A0A061IBU7_CRIGR Loading...

Calcium homeostasis modulator 3

AlphaFold DB , UniProt , Accession A0A061IBU7, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Calhm3, Length 341 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	45.1	Very low	41.9	Very low	194 Å²	194	136.3 Å²	136.3	96%	0.956	63%	0.627	S	S	*	*				0	-37.3	0	-72.2	-85.1	-92.1	0	0	111.4	F4 R5	M1-F4 PolarHBondContact O-N 3.32Å; M1-R5 PolarHBondContact O-N 3.04Å
2	D	39.7	Very low	41.5	Very low	114 Å²	114	136.2 Å²	136.2	61%	0.61	63%	0.628	S	S	*	*	H	α-helix	trans	-76.1	-26.6	-173.5	-48.1	-60.6	0	0	0	115.4	R5 M6	D2-R5 WeakPolarHBondContact O-CB 3.01Å; D2-R5 PolarHBondContact O-N 2.89Å; D2-M6 PolarHBondContact O-N 3.04Å
3	R	40.2	Very low	41.2	Very low	214 Å²	214	133 Å²	133	81%	0.808	63%	0.631	S	S	*	*	H	α-helix	trans	-67.4	-36.7	173	-65.2	-170.1	-170.6	179.4	3.3	112.8	R5 L7	R3-R5 VanDerWaalsContact C-N 3.32Å; R3-L7 WeakPolarHBondContact O-CG 3.46Å; R3-L7 PolarHBondContact O-N 2.9Å
4	F	43.3	Very low	41.5	Very low	158 Å²	158	126.3 Å²	126.3	69%	0.693	61%	0.605	S	S	*	*	H	α-helix	trans	-69	-35.1	172.7	-82.1	-80.9	0	0	0	111.4	M1 L7 F8	M1-F4 PolarHBondContact O-N 3.32Å; F4-L7 PolarHBondContact O-N 3.22Å; F4-F8 WeakPolarHBondContact O-CB 3.18Å; F4-F8 PolarHBondContact O-N 2.78Å
5	R	43.5	Very low	41.8	Very low	169 Å²	169	120.1 Å²	120.1	64%	0.638	58%	0.58	S	S	*	*	H	α-helix	trans	-66.9	-40.2	176.5	-146.5	179.9	-102.4	-124.8	2.1	112	M1 D2 R3 F8 Q9	M1-R5 PolarHBondContact O-N 3.04Å; D2-R5 WeakPolarHBondContact O-CB 3.01Å; D2-R5 PolarHBondContact O-N 2.89Å; R3-R5 VanDerWaalsContact C-N 3.32Å; R5-F8 PolarHBondContact O-N 3.11Å; R5-Q9 WeakPolarHBondContact O-CB 3.19Å; R5-Q9 WeakPolarHBondContact O-CG 3.29Å; R5-Q9 PolarHBondContact O-N 3.44Å
6	M	41.8	Very low	42.3	Very low	112 Å²	112	114.7 Å²	114.7	55%	0.552	55%	0.554	S	S	*	*	H	α-helix	trans	-67.8	-38.9	172.5	-98.1	-168.3	-85.5	0	0	113.3	D2 F8 Q9 N10	D2-M6 PolarHBondContact O-N 3.04Å; M6-F8 VanDerWaalsContact C-N 3.35Å; M6-Q9 PolarHBondContact O-N 2.93Å; M6-N10 WeakPolarHBondContact O-CB 3.24Å; M6-N10 PolarHBondContact O-N 3.27Å
7	L	44.2	Very low	42.8	Very low	106 Å²	106	109.3 Å²	109.3	56%	0.555	53%	0.531	S	S	*	.	H	α-helix	trans	-64.8	-40.6	172.8	-72.1	171.1	0	0	0	111.1	R3 F4 L11	R3-L7 WeakPolarHBondContact O-CG 3.46Å; R3-L7 PolarHBondContact O-N 2.9Å; F4-L7 PolarHBondContact O-N 3.22Å; L7-L11 WeakPolarHBondContact O-CB 3.48Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 WeakPolarHBondContact O-CG 3.45Å; L7-L11 PolarHBondContact O-N 3.28Å
8	F	46	Very low	43.3	Very low	140 Å²	140	106.9 Å²	106.9	61%	0.614	52%	0.524	S	S	*	.	H	α-helix	trans	-64.3	-42.3	173	-109.1	-93.2	0	0	0	112.4	F4 R5 M6 L11 Q12	F4-F8 WeakPolarHBondContact O-CB 3.18Å; F4-F8 PolarHBondContact O-N 2.78Å; R5-F8 PolarHBondContact O-N 3.11Å; M6-F8 VanDerWaalsContact C-N 3.35Å; F8-L11 CarbonylContact O-C 3.56Å; F8-L11 WeakPolarHBondContact O-CA 3.5Å; F8-L11 WeakPolarHBondContact O-CB 3.29Å; F8-L11 PolarHBondContact O-N 2.91Å; F8-L11 VanDerWaalsContact O-N 3.15Å; F8-Q12 VanDerWaalsContact O-CB 3.24Å; F8-Q12 WeakPolarHBondContact O-CB 3Å; F8-Q12 PolarHBondContact O-N 2.83Å
9	Q	43	Very low	44	Very low	114 Å²	114	102.7 Å²	102.7	53%	0.533	50%	0.503	S	S	.	.	H	α-helix	trans	-67.4	-37.9	178.2	-80.3	172.7	-26.5	0	0	112.8	R5 M6 L11 Q12 S13	R5-Q9 WeakPolarHBondContact O-CB 3.19Å; R5-Q9 WeakPolarHBondContact O-CG 3.29Å; R5-Q9 PolarHBondContact O-N 3.44Å; M6-Q9 PolarHBondContact O-N 2.93Å; Q9-L11 VanDerWaalsContact C-N 3.29Å; Q9-Q12 PolarHBondContact O-N 3.35Å; Q9-Q12 VanDerWaalsContact O-N 3.1Å; Q9-S13 PolarHBondContact O-N 3.13Å
10	N	37.5	Very low	45.1	Very low	114 Å²	114	102.3 Å²	102.3	61%	0.61	50%	0.503	S	S	*	.	H	α-helix	trans	-71.2	-24.9	170.9	-80.7	-17.8	0	0	0	112.8	M6 Q12 S17	M6-N10 WeakPolarHBondContact O-CB 3.24Å; M6-N10 PolarHBondContact O-N 3.27Å; N10-Q12 VanDerWaalsContact C-N 3.28Å; N10-S17 PolarHBondContact O-OG 2.94Å
11	L	37	Very low	46.3	Very low	64 Å²	64	98.4 Å²	98.4	34%	0.335	49%	0.489	S	S	.	.	H	α-helix	trans	-74.9	-17.2	168.1	-75.3	164.7	0	0	0	113.1	L7 F8 Q9 S17 V18	L7-L11 WeakPolarHBondContact O-CB 3.48Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 WeakPolarHBondContact O-CG 3.45Å; L7-L11 PolarHBondContact O-N 3.28Å; F8-L11 CarbonylContact O-C 3.56Å; F8-L11 WeakPolarHBondContact O-CA 3.5Å; F8-L11 WeakPolarHBondContact O-CB 3.29Å; F8-L11 PolarHBondContact O-N 2.91Å; F8-L11 VanDerWaalsContact O-N 3.15Å; Q9-L11 VanDerWaalsContact C-N 3.29Å; L11-S17 VanDerWaalsContact CA-OG 3.23Å; L11-S17 WeakPolarHBondContact CA-OG 3.41Å; L11-S17 CarbonylContact O-C 3.46Å; L11-S17 VanDerWaalsContact O-CB 3.22Å; L11-S17 WeakPolarHBondContact O-CB 3.47Å; L11-S17 PolarHBondContact O-OG 3.49Å; L11-V18 WeakPolarHBondContact O-CA 3.39Å; L11-V18 WeakPolarHBondContact O-CG2 3.41Å; L11-V18 PolarHBondContact O-N 2.84Å
12	Q	37.2	Very low	47.5	Very low	135 Å²	135	92.1 Å²	92.1	63%	0.631	46%	0.459	S	S	*	.	H	α-helix	trans	-103.6	-12.7	-172.1	-159.8	167.5	8.4	0	0	113.6	F8 Q9 N10	F8-Q12 VanDerWaalsContact O-CB 3.24Å; F8-Q12 WeakPolarHBondContact O-CB 3Å; F8-Q12 PolarHBondContact O-N 2.83Å; Q9-Q12 PolarHBondContact O-N 3.35Å; Q9-Q12 VanDerWaalsContact O-N 3.1Å; N10-Q12 VanDerWaalsContact C-N 3.28Å
13	S	37.4	Very low	49.1	Very low	95 Å²	95	88.1 Å²	88.1	66%	0.664	44%	0.44	S	S	*	.	S	Bend	trans	-86.2	-11	-173.6	63.1	0	0	0	0	115.4	Q9	Q9-S13 PolarHBondContact O-N 3.13Å
14	S	45.3	Very low	50.8	Low	39 Å²	39	83.6 Å²	83.6	27%	0.273	43%	0.431	S	S	.	.	S	Bend	trans	-134	143.5	167.2	92.1	0	0	0	0	110.7	E16 S17 V18	S14-E16 PolarHBondContact O-N 3.28Å; S14-S17 WeakPolarHBondContact O-CA 3.01Å; S14-S17 WeakPolarHBondContact O-CB 3.27Å; S14-S17 PolarHBondContact O-N 3.49Å; S14-S17 WeakPolarHBondContact OG-CB 3.41Å; S14-S17 PolarHBondContact OG-N 3.27Å; S14-S17 VanDerWaalsContact OG-N 3.1Å; S14-V18 PolarHBondContact O-N 2.99Å
15	S	46.2	Very low	52.7	Low	34 Å²	34	81.5 Å²	81.5	24%	0.238	43%	0.426	C	S	.	.	H	α-helix	trans	-60.6	-30.4	175.4	53.8	0	0	0	0	112.9	S17 M19 D221	S15-S17 VanDerWaalsContact C-N 3.27Å; S15-S17 PolarHBondContact O-N 3.43Å; S15-M19 WeakPolarHBondContact O-CB 3.4Å; S15-M19 PolarHBondContact O-N 2.01Å; S15-D221 WeakPolarHBondContact CB-OD2 3.22Å; S15-D221 WeakPolarHBondContact OG-CB 3.49Å; S15-D221 PolarHBondContact OG-OD2 3.37Å
16	E	49.1	Very low	54.4	Low	33 Å²	33	75.4 Å²	75.4	15%	0.154	41%	0.406	C	S	.	.	H	α-helix	trans	-61.2	-35.9	167.8	-66	-165.5	147.5	0	0	111.9	S14 N20 R214 S217	S14-E16 PolarHBondContact O-N 3.28Å; E16-N20 VanDerWaalsContact O-CB 3.32Å; E16-N20 WeakPolarHBondContact O-CB 3.5Å; E16-N20 PolarHBondContact O-N 2.92Å; E16-N20 VanDerWaalsContact O-N 3.07Å; E16-N20 PolarHBondContact O-ND2 3.2Å; E16-N20 PolarHBondContact O-OD1 3Å; E16-R214 IonicContact OE2-CZ 3.02Å; E16-R214 IonicContact OE2-NH1 2.65Å; E16-R214 PolarHBondContact OE2-NH1 2.87Å; E16-R214 IonicContact OE2-NH2 2.72Å; E16-S217 PolarHBondContact OE1-OG 3.27Å
17	S	52.1	Low	56.4	Low	23 Å²	23	71 Å²	71	16%	0.161	39%	0.388	C	S	.	.	H	α-helix	trans	-76.8	-38.5	-178.4	-147.4	0	0	0	0	112.6	N10 L11 S14 S15 N20 G21	N10-S17 PolarHBondContact O-OG 2.94Å; L11-S17 VanDerWaalsContact CA-OG 3.23Å; L11-S17 WeakPolarHBondContact CA-OG 3.41Å; L11-S17 CarbonylContact O-C 3.46Å; L11-S17 VanDerWaalsContact O-CB 3.22Å; L11-S17 WeakPolarHBondContact O-CB 3.47Å; L11-S17 PolarHBondContact O-OG 3.49Å; S14-S17 WeakPolarHBondContact O-CA 3.01Å; S14-S17 WeakPolarHBondContact O-CB 3.27Å; S14-S17 PolarHBondContact O-N 3.49Å; S14-S17 WeakPolarHBondContact OG-CB 3.41Å; S14-S17 PolarHBondContact OG-N 3.27Å; S14-S17 VanDerWaalsContact OG-N 3.1Å; S15-S17 VanDerWaalsContact C-N 3.27Å; S15-S17 PolarHBondContact O-N 3.43Å; S17-N20 PolarHBondContact O-N 3.34Å; S17-G21 PolarHBondContact O-N 3.05Å
18	V	51.3	Low	58.3	Low	67 Å²	67	68.5 Å²	68.5	41%	0.406	38%	0.382	S	S	.	.	H	α-helix	trans	-65.1	-43.1	175	174.1	0	0	0	0	111	L11 S14 G21 I22	L11-V18 WeakPolarHBondContact O-CA 3.39Å; L11-V18 WeakPolarHBondContact O-CG2 3.41Å; L11-V18 PolarHBondContact O-N 2.84Å; S14-V18 PolarHBondContact O-N 2.99Å; V18-G21 CarbonylContact O-C 3.09Å; V18-G21 WeakPolarHBondContact O-CA 3.34Å; V18-G21 PolarHBondContact O-N 3.47Å; V18-G21 VanDerWaalsContact O-N 3.13Å; V18-I22 HydrophobicContact CG1-CD1 4.46Å; V18-I22 PolarHBondContact O-N 3.34Å
19	M	56.5	Low	60.3	Low	26 Å²	26	65.1 Å²	65.1	13%	0.128	37%	0.373	C	S	.	.	H	α-helix	trans	-72.1	-34.4	179.7	-171.6	115.2	39	0	0	112.6	S15 G21 I22 C23 N71 Q73 R105	S15-M19 WeakPolarHBondContact O-CB 3.4Å; S15-M19 PolarHBondContact O-N 2.01Å; M19-G21 VanDerWaalsContact C-N 3.28Å; M19-I22 PolarHBondContact O-N 3.03Å; M19-C23 WeakPolarHBondContact O-CB 3.15Å; M19-C23 PolarHBondContact O-N 3.22Å; M19-C23 VanDerWaalsContact O-N 3.09Å; M19-N71 HydrophobicContact SD-CB 4.44Å; M19-N71 PolarHBondContact SD-OD1 3.32Å; M19-Q73 HydrophobicContact CE-CG 3.92Å; M19-R105 HydrophobicContact CG-CG 4.37Å; M19-R105 PolarHBondContact SD-NH1 3.3Å; M19-R105 VanDerWaalsContact SD-NH1 3.4Å
20	N	64.9	Low	62.4	Low	94 Å²	94	59.7 Å²	59.7	50%	0.503	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-34	167.3	-71.3	-18.2	0	0	0	111.6	E16 S17 C23 L24	E16-N20 VanDerWaalsContact O-CB 3.32Å; E16-N20 WeakPolarHBondContact O-CB 3.5Å; E16-N20 PolarHBondContact O-N 2.92Å; E16-N20 VanDerWaalsContact O-N 3.07Å; E16-N20 PolarHBondContact O-ND2 3.2Å; E16-N20 PolarHBondContact O-OD1 3Å; S17-N20 PolarHBondContact O-N 3.34Å; N20-C23 WeakPolarHBondContact O-CB 3.41Å; N20-C23 PolarHBondContact O-N 3.05Å; N20-L24 WeakPolarHBondContact O-CB 3.42Å; N20-L24 PolarHBondContact O-N 3.22Å
21	G	70.4	Confident	64.9	Low	21 Å²	21	57.5 Å²	57.5	22%	0.216	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-44.5	172.6	0	0	0	0	0	113.4	S17 V18 M19 C23 L24 L25	S17-G21 PolarHBondContact O-N 3.05Å; V18-G21 CarbonylContact O-C 3.09Å; V18-G21 WeakPolarHBondContact O-CA 3.34Å; V18-G21 PolarHBondContact O-N 3.47Å; V18-G21 VanDerWaalsContact O-N 3.13Å; M19-G21 VanDerWaalsContact C-N 3.28Å; G21-C23 VanDerWaalsContact C-N 3.35Å; G21-C23 PolarHBondContact O-N 3.1Å; G21-L24 PolarHBondContact O-N 2.84Å; G21-L25 WeakPolarHBondContact O-CB 3.37Å; G21-L25 PolarHBondContact O-N 3.38Å
22	I	71.6	Confident	67.4	Low	62 Å²	62	61.6 Å²	61.6	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-61.9	-43.3	175.4	-69.1	168.1	0	0	0	110.9	V18 M19 L24 L25 L26 V70	V18-I22 HydrophobicContact CG1-CD1 4.46Å; V18-I22 PolarHBondContact O-N 3.34Å; M19-I22 PolarHBondContact O-N 3.03Å; I22-L24 PolarHBondContact O-N 3.24Å; I22-L25 PolarHBondContact O-N 3.37Å; I22-L26 HydrophobicContact CG2-CD1 3.7Å; I22-L26 WeakPolarHBondContact O-CB 3.49Å; I22-L26 PolarHBondContact O-N 3.36Å; I22-V70 HydrophobicContact CG2-CG1 3.78Å
