 CarbonylContact O-C 3.59Å; F175-A178 WeakPolarHBondContact O-CA 3.45Å; F175-A178 WeakPolarHBondContact O-CB 3.38Å; F175-A178 PolarHBondContact O-N 2.99Å; W176-A178 PolarHBondContact O-N 3.11Å
179	T	45	Very low	49.6	Very low	73 Å²	73	100.7 Å²	100.7	45%	0.448	55%	0.552	S	S	.	*	H	α-helix	trans	-96.6	-18.9	-177.7	19.3	0	0	0	0	114.7	F175 W176 P181	F175-T179 WeakPolarHBondContact CD1-OG1 3.4Å; F175-T179 HydrophobicContact CE1-CG2 3.88Å; F175-T179 WeakPolarHBondContact CE1-OG1 3.39Å; F175-T179 HydrophobicContact CZ-CG2 3.87Å; F175-T179 PolarHBondContact O-N 3.48Å; F175-T179 PolarHBondContact O-OG1 3.37Å; W176-T179 WeakPolarHBondContact CA-OG1 3.3Å; W176-T179 PolarHBondContact O-N 3.47Å; T179-P181 WeakPolarHBondContact O-CD 3.11Å
180	V	41	Very low	49.2	Very low	86 Å²	86	95.2 Å²	95.2	52%	0.521	56%	0.557	S	S	.	*	S	Bend	trans	-76.2	107	169	177.4	0	0	0	0	105.9	W176 A182	W176-V180 HydrophobicContact CE3-CG2 4.5Å; W176-V180 WeakPolarHBondContact O-CB 3.46Å; W176-V180 WeakPolarHBondContact O-CG2 3.47Å; W176-V180 PolarHBondContact O-N 3.29Å; V180-A182 PolarHBondContact O-N 2.87Å; V180-A182 VanDerWaalsContact O-N 3.09Å
181	P	44.4	Very low	48.5	Very low	89 Å²	89	92.2 Å²	92.2	58%	0.578	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-57.8	124	173.7	25	-32	0	0	0	106.9	T179 Y195	T179-P181 WeakPolarHBondContact O-CD 3.11Å; P181-Y195 HydrophobicContact CB-CD1 4.26Å; P181-Y195 HydrophobicContact CB-CE1 4.35Å
182	A	46.9	Very low	48	Very low	25 Å²	25	95.4 Å²	95.4	21%	0.207	57%	0.566	C	S	.	*	P	Polyproline II helix	trans	-49.5	138.8	173.1	0	0	0	0	0	108.3	V180 P196	V180-A182 PolarHBondContact O-N 2.87Å; V180-A182 VanDerWaalsContact O-N 3.09Å; A182-P196 HydrophobicContact CB-CG 3.85Å
183	P	49.8	Very low	47.6	Very low	104 Å²	104	96.3 Å²	96.3	68%	0.675	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-53.1	137.5	179	21.6	-31.4	0	0	0	108.9	V185	P183-V185 PolarHBondContact O-N 2.86Å
184	P	52.8	Low	47.6	Very low	59 Å²	59	93.9 Å²	93.9	38%	0.383	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-55.2	125.7	-175.7	20.3	-31.3	0	0	0	109.9	C186 C193	P184-C186 PolarHBondContact O-N 2.88Å; P184-C193 HydrophobicContact CB-CB 3.59Å
185	V	49.5	Very low	47.2	Very low	95 Å²	95	96.1 Å²	96.1	58%	0.576	57%	0.57	S	S	*	*	B	Isolated β-bridge	trans	-81.9	101.3	175.6	-176.3	0	0	0	0	106.7	P183	P183-V185 PolarHBondContact O-N 2.86Å
186	C	44.8	Very low	47	Very low	63 Å²	63	93.3 Å²	93.3	43%	0.426	56%	0.564	S	S	.	*			trans	-87.9	116.6	173	-46.6	0	0	0	0	107.6	P184 A188 C193	P184-C186 PolarHBondContact O-N 2.88Å; C186-A188 PolarHBondContact O-N 3.42Å; C186-C193 HydrophobicContact CB-CB 4.08Å; C186-C193 WeakPolarHBondContact CB-SG 3.29Å; C186-C193 WeakPolarHBondContact SG-CB 3.07Å; C186-C193 CovalentContact SG-SG 2.05Å; C186-C193 PolarHBondContact SG-SG 3.35Å
187	Q	54.9	Low	47.2	Very low	186 Å²	186	92.8 Å²	92.8	87%	0.869	57%	0.572	S	S	*	*	S	Bend	trans	-68.9	-17.4	-179.5	-79.8	-176	-15.7	0	0	113.1
188	A	43.7	Very low	47	Very low	59 Å²	59	94.7 Å²	94.7	49%	0.488	57%	0.574	S	S	.	*	S	Bend	trans	-164.1	162.1	170.8	0	0	0	0	0	111.7	C186 G190 S191	C186-A188 PolarHBondContact O-N 3.42Å; A188-G190 PolarHBondContact O-N 2.88Å; A188-G190 VanDerWaalsContact O-N 3.12Å; A188-S191 PolarHBondContact N-OG 3.46Å; A188-S191 VanDerWaalsContact N-OG 3.14Å; A188-S191 PolarHBondContact O-N 2.99Å; A188-S191 PolarHBondContact O-OG 3.33Å; A188-S191 VanDerWaalsContact O-OG 3.06Å
189	V	48.3	Very low	46.3	Very low	161 Å²	161	100.3 Å²	100.3	98%	0.976	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	111.1	171.8	-179.9	0	0	0	0	108.8
190	G	50.8	Low	45.9	Very low	84 Å²	84	105.3 Å²	105.3	87%	0.866	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.2	-3.9	179.7	0	0	0	0	0	115.9	A188	A188-G190 PolarHBondContact O-N 2.88Å; A188-G190 VanDerWaalsContact O-N 3.12Å
191	S	45.5	Very low	45.6	Very low	44 Å²	44	107.5 Å²	107.5	31%	0.308	61%	0.608	S	S	.	*	S	Bend	trans	-95.4	148.5	171.8	56	0	0	0	0	112.2	A188 C193	A188-S191 PolarHBondContact N-OG 3.46Å; A188-S191 VanDerWaalsContact N-OG 3.14Å; A188-S191 PolarHBondContact O-N 2.99Å; A188-S191 PolarHBondContact O-OG 3.33Å; A188-S191 VanDerWaalsContact O-OG 3.06Å; S191-C193 PolarHBondContact O-N 3.09Å
192	P	46.4	Very low	45.2	Very low	126 Å²	126	111.1 Å²	111.1	82%	0.818	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-64.8	127.5	180	25.3	-32.6	0	0	0	110.2
193	C	46.8	Very low	44.7	Very low	58 Å²	58	117.3 Å²	117.3	39%	0.392	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-80.9	134.6	-178.3	-41.8	0	0	0	0	110.6	P184 C186 S191	P184-C193 HydrophobicContact CB-CB 3.59Å; C186-C193 HydrophobicContact CB-CB 4.08Å; C186-C193 WeakPolarHBondContact CB-SG 3.29Å; C186-C193 WeakPolarHBondContact SG-CB 3.07Å; C186-C193 CovalentContact SG-SG 2.05Å; C186-C193 PolarHBondContact SG-SG 3.35Å; S191-C193 PolarHBondContact O-N 3.09Å
194	S	50.8	Low	43.7	Very low	83 Å²	83	117.6 Å²	117.6	58%	0.58	65%	0.649	S	S	*	*	B	Isolated β-bridge	trans	-99.8	138.2	176.7	52.3	0	0	0	0	110.8