23	C	72.3	Confident	69.9	Low	30 Å²	30	60 Å²	60	20%	0.203	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-45.2	175.1	178.9	0	0	0	0	112	M19 N20 G21 L26 A27 A108	M19-C23 WeakPolarHBondContact O-CB 3.15Å; M19-C23 PolarHBondContact O-N 3.22Å; M19-C23 VanDerWaalsContact O-N 3.09Å; N20-C23 WeakPolarHBondContact O-CB 3.41Å; N20-C23 PolarHBondContact O-N 3.05Å; G21-C23 VanDerWaalsContact C-N 3.35Å; G21-C23 PolarHBondContact O-N 3.1Å; C23-L26 PolarHBondContact O-N 3.28Å; C23-A27 WeakPolarHBondContact O-CB 2.96Å; C23-A27 PolarHBondContact O-N 3.18Å; C23-A108 WeakPolarHBondContact SG-CB 3.36Å
24	L	76.9	Confident	72.4	Confident	120 Å²	120	57.1 Å²	57.1	63%	0.628	32%	0.322	S	S	*	.	H	α-helix	trans	-64	-41.4	176.4	-175.3	66.5	0	0	0	112.2	N20 G21 I22 A27 A28	N20-L24 WeakPolarHBondContact O-CB 3.42Å; N20-L24 PolarHBondContact O-N 3.22Å; G21-L24 PolarHBondContact O-N 2.84Å; I22-L24 PolarHBondContact O-N 3.24Å; L24-A27 PolarHBondContact O-N 3.11Å; L24-A28 PolarHBondContact O-N 3.43Å
25	L	82	Confident	74.4	Confident	114 Å²	114	59.1 Å²	59.1	60%	0.597	34%	0.336	S	S	*	.	H	α-helix	trans	-63.2	-48	176.2	-178.8	67.5	0	0	0	111.3	G21 I22 A27 A28 V29	G21-L25 WeakPolarHBondContact O-CB 3.37Å; G21-L25 PolarHBondContact O-N 3.38Å; I22-L25 PolarHBondContact O-N 3.37Å; L25-A27 VanDerWaalsContact C-N 3.29Å; L25-A27 PolarHBondContact O-N 3.45Å; L25-A28 PolarHBondContact O-N 3.3Å; L25-A28 VanDerWaalsContact O-N 3.14Å; L25-V29 WeakPolarHBondContact O-CG2 3.12Å; L25-V29 PolarHBondContact O-N 3.07Å
26	L	80.6	Confident	76.5	Confident	41 Å²	41	62.1 Å²	62.1	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-58	-42	176.1	-86.7	153.5	0	0	0	111.4	I22 C23 V29 T30 A109	I22-L26 HydrophobicContact CG2-CD1 3.7Å; I22-L26 WeakPolarHBondContact O-CB 3.49Å; I22-L26 PolarHBondContact O-N 3.36Å; C23-L26 PolarHBondContact O-N 3.28Å; L26-V29 PolarHBondContact O-N 3.1Å; L26-T30 WeakPolarHBondContact O-CB 3.11Å; L26-T30 PolarHBondContact O-N 3.33Å; L26-T30 PolarHBondContact O-OG1 2.97Å; L26-A109 HydrophobicContact CB-CB 4.08Å
27	A	83.2	Confident	78.4	Confident	20 Å²	20	64.4 Å²	64.4	17%	0.165	37%	0.367	C	S	.	.	H	α-helix	trans	-62.8	-43.8	174.5	0	0	0	0	0	112.2	C23 L24 L25 T30 V31 V112	C23-A27 WeakPolarHBondContact O-CB 2.96Å; C23-A27 PolarHBondContact O-N 3.18Å; L24-A27 PolarHBondContact O-N 3.11Å; L25-A27 VanDerWaalsContact C-N 3.29Å; L25-A27 PolarHBondContact O-N 3.45Å; A27-T30 WeakPolarHBondContact O-CB 3.46Å; A27-T30 PolarHBondContact O-N 2.96Å; A27-V31 WeakPolarHBondContact O-CG2 3.13Å; A27-V31 PolarHBondContact O-N 3.07Å; A27-V112 HydrophobicContact CB-CG2 4.17Å
28	A	83.3	Confident	80.1	Confident	53 Å²	53	69 Å²	69	44%	0.438	39%	0.389	S	S	.	.	H	α-helix	trans	-64.6	-42.7	177.4	0	0	0	0	0	112.5	L24 L25 T30 V31 K32	L24-A28 PolarHBondContact O-N 3.43Å; L25-A28 PolarHBondContact O-N 3.3Å; L25-A28 VanDerWaalsContact O-N 3.14Å; A28-T30 VanDerWaalsContact C-N 3.31Å; A28-T30 PolarHBondContact O-N 2.93Å; A28-V31 PolarHBondContact O-N 2.98Å; A28-K32 PolarHBondContact O-N 3Å; A28-K32 VanDerWaalsContact O-N 3.11Å
29	V	88.3	Confident	82	Confident	68 Å²	68	67.3 Å²	67.3	41%	0.412	38%	0.377	S	S	.	.	H	α-helix	trans	-61.5	-41.8	173.5	171.8	0	0	0	0	110.4	L25 L26 V31 K32 M33	L25-V29 WeakPolarHBondContact O-CG2 3.12Å; L25-V29 PolarHBondContact O-N 3.07Å; L26-V29 PolarHBondContact O-N 3.1Å; V29-V31 PolarHBondContact O-N 3Å; V29-K32 PolarHBondContact O-N 3.48Å; V29-K32 VanDerWaalsContact O-N 3.14Å; V29-M33 HydrophobicContact CG1-CG 4.09Å; V29-M33 HydrophobicContact CG1-SD 3.83Å; V29-M33 WeakPolarHBondContact O-CB 3.27Å; V29-M33 WeakPolarHBondContact O-CG 3.45Å; V29-M33 PolarHBondContact O-N 2.05Å
30	T	88.3	Confident	83.7	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-57.9	-45.9	176.5	-60	0	0	0	0	111.5	L26 A27 A28 K32 M33 Y34 L63 V112 W113	L26-T30 WeakPolarHBondContact O-CB 3.11Å; L26-T30 PolarHBondContact O-N 3.33Å; L26-T30 PolarHBondContact O-OG1 2.97Å; A27-T30 WeakPolarHBondContact O-CB 3.46Å; A27-T30 PolarHBondContact O-N 2.96Å; A28-T30 VanDerWaalsContact C-N 3.31Å; A28-T30 PolarHBondContact O-N 2.93Å; T30-K32 VanDerWaalsContact C-N 3.34Å; T30-K32 PolarHBondContact O-N 2.98Å; T30-M33 PolarHBondContact O-N 2.81Å; T30-Y34 WeakPolarHBondContact O-CB 3.43Å; T30-Y34 PolarHBondContact O-N 2.92Å; T30-L63 HydrophobicContact CG2-CD1 3.77Å; T30-V112 HydrophobicContact CG2-CB 4.34Å; T30-V112 HydrophobicContact CG2-CG1 4.01Å; T30-W113 HydrophobicContact CG2-CB 3.89Å; T30-W113 HydrophobicContact CG2-CE3 3.89Å
31	V	89.1	Confident	85.1	Confident	69 Å²	69	67.1 Å²	67.1	42%	0.418	38%	0.377	S	S	.	.	H	α-helix	trans	-59.7	-44.9	175.9	173.7	0	0	0	0	111	A27 A28 V29 Y34 S35 V112 L116	A27-V31 WeakPolarHBondContact O-CG2 3.13Å; A27-V31 PolarHBondContact O-N 3.07Å; A28-V31 PolarHBondContact O-N 2.98Å; V29-V31 PolarHBondContact O-N 3Å; V31-Y34 PolarHBondContact O-N 3.44Å; V31-S35 PolarHBondContact O-N 2.82Å; V31-S35 PolarHBondContact O-OG 3.05Å; V31-V112 HydrophobicContact CG2-CG1 4.12Å; V31-L116 HydrophobicContact CB-CD1 4.4Å; V31-L116 HydrophobicContact CG2-CD1 3.97Å
32	K	89.4	Confident	86.2	Confident	149 Å²	149	68.6 Å²	68.6	65%	0.648	38%	0.383	S	S	*	.	H	α-helix	trans	-66.9	-41.1	179.3	-73.6	-65.5	-172.5	179.8	0	113.1	A28 V29 T30 S35 S36	A28-K32 PolarHBondContact O-N 3Å; A28-K32 VanDerWaalsContact O-N 3.11Å; V29-K32 PolarHBondContact O-N 3.48Å; V29-K32 VanDerWaalsContact O-N 3.14Å; T30-K32 VanDerWaalsContact C-N 3.34Å; T30-K32 PolarHBondContact O-N 2.98Å; K32-S35 WeakPolarHBondContact CA-OG 3.5Å; K32-S35 PolarHBondContact O-N 3.02Å; K32-S35 PolarHBondContact O-OG 2.85Å; K32-S36 WeakPolarHBondContact O-CB 3.29Å; K32-S36 PolarHBondContact O-N 3.11Å; K32-S36 VanDerWaalsContact O-N 3.09Å; K32-S36 PolarHBondContact O-OG 3.04Å
33	M	89.8	Confident	87.2	Confident	103 Å²	103	66.4 Å²	66.4	51%	0.507	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-46.2	174.5	-73	-179.9	76.9	0	0	110.3	V29 T30 S35 S36 F37 W113	V29-M33 HydrophobicContact CG1-CG 4.09Å; V29-M33 HydrophobicContact CG1-SD 3.83Å; V29-M33 WeakPolarHBondContact O-CB 3.27Å; V29-M33 WeakPolarHBondContact O-CG 3.45Å; V29-M33 PolarHBondContact O-N 2.05Å; T30-M33 PolarHBondContact O-N 2.81Å; M33-S35 PolarHBondContact O-N 3.43Å; M33-S36 PolarHBondContact O-N 2.73Å; M33-F37 WeakPolarHBondContact O-CB 3.34Å; M33-F37 PolarHBondContact O-N 2.73Å; M33-W113 HydrophobicContact CB-CZ3 4.31Å
34	Y	90.7	Very high	88.1	Confident	33 Å²	33	69.3 Å²	69.3	13%	0.129	39%	0.386	C	S	.	.	H	α-helix	trans	-61.8	-43.8	177.8	-171.4	-92.7	0	0	0	112.2	T30 V31 S36 F37 W113 L116 A117 D120	T30-Y34 WeakPolarHBondContact O-CB 3.43Å; T30-Y34 PolarHBondContact O-N 2.92Å; V31-Y34 PolarHBondContact O-N 3.44Å; Y34-S36 VanDerWaalsContact C-N 3.26Å; Y34-S36 PolarHBondContact O-N 3.3Å; Y34-F37 PolarHBondContact O-N 3.48Å; Y34-W113 HydrophobicContact CD2-CD2 4.31Å; Y34-W113 HydrophobicContact CD2-CE3 4.24Å; Y34-W113 HydrophobicContact CD2-CH2 4.04Å; Y34-W113 HydrophobicContact CD2-CZ2 4.07Å; Y34-W113 HydrophobicContact CD2-CZ3 4.12Å; Y34-L116 HydrophobicContact CD1-CB 3.94Å; Y34-L116 HydrophobicContact CD1-CD1 4.35Å; Y34-L116 HydrophobicContact CD2-CB 4.2Å; Y34-L116 HydrophobicContact CE1-CB 4.11Å; Y34-L116 HydrophobicContact CE2-CB 4.37Å; Y34-L116 HydrophobicContact CG-CB 4Å; Y34-L116 HydrophobicContact CG-CD1 4.12Å; Y34-A117 HydrophobicContact CE2-CB 3.95Å; Y34-A117 WeakPolarHBondContact OH-CA 3.36Å; Y34-D120 HydrophobicContact CE1-CB 4.24Å; Y34-D120 WeakPolarHBondContact OH-CB 3.47Å; Y34-D120 PolarHBondContact OH-OD2 2.85Å
35	S	87.3	Confident	88.6	Confident	82 Å²	82	65.3 Å²	65.3	57%	0.573	37%	0.37	S	S	*	.	H	α-helix	trans	-67.8	-25.6	179.2	63.9	0	0	0	0	114	V31 K32 M33	V31-S35 PolarHBondContact O-N 2.82Å; V31-S35 PolarHBondContact O-OG 3.05Å; K32-S35 WeakPolarHBondContact CA-OG 3.5Å; K32-S35 PolarHBondContact O-N 3.02Å; K32-S35 PolarHBondContact O-OG 2.85Å; M33-S35 PolarHBondContact O-N 3.43Å
36	S	88.7	Confident	88.8	Confident	97 Å²	97	70.7 Å²	70.7	68%	0.678	38%	0.383	S	S	*	.	H	α-helix	trans	-91.4	-12.2	179.7	-47.8	0	0	0	0	112.4	K32 M33 Y34	K32-S36 WeakPolarHBondContact O-CB 3.29Å; K32-S36 PolarHBondContact O-N 3.11Å; K32-S36 VanDerWaalsContact O-N 3.09Å; K32-S36 PolarHBondContact O-OG 3.04Å; M33-S36 PolarHBondContact O-N 2.73Å; Y34-S36 VanDerWaalsContact C-N 3.26Å; Y34-S36 PolarHBondContact O-N 3.3Å
37	F	89.4	Confident	89.4	Confident	81 Å²	81	75.6 Å²	75.6	36%	0.355	40%	0.399	S	S	.	.			trans	-78.1	124.2	-178.4	179.3	-96.2	0	0	0	110.5	M33 Y34 F39 L55	M33-F37 WeakPolarHBondContact O-CB 3.34Å; M33-F37 PolarHBondContact O-N 2.73Å; Y34-F37 PolarHBondContact O-N 3.48Å; F37-F39 HydrophobicContact CD1-CB 4.32Å; F37-F39 HydrophobicContact CE1-CB 3.96Å; F37-F39 HydrophobicContact CE1-CD2 4.18Å; F37-L55 HydrophobicContact CE1-CD1 3.82Å; F37-L55 HydrophobicContact CE1-CD2 4.26Å; F37-L55 HydrophobicContact CE2-CD2 4.14Å; F37-L55 HydrophobicContact CZ-CD1 3.6Å; F37-L55 HydrophobicContact CZ-CD2 3.53Å; F37-L55 HydrophobicContact CZ-CG 4.2Å
38	D	88.6	Confident	90	Very high	118 Å²	118	74.7 Å²	74.7	63%	0.631	39%	0.392	S	S	*	.			trans	-93.3	111.7	176.3	-170.6	31.9	0	0	0	111.3	N40	D38-N40 PolarHBondContact O-ND2 3.25Å; D38-N40 PolarHBondContact OD2-ND2 2.98Å
39	F	91	Very high	90.5	Very high	33 Å²	33	74.2 Å²	74.2	15%	0.145	39%	0.387	C	S	.	.			trans	-88.3	113.9	-176.7	177.7	-89.7	0	0	0	111	F37 C41 Y51 L55 K122 C123 C126	F37-F39 HydrophobicContact CD1-CB 4.32Å; F37-F39 HydrophobicContact CE1-CB 3.96Å; F37-F39 HydrophobicContact CE1-CD2 4.18Å; F39-C41 HydrophobicContact CE1-CB 3.82Å; F39-C41 HydrophobicContact CZ-CB 4.13Å; F39-Y51 HydrophobicContact CD2-CE1 4.26Å; F39-Y51 HydrophobicContact CE2-CD1 4.17Å; F39-Y51 AromaticContact CE2-CE1 3.73Å; F39-Y51 HydrophobicContact CE2-CE1 3.73Å; F39-Y51 HydrophobicContact CZ-CD1 4.29Å; F39-Y51 HydrophobicContact CZ-CE1 4.02Å; F39-L55 HydrophobicContact CD2-CD1 3.58Å; F39-L55 HydrophobicContact CE2-CD1 3.65Å; F39-K122 HydrophobicContact CB-CD 4.25Å; F39-K122 HydrophobicContact CD1-CB 3.69Å; F39-K122 HydrophobicContact CD1-CD 4.21Å; F39-K122 HydrophobicContact CD1-CG 4.49Å; F39-K122 HydrophobicContact CE1-CB 3.91Å; F39-K122 HydrophobicContact CG-CB 4.12Å; F39-K122 HydrophobicContact CG-CD 4.46Å; F39-C123 HydrophobicContact CE2-CB 4.34Å; F39-C126 HydrophobicContact CE1-CB 4.05Å; F39-C126 HydrophobicContact CZ-CB 3.52Å
40	N	92.4	Very high	90.9	Very high	97 Å²	97	77 Å²	77	52%	0.519	40%	0.399	S	S	.	.			trans	-120.4	100.6	179	-69.6	-70.8	0	0	0	110.8	D38 Y51	D38-N40 PolarHBondContact O-ND2 3.25Å; D38-N40 PolarHBondContact OD2-ND2 2.98Å; N40-Y51 WeakPolarHBondContact O-CE1 3.27Å; N40-Y51 PolarHBondContact O-OH 3.42Å
41	C	93.8	Very high	91.2	Very high	18 Å²	18	80.6 Å²	80.6	12%	0.122	41%	0.413	C	S	.	.			trans	-70.6	135.5	178.5	-173.1	0	0	0	0	110.3	F39 C43 C126 P156	F39-C41 HydrophobicContact CE1-CB 3.82Å; F39-C41 HydrophobicContact CZ-CB 4.13Å; C41-C43 PolarHBondContact O-N 3.29Å; C41-C126 HydrophobicContact CB-CB 3.87Å; C41-C126 WeakPolarHBondContact CB-SG 3.23Å; C41-C126 WeakPolarHBondContact SG-CB 3.42Å; C41-C126 CovalentContact SG-SG 2.05Å; C41-C126 PolarHBondContact SG-SG 3.35Å; C41-P156 HydrophobicContact CB-CB 3.84Å; C41-P156 VanDerWaalsContact SG-CB 3.58Å