195	Y	47.3	Very low	42.6	Very low	153 Å²	153	120.5 Å²	120.5	60%	0.6	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-81.5	127.4	167.1	-69.7	-85.6	0	0	0	108.3	P181 I197	P181-Y195 HydrophobicContact CB-CD1 4.26Å; P181-Y195 HydrophobicContact CB-CE1 4.35Å; Y195-I197 PolarHBondContact O-N 3.18Å; Y195-I197 VanDerWaalsContact O-N 3.08Å
196	P	46.4	Very low	41.8	Very low	61 Å²	61	122.4 Å²	122.4	40%	0.396	68%	0.683	S	S	.	*			trans	-66.8	111.9	170	26.1	-30.3	0	0	0	108.7	A182 Y198	A182-P196 HydrophobicContact CB-CG 3.85Å; P196-Y198 PolarHBondContact O-N 2.05Å
197	I	44.4	Very low	41.1	Very low	162 Å²	162	125.6 Å²	125.6	83%	0.831	71%	0.705	S	S	*	*			trans	-71.6	107.4	170.1	-59.9	169	0	0	0	106.3	Y195 K199	Y195-I197 PolarHBondContact O-N 3.18Å; Y195-I197 VanDerWaalsContact O-N 3.08Å; I197-K199 PolarHBondContact O-N 3.22Å; I197-K199 VanDerWaalsContact O-N 3.09Å
198	Y	40.5	Very low	39.8	Very low	156 Å²	156	119.3 Å²	119.3	61%	0.612	69%	0.69	S	S	*	*			trans	-66.2	110.4	169	-74	-82.4	0	0	0	108.1	P196 Y200	P196-Y198 PolarHBondContact O-N 2.05Å; Y198-Y200 PolarHBondContact O-N 2.78Å
199	K	32	Very low	39	Very low	179 Å²	179	122.5 Å²	122.5	78%	0.778	71%	0.71	S	S	*	*			trans	-62	118.2	169.6	-134.8	177.8	-177.2	-176.1	0	107	I197 D201	I197-K199 PolarHBondContact O-N 3.22Å; I197-K199 VanDerWaalsContact O-N 3.09Å; K199-D201 VanDerWaalsContact C-N 3.32Å; K199-D201 PolarHBondContact O-N 3.3Å
200	Y	36.5	Very low	38.3	Very low	179 Å²	179	124.3 Å²	124.3	70%	0.702	71%	0.705	S	S	*	*			trans	-68.2	97.3	162.2	-88.2	-92.7	0	0	0	106.6	Y198 D202	Y198-Y200 PolarHBondContact O-N 2.78Å; Y200-D202 PolarHBondContact O-N 2.9Å
201	D	35.7	Very low	37.2	Very low	132 Å²	132	128.7 Å²	128.7	71%	0.706	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	129.3	157.5	-68.3	-35.8	0	0	0	105.8	K199	K199-D201 VanDerWaalsContact C-N 3.32Å; K199-D201 PolarHBondContact O-N 3.3Å
202	D	36.5	Very low	36.5	Very low	164 Å²	164	134 Å²	134	88%	0.877	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	97	23.4	-177.7	-46.6	-28	0	0	0	118.4	Y200	Y200-D202 PolarHBondContact O-N 2.9Å
203	Q	34.5	Very low	35.8	Very low	156 Å²	156	133.6 Å²	133.6	73%	0.729	73%	0.725	S	S	*	*			trans	-110.6	107.2	158.4	-150.6	166.8	2	0	0	111.1	S205	Q203-S205 PolarHBondContact O-N 2.75Å
204	P	30.2	Very low	34.9	Very low	109 Å²	109	133.5 Å²	133.5	71%	0.708	73%	0.734	S	S	*	*			trans	-61.6	126.8	179.2	22.7	-30.2	0	0	0	109.3	T206	P204-T206 VanDerWaalsContact C-N 3.32Å; P204-T206 PolarHBondContact O-N 3.25Å; P204-T206 PolarHBondContact O-OG1 3.2Å
205	S	30	Very low	33.9	Very low	121 Å²	121	136.7 Å²	136.7	85%	0.846	74%	0.743	S	S	*	*			trans	-52.4	89.6	178.7	45.5	0	0	0	0	111	Q203 S207	Q203-S205 PolarHBondContact O-N 2.75Å; S205-S207 PolarHBondContact O-N 3.08Å
206	T	31.3	Very low	33.3	Very low	135 Å²	135	137.6 Å²	137.6	83%	0.828	76%	0.758	S	S	*	*			trans	-87.2	97.7	158	21.3	0	0	0	0	105.7	P204 G208	P204-T206 VanDerWaalsContact C-N 3.32Å; P204-T206 PolarHBondContact O-N 3.25Å; P204-T206 PolarHBondContact O-OG1 3.2Å; T206-G208 PolarHBondContact O-N 3.35Å
207	S	31.4	Very low	32.7	Very low	129 Å²	129	144.5 Å²	144.5	90%	0.902	78%	0.776	S	S	*	*			trans	-60.2	80.9	166.8	53.1	0	0	0	0	109.3	S205	S205-S207 PolarHBondContact O-N 3.08Å
208	G	26.7	Very low	32.4	Very low	54 Å²	54	142.3 Å²	142.3	56%	0.557	78%	0.775	S	S	*	*			trans	-110.4	129.6	162.7	0	0	0	0	0	107.9	T206 F210	T206-G208 PolarHBondContact O-N 3.35Å; G208-F210 VanDerWaalsContact C-N 3.3Å; G208-F210 PolarHBondContact O-N 3.06Å
209	S	27.8	Very low	32.1	Very low	127 Å²	127	139.5 Å²	139.5	89%	0.888	77%	0.769	S	S	*	*			trans	-61	92.9	169.3	54.1	0	0	0	0	108.7	E211	S209-E211 PolarHBondContact O-N 3.14Å
210	F	33.6	Very low	32.2	Very low	199 Å²	199	134.8 Å²	134.8	87%	0.873	76%	0.757	S	S	*	*			trans	-77.5	115.9	169.1	-122.8	-94	0	0	0	107	G208 D212	G208-F210 VanDerWaalsContact C-N 3.3Å; G208-F210 PolarHBondContact O-N 3.06Å; F210-D212 PolarHBondContact O-N 3.26Å
211	E	26.1	Very low	32.6	Very low	175 Å²	175	134.9 Å²	134.9	82%	0.818	76%	0.757	S	S	*	*			trans	-48.6	125.8	172.3	-68.6	178.2	118.1	0	0	109.7	S209 P213	S209-E211 PolarHBondContact O-N 3.14Å; E211-P213 WeakPolarHBondContact O-CD 3.11Å; E211-P213 VanDerWaalsContact O-N 3.12Å
212	D	31.3	Very low	32.8	Very low	157 Å²	157	132.9 Å²	132.9	84%	0.84	75%	0.754	S	S	*	*			trans	-47.4	112.6	169.8	-89.7	-47.6	0	0	0	110.2	F210 G214	F210-D212 PolarHBondContact O-N 3.26Å; D212-G214 PolarHBondContact O-N 3.12Å
213	P	31.9	Very low	32.8	Very low	117 Å²	117	130.7 Å²	130.7	76%	0.76	74%	0.739	S	S	*	*			trans	-80	49.3	155.4	15.6	4.4	0	0	0	107.7	E211 L215	E211-P213 WeakPolarHBondContact O-CD 3.11Å; E211-P213 VanDerWaalsContact O-N 3.12Å; P213-L215 PolarHBondContact O-N 3Å
214	G	29.3	Very low	33.4	Very low	56 Å²	56	125.8 Å²	125.8	58%	0.577	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	64.4	177.9	0	0	0	0	0	110.4	D212	D212-G214 PolarHBondContact O-N 3.12Å