42	P	93.3	Very high	91.5	Very high	53 Å²	53	77.3 Å²	77.3	34%	0.344	39%	0.394	S	S	.	.			trans	-70.2	-19.1	-178	26.8	-35.1	0	0	0	113.9	L44 Y51	P42-L44 VanDerWaalsContact C-N 3.25Å; P42-L44 HydrophobicContact CB-CD1 4.26Å; P42-L44 PolarHBondContact O-N 3.46Å; P42-Y51 VanDerWaalsContact CD-CD1 3.42Å; P42-Y51 HydrophobicContact CG-CD1 4.4Å; P42-Y51 HydrophobicContact CG-CG 4.2Å
43	C	93.4	Very high	91.8	Very high	15 Å²	15	73.4 Å²	73.4	10%	0.101	38%	0.379	C	S	.	.			trans	55.1	38.5	-179.3	-65.5	0	0	0	0	114.4	C41 N48 A153 K154 C157	C41-C43 PolarHBondContact O-N 3.29Å; C43-N48 WeakPolarHBondContact CA-OD1 3.16Å; C43-N48 PolarHBondContact N-OD1 2.85Å; C43-A153 CarbonylContact C-O 3.44Å; C43-A153 VanDerWaalsContact CA-O 3.27Å; C43-A153 WeakPolarHBondContact CA-O 3.08Å; C43-K154 HydrophobicContact CB-CG 4.45Å; C43-C157 HydrophobicContact CB-CB 3.97Å; C43-C157 WeakPolarHBondContact CB-SG 3.39Å; C43-C157 WeakPolarHBondContact SG-CB 3.34Å; C43-C157 PolarHBondContact SG-N 2.88Å; C43-C157 CovalentContact SG-SG 2.01Å; C43-C157 PolarHBondContact SG-SG 3.39Å
44	L	91.6	Very high	92.1	Very high	92 Å²	92	69.6 Å²	69.6	48%	0.482	37%	0.367	S	S	.	.			trans	-116.5	126.2	175.6	-66.5	163.6	0	0	0	108.6	P42 R46 Y47 N48	P42-L44 VanDerWaalsContact C-N 3.25Å; P42-L44 HydrophobicContact CB-CD1 4.26Å; P42-L44 PolarHBondContact O-N 3.46Å; L44-R46 PolarHBondContact O-N 3.44Å; L44-Y47 HydrophobicContact CB-CD2 3.81Å; L44-Y47 HydrophobicContact CB-CG 4.48Å; L44-Y47 HydrophobicContact CD1-CD2 3.76Å; L44-Y47 HydrophobicContact CD1-CE2 4.4Å; L44-Y47 HydrophobicContact CD1-CG 4.49Å; L44-Y47 HydrophobicContact CG-CD2 4.42Å; L44-Y47 PolarHBondContact O-N 2.89Å; L44-N48 PolarHBondContact N-OD1 3.46Å; L44-N48 PolarHBondContact O-N 3.25Å; L44-N48 PolarHBondContact O-OD1 2.89Å; L44-N48 VanDerWaalsContact O-OD1 3.07Å
45	A	86.5	Confident	92.3	Very high	35 Å²	35	69.4 Å²	69.4	29%	0.289	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-35.9	-171.7	0	0	0	0	0	114.4	N130 A153	A45-N130 PolarHBondContact O-ND2 3.45Å; A45-A153 HydrophobicContact CB-CB 3.93Å
46	R	87.1	Confident	92.6	Very high	228 Å²	228	66.5 Å²	66.5	86%	0.86	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-25.1	179.5	-66.9	-170.5	176.4	-176.1	-0.6	114.6	L44	L44-R46 PolarHBondContact O-N 3.44Å
47	Y	93.5	Very high	92.9	Very high	144 Å²	144	66.7 Å²	66.7	57%	0.565	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-19.8	-173.4	-64.4	-78.9	0	0	0	113.5	L44 A49 L50 Y51	L44-Y47 HydrophobicContact CB-CD2 3.81Å; L44-Y47 HydrophobicContact CB-CG 4.48Å; L44-Y47 HydrophobicContact CD1-CD2 3.76Å; L44-Y47 HydrophobicContact CD1-CE2 4.4Å; L44-Y47 HydrophobicContact CD1-CG 4.49Å; L44-Y47 HydrophobicContact CG-CD2 4.42Å; L44-Y47 PolarHBondContact O-N 2.89Å; Y47-A49 PolarHBondContact O-N 2.88Å; Y47-L50 PolarHBondContact O-N 3.33Å; Y47-Y51 VanDerWaalsContact O-CB 3.29Å; Y47-Y51 WeakPolarHBondContact O-CB 3.15Å; Y47-Y51 PolarHBondContact O-N 2.96Å
48	N	94.8	Very high	93.2	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-54.6	-49.9	179.6	-80.3	7.7	0	0	0	113.2	C43 L44 G52 C126 S129 A153	C43-N48 WeakPolarHBondContact CA-OD1 3.16Å; C43-N48 PolarHBondContact N-OD1 2.85Å; L44-N48 PolarHBondContact N-OD1 3.46Å; L44-N48 PolarHBondContact O-N 3.25Å; L44-N48 PolarHBondContact O-OD1 2.89Å; L44-N48 VanDerWaalsContact O-OD1 3.07Å; N48-G52 PolarHBondContact O-N 2.96Å; N48-C126 WeakPolarHBondContact CB-O 3.29Å; N48-S129 PolarHBondContact ND2-OG 3.39Å; N48-A153 PolarHBondContact ND2-O 2.84Å
49	A	94.7	Very high	93.5	Very high	42 Å²	42	63 Å²	63	35%	0.347	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-49.1	178.8	0	0	0	0	0	111.8	Y47 Y51 L53	Y47-A49 PolarHBondContact O-N 2.88Å; A49-Y51 PolarHBondContact O-N 3.38Å; A49-L53 VanDerWaalsContact O-CB 3.27Å; A49-L53 WeakPolarHBondContact O-CB 3.46Å; A49-L53 WeakPolarHBondContact O-CG 3.2Å; A49-L53 PolarHBondContact O-N 3.48Å
50	L	95.7	Very high	93.7	Very high	127 Å²	127	61.9 Å²	61.9	67%	0.665	32%	0.324	S	S	*	.	H	α-helix	trans	-62.2	-44.8	-179.3	-175.3	66.6	0	0	0	111.7	Y47 G54	Y47-L50 PolarHBondContact O-N 3.33Å; L50-G54 WeakPolarHBondContact O-CA 3.48Å; L50-G54 PolarHBondContact O-N 3.42Å
51	Y	95.4	Very high	93.8	Very high	76 Å²	76	62.1 Å²	62.1	30%	0.298	32%	0.324	S	S	.	.	H	α-helix	trans	-69.3	-47.8	-179.7	-177	-100	0	0	0	112.2	F39 N40 P42 Y47 A49 G54 L55	F39-Y51 HydrophobicContact CD2-CE1 4.26Å; F39-Y51 HydrophobicContact CE2-CD1 4.17Å; F39-Y51 AromaticContact CE2-CE1 3.73Å; F39-Y51 HydrophobicContact CE2-CE1 3.73Å; F39-Y51 HydrophobicContact CZ-CD1 4.29Å; F39-Y51 HydrophobicContact CZ-CE1 4.02Å; N40-Y51 WeakPolarHBondContact O-CE1 3.27Å; N40-Y51 PolarHBondContact O-OH 3.42Å; P42-Y51 VanDerWaalsContact CD-CD1 3.42Å; P42-Y51 HydrophobicContact CG-CD1 4.4Å; P42-Y51 HydrophobicContact CG-CG 4.2Å; Y47-Y51 VanDerWaalsContact O-CB 3.29Å; Y47-Y51 WeakPolarHBondContact O-CB 3.15Å; Y47-Y51 PolarHBondContact O-N 2.96Å; A49-Y51 PolarHBondContact O-N 3.38Å; Y51-G54 PolarHBondContact O-N 2.9Å; Y51-L55 HydrophobicContact CD1-CD1 4.08Å; Y51-L55 HydrophobicContact CD2-CD1 4.45Å; Y51-L55 HydrophobicContact CE1-CD1 3.44Å; Y51-L55 VanDerWaalsContact CE1-CD1 3.44Å; Y51-L55 HydrophobicContact CE2-CD1 3.86Å; Y51-L55 HydrophobicContact CE2-CG 4.42Å; Y51-L55 PolarHBondContact O-N 3.01Å
52	G	95.2	Very high	93.8	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-45.1	-179.7	0	0	0	0	0	113	N48 L56	N48-G52 PolarHBondContact O-N 2.96Å; G52-L56 WeakPolarHBondContact O-CB 3.36Å; G52-L56 PolarHBondContact O-N 3.29Å
53	L	95.6	Very high	93.8	Very high	67 Å²	67	62 Å²	62	35%	0.351	33%	0.327	S	S	.	.	H	α-helix	trans	-71	-36.2	174.9	-68.8	172.5	0	0	0	112	A49 L56 L57 A127 F128	A49-L53 VanDerWaalsContact O-CB 3.27Å; A49-L53 WeakPolarHBondContact O-CB 3.46Å; A49-L53 WeakPolarHBondContact O-CG 3.2Å; A49-L53 PolarHBondContact O-N 3.48Å; L53-L56 HydrophobicContact CD2-CD2 4.48Å; L53-L56 WeakPolarHBondContact O-CB 3.47Å; L53-L56 PolarHBondContact O-N 2.9Å; L53-L57 WeakPolarHBondContact O-CB 3.4Å; L53-L57 WeakPolarHBondContact O-CG 3.29Å; L53-L57 PolarHBondContact O-N 2.97Å; L53-A127 HydrophobicContact CD2-CB 4.34Å; L53-A127 HydrophobicContact CG-CB 4.03Å; L53-F128 HydrophobicContact CD2-CE2 4.4Å; L53-F128 HydrophobicContact CD2-CZ 4.38Å
54	G	95.6	Very high	93.8	Very high	23 Å²	23	63.4 Å²	63.4	24%	0.237	33%	0.331	C	S	.	.	H	α-helix	trans	-58.1	-49.9	175	0	0	0	0	0	111.7	L50 Y51 L56 L57 T58 P59	L50-G54 WeakPolarHBondContact O-CA 3.48Å; L50-G54 PolarHBondContact O-N 3.42Å; Y51-G54 PolarHBondContact O-N 2.9Å; G54-L56 VanDerWaalsContact C-N 3.26Å; G54-L56 PolarHBondContact O-N 3.42Å; G54-L57 PolarHBondContact O-N 3.23Å; G54-T58 WeakPolarHBondContact O-CA 3.39Å; G54-T58 WeakPolarHBondContact O-CB 3.22Å; G54-T58 PolarHBondContact O-N 3.17Å; G54-T58 PolarHBondContact O-OG1 3.34Å; G54-T58 VanDerWaalsContact O-OG1 3.07Å; G54-P59 WeakPolarHBondContact O-CD 3.47Å
55	L	94.4	Very high	93.8	Very high	29 Å²	29	63.2 Å²	63.2	15%	0.152	33%	0.33	C	S	.	.	H	α-helix	trans	-70.2	-22.1	177.3	-71.5	178	0	0	0	114	F37 F39 Y51 P59 W113	F37-L55 HydrophobicContact CE1-CD1 3.82Å; F37-L55 HydrophobicContact CE1-CD2 4.26Å; F37-L55 HydrophobicContact CE2-CD2 4.14Å; F37-L55 HydrophobicContact CZ-CD1 3.6Å; F37-L55 HydrophobicContact CZ-CD2 3.53Å; F37-L55 HydrophobicContact CZ-CG 4.2Å; F39-L55 HydrophobicContact CD2-CD1 3.58Å; F39-L55 HydrophobicContact CE2-CD1 3.65Å; Y51-L55 HydrophobicContact CD1-CD1 4.08Å; Y51-L55 HydrophobicContact CD2-CD1 4.45Å; Y51-L55 HydrophobicContact CE1-CD1 3.44Å; Y51-L55 VanDerWaalsContact CE1-CD1 3.44Å; Y51-L55 HydrophobicContact CE2-CD1 3.86Å; Y51-L55 HydrophobicContact CE2-CG 4.42Å; Y51-L55 PolarHBondContact O-N 3.01Å; L55-P59 VanDerWaalsContact O-CD 3.29Å; L55-P59 WeakPolarHBondContact O-CD 3.38Å; L55-P59 WeakPolarHBondContact O-CG 3.45Å; L55-W113 PolarHBondContact O-NE1 3.07Å; L55-W113 VanDerWaalsContact O-NE1 3.08Å
56	L	94.5	Very high	93.9	Very high	21 Å²	21	64.4 Å²	64.4	11%	0.11	34%	0.335	C	S	.	.	H	α-helix	trans	-72.7	-45.8	170.9	-173.9	64.6	0	0	0	111.2	G52 L53 G54 S60 I114 A117 L118 C123	G52-L56 WeakPolarHBondContact O-CB 3.36Å; G52-L56 PolarHBondContact O-N 3.29Å; L53-L56 HydrophobicContact CD2-CD2 4.48Å; L53-L56 WeakPolarHBondContact O-CB 3.47Å; L53-L56 PolarHBondContact O-N 2.9Å; G54-L56 VanDerWaalsContact C-N 3.26Å; G54-L56 PolarHBondContact O-N 3.42Å; L56-S60 PolarHBondContact O-OG 3.34Å; L56-I114 HydrophobicContact CD1-CD1 3.84Å; L56-I114 HydrophobicContact CG-CD1 3.86Å; L56-I114 WeakPolarHBondContact O-CD1 3.5Å; L56-A117 HydrophobicContact CD1-CB 3.49Å; L56-A117 VanDerWaalsContact CD1-CB 3.49Å; L56-L118 HydrophobicContact CD1-CG 4.41Å; L56-C123 HydrophobicContact CB-CB 4.49Å
57	L	95.4	Very high	94	Very high	100 Å²	100	53.9 Å²	53.9	52%	0.524	30%	0.298	S	S	.	.	H	α-helix	trans	-98.9	-39.7	-168.3	-62.2	176.8	0	0	0	114.5	L53 G54 S60 L61 I114	L53-L57 WeakPolarHBondContact O-CB 3.4Å; L53-L57 WeakPolarHBondContact O-CG 3.29Å; L53-L57 PolarHBondContact O-N 2.97Å; G54-L57 PolarHBondContact O-N 3.23Å; L57-S60 WeakPolarHBondContact O-CB 3.31Å; L57-S60 PolarHBondContact O-N 3.44Å; L57-L61 PolarHBondContact O-N 3.49Å; L57-I114 HydrophobicContact CD2-CD1 4.36Å
58	T	95.4	Very high	93.6	Very high	92 Å²	92	49.1 Å²	49.1	56%	0.564	28%	0.282	S	S	*	.	H	α-helix	trans	-62.9	-47.1	-174.1	-59.6	0	0	0	0	112.3	G54 S60 L61 A62	G54-T58 WeakPolarHBondContact O-CA 3.39Å; G54-T58 WeakPolarHBondContact O-CB 3.22Å; G54-T58 PolarHBondContact O-N 3.17Å; G54-T58 PolarHBondContact O-OG1 3.34Å; G54-T58 VanDerWaalsContact O-OG1 3.07Å; T58-S60 VanDerWaalsContact C-N 3.32Å; T58-S60 PolarHBondContact O-N 3.45Å; T58-L61 PolarHBondContact O-N 2.98Å; T58-A62 PolarHBondContact O-N 3.32Å
59	P	94.4	Very high	93.2	Very high	29 Å²	29	55.7 Å²	55.7	19%	0.188	32%	0.317	C	S	.	.	H	α-helix	trans	-65.5	-36.3	176.1	-21.5	35.3	0	0	0	112.1	G54 L55 L61 A62 L63 W113	G54-P59 WeakPolarHBondContact O-CD 3.47Å; L55-P59 VanDerWaalsContact O-CD 3.29Å; L55-P59 WeakPolarHBondContact O-CD 3.38Å; L55-P59 WeakPolarHBondContact O-CG 3.45Å; P59-L61 VanDerWaalsContact C-N 3.35Å; P59-L61 PolarHBondContact O-N 3.44Å; P59-A62 PolarHBondContact O-N 3.27Å; P59-L63 WeakPolarHBondContact O-CB 3.24Å; P59-L63 VanDerWaalsContact O-CG 3.23Å; P59-L63 WeakPolarHBondContact O-CG 3.48Å; P59-L63 PolarHBondContact O-N 3.4Å; P59-W113 HydrophobicContact CB-CD2 3.81Å; P59-W113 HydrophobicContact CB-CE3 4.29Å; P59-W113 HydrophobicContact CB-CG 4.36Å; P59-W113 HydrophobicContact CB-CH2 3.97Å; P59-W113 HydrophobicContact CB-CZ2 3.46Å; P59-W113 VanDerWaalsContact CB-CZ2 3.46Å; P59-W113 HydrophobicContact CB-CZ3 4.36Å; P59-W113 HydrophobicContact CG-CH2 4.22Å; P59-W113 HydrophobicContact CG-CZ2 3.46Å; P59-W113 VanDerWaalsContact CG-CZ2 3.46Å