215	L	29.5	Very low	33.7	Very low	150 Å²	150	127.7 Å²	127.7	79%	0.785	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.5	41	158.4	-113.7	134.3	0	0	0	113.1	P213 R217	P213-L215 PolarHBondContact O-N 3Å; L215-R217 HydrophobicContact CD2-CG 4.36Å; L215-R217 PolarHBondContact O-N 3.26Å
216	L	34.6	Very low	34	Very low	171 Å²	171	125.4 Å²	125.4	90%	0.895	70%	0.702	S	S	*	*			trans	-69.6	87.8	151.4	-84	161.2	0	0	0	107	S218	L216-S218 PolarHBondContact O-N 3.04Å
217	R	33.9	Very low	34.6	Very low	206 Å²	206	127.4 Å²	127.4	78%	0.777	70%	0.7	S	S	*	*			trans	-33.8	124.4	174.5	-78.1	178.4	171.6	-178.6	-2.9	109.8	L215 I219	L215-R217 HydrophobicContact CD2-CG 4.36Å; L215-R217 PolarHBondContact O-N 3.26Å; R217-I219 HydrophobicContact CB-CG1 4.34Å; R217-I219 PolarHBondContact O-N 3.09Å
218	S	37.1	Very low	35.3	Very low	117 Å²	117	127 Å²	127	82%	0.818	69%	0.692	S	S	*	*			trans	-60.2	83.7	160.5	53.7	0	0	0	0	108.2	L216 P220	L216-S218 PolarHBondContact O-N 3.04Å; S218-P220 VanDerWaalsContact O-CD 3.29Å; S218-P220 WeakPolarHBondContact O-CD 3.16Å
219	I	34.9	Very low	35.8	Very low	96 Å²	96	130.1 Å²	130.1	49%	0.492	70%	0.699	S	S	.	*			trans	-69	116	166.7	-62.7	173.6	0	0	0	104.9	R217 Y221 E223	R217-I219 HydrophobicContact CB-CG1 4.34Å; R217-I219 PolarHBondContact O-N 3.09Å; I219-Y221 PolarHBondContact O-N 3.42Å; I219-E223 HydrophobicContact CG2-CB 3.38Å; I219-E223 HydrophobicContact CG2-CG 4.45Å; I219-E223 WeakPolarHBondContact CG2-OE2 3.11Å
220	P	34	Very low	36.4	Very low	80 Å²	80	136.2 Å²	136.2	52%	0.519	71%	0.71	S	S	.	*			trans	-57.4	141.2	174.8	22.8	-30.4	0	0	0	109.4	S218 S222 E223	S218-P220 VanDerWaalsContact O-CD 3.29Å; S218-P220 WeakPolarHBondContact O-CD 3.16Å; P220-S222 PolarHBondContact O-N 2.97Å; P220-E223 PolarHBondContact O-N 3.3Å
221	Y	43.5	Very low	36.5	Very low	181 Å²	181	133.1 Å²	133.1	71%	0.71	70%	0.702	S	S	*	*	H	α-helix	trans	-50.8	-24.7	-169.6	-146.5	-97.8	0	0	0	114.4	I219 E223 Y225	I219-Y221 PolarHBondContact O-N 3.42Å; Y221-E223 PolarHBondContact O-N 3.47Å; Y221-Y225 AromaticContact CD1-CD2 3.91Å; Y221-Y225 HydrophobicContact CD1-CD2 3.91Å; Y221-Y225 HydrophobicContact CD1-CE2 4.15Å; Y221-Y225 AromaticContact CE1-CD2 3.65Å; Y221-Y225 HydrophobicContact CE1-CD2 3.65Å; Y221-Y225 AromaticContact CE1-CE2 3.41Å; Y221-Y225 HydrophobicContact CE1-CE2 3.41Å; Y221-Y225 VanDerWaalsContact CE1-CE2 3.41Å; Y221-Y225 PolarHBondContact O-N 2.77Å
222	S	40.2	Very low	37.1	Very low	91 Å²	91	130.8 Å²	130.8	64%	0.636	70%	0.696	S	S	*	*	H	α-helix	trans	-62.8	-34	175.7	53.8	0	0	0	0	113.9	P220	P220-S222 PolarHBondContact O-N 2.97Å