60	S	94.2	Very high	92.6	Very high	11 Å²	11	57.3 Å²	57.3	8%	0.077	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-42.4	172.9	-66.6	0	0	0	0	112.1	L56 L57 T58 F64 P110 I114	L56-S60 PolarHBondContact O-OG 3.34Å; L57-S60 WeakPolarHBondContact O-CB 3.31Å; L57-S60 PolarHBondContact O-N 3.44Å; T58-S60 VanDerWaalsContact C-N 3.32Å; T58-S60 PolarHBondContact O-N 3.45Å; S60-F64 WeakPolarHBondContact O-CB 3.12Å; S60-F64 PolarHBondContact O-N 3.33Å; S60-P110 WeakPolarHBondContact O-CG 3.49Å; S60-P110 PolarHBondContact OG-O 2.87Å; S60-I114 WeakPolarHBondContact OG-CD1 3.47Å; S60-I114 WeakPolarHBondContact OG-CG1 3.45Å
61	L	95.5	Very high	91.6	Very high	101 Å²	101	51.6 Å²	51.6	53%	0.529	29%	0.292	S	S	.	.	H	α-helix	trans	-65.7	-42.8	175.3	-178.3	61.7	0	0	0	111.5	L57 T58 P59 F64 L65	L57-L61 PolarHBondContact O-N 3.49Å; T58-L61 PolarHBondContact O-N 2.98Å; P59-L61 VanDerWaalsContact C-N 3.35Å; P59-L61 PolarHBondContact O-N 3.44Å; L61-F64 HydrophobicContact CD1-CD1 4.47Å; L61-F64 WeakPolarHBondContact O-CB 3.24Å; L61-F64 PolarHBondContact O-N 3.46Å; L61-L65 HydrophobicContact CG-CD1 4.43Å; L61-L65 WeakPolarHBondContact O-CG 3.29Å; L61-L65 PolarHBondContact O-N 2.88Å
62	A	94.4	Very high	90.5	Very high	50 Å²	50	55.5 Å²	55.5	41%	0.413	31%	0.306	S	S	.	.	H	α-helix	trans	-61.6	-46.1	176.4	0	0	0	0	0	111.7	T58 P59 F64 L65 C66	T58-A62 PolarHBondContact O-N 3.32Å; P59-A62 PolarHBondContact O-N 3.27Å; A62-F64 VanDerWaalsContact C-N 3.28Å; A62-F64 PolarHBondContact O-N 3.09Å; A62-L65 PolarHBondContact O-N 3.35Å; A62-C66 WeakPolarHBondContact O-CB 3.48Å; A62-C66 PolarHBondContact O-N 2.9Å; A62-C66 PolarHBondContact O-SG 2.94Å
63	L	92.4	Very high	89.3	Confident	19 Å²	19	56 Å²	56	10%	0.099	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-36.3	175.7	-71.4	169.7	0	0	0	111.9	T30 P59 C66 G67 A109 P110 W113	T30-L63 HydrophobicContact CG2-CD1 3.77Å; P59-L63 WeakPolarHBondContact O-CB 3.24Å; P59-L63 VanDerWaalsContact O-CG 3.23Å; P59-L63 WeakPolarHBondContact O-CG 3.48Å; P59-L63 PolarHBondContact O-N 3.4Å; L63-C66 PolarHBondContact O-N 3.45Å; L63-G67 PolarHBondContact O-N 3Å; L63-A109 HydrophobicContact CB-CB 4.33Å; L63-P110 HydrophobicContact CB-CG 4.14Å; L63-W113 HydrophobicContact CD1-CB 3.97Å; L63-W113 HydrophobicContact CD1-CD2 4.44Å; L63-W113 HydrophobicContact CD1-CE3 4.15Å; L63-W113 HydrophobicContact CD1-CG 4.39Å
64	F	92.9	Very high	88.3	Confident	44 Å²	44	53.5 Å²	53.5	19%	0.193	30%	0.297	C	S	.	.	H	α-helix	trans	-64.1	-47.9	176.1	176.8	-110.7	0	0	0	111	S60 L61 A62 G67 L68 L103 A106 L107 P110	S60-F64 WeakPolarHBondContact O-CB 3.12Å; S60-F64 PolarHBondContact O-N 3.33Å; L61-F64 HydrophobicContact CD1-CD1 4.47Å; L61-F64 WeakPolarHBondContact O-CB 3.24Å; L61-F64 PolarHBondContact O-N 3.46Å; A62-F64 VanDerWaalsContact C-N 3.28Å; A62-F64 PolarHBondContact O-N 3.09Å; F64-G67 PolarHBondContact O-N 3.48Å; F64-L68 HydrophobicContact CD1-CD1 4.16Å; F64-L68 HydrophobicContact CE1-CD1 3.57Å; F64-L68 HydrophobicContact CE1-CG 4.32Å; F64-L68 HydrophobicContact CE2-CD1 4.47Å; F64-L68 HydrophobicContact CE2-CG 4.42Å; F64-L68 HydrophobicContact CZ-CD1 3.76Å; F64-L68 HydrophobicContact CZ-CD2 4.34Å; F64-L68 HydrophobicContact CZ-CG 4.17Å; F64-L68 WeakPolarHBondContact O-CG 3.38Å; F64-L68 PolarHBondContact O-N 3.39Å; F64-L103 HydrophobicContact CE2-CD1 3.59Å; F64-L103 HydrophobicContact CZ-CD1 3.61Å; F64-A106 HydrophobicContact CD2-CB 3.93Å; F64-A106 HydrophobicContact CE2-CB 3.81Å; F64-L107 HydrophobicContact CD2-CD2 3.78Å; F64-L107 HydrophobicContact CD2-CG 4.25Å; F64-L107 HydrophobicContact CE2-CD2 3.87Å; F64-L107 HydrophobicContact CE2-CG 4.06Å; F64-P110 HydrophobicContact CB-CG 3.61Å; F64-P110 HydrophobicContact CD2-CG 4.41Å
65	L	92.2	Very high	87.2	Confident	89 Å²	89	55.9 Å²	55.9	47%	0.466	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-44.2	176.5	-66.5	174.2	0	0	0	111.4	L61 A62 G67 L68 L69	L61-L65 HydrophobicContact CG-CD1 4.43Å; L61-L65 WeakPolarHBondContact O-CG 3.29Å; L61-L65 PolarHBondContact O-N 2.88Å; A62-L65 PolarHBondContact O-N 3.35Å; L65-G67 VanDerWaalsContact C-N 3.31Å; L65-G67 PolarHBondContact O-N 2.8Å; L65-L68 WeakPolarHBondContact O-CB 3.27Å; L65-L68 PolarHBondContact O-N 2.93Å; L65-L68 VanDerWaalsContact O-N 3.16Å; L65-L69 WeakPolarHBondContact O-CG 3.44Å; L65-L69 PolarHBondContact O-N 3.1Å
66	C	89.3	Confident	86	Confident	59 Å²	59	55.9 Å²	55.9	40%	0.399	31%	0.307	S	S	.	.	H	α-helix	trans	-59.1	-42.5	173.2	-71.1	0	0	0	0	111.7	A62 L63 L68 L69 V70	A62-C66 WeakPolarHBondContact O-CB 3.48Å; A62-C66 PolarHBondContact O-N 2.9Å; A62-C66 PolarHBondContact O-SG 2.94Å; L63-C66 PolarHBondContact O-N 3.45Å; C66-L68 VanDerWaalsContact C-N 3.31Å; C66-L68 PolarHBondContact O-N 3.38Å; C66-L69 PolarHBondContact O-N 3.48Å; C66-V70 WeakPolarHBondContact O-CB 3.12Å; C66-V70 VanDerWaalsContact O-CG2 3.28Å; C66-V70 WeakPolarHBondContact O-CG2 3.47Å; C66-V70 PolarHBondContact O-N 3.43Å
67	G	87.7	Confident	84.9	Confident	8 Å²	8	57.1 Å²	57.1	8%	0.082	31%	0.313	C	S	.	.	H	α-helix	trans	-60.4	-39	175.2	0	0	0	0	0	112.8	L63 F64 L65 N71	L63-G67 PolarHBondContact O-N 3Å; F64-G67 PolarHBondContact O-N 3.48Å; L65-G67 VanDerWaalsContact C-N 3.31Å; L65-G67 PolarHBondContact O-N 2.8Å; G67-N71 WeakPolarHBondContact O-CB 3.48Å; G67-N71 PolarHBondContact O-N 3.27Å
68	L	86.4	Confident	83.8	Confident	43 Å²	43	56.7 Å²	56.7	23%	0.225	32%	0.315	C	S	.	.	H	α-helix	trans	-67.1	-45.3	172.8	-68	177.5	0	0	0	111.8	F64 L65 C66 N71 S74 V102 A106	F64-L68 HydrophobicContact CD1-CD1 4.16Å; F64-L68 HydrophobicContact CE1-CD1 3.57Å; F64-L68 HydrophobicContact CE1-CG 4.32Å; F64-L68 HydrophobicContact CE2-CD1 4.47Å; F64-L68 HydrophobicContact CE2-CG 4.42Å; F64-L68 HydrophobicContact CZ-CD1 3.76Å; F64-L68 HydrophobicContact CZ-CD2 4.34Å; F64-L68 HydrophobicContact CZ-CG 4.17Å; F64-L68 WeakPolarHBondContact O-CG 3.38Å; F64-L68 PolarHBondContact O-N 3.39Å; L65-L68 WeakPolarHBondContact O-CB 3.27Å; L65-L68 PolarHBondContact O-N 2.93Å; L65-L68 VanDerWaalsContact O-N 3.16Å; C66-L68 VanDerWaalsContact C-N 3.31Å; C66-L68 PolarHBondContact O-N 3.38Å; L68-N71 PolarHBondContact O-N 3.02Å; L68-S74 VanDerWaalsContact O-CB 3.29Å; L68-S74 WeakPolarHBondContact O-CB 3.43Å; L68-S74 PolarHBondContact O-OG 3.08Å; L68-V102 HydrophobicContact CD2-CG1 3.76Å; L68-A106 HydrophobicContact CD2-CB 3.75Å; L68-A106 HydrophobicContact CG-CB 4.06Å
69	L	86.2	Confident	82.7	Confident	140 Å²	140	57 Å²	57	73%	0.733	31%	0.31	S	S	*	.	H	α-helix	trans	-65.5	-40.6	-178.3	-70.6	172.5	0	0	0	112.9	L65 C66 N71	L65-L69 WeakPolarHBondContact O-CG 3.44Å; L65-L69 PolarHBondContact O-N 3.1Å; C66-L69 PolarHBondContact O-N 3.48Å; L69-N71 VanDerWaalsContact C-N 3.33Å
70	V	80.9	Confident	81.4	Confident	76 Å²	76	56.4 Å²	56.4	46%	0.461	31%	0.305	S	S	.	.	H	α-helix	trans	-73.4	-29.4	179.4	175.2	0	0	0	0	111.2	I22 C66 R72	I22-V70 HydrophobicContact CG2-CG1 3.78Å; C66-V70 WeakPolarHBondContact O-CB 3.12Å; C66-V70 VanDerWaalsContact O-CG2 3.28Å; C66-V70 WeakPolarHBondContact O-CG2 3.47Å; C66-V70 PolarHBondContact O-N 3.43Å; V70-R72 PolarHBondContact O-N 2.96Å; V70-R72 VanDerWaalsContact O-N 3.13Å
71	N	76.3	Confident	80.2	Confident	6 Å²	6	65.6 Å²	65.6	3%	0.032	34%	0.337	C	S	.	.			trans	-76.1	101.7	179.1	-175.4	-6.7	0	0	0	110.8	M19 G67 L68 L69 Q73 S74	M19-N71 HydrophobicContact SD-CB 4.44Å; M19-N71 PolarHBondContact SD-OD1 3.32Å; G67-N71 WeakPolarHBondContact O-CB 3.48Å; G67-N71 PolarHBondContact O-N 3.27Å; L68-N71 PolarHBondContact O-N 3.02Å; L69-N71 VanDerWaalsContact C-N 3.33Å; N71-Q73 PolarHBondContact O-N 2.95Å; N71-Q73 VanDerWaalsContact OD1-CB 3.29Å; N71-Q73 WeakPolarHBondContact OD1-CB 3.46Å; N71-Q73 PolarHBondContact OD1-N 2.86Å; N71-S74 VanDerWaalsContact O-CB 3.28Å; N71-S74 WeakPolarHBondContact O-CB 3.45Å; N71-S74 PolarHBondContact O-N 3.31Å; N71-S74 PolarHBondContact O-OG 3.07Å
72	R	71.9	Confident	78.9	Confident	158 Å²	158	71.2 Å²	71.2	60%	0.596	35%	0.352	S	S	*	.	H	α-helix	trans	-52.9	-30.1	176.7	-70.2	-173.2	175.4	-168.4	-3.4	113.9	V70 S74 V75 V76 D228	V70-R72 PolarHBondContact O-N 2.96Å; V70-R72 VanDerWaalsContact O-N 3.13Å; R72-S74 PolarHBondContact O-N 3.32Å; R72-V75 PolarHBondContact O-N 2.95Å; R72-V76 PolarHBondContact O-N 2.77Å; R72-D228 IonicContact NH1-OD2 3.48Å; R72-D228 PolarHBondContact NH1-OD2 3.01Å
73	Q	70.6	Confident	77.5	Confident	12 Å²	12	71 Å²	71	6%	0.056	34%	0.34	C	S	.	.	H	α-helix	trans	-68.4	-18.9	178.1	-62.6	178.9	-9	0	0	113	M19 N71 M77 V102 R105 D221	M19-Q73 HydrophobicContact CE-CG 3.92Å; N71-Q73 PolarHBondContact O-N 2.95Å; N71-Q73 VanDerWaalsContact OD1-CB 3.29Å; N71-Q73 WeakPolarHBondContact OD1-CB 3.46Å; N71-Q73 PolarHBondContact OD1-N 2.86Å; Q73-M77 WeakPolarHBondContact O-CB 3.49Å; Q73-M77 PolarHBondContact O-N 3.28Å; Q73-V102 HydrophobicContact CB-CG2 3.91Å; Q73-R105 VanDerWaalsContact CD-NH1 3.26Å; Q73-D221 PolarHBondContact NE2-OD1 3.3Å; Q73-D221 PolarHBondContact NE2-OD2 3.35Å
74	S	73.3	Confident	75.9	Confident	13 Å²	13	75.5 Å²	75.5	9%	0.091	37%	0.371	C	S	.	.	H	α-helix	trans	-68.5	-39.4	175.6	75.9	0	0	0	0	111.6	L68 N71 R72 M77 V78	L68-S74 VanDerWaalsContact O-CB 3.29Å; L68-S74 WeakPolarHBondContact O-CB 3.43Å; L68-S74 PolarHBondContact O-OG 3.08Å; N71-S74 VanDerWaalsContact O-CB 3.28Å; N71-S74 WeakPolarHBondContact O-CB 3.45Å; N71-S74 PolarHBondContact O-N 3.31Å; N71-S74 PolarHBondContact O-OG 3.07Å; R72-S74 PolarHBondContact O-N 3.32Å; S74-M77 WeakPolarHBondContact O-CB 3.28Å; S74-M77 PolarHBondContact O-N 2.88Å; S74-V78 WeakPolarHBondContact O-CG2 3.41Å; S74-V78 PolarHBondContact O-N 3.2Å
75	V	72.8	Confident	74	Confident	74 Å²	74	78.6 Å²	78.6	45%	0.448	40%	0.404	S	S	.	.	H	α-helix	trans	-66.9	-47.4	177.7	179.8	0	0	0	0	109.7	R72 M77 V78 E79	R72-V75 PolarHBondContact O-N 2.95Å; V75-M77 VanDerWaalsContact C-N 3.25Å; V75-M77 PolarHBondContact O-N 3.34Å; V75-V78 PolarHBondContact O-N 3.18Å; V75-V78 VanDerWaalsContact O-N 3.08Å; V75-E79 HydrophobicContact CG1-CG 4.36Å; V75-E79 WeakPolarHBondContact O-CG 3.35Å; V75-E79 PolarHBondContact O-N 3.43Å
76	V	70.2	Confident	72.1	Confident	28 Å²	28	77.6 Å²	77.6	17%	0.17	42%	0.415	C	S	.	.	H	α-helix	trans	-56	-43.4	173.9	178.9	0	0	0	0	110.2	R72 V78 E80 M98	R72-V76 PolarHBondContact O-N 2.77Å; V76-V78 PolarHBondContact O-N 3.08Å; V76-E80 HydrophobicContact CG1-CG 4.09Å; V76-E80 WeakPolarHBondContact O-CB 3.18Å; V76-E80 WeakPolarHBondContact O-CG 3.45Å; V76-E80 PolarHBondContact O-N 3.42Å; V76-M98 HydrophobicContact CG1-CE 4.28Å
77	M	70.3	Confident	70.1	Confident	48 Å²	48	83.4 Å²	83.4	24%	0.236	44%	0.436	C	S	.	.	H	α-helix	trans	-60.8	-42.1	176.7	-176.8	-169.7	73	0	0	112.9	Q73 S74 V75 W81 C99	Q73-M77 WeakPolarHBondContact O-CB 3.49Å; Q73-M77 PolarHBondContact O-N 3.28Å; S74-M77 WeakPolarHBondContact O-CB 3.28Å; S74-M77 PolarHBondContact O-N 2.88Å; V75-M77 VanDerWaalsContact C-N 3.25Å; V75-M77 PolarHBondContact O-N 3.34Å; M77-W81 WeakPolarHBondContact O-CB 3.23Å; M77-W81 PolarHBondContact O-N 2.87Å; M77-C99 HydrophobicContact SD-CB 3.92Å
78	V	73.5	Confident	68.4	Low	90 Å²	90	86.8 Å²	86.8	55%	0.545	45%	0.446	S	S	.	.	H	α-helix	trans	-71.1	-44.9	-179.8	172.3	0	0	0	0	111.6	S74 V75 V76 E80 W81 R82	S74-V78 WeakPolarHBondContact O-CG2 3.41Å; S74-V78 PolarHBondContact O-N 3.2Å; V75-V78 PolarHBondContact O-N 3.18Å; V75-V78 VanDerWaalsContact O-N 3.08Å; V76-V78 PolarHBondContact O-N 3.08Å; V78-E80 VanDerWaalsContact C-N 3.26Å; V78-E80 PolarHBondContact O-N 3.03Å; V78-W81 PolarHBondContact O-N 3.3Å; V78-R82 WeakPolarHBondContact O-CB 3.36Å; V78-R82 PolarHBondContact O-N 3.25Å
79	E	71.4	Confident	66.7	Low	99 Å²	99	92.7 Å²	92.7	46%	0.463	47%	0.47	S	S	.	.	H	α-helix	trans	-59.8	-42.7	173.7	-74	-179.9	177.7	0	0	110.9	V75 R82 R83 Y303	V75-E79 HydrophobicContact CG1-CG 4.36Å; V75-E79 WeakPolarHBondContact O-CG 3.35Å; V75-E79 PolarHBondContact O-N 3.43Å; E79-R82 PolarHBondContact O-N 3.49Å; E79-R83 PolarHBondContact O-N 3.48Å; E79-Y303 PolarHBondContact O-OH 3.4Å
80	E	67.7	Low	65.2	Low	17 Å²	17	88.1 Å²	88.1	8%	0.079	44%	0.444	C	S	.	.	H	α-helix	trans	-60.2	-52.2	174	-71.2	-69	120.7	0	0	109.1	V76 V78 R82 R83 R88 K90	V76-E80 HydrophobicContact CG1-CG 4.09Å; V76-E80 WeakPolarHBondContact O-CB 3.18Å; V76-E80 WeakPolarHBondContact O-CG 3.45Å; V76-E80 PolarHBondContact O-N 3.42Å; V78-E80 VanDerWaalsContact C-N 3.26Å; V78-E80 PolarHBondContact O-N 3.03Å; E80-R82 PolarHBondContact O-N 3.14Å; E80-R82 VanDerWaalsContact O-N 3.12Å; E80-R83 PolarHBondContact O-N 2.92Å; E80-R83 VanDerWaalsContact O-N 3.15Å; E80-R83 IonicContact OE1-CZ 3.98Å; E80-R83 IonicContact OE1-NE 3.99Å; E80-R83 PolarHBondContact OE1-NE 3.01Å; E80-R83 VanDerWaalsContact OE1-NE 3.08Å; E80-R83 IonicContact OE1-NH2 3.69Å; E80-R83 PolarHBondContact OE1-NH2 3.37Å; E80-R88 VanDerWaalsContact C-NH1 3.35Å; E80-R88 PolarHBondContact O-NH1 3.33Å; E80-R88 PolarHBondContact O-NH2 3.45Å; E80-R88 IonicContact OE1-NH2 2.8Å; E80-R88 IonicContact OE2-CZ 2.83Å; E80-R88 IonicContact OE2-NE 3.08Å; E80-R88 PolarHBondContact OE2-NE 3.31Å; E80-R88 IonicContact OE2-NH2 3.17Å; E80-R88 PolarHBondContact OE2-NH2 2.97Å; E80-K90 WeakPolarHBondContact OE2-CE 3.33Å; E80-K90 IonicContact OE2-NZ 3.72Å; E80-K90 PolarHBondContact OE2-NZ 3.41Å
81	W	68	Low	64.3	Low	203 Å²	203	89.4 Å²	89.4	77%	0.769	45%	0.449	S	S	*	.	H	α-helix	trans	-55	-33.7	178.5	-168.4	-89.5	0	0	0	114.1	M77 V78 R83 I95	M77-W81 WeakPolarHBondContact O-CB 3.23Å; M77-W81 PolarHBondContact O-N 2.87Å; V78-W81 PolarHBondContact O-N 3.3Å; W81-R83 PolarHBondContact O-N 3.37Å; W81-I95 HydrophobicContact CE3-CG2 4.33Å; W81-I95 HydrophobicContact CZ3-CG2 4.16Å
82	R	67.8	Low	63.8	Low	220 Å²	220	93.8 Å²	93.8	83%	0.83	47%	0.472	S	S	*	.	H	α-helix	trans	-79.5	-8.5	-177.2	-162.8	177.6	177.9	-167.4	-0.3	114.8	V78 E79 E80	V78-R82 WeakPolarHBondContact O-CB 3.36Å; V78-R82 PolarHBondContact O-N 3.25Å; E79-R82 PolarHBondContact O-N 3.49Å; E80-R82 PolarHBondContact O-N 3.14Å; E80-R82 VanDerWaalsContact O-N 3.12Å
83	R	65.3	Low	63.6	Low	45 Å²	45	88.1 Å²	88.1	17%	0.17	46%	0.462	C	S	.	.	S	Bend	trans	-62.5	137.1	-179.9	-77.4	-167.7	-162.2	-145.3	3.8	112.8	E79 E80 W81 R88 Y303	E79-R83 PolarHBondContact O-N 3.48Å; E80-R83 PolarHBondContact O-N 2.92Å; E80-R83 VanDerWaalsContact O-N 3.15Å; E80-R83 IonicContact OE1-CZ 3.98Å; E80-R83 IonicContact OE1-NE 3.99Å; E80-R83 PolarHBondContact OE1-NE 3.01Å; E80-R83 VanDerWaalsContact OE1-NE 3.08Å; E80-R83 IonicContact OE1-NH2 3.69Å; E80-R83 PolarHBondContact OE1-NH2 3.37Å; W81-R83 PolarHBondContact O-N 3.37Å; R83-R88 VanDerWaalsContact CD-NH2 3.33Å; R83-Y303 HydrophobicContact CG-CE1 3.6Å; R83-Y303 HydrophobicContact CG-CE2 4.42Å; R83-Y303 WeakPolarHBondContact CG-OH 3.25Å; R83-Y303 PolarHBondContact NE-OH 3.45Å; R83-Y303 PolarHBondContact NH1-O 2.99Å
84	P	58.8	Low	63.4	Low	114 Å²	114	88.1 Å²	88.1	74%	0.74	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-56.5	139.8	174.9	-21.7	30.7	0	0	0	112.6	G86	P84-G86 PolarHBondContact O-N 3.47Å
85	A	54.3	Low	63.2	Low	109 Å²	109	89.6 Å²	89.6	90%	0.901	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	124.4	174.5	0	0	0	0	0	110
86	G	50.8	Low	63.1	Low	67 Å²	67	94.3 Å²	94.3	69%	0.691	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	160	-30	175.4	0	0	0	0	0	115.6	P84	P84-G86 PolarHBondContact O-N 3.47Å
87	H	48.3	Very low	63.2	Low	181 Å²	181	95.2 Å²	95.2	84%	0.838	48%	0.479	S	S	*	.	S	Bend	trans	-120.6	6.9	-178.6	-72.3	82.1	0	0	0	114.1
88	R	52.2	Low	63.2	Low	79 Å²	79	93.9 Å²	93.9	30%	0.298	47%	0.473	S	S	.	.			trans	-103.4	105.4	-176.7	-118.7	-159.1	-161.7	136.1	24.7	112	E80 R83 K90	E80-R88 VanDerWaalsContact C-NH1 3.35Å; E80-R88 PolarHBondContact O-NH1 3.33Å; E80-R88 PolarHBondContact O-NH2 3.45Å; E80-R88 IonicContact OE1-NH2 2.8Å; E80-R88 IonicContact OE2-CZ 2.83Å; E80-R88 IonicContact OE2-NE 3.08Å; E80-R88 PolarHBondContact OE2-NE 3.31Å; E80-R88 IonicContact OE2-NH2 3.17Å; E80-R88 PolarHBondContact OE2-NH2 2.97Å; R83-R88 VanDerWaalsContact CD-NH2 3.33Å; R88-K90 HydrophobicContact CG-CB 4.47Å; R88-K90 HydrophobicContact CG-CD 4.48Å; R88-K90 HydrophobicContact CG-CG 4.1Å
89	K	49.5	Very low	63.3	Low	168 Å²	168	92.3 Å²	92.3	73%	0.73	47%	0.465	S	S	*	.			trans	-100.2	70.4	148.8	-72.2	-174.7	179.2	-176.5	0	108
90	K	54.5	Low	63.5	Low	43 Å²	43	90.1 Å²	90.1	19%	0.187	46%	0.461	C	S	.	.			trans	-93.9	120.9	159.1	-72.1	-169.7	-179.2	-165.7	0	105.7	E80 R88 L92 L309	E80-K90 WeakPolarHBondContact OE2-CE 3.33Å; E80-K90 IonicContact OE2-NZ 3.72Å; E80-K90 PolarHBondContact OE2-NZ 3.41Å; R88-K90 HydrophobicContact CG-CB 4.47Å; R88-K90 HydrophobicContact CG-CD 4.48Å; R88-K90 HydrophobicContact CG-CG 4.1Å; K90-L92 PolarHBondContact O-N 2.93Å; K90-L309 HydrophobicContact CD-CD1 3.41Å; K90-L309 VanDerWaalsContact CD-CD1 3.41Å; K90-L309 HydrophobicContact CD-CG 4.1Å; K90-L309 HydrophobicContact CG-CB 4.24Å; K90-L309 HydrophobicContact CG-CD1 3.71Å; K90-L309 HydrophobicContact CG-CG 3.96Å
91	D	63.1	Low	63.8	Low	103 Å²	103	89.8 Å²	89.8	55%	0.551	46%	0.46	S	S	*	.			trans	-52.4	134.6	173.9	-179.4	7.3	0	0	0	109.2	G93 I94	D91-G93 PolarHBondContact O-N 2.9Å; D91-G93 VanDerWaalsContact O-N 3.08Å; D91-G93 PolarHBondContact OD1-N 2.91Å; D91-I94 HydrophobicContact CB-CD1 4.14Å; D91-I94 HydrophobicContact CB-CG1 4.22Å; D91-I94 WeakPolarHBondContact O-CB 3.2Å; D91-I94 PolarHBondContact O-N 3.4Å
92	L	66.4	Low	64.5	Low	99 Å²	99	80.2 Å²	80.2	52%	0.518	42%	0.424	S	S	.	.	H	α-helix	trans	-54.5	-28.7	178.1	-173.6	66.1	0	0	0	111.1	K90 I94 I95 R96	K90-L92 PolarHBondContact O-N 2.93Å; L92-I94 VanDerWaalsContact C-N 3.3Å; L92-I94 PolarHBondContact O-N 2.63Å; L92-I95 PolarHBondContact O-N 3.31Å; L92-R96 WeakPolarHBondContact O-CG 3.33Å; L92-R96 PolarHBondContact O-N 2.92Å; L92-R96 VanDerWaalsContact O-N 3.1Å
93	G	66.3	Low	65.3	Low	38 Å²	38	73.3 Å²	73.3	39%	0.392	40%	0.403	S	S	.	.	H	α-helix	trans	-57.8	-37.2	172.3	0	0	0	0	0	113.9	D91 Y97	D91-G93 PolarHBondContact O-N 2.9Å; D91-G93 VanDerWaalsContact O-N 3.08Å; D91-G93 PolarHBondContact OD1-N 2.91Å; G93-Y97 WeakPolarHBondContact O-CB 3.37Å; G93-Y97 PolarHBondContact O-N 3.47Å
94	I	66.8	Low	66	Low	13 Å²	13	77.7 Å²	77.7	7%	0.067	43%	0.426	C	S	.	.	H	α-helix	trans	-71.6	-42.8	-178.5	-60.2	171.9	0	0	0	110.6	D91 L92 Y97 M98 W216 L309	D91-I94 HydrophobicContact CB-CD1 4.14Å; D91-I94 HydrophobicContact CB-CG1 4.22Å; D91-I94 WeakPolarHBondContact O-CB 3.2Å; D91-I94 PolarHBondContact O-N 3.4Å; L92-I94 VanDerWaalsContact C-N 3.3Å; L92-I94 PolarHBondContact O-N 2.63Å; I94-Y97 PolarHBondContact O-N 3.46Å; I94-M98 WeakPolarHBondContact O-CG 3.43Å; I94-M98 PolarHBondContact O-N 2.86Å; I94-W216 HydrophobicContact CG2-CD2 4.31Å; I94-W216 HydrophobicContact CG2-CG 4.31Å; I94-L309 HydrophobicContact CD1-CB 3.94Å; I94-L309 HydrophobicContact CD1-CD1 4.43Å; I94-L309 HydrophobicContact CG2-CD1 4.26Å
95	I	69.5	Low	67.1	Low	43 Å²	43	74 Å²	74	22%	0.221	40%	0.397	C	S	.	.	H	α-helix	trans	-64.9	-45.6	178.1	-63	175.5	0	0	0	110.5	W81 L92 Y97 M98 C99	W81-I95 HydrophobicContact CE3-CG2 4.33Å; W81-I95 HydrophobicContact CZ3-CG2 4.16Å; L92-I95 PolarHBondContact O-N 3.31Å; I95-Y97 VanDerWaalsContact C-N 3.26Å; I95-Y97 PolarHBondContact O-N 3.38Å; I95-M98 PolarHBondContact O-N 2.93Å; I95-C99 WeakPolarHBondContact O-CB 3.32Å; I95-C99 PolarHBondContact O-N 3.33Å
96	R	71.2	Confident	68.7	Low	173 Å²	173	69 Å²	69	65%	0.653	36%	0.355	S	S	*	.	H	α-helix	trans	-59.3	-39.9	175.8	-74	178.2	176	-177.6	-0.3	111.7	L92 S100	L92-R96 WeakPolarHBondContact O-CG 3.33Å; L92-R96 PolarHBondContact O-N 2.92Å; L92-R96 VanDerWaalsContact O-N 3.1Å; R96-S100 WeakPolarHBondContact O-CB 3.43Å; R96-S100 PolarHBondContact O-N 3.3Å
97	Y	71.5	Confident	70.6	Confident	47 Å²	47	69.1 Å²	69.1	18%	0.184	34%	0.34	C	S	.	.	H	α-helix	trans	-65.6	-48.5	176.8	171.7	-109.2	0	0	0	112.7	G93 I94 I95 C99 S100 S101 R213	G93-Y97 WeakPolarHBondContact O-CB 3.37Å; G93-Y97 PolarHBondContact O-N 3.47Å; I94-Y97 PolarHBondContact O-N 3.46Å; I95-Y97 VanDerWaalsContact C-N 3.26Å; I95-Y97 PolarHBondContact O-N 3.38Å; Y97-C99 VanDerWaalsContact C-N 3.31Å; Y97-C99 PolarHBondContact O-N 2.84Å; Y97-S100 PolarHBondContact O-N 2.9Å; Y97-S101 PolarHBondContact O-N 3.21Å; Y97-R213 HydrophobicContact CD1-CB 4.38Å; Y97-R213 HydrophobicContact CD1-CG 4.05Å; Y97-R213 HydrophobicContact CD2-CB 4.15Å; Y97-R213 VanDerWaalsContact CD2-CD 3.42Å; Y97-R213 HydrophobicContact CD2-CG 3.5Å; Y97-R213 HydrophobicContact CE1-CB 3.92Å; Y97-R213 HydrophobicContact CE1-CG 4.1Å; Y97-R213 WeakPolarHBondContact CE1-O 3.47Å; Y97-R213 HydrophobicContact CE2-CB 3.68Å; Y97-R213 VanDerWaalsContact CE2-CD 3.49Å; Y97-R213 HydrophobicContact CE2-CG 3.56Å; Y97-R213 HydrophobicContact CG-CB 4.46Å; Y97-R213 HydrophobicContact CG-CG 3.75Å; Y97-R213 PolarHBondContact OH-O 3.36Å
98	M	71.1	Confident	72.4	Confident	20 Å²	20	61.8 Å²	61.8	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-58	-45.4	177.4	-72.6	-176.6	70.1	0	0	111.2	V76 I94 I95 S100 S101 V102 W216	V76-M98 HydrophobicContact CG1-CE 4.28Å; I94-M98 WeakPolarHBondContact O-CG 3.43Å; I94-M98 PolarHBondContact O-N 2.86Å; I95-M98 PolarHBondContact O-N 2.93Å; M98-S100 PolarHBondContact O-N 3.22Å; M98-S101 PolarHBondContact O-N 3.1Å; M98-V102 WeakPolarHBondContact O-CG2 3.43Å; M98-V102 PolarHBondContact O-N 2.85Å; M98-W216 HydrophobicContact SD-CZ2 4.5Å; M98-W216 PolarHBondContact SD-NE1 3.11Å
99	C	75.9	Confident	74.2	Confident	58 Å²	58	58.2 Å²	58.2	39%	0.392	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-45.9	175.9	-177.4	0	0	0	0	112	M77 I95 Y97 S101 V102 L103	M77-C99 HydrophobicContact SD-CB 3.92Å; I95-C99 WeakPolarHBondContact O-CB 3.32Å; I95-C99 PolarHBondContact O-N 3.33Å; Y97-C99 VanDerWaalsContact C-N 3.31Å; Y97-C99 PolarHBondContact O-N 2.84Å; C99-S101 PolarHBondContact O-N 3.3Å; C99-V102 PolarHBondContact O-N 3.28Å; C99-L103 VanDerWaalsContact O-CB 3.24Å; C99-L103 WeakPolarHBondContact O-CB 3.36Å; C99-L103 PolarHBondContact O-N 2.88Å