223	E	37.8	Very low	37.4	Very low	118 Å²	118	129.4 Å²	129.4	55%	0.551	69%	0.688	S	S	*	*	H	α-helix	trans	-80.7	-35.5	179.8	-87.5	-173.9	171.8	0	0	112.3	I219 P220 Y221 Y225 S226	I219-E223 HydrophobicContact CG2-CB 3.38Å; I219-E223 HydrophobicContact CG2-CG 4.45Å; I219-E223 WeakPolarHBondContact CG2-OE2 3.11Å; P220-E223 PolarHBondContact O-N 3.3Å; Y221-E223 PolarHBondContact O-N 3.47Å; E223-Y225 VanDerWaalsContact C-N 3.33Å; E223-Y225 PolarHBondContact O-N 3.24Å; E223-S226 PolarHBondContact O-N 3.41Å; E223-S226 PolarHBondContact O-OG 2.86Å
224	A	46.7	Very low	37.7	Very low	52 Å²	52	130.1 Å²	130.1	43%	0.43	68%	0.683	S	S	.	*	H	α-helix	trans	-65	-36.5	179.1	0	0	0	0	0	112.2
225	Y	36	Very low	38.3	Very low	150 Å²	150	134.8 Å²	134.8	59%	0.588	69%	0.69	S	S	*	*	H	α-helix	trans	-72.6	-30.7	176.7	-105.9	-95.6	0	0	0	113.3	Y221 E223 K227 V228	Y221-Y225 AromaticContact CD1-CD2 3.91Å; Y221-Y225 HydrophobicContact CD1-CD2 3.91Å; Y221-Y225 HydrophobicContact CD1-CE2 4.15Å; Y221-Y225 AromaticContact CE1-CD2 3.65Å; Y221-Y225 HydrophobicContact CE1-CD2 3.65Å; Y221-Y225 AromaticContact CE1-CE2 3.41Å; Y221-Y225 HydrophobicContact CE1-CE2 3.41Å; Y221-Y225 VanDerWaalsContact CE1-CE2 3.41Å; Y221-Y225 PolarHBondContact O-N 2.77Å; E223-Y225 VanDerWaalsContact C-N 3.33Å; E223-Y225 PolarHBondContact O-N 3.24Å; Y225-K227 PolarHBondContact O-N 2.82Å; Y225-V228 PolarHBondContact O-N 3.43Å
226	S	36.6	Very low	38.8	Very low	72 Å²	72	133.7 Å²	133.7	50%	0.503	68%	0.684	S	S	.	*	H	α-helix	trans	-66.2	-25	-178.8	77	0	0	0	0	113.9	E223	E223-S226 PolarHBondContact O-N 3.41Å; E223-S226 PolarHBondContact O-OG 2.86Å
227	K	42.8	Very low	39.1	Very low	178 Å²	178	131.1 Å²	131.1	77%	0.774	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-10.5	179.7	-76.3	-172.5	177.5	179.1	0	114.5	Y225	Y225-K227 PolarHBondContact O-N 2.82Å
228	V	46.6	Very low	39.5	Very low	121 Å²	121	125.3 Å²	125.3	73%	0.733	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-15.4	179.4	-173.2	0	0	0	0	111.7	Y225	Y225-V228 PolarHBondContact O-N 3.43Å
229	V	37.5	Very low	39.7	Very low	118 Å²	118	126 Å²	126	72%	0.715	65%	0.647	S	S	*	*			trans	-114.2	35	-177.8	-161.2	0	0	0	0	112.6
230	K	40.2	Very low	40.2	Very low	255 Å²	255	128.7 Å²	128.7	100%	1.109	66%	0.661	S	S	*	*			trans	-136.9	0	158.2	-81.5	-171.5	177.7	179.1	0	108.9

Retrieved 230 of 230 residues in 149.1 ms (Link to these results)

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