100	S	74.6	Confident	76.4	Confident	52 Å²	52	50.6 Å²	50.6	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-42.1	177.5	-178	0	0	0	0	112.4	R96 Y97 M98 L103 Q104	R96-S100 WeakPolarHBondContact O-CB 3.43Å; R96-S100 PolarHBondContact O-N 3.3Å; Y97-S100 PolarHBondContact O-N 2.9Å; M98-S100 PolarHBondContact O-N 3.22Å; S100-L103 PolarHBondContact O-N 3.3Å; S100-Q104 WeakPolarHBondContact O-CB 3.43Å; S100-Q104 WeakPolarHBondContact O-CG 3.42Å; S100-Q104 PolarHBondContact O-N 3.24Å
101	S	75.1	Confident	78.1	Confident	10 Å²	10	51.3 Å²	51.3	7%	0.07	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-47.9	177.5	-180	0	0	0	0	112	Y97 M98 C99 L103 Q104 R105	Y97-S101 PolarHBondContact O-N 3.21Å; M98-S101 PolarHBondContact O-N 3.1Å; C99-S101 PolarHBondContact O-N 3.3Å; S101-L103 VanDerWaalsContact C-N 3.35Å; S101-L103 PolarHBondContact O-N 2.9Å; S101-Q104 PolarHBondContact O-N 3.23Å; S101-R105 WeakPolarHBondContact O-CD 3.43Å; S101-R105 WeakPolarHBondContact O-CG 3.3Å; S101-R105 PolarHBondContact O-N 2.86Å
102	V	81.5	Confident	79.5	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-45.9	177.6	171.1	0	0	0	0	110.6	L68 Q73 M98 C99 R105 A106	L68-V102 HydrophobicContact CD2-CG1 3.76Å; Q73-V102 HydrophobicContact CB-CG2 3.91Å; M98-V102 WeakPolarHBondContact O-CG2 3.43Å; M98-V102 PolarHBondContact O-N 2.85Å; C99-V102 PolarHBondContact O-N 3.28Å; V102-R105 PolarHBondContact O-N 3.39Å; V102-A106 WeakPolarHBondContact O-CB 3.48Å; V102-A106 PolarHBondContact O-N 3.48Å
103	L	84.6	Confident	80.9	Confident	74 Å²	74	44.2 Å²	44.2	39%	0.387	23%	0.233	S	C	.	.	H	α-helix	trans	-66.1	-43.9	-178.3	-170.9	70.6	0	0	0	112.1	F64 C99 S100 S101 R105 A106 L107	F64-L103 HydrophobicContact CE2-CD1 3.59Å; F64-L103 HydrophobicContact CZ-CD1 3.61Å; C99-L103 VanDerWaalsContact O-CB 3.24Å; C99-L103 WeakPolarHBondContact O-CB 3.36Å; C99-L103 PolarHBondContact O-N 2.88Å; S100-L103 PolarHBondContact O-N 3.3Å; S101-L103 VanDerWaalsContact C-N 3.35Å; S101-L103 PolarHBondContact O-N 2.9Å; L103-R105 VanDerWaalsContact C-N 3.25Å; L103-R105 PolarHBondContact O-N 2.96Å; L103-A106 PolarHBondContact O-N 2.94Å; L103-L107 HydrophobicContact CD1-CD1 4.16Å; L103-L107 HydrophobicContact CD1-CG 4.25Å; L103-L107 HydrophobicContact CD2-CD1 4.28Å; L103-L107 HydrophobicContact CG-CD1 3.74Å; L103-L107 HydrophobicContact CG-CG 4.23Å; L103-L107 WeakPolarHBondContact O-CB 3.45Å; L103-L107 VanDerWaalsContact O-CG 3.28Å; L103-L107 WeakPolarHBondContact O-CG 3.43Å; L103-L107 PolarHBondContact O-N 3.45Å
104	Q	80.6	Confident	82.3	Confident	137 Å²	137	43.8 Å²	43.8	64%	0.64	22%	0.222	S	C	*	.	H	α-helix	trans	-58	-38.7	177.5	-79.5	176.4	-20.8	0	0	112.2	S100 S101	S100-Q104 WeakPolarHBondContact O-CB 3.43Å; S100-Q104 WeakPolarHBondContact O-CG 3.42Å; S100-Q104 PolarHBondContact O-N 3.24Å; S101-Q104 PolarHBondContact O-N 3.23Å
105	R	80.9	Confident	83.7	Confident	38 Å²	38	44.5 Å²	44.5	14%	0.143	23%	0.226	C	C	.	.	H	α-helix	trans	-74.1	-43.3	178.4	-68.8	161.5	174.9	-179.9	8.2	112.1	M19 Q73 S101 V102 L103 L107 A108	M19-R105 HydrophobicContact CG-CG 4.37Å; M19-R105 PolarHBondContact SD-NH1 3.3Å; M19-R105 VanDerWaalsContact SD-NH1 3.4Å; Q73-R105 VanDerWaalsContact CD-NH1 3.26Å; S101-R105 WeakPolarHBondContact O-CD 3.43Å; S101-R105 WeakPolarHBondContact O-CG 3.3Å; S101-R105 PolarHBondContact O-N 2.86Å; V102-R105 PolarHBondContact O-N 3.39Å; L103-R105 VanDerWaalsContact C-N 3.25Å; L103-R105 PolarHBondContact O-N 2.96Å; R105-L107 VanDerWaalsContact C-N 3.31Å; R105-L107 PolarHBondContact O-N 3.27Å; R105-A108 PolarHBondContact O-N 3.34Å
106	A	88.4	Confident	84.8	Confident	2 Å²	2	44.7 Å²	44.7	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-68.7	-28	179.9	0	0	0	0	0	113.2	F64 L68 V102 L103 P110	F64-A106 HydrophobicContact CD2-CB 3.93Å; F64-A106 HydrophobicContact CE2-CB 3.81Å; L68-A106 HydrophobicContact CD2-CB 3.75Å; L68-A106 HydrophobicContact CG-CB 4.06Å; V102-A106 WeakPolarHBondContact O-CB 3.48Å; V102-A106 PolarHBondContact O-N 3.48Å; L103-A106 PolarHBondContact O-N 2.94Å; A106-P110 WeakPolarHBondContact O-CD 3.23Å; A106-P110 WeakPolarHBondContact O-CG 3.4Å
107	L	89.9	Confident	86	Confident	70 Å²	70	36.5 Å²	36.5	37%	0.366	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-15.1	-179.6	-76.3	174.1	0	0	0	114.6	F64 L103 R105 A109 P110 M111	F64-L107 HydrophobicContact CD2-CD2 3.78Å; F64-L107 HydrophobicContact CD2-CG 4.25Å; F64-L107 HydrophobicContact CE2-CD2 3.87Å; F64-L107 HydrophobicContact CE2-CG 4.06Å; L103-L107 HydrophobicContact CD1-CD1 4.16Å; L103-L107 HydrophobicContact CD1-CG 4.25Å; L103-L107 HydrophobicContact CD2-CD1 4.28Å; L103-L107 HydrophobicContact CG-CD1 3.74Å; L103-L107 HydrophobicContact CG-CG 4.23Å; L103-L107 WeakPolarHBondContact O-CB 3.45Å; L103-L107 VanDerWaalsContact O-CG 3.28Å; L103-L107 WeakPolarHBondContact O-CG 3.43Å; L103-L107 PolarHBondContact O-N 3.45Å; R105-L107 VanDerWaalsContact C-N 3.31Å; R105-L107 PolarHBondContact O-N 3.27Å; L107-A109 PolarHBondContact O-N 3.31Å; L107-P110 WeakPolarHBondContact O-CD 3.38Å; L107-M111 WeakPolarHBondContact O-CB 3.4Å; L107-M111 WeakPolarHBondContact O-CG 3.35Å; L107-M111 PolarHBondContact O-N 2.97Å
108	A	87.6	Confident	87.2	Confident	27 Å²	27	34.8 Å²	34.8	22%	0.223	19%	0.19	C	C	.	.	H	α-helix	trans	-60	-51.8	-174.1	0	0	0	0	0	113.5	C23 R105 M111 V112	C23-A108 WeakPolarHBondContact SG-CB 3.36Å; R105-A108 PolarHBondContact O-N 3.34Å; A108-M111 PolarHBondContact O-N 3.39Å; A108-V112 WeakPolarHBondContact O-CG2 3.34Å; A108-V112 PolarHBondContact O-N 3.39Å
109	A	89.9	Confident	88.3	Confident	4 Å²	4	36.4 Å²	36.4	3%	0.033	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-45.3	177.9	0	0	0	0	0	113.5	L26 L63 L107 M111 V112 W113	L26-A109 HydrophobicContact CB-CB 4.08Å; L63-A109 HydrophobicContact CB-CB 4.33Å; L107-A109 PolarHBondContact O-N 3.31Å; A109-M111 VanDerWaalsContact C-N 3.3Å; A109-M111 PolarHBondContact O-N 3.03Å; A109-V112 PolarHBondContact O-N 3.47Å; A109-W113 PolarHBondContact O-N 3.47Å
110	P	94.2	Very high	89.1	Confident	8 Å²	8	35.6 Å²	35.6	5%	0.052	19%	0.19	C	C	.	.	H	α-helix	trans	-52.5	-44	171.1	-29	33.2	0	0	0	113.9	S60 L63 F64 A106 L107 W113 I114	S60-P110 WeakPolarHBondContact O-CG 3.49Å; S60-P110 PolarHBondContact OG-O 2.87Å; L63-P110 HydrophobicContact CB-CG 4.14Å; F64-P110 HydrophobicContact CB-CG 3.61Å; F64-P110 HydrophobicContact CD2-CG 4.41Å; A106-P110 WeakPolarHBondContact O-CD 3.23Å; A106-P110 WeakPolarHBondContact O-CG 3.4Å; L107-P110 WeakPolarHBondContact O-CD 3.38Å; P110-W113 PolarHBondContact O-N 3.43Å; P110-I114 WeakPolarHBondContact O-CG1 3.44Å; P110-I114 PolarHBondContact O-N 2.66Å
111	M	91.8	Very high	90.1	Very high	59 Å²	59	33.1 Å²	33.1	29%	0.291	17%	0.173	S	C	.	.	H	α-helix	trans	-65.6	-41.6	178.5	-71.1	-56.6	-63.5	0	0	111.6	L107 A108 A109 W113 I114 L115 I187 L191	L107-M111 WeakPolarHBondContact O-CB 3.4Å; L107-M111 WeakPolarHBondContact O-CG 3.35Å; L107-M111 PolarHBondContact O-N 2.97Å; A108-M111 PolarHBondContact O-N 3.39Å; A109-M111 VanDerWaalsContact C-N 3.3Å; A109-M111 PolarHBondContact O-N 3.03Å; M111-W113 VanDerWaalsContact C-N 3.33Å; M111-W113 PolarHBondContact O-N 3.37Å; M111-I114 PolarHBondContact O-N 3.33Å; M111-L115 WeakPolarHBondContact O-CB 3.33Å; M111-L115 VanDerWaalsContact O-CG 3.28Å; M111-L115 WeakPolarHBondContact O-CG 3.42Å; M111-L115 PolarHBondContact O-N 2.98Å; M111-I187 HydrophobicContact CE-CG2 3.77Å; M111-L191 HydrophobicContact CE-CD1 3.81Å; M111-L191 HydrophobicContact CE-CD2 4.21Å; M111-L191 HydrophobicContact CE-CG 4.4Å
112	V	91.8	Very high	91	Very high	40 Å²	40	36.8 Å²	36.8	24%	0.242	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-45.1	174	171.4	0	0	0	0	110.7	A27 T30 V31 A108 A109 L115 L116	A27-V112 HydrophobicContact CB-CG2 4.17Å; T30-V112 HydrophobicContact CG2-CB 4.34Å; T30-V112 HydrophobicContact CG2-CG1 4.01Å; V31-V112 HydrophobicContact CG2-CG1 4.12Å; A108-V112 WeakPolarHBondContact O-CG2 3.34Å; A108-V112 PolarHBondContact O-N 3.39Å; A109-V112 PolarHBondContact O-N 3.47Å; V112-L115 PolarHBondContact O-N 2.96Å; V112-L116 HydrophobicContact CG1-CD1 3.88Å; V112-L116 HydrophobicContact CG1-CG 4.33Å; V112-L116 VanDerWaalsContact O-CG 3.27Å; V112-L116 WeakPolarHBondContact O-CG 3.35Å; V112-L116 PolarHBondContact O-N 3.26Å
113	W	95.4	Very high	91.7	Very high	13 Å²	13	36.9 Å²	36.9	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-50.1	176.9	-176.5	-86.3	0	0	0	112.3	T30 M33 Y34 L55 P59 L63 A109 P110 M111 L115 L116 A117	T30-W113 HydrophobicContact CG2-CB 3.89Å; T30-W113 HydrophobicContact CG2-CE3 3.89Å; M33-W113 HydrophobicContact CB-CZ3 4.31Å; Y34-W113 HydrophobicContact CD2-CD2 4.31Å; Y34-W113 HydrophobicContact CD2-CE3 4.24Å; Y34-W113 HydrophobicContact CD2-CH2 4.04Å; Y34-W113 HydrophobicContact CD2-CZ2 4.07Å; Y34-W113 HydrophobicContact CD2-CZ3 4.12Å; L55-W113 PolarHBondContact O-NE1 3.07Å; L55-W113 VanDerWaalsContact O-NE1 3.08Å; P59-W113 HydrophobicContact CB-CD2 3.81Å; P59-W113 HydrophobicContact CB-CE3 4.29Å; P59-W113 HydrophobicContact CB-CG 4.36Å; P59-W113 HydrophobicContact CB-CH2 3.97Å; P59-W113 HydrophobicContact CB-CZ2 3.46Å; P59-W113 VanDerWaalsContact CB-CZ2 3.46Å; P59-W113 HydrophobicContact CB-CZ3 4.36Å; P59-W113 HydrophobicContact CG-CH2 4.22Å; P59-W113 HydrophobicContact CG-CZ2 3.46Å; P59-W113 VanDerWaalsContact CG-CZ2 3.46Å; L63-W113 HydrophobicContact CD1-CB 3.97Å; L63-W113 HydrophobicContact CD1-CD2 4.44Å; L63-W113 HydrophobicContact CD1-CE3 4.15Å; L63-W113 HydrophobicContact CD1-CG 4.39Å; A109-W113 PolarHBondContact O-N 3.47Å; P110-W113 PolarHBondContact O-N 3.43Å; M111-W113 VanDerWaalsContact C-N 3.33Å; M111-W113 PolarHBondContact O-N 3.37Å; W113-L115 VanDerWaalsContact C-N 3.33Å; W113-L115 PolarHBondContact O-N 3.18Å; W113-L116 PolarHBondContact O-N 3.27Å; W113-A117 WeakPolarHBondContact O-CB 3.46Å; W113-A117 PolarHBondContact O-N 3.31Å
114	I	96	Very high	92.2	Very high	28 Å²	28	34.2 Å²	34.2	14%	0.144	17%	0.174	C	C	.	.	H	α-helix	trans	-58.6	-45.7	179.3	-68.3	-64.3	0	0	0	110.9	L56 L57 S60 P110 M111 A117 L118	L56-I114 HydrophobicContact CD1-CD1 3.84Å; L56-I114 HydrophobicContact CG-CD1 3.86Å; L56-I114 WeakPolarHBondContact O-CD1 3.5Å; L57-I114 HydrophobicContact CD2-CD1 4.36Å; S60-I114 WeakPolarHBondContact OG-CD1 3.47Å; S60-I114 WeakPolarHBondContact OG-CG1 3.45Å; P110-I114 WeakPolarHBondContact O-CG1 3.44Å; P110-I114 PolarHBondContact O-N 2.66Å; M111-I114 PolarHBondContact O-N 3.33Å; I114-A117 PolarHBondContact O-N 3.14Å; I114-L118 HydrophobicContact CG2-CD1 3.6Å; I114-L118 HydrophobicContact CG2-CG 4.23Å; I114-L118 WeakPolarHBondContact O-CB 3.3Å; I114-L118 VanDerWaalsContact O-CG 3.27Å; I114-L118 WeakPolarHBondContact O-CG 3.42Å; I114-L118 PolarHBondContact O-N 2.97Å
115	L	95.2	Very high	92.9	Very high	29 Å²	29	28.1 Å²	28.1	15%	0.152	15%	0.146	C	C	.	.	H	α-helix	trans	-63.1	-45.8	179.6	-71.6	174.9	0	0	0	111.8	M111 V112 W113 A117 L118 L119 G184 I187 T188 L191	M111-L115 WeakPolarHBondContact O-CB 3.33Å; M111-L115 VanDerWaalsContact O-CG 3.28Å; M111-L115 WeakPolarHBondContact O-CG 3.42Å; M111-L115 PolarHBondContact O-N 2.98Å; V112-L115 PolarHBondContact O-N 2.96Å; W113-L115 VanDerWaalsContact C-N 3.33Å; W113-L115 PolarHBondContact O-N 3.18Å; L115-A117 PolarHBondContact O-N 2.91Å; L115-L118 PolarHBondContact O-N 3.37Å; L115-L119 WeakPolarHBondContact O-CB 3.34Å; L115-L119 WeakPolarHBondContact O-CG 3.27Å; L115-L119 PolarHBondContact O-N 3.46Å; L115-G184 WeakPolarHBondContact CD2-O 3.43Å; L115-I187 HydrophobicContact CD2-CB 4.01Å; L115-I187 HydrophobicContact CD2-CG2 3.79Å; L115-T188 WeakPolarHBondContact CD2-OG1 3.28Å; L115-L191 HydrophobicContact CD1-CD1 4.18Å
116	L	94.1	Very high	93.6	Very high	47 Å²	47	26.3 Å²	26.3	25%	0.246	14%	0.139	C	C	.	.	H	α-helix	trans	-59.4	-46.9	176	-69.6	172.4	0	0	0	111.4	V31 Y34 V112 W113 L118 L119 D120	V31-L116 HydrophobicContact CB-CD1 4.4Å; V31-L116 HydrophobicContact CG2-CD1 3.97Å; Y34-L116 HydrophobicContact CD1-CB 3.94Å; Y34-L116 HydrophobicContact CD1-CD1 4.35Å; Y34-L116 HydrophobicContact CD2-CB 4.2Å; Y34-L116 HydrophobicContact CE1-CB 4.11Å; Y34-L116 HydrophobicContact CE2-CB 4.37Å; Y34-L116 HydrophobicContact CG-CB 4Å; Y34-L116 HydrophobicContact CG-CD1 4.12Å; V112-L116 HydrophobicContact CG1-CD1 3.88Å; V112-L116 HydrophobicContact CG1-CG 4.33Å; V112-L116 VanDerWaalsContact O-CG 3.27Å; V112-L116 WeakPolarHBondContact O-CG 3.35Å; V112-L116 PolarHBondContact O-N 3.26Å; W113-L116 PolarHBondContact O-N 3.27Å; L116-L118 PolarHBondContact O-N 2.92Å; L116-L119 PolarHBondContact O-N 3.45Å; L116-D120 WeakPolarHBondContact O-CB 3.49Å; L116-D120 PolarHBondContact O-N 2.98Å
117	A	95.3	Very high	94	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-63.4	-40.4	-179.9	0	0	0	0	0	113.2	Y34 L56 W113 I114 L115 G121	Y34-A117 HydrophobicContact CE2-CB 3.95Å; Y34-A117 WeakPolarHBondContact OH-CA 3.36Å; L56-A117 HydrophobicContact CD1-CB 3.49Å; L56-A117 VanDerWaalsContact CD1-CB 3.49Å; W113-A117 WeakPolarHBondContact O-CB 3.46Å; W113-A117 PolarHBondContact O-N 3.31Å; I114-A117 PolarHBondContact O-N 3.14Å; L115-A117 PolarHBondContact O-N 2.91Å; A117-G121 PolarHBondContact O-N 2.98Å
118	L	96.4	Very high	94.3	Very high	10 Å²	10	26.6 Å²	26.6	5%	0.052	14%	0.138	C	C	.	.	H	α-helix	trans	-71.3	-38.6	177.1	-72.9	172.5	0	0	0	112.4	L56 I114 L115 L116 G121 F124 S180 I183 I187	L56-L118 HydrophobicContact CD1-CG 4.41Å; I114-L118 HydrophobicContact CG2-CD1 3.6Å; I114-L118 HydrophobicContact CG2-CG 4.23Å; I114-L118 WeakPolarHBondContact O-CB 3.3Å; I114-L118 VanDerWaalsContact O-CG 3.27Å; I114-L118 WeakPolarHBondContact O-CG 3.42Å; I114-L118 PolarHBondContact O-N 2.97Å; L115-L118 PolarHBondContact O-N 3.37Å; L116-L118 PolarHBondContact O-N 2.92Å; L118-G121 PolarHBondContact O-N 2.95Å; L118-F124 HydrophobicContact CD2-CD2 4.12Å; L118-S180 WeakPolarHBondContact CA-OG 3.27Å; L118-S180 CarbonylContact O-C 3.59Å; L118-S180 WeakPolarHBondContact O-CB 3.33Å; L118-S180 PolarHBondContact O-OG 2.82Å; L118-I183 HydrophobicContact CD1-CG2 4.07Å; L118-I187 HydrophobicContact CD1-CD1 3.67Å
119	L	94.6	Very high	94.6	Very high	55 Å²	55	25.3 Å²	25.3	29%	0.288	13%	0.127	S	C	.	.	H	α-helix	trans	-71.9	-35.4	179.9	-69.8	172.5	0	0	0	112.6	L115 L116 Q181 W185	L115-L119 WeakPolarHBondContact O-CB 3.34Å; L115-L119 WeakPolarHBondContact O-CG 3.27Å; L115-L119 PolarHBondContact O-N 3.46Å; L116-L119 PolarHBondContact O-N 3.45Å; L119-Q181 WeakPolarHBondContact O-CG 3.48Å; L119-Q181 PolarHBondContact O-NE2 3.48Å; L119-Q181 VanDerWaalsContact O-NE2 3.08Å; L119-W185 HydrophobicContact CD2-CD2 4.44Å; L119-W185 HydrophobicContact CD2-CG 4.34Å
120	D	94.1	Very high	94.6	Very high	40 Å²	40	27.2 Å²	27.2	21%	0.214	14%	0.137	C	C	.	.	H	α-helix	trans	-69.9	-38.3	170.7	-171	16.9	0	0	0	111.5	Y34 L116 K122 R177	Y34-D120 HydrophobicContact CE1-CB 4.24Å; Y34-D120 WeakPolarHBondContact OH-CB 3.47Å; Y34-D120 PolarHBondContact OH-OD2 2.85Å; L116-D120 WeakPolarHBondContact O-CB 3.49Å; L116-D120 PolarHBondContact O-N 2.98Å; D120-K122 VanDerWaalsContact C-N 3.25Å; D120-K122 PolarHBondContact O-N 2.82Å; D120-K122 VanDerWaalsContact OD1-CE 3.29Å; D120-K122 WeakPolarHBondContact OD1-CE 3.48Å; D120-K122 IonicContact OD1-NZ 2.73Å; D120-K122 PolarHBondContact OD1-NZ 3.43Å; D120-K122 WeakPolarHBondContact OD2-CD 3.42Å; D120-K122 WeakPolarHBondContact OD2-CE 3.29Å; D120-K122 WeakPolarHBondContact OD2-CG 3.39Å; D120-K122 IonicContact OD2-NZ 3.04Å; D120-K122 PolarHBondContact OD2-NZ 3.21Å; D120-R177 PolarHBondContact O-NE 3.34Å; D120-R177 VanDerWaalsContact O-NE 3.1Å; D120-R177 PolarHBondContact O-NH2 3.44Å
121	G	94.6	Very high	94.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.			trans	76.5	-0.3	172.4	0	0	0	0	0	115.2	A117 L118 F124 V125 S180	A117-G121 PolarHBondContact O-N 2.98Å; L118-G121 PolarHBondContact O-N 2.95Å; G121-F124 PolarHBondContact O-N 3.14Å; G121-V125 WeakPolarHBondContact O-CB 3.45Å; G121-V125 VanDerWaalsContact O-CG2 3.22Å; G121-V125 WeakPolarHBondContact O-CG2 3.4Å; G121-V125 PolarHBondContact O-N 3.14Å; G121-S180 WeakPolarHBondContact CA-OG 3.45Å
122	K	94.5	Very high	94.4	Very high	87 Å²	87	29 Å²	29	38%	0.378	16%	0.155	S	C	.	.	H	α-helix	trans	-61.6	-46.9	-179.7	-64	179.5	-167	135.4	0	112.6	F39 D120 F124 V125 C126	F39-K122 HydrophobicContact CB-CD 4.25Å; F39-K122 HydrophobicContact CD1-CB 3.69Å; F39-K122 HydrophobicContact CD1-CD 4.21Å; F39-K122 HydrophobicContact CD1-CG 4.49Å; F39-K122 HydrophobicContact CE1-CB 3.91Å; F39-K122 HydrophobicContact CG-CB 4.12Å; F39-K122 HydrophobicContact CG-CD 4.46Å; D120-K122 VanDerWaalsContact C-N 3.25Å; D120-K122 PolarHBondContact O-N 2.82Å; D120-K122 VanDerWaalsContact OD1-CE 3.29Å; D120-K122 WeakPolarHBondContact OD1-CE 3.48Å; D120-K122 IonicContact OD1-NZ 2.73Å; D120-K122 PolarHBondContact OD1-NZ 3.43Å; D120-K122 WeakPolarHBondContact OD2-CD 3.42Å; D120-K122 WeakPolarHBondContact OD2-CE 3.29Å; D120-K122 WeakPolarHBondContact OD2-CG 3.39Å; D120-K122 IonicContact OD2-NZ 3.04Å; D120-K122 PolarHBondContact OD2-NZ 3.21Å; K122-F124 VanDerWaalsContact C-N 3.32Å; K122-F124 PolarHBondContact O-N 2.91Å; K122-V125 PolarHBondContact O-N 3.26Å; K122-C126 WeakPolarHBondContact O-CB 3.33Å; K122-C126 PolarHBondContact O-N 3.29Å
123	C	94.9	Very high	94.2	Very high	6 Å²	6	30.2 Å²	30.2	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-41.7	177.3	-61	0	0	0	0	111.5	F39 L56 C126 A127	F39-C123 HydrophobicContact CE2-CB 4.34Å; L56-C123 HydrophobicContact CB-CB 4.49Å; C123-C126 PolarHBondContact O-N 2.85Å; C123-A127 VanDerWaalsContact O-CB 3.28Å; C123-A127 WeakPolarHBondContact O-CB 3.29Å; C123-A127 PolarHBondContact O-N 2.92Å
124	F	96.4	Very high	93.6	Very high	17 Å²	17	32 Å²	32	8%	0.075	17%	0.174	C	C	.	.	H	α-helix	trans	-67.5	-45.8	179.5	-166.3	-84.4	0	0	0	112	L118 G121 K122 C126 A127 F128 L176 L179 S180 I183	L118-F124 HydrophobicContact CD2-CD2 4.12Å; G121-F124 PolarHBondContact O-N 3.14Å; K122-F124 VanDerWaalsContact C-N 3.32Å; K122-F124 PolarHBondContact O-N 2.91Å; F124-C126 VanDerWaalsContact C-N 3.35Å; F124-C126 PolarHBondContact O-N 3.41Å; F124-A127 PolarHBondContact O-N 3.35Å; F124-F128 AromaticContact CD1-CD2 3.86Å; F124-F128 HydrophobicContact CD1-CD2 3.86Å; F124-F128 AromaticContact CD2-CD2 3.71Å; F124-F128 HydrophobicContact CD2-CD2 3.71Å; F124-F128 AromaticContact CD2-CE2 3.67Å; F124-F128 HydrophobicContact CD2-CE2 3.67Å; F124-F128 HydrophobicContact CE1-CB 4.37Å; F124-F128 AromaticContact CE1-CD2 3.75Å; F124-F128 HydrophobicContact CE1-CD2 3.75Å; F124-F128 HydrophobicContact CE1-CE2 4.44Å; F124-F128 HydrophobicContact CE1-CG 4.27Å; F124-F128 AromaticContact CE2-CD2 3.6Å; F124-F128 HydrophobicContact CE2-CD2 3.6Å; F124-F128 AromaticContact CE2-CE2 3.45Å; F124-F128 HydrophobicContact CE2-CE2 3.45Å; F124-F128 VanDerWaalsContact CE2-CE2 3.45Å; F124-F128 HydrophobicContact CE2-CZ 4.38Å; F124-F128 AromaticContact CG-CD2 3.83Å; F124-F128 HydrophobicContact CG-CD2 3.83Å; F124-F128 HydrophobicContact CG-CE2 4.26Å; F124-F128 AromaticContact CZ-CD2 3.62Å; F124-F128 HydrophobicContact CZ-CD2 3.62Å; F124-F128 AromaticContact CZ-CE2 3.88Å; F124-F128 HydrophobicContact CZ-CE2 3.88Å; F124-F128 HydrophobicContact CZ-CG 4.28Å; F124-F128 WeakPolarHBondContact O-CD2 3.32Å; F124-F128 PolarHBondContact O-N 2.89Å; F124-L176 WeakPolarHBondContact CD1-O 3.33Å; F124-L176 HydrophobicContact CE1-CD2 4.14Å; F124-L179 HydrophobicContact CE1-CB 4.21Å; F124-L179 HydrophobicContact CE1-CD2 3.95Å; F124-L179 HydrophobicContact CE1-CG 4.13Å; F124-L179 HydrophobicContact CZ-CD2 3.87Å; F124-L179 HydrophobicContact CZ-CG 4.01Å; F124-S180 VanDerWaalsContact CB-OG 3.23Å; F124-S180 WeakPolarHBondContact CB-OG 3.36Å; F124-I183 HydrophobicContact CE2-CD1 3.67Å; F124-I183 HydrophobicContact CZ-CD1 3.88Å
125	V	95.8	Very high	93.1	Very high	9 Å²	9	39.2 Å²	39.2	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-59.1	-47.1	175.4	171.1	0	0	0	0	110.5	G121 K122 S129 P156 L176 R177	G121-V125 WeakPolarHBondContact O-CB 3.45Å; G121-V125 VanDerWaalsContact O-CG2 3.22Å; G121-V125 WeakPolarHBondContact O-CG2 3.4Å; G121-V125 PolarHBondContact O-N 3.14Å; K122-V125 PolarHBondContact O-N 3.26Å; V125-S129 WeakPolarHBondContact O-CA 3.49Å; V125-S129 WeakPolarHBondContact O-CB 3.48Å; V125-S129 PolarHBondContact O-N 3.11Å; V125-S129 PolarHBondContact O-OG 3.46Å; V125-P156 HydrophobicContact CG1-CB 4.43Å; V125-P156 HydrophobicContact CG1-CG 4.33Å; V125-L176 HydrophobicContact CG1-CD1 4.4Å; V125-L176 HydrophobicContact CG2-CB 3.81Å; V125-R177 HydrophobicContact CG2-CB 4.36Å
126	C	95.8	Very high	92.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-50.3	176.4	-174.7	0	0	0	0	110.9	F39 C41 N48 K122 C123 F124 F128 S129 P156	F39-C126 HydrophobicContact CE1-CB 4.05Å; F39-C126 HydrophobicContact CZ-CB 3.52Å; C41-C126 HydrophobicContact CB-CB 3.87Å; C41-C126 WeakPolarHBondContact CB-SG 3.23Å; C41-C126 WeakPolarHBondContact SG-CB 3.42Å; C41-C126 CovalentContact SG-SG 2.05Å; C41-C126 PolarHBondContact SG-SG 3.35Å; N48-C126 WeakPolarHBondContact CB-O 3.29Å; K122-C126 WeakPolarHBondContact O-CB 3.33Å; K122-C126 PolarHBondContact O-N 3.29Å; C123-C126 PolarHBondContact O-N 2.85Å; F124-C126 VanDerWaalsContact C-N 3.35Å; F124-C126 PolarHBondContact O-N 3.41Å; C126-F128 PolarHBondContact O-N 2.65Å; C126-S129 PolarHBondContact O-OG 2.94Å; C126-P156 HydrophobicContact CB-CB 4.43Å; C126-P156 HydrophobicContact CB-CG 4.4Å
127	A	96.2	Very high	92	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-43.1	-175	0	0	0	0	0	114	L53 C123 F124	L53-A127 HydrophobicContact CD2-CB 4.34Å; L53-A127 HydrophobicContact CG-CB 4.03Å; C123-A127 VanDerWaalsContact O-CB 3.28Å; C123-A127 WeakPolarHBondContact O-CB 3.29Å; C123-A127 PolarHBondContact O-N 2.92Å; F124-A127 PolarHBondContact O-N 3.35Å
128	F	95.6	Very high	91.2	Very high	74 Å²	74	50.5 Å²	50.5	33%	0.325	26%	0.259	S	S	.	.	H	α-helix	trans	-103.2	-3.5	-170.4	-67.7	-74.7	0	0	0	114.4	L53 F124 C126 N130 S131 V132 L176	L53-F128 HydrophobicContact CD2-CE2 4.4Å; L53-F128 HydrophobicContact CD2-CZ 4.38Å; F124-F128 AromaticContact CD1-CD2 3.86Å; F124-F128 HydrophobicContact CD1-CD2 3.86Å; F124-F128 AromaticContact CD2-CD2 3.71Å; F124-F128 HydrophobicContact CD2-CD2 3.71Å; F124-F128 AromaticContact CD2-CE2 3.67Å; F124-F128 HydrophobicContact CD2-CE2 3.67Å; F124-F128 HydrophobicContact CE1-CB 4.37Å; F124-F128 AromaticContact CE1-CD2 3.75Å; F124-F128 HydrophobicContact CE1-CD2 3.75Å; F124-F128 HydrophobicContact CE1-CE2 4.44Å; F124-F128 HydrophobicContact CE1-CG 4.27Å; F124-F128 AromaticContact CE2-CD2 3.6Å; F124-F128 HydrophobicContact CE2-CD2 3.6Å; F124-F128 AromaticContact CE2-CE2 3.45Å; F124-F128 HydrophobicContact CE2-CE2 3.45Å; F124-F128 VanDerWaalsContact CE2-CE2 3.45Å; F124-F128 HydrophobicContact CE2-CZ 4.38Å; F124-F128 AromaticContact CG-CD2 3.83Å; F124-F128 HydrophobicContact CG-CD2 3.83Å; F124-F128 HydrophobicContact CG-CE2 4.26Å; F124-F128 AromaticContact CZ-CD2 3.62Å; F124-F128 HydrophobicContact CZ-CD2 3.62Å; F124-F128 AromaticContact CZ-CE2 3.88Å; F124-F128 HydrophobicContact CZ-CE2 3.88Å; F124-F128 HydrophobicContact CZ-CG 4.28Å; F124-F128 WeakPolarHBondContact O-CD2 3.32Å; F124-F128 PolarHBondContact O-N 2.89Å; C126-F128 PolarHBondContact O-N 2.65Å; F128-N130 VanDerWaalsContact C-N 3.27Å; F128-N130 PolarHBondContact O-N 3.38Å; F128-S131 PolarHBondContact O-N 2.91Å; F128-V132 PolarHBondContact O-N 2.9Å; F128-L176 HydrophobicContact CB-CD2 3.96Å
129	S	93.3	Very high	90.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-48.3	-47	177.2	54.4	0	0	0	0	113.3	N48 V125 C126 S131 L152	N48-S129 PolarHBondContact ND2-OG 3.39Å; V125-S129 WeakPolarHBondContact O-CA 3.49Å; V125-S129 WeakPolarHBondContact O-CB 3.48Å; V125-S129 PolarHBondContact O-N 3.11Å; V125-S129 PolarHBondContact O-OG 3.46Å; C126-S129 PolarHBondContact O-OG 2.94Å; S129-S131 VanDerWaalsContact C-N 3.27Å; S129-S131 PolarHBondContact O-N 3.45Å; S129-L152 VanDerWaalsContact CB-O 3.27Å; S129-L152 WeakPolarHBondContact CB-O 3.28Å; S129-L152 WeakPolarHBondContact O-CB 3.47Å
130	N	91.7	Very high	89.8	Confident	45 Å²	45	51.6 Å²	51.6	24%	0.241	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-74.9	-10.7	-178.4	-164.4	37.2	0	0	0	114.3	A45 F128 Q149	A45-N130 PolarHBondContact O-ND2 3.45Å; F128-N130 VanDerWaalsContact C-N 3.27Å; F128-N130 PolarHBondContact O-N 3.38Å; N130-Q149 WeakPolarHBondContact OD1-CG 3.36Å
131	S	89.9	Confident	88.9	Confident	94 Å²	94	53.6 Å²	53.6	66%	0.657	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-106.4	7.4	-178	-56.2	0	0	0	0	112.8	F128 S129	F128-S131 PolarHBondContact O-N 2.91Å; S129-S131 VanDerWaalsContact C-N 3.27Å; S129-S131 PolarHBondContact O-N 3.45Å
132	V	90.6	Very high	88.3	Confident	10 Å²	10	61.3 Å²	61.3	6%	0.061	33%	0.329	C	S	.	.			trans	-72.4	130.4	175.9	174.6	0	0	0	0	109.5	F128 P134 F137 L152 V172 L176	F128-V132 PolarHBondContact O-N 2.9Å; V132-P134 VanDerWaalsContact O-CD 3.31Å; V132-P134 WeakPolarHBondContact O-CD 3.45Å; V132-F137 HydrophobicContact CG1-CD2 4.2Å; V132-F137 HydrophobicContact CG1-CE2 3.47Å; V132-F137 VanDerWaalsContact CG1-CE2 3.47Å; V132-F137 HydrophobicContact CG1-CZ 4.35Å; V132-L152 HydrophobicContact CB-CD2 4.16Å; V132-L152 WeakPolarHBondContact O-CD1 3.35Å; V132-V172 HydrophobicContact CG1-CG1 4.35Å; V132-V172 HydrophobicContact CG2-CG1 4.06Å; V132-L176 HydrophobicContact CG2-CD1 3.8Å; V132-L176 HydrophobicContact CG2-CD2 3.75Å; V132-L176 HydrophobicContact CG2-CG 3.93Å
133	D	87.1	Confident	87.7	Confident	66 Å²	66	60.4 Å²	60.4	35%	0.353	33%	0.326	S	S	.	.			trans	-66.3	116.6	173.5	-176.8	3.8	0	0	0	110.8	E135 K136	D133-E135 PolarHBondContact O-N 2.89Å; D133-E135 PolarHBondContact OD1-N 3.23Å; D133-K136 HydrophobicContact CB-CD 4.18Å; D133-K136 HydrophobicContact CB-CG 4.34Å; D133-K136 PolarHBondContact O-N 3.37Å
134	P	84.6	Confident	87.3	Confident	50 Å²	50	63.3 Å²	63.3	33%	0.325	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-63.9	-28.1	-178.5	-20.8	33.6	0	0	0	113.4	V132 K136 F137 F140 V148	V132-P134 VanDerWaalsContact O-CD 3.31Å; V132-P134 WeakPolarHBondContact O-CD 3.45Å; P134-K136 PolarHBondContact O-N 3.38Å; P134-K136 VanDerWaalsContact O-N 3.11Å; P134-F137 PolarHBondContact O-N 3.06Å; P134-F140 HydrophobicContact CB-CB 4.25Å; P134-F140 HydrophobicContact CB-CD2 4.16Å; P134-V148 HydrophobicContact CB-CG1 3.85Å; P134-V148 HydrophobicContact CG-CG1 3.63Å
135	E	83.9	Confident	86.8	Confident	180 Å²	180	67.9 Å²	67.9	84%	0.841	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-63.8	-20.8	-175.9	-62.9	-172.4	177.2	0	0	112.7	D133 F137	D133-E135 PolarHBondContact O-N 2.89Å; D133-E135 PolarHBondContact OD1-N 3.23Å; E135-F137 PolarHBondContact O-N 3.49Å
136	K	82.5	Confident	86.3	Confident	121 Å²	121	71.4 Å²	71.4	53%	0.526	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-72.2	-11.8	176.8	-66.4	177.9	-178.9	169.3	0	113.8	D133 P134 Y175	D133-K136 HydrophobicContact CB-CD 4.18Å; D133-K136 HydrophobicContact CB-CG 4.34Å; D133-K136 PolarHBondContact O-N 3.37Å; P134-K136 PolarHBondContact O-N 3.38Å; P134-K136 VanDerWaalsContact O-N 3.11Å; K136-Y175 PolarHBondContact NZ-OH 3.29Å
137	F	84.3	Confident	85.9	Confident	29 Å²	29	76.2 Å²	76.2	13%	0.127	42%	0.423	C	S	.	.			trans	-129.3	113.3	-176.3	-55	-90.8	0	0	0	110.8	V132 P134 E135 D139 F140 A171 V172 Y175	V132-F137 HydrophobicContact CG1-CD2 4.2Å; V132-F137 HydrophobicContact CG1-CE2 3.47Å; V132-F137 VanDerWaalsContact CG1-CE2 3.47Å; V132-F137 HydrophobicContact CG1-CZ 4.35Å; P134-F137 PolarHBondContact O-N 3.06Å; E135-F137 PolarHBondContact O-N 3.49Å; F137-D139 PolarHBondContact O-N 3.16Å; F137-D139 VanDerWaalsContact O-N 3.11Å; F137-F140 HydrophobicContact CB-CD2 3.58Å; F137-F140 HydrophobicContact CB-CE2 3.67Å; F137-F140 HydrophobicContact CD2-CD2 4.22Å; F137-F140 AromaticContact CD2-CE2 3.84Å; F137-F140 HydrophobicContact CD2-CE2 3.84Å; F137-F140 HydrophobicContact CG-CD2 4.24Å; F137-F140 AromaticContact CG-CE2 3.9Å; F137-F140 HydrophobicContact CG-CE2 3.9Å; F137-F140 PolarHBondContact O-N 3.42Å; F137-F140 VanDerWaalsContact O-N 3.1Å; F137-A171 HydrophobicContact CD1-CB 3.89Å; F137-A171 HydrophobicContact CE1-CB 3.82Å; F137-V172 HydrophobicContact CD1-CG2 4.11Å; F137-V172 HydrophobicContact CD2-CG2 4.05Å; F137-V172 HydrophobicContact CE1-CG2 3.9Å; F137-V172 HydrophobicContact CE2-CG2 3.86Å; F137-V172 HydrophobicContact CG-CG2 4.19Å; F137-V172 HydrophobicContact CZ-CB 4.38Å; F137-V172 HydrophobicContact CZ-CG2 3.78Å; F137-Y175 HydrophobicContact CZ-CD1 4.13Å; F137-Y175 HydrophobicContact CZ-CG 4.15Å
138	L	78.4	Confident	85.5	Confident	164 Å²	164	76.5 Å²	76.5	86%	0.859	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-56.6	-28.2	179.8	-72.4	153.5	0	0	0	113.3	F140 A141	L138-F140 PolarHBondContact O-N 2.94Å; L138-A141 WeakPolarHBondContact O-CB 3.2Å; L138-A141 PolarHBondContact O-N 2.9Å
139	D	79.5	Confident	85.2	Confident	79 Å²	79	78 Å²	78	42%	0.422	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-64.2	-18.1	179.7	-62.7	-29	0	0	0	113.5	F137 A168	F137-D139 PolarHBondContact O-N 3.16Å; F137-D139 VanDerWaalsContact O-N 3.11Å; D139-A168 HydrophobicContact CB-CB 3.58Å; D139-A168 WeakPolarHBondContact OD2-CA 3.37Å; D139-A168 WeakPolarHBondContact OD2-CB 3.42Å; D139-A168 PolarHBondContact OD2-N 3.49Å
140	F	82.1	Confident	85	Confident	8 Å²	8	82.3 Å²	82.3	4%	0.035	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-90.9	-8.5	178.9	-62.3	-45.5	0	0	0	114.4	P134 F137 L138 N142 M143 V148 F151 L152 A168 V172	P134-F140 HydrophobicContact CB-CB 4.25Å; P134-F140 HydrophobicContact CB-CD2 4.16Å; F137-F140 HydrophobicContact CB-CD2 3.58Å; F137-F140 HydrophobicContact CB-CE2 3.67Å; F137-F140 HydrophobicContact CD2-CD2 4.22Å; F137-F140 AromaticContact CD2-CE2 3.84Å; F137-F140 HydrophobicContact CD2-CE2 3.84Å; F137-F140 HydrophobicContact CG-CD2 4.24Å; F137-F140 AromaticContact CG-CE2 3.9Å; F137-F140 HydrophobicContact CG-CE2 3.9Å; F137-F140 PolarHBondContact O-N 3.42Å; F137-F140 VanDerWaalsContact O-N 3.1Å; L138-F140 PolarHBondContact O-N 2.94Å; F140-N142 PolarHBondContact O-N 3.19Å; F140-N142 VanDerWaalsContact O-N 3.1Å; F140-M143 HydrophobicContact CD1-SD 4Å; F140-M143 PolarHBondContact O-N 3.43Å; F140-V148 HydrophobicContact CB-CG2 4.16Å; F140-V148 HydrophobicContact CD1-CG2 4.44Å; F140-V148 HydrophobicContact CG-CG1 4.44Å; F140-V148 HydrophobicContact CG-CG2 4.48Å; F140-F151 AromaticContact CE1-CD1 3.36Å; F140-F151 HydrophobicContact CE1-CD1 3.36Å; F140-F151 AromaticContact CE1-CE1 3.47Å; F140-F151 HydrophobicContact CE1-CE1 3.47Å; F140-F151 VanDerWaalsContact CE1-CE1 3.47Å; F140-F151 HydrophobicContact CE1-CG 4.1Å; F140-F151 HydrophobicContact CE1-CZ 4.27Å; F140-F151 AromaticContact CZ-CD1 3.71Å; F140-F151 HydrophobicContact CZ-CD1 3.71Å; F140-F151 AromaticContact CZ-CE1 3.63Å; F140-F151 HydrophobicContact CZ-CE1 3.63Å; F140-L152 HydrophobicContact CE2-CD2 4.25Å; F140-L152 HydrophobicContact CZ-CD2 4.11Å; F140-A168 HydrophobicContact CE1-CB 4.05Å; F140-A168 HydrophobicContact CZ-CB 4.11Å; F140-V172 HydrophobicContact CE2-CG2 3.86Å; F140-V172 HydrophobicContact CZ-CG2 3.86Å
141	A	76.2	Confident	84.9	Confident	83 Å²	83	80.4 Å²	80.4	69%	0.686	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.6	-176.2	0	0	0	0	0	113.7	L138	L138-A141 WeakPolarHBondContact O-CB 3.2Å; L138-A141 PolarHBondContact O-N 2.9Å
142	N	80.4	Confident	85	Confident	161 Å²	161	76.2 Å²	76.2	86%	0.861	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	0	-179.1	-64.2	-28.2	0	0	0	113.8	F140	F140-N142 PolarHBondContact O-N 3.19Å; F140-N142 VanDerWaalsContact O-N 3.1Å
143	M	82.3	Confident	85	Confident	68 Å²	68	75.8 Å²	75.8	34%	0.335	41%	0.412	S	S	.	.	S	Bend	trans	-100.8	144.2	-177.9	-67.5	-170.8	-172.7	0	0	111.2	F140 Q147 V148 F151	F140-M143 HydrophobicContact CD1-SD 4Å; F140-M143 PolarHBondContact O-N 3.43Å; M143-Q147 HydrophobicContact CB-CB 4.26Å; M143-V148 HydrophobicContact CB-CG2 3.51Å; M143-V148 HydrophobicContact SD-CG2 4.49Å; M143-F151 HydrophobicContact CE-CD2 4.37Å
144	T	87.3	Confident	85.2	Confident	68 Å²	68	74.8 Å²	74.8	42%	0.417	41%	0.405	S	S	.	.			trans	-68.1	153.4	169.3	58.9	0	0	0	0	110.7	S146 Q147 V148	T144-S146 PolarHBondContact O-N 3.21Å; T144-S146 VanDerWaalsContact O-N 3.13Å; T144-S146 PolarHBondContact OG1-OG 3.09Å; T144-Q147 WeakPolarHBondContact O-CB 3.34Å; T144-Q147 PolarHBondContact O-N 3.49Å; T144-Q147 WeakPolarHBondContact OG1-CB 3.41Å; T144-Q147 WeakPolarHBondContact OG1-CG 3.21Å; T144-Q147 PolarHBondContact OG1-OE1 3.28Å; T144-V148 WeakPolarHBondContact O-CG2 3.15Å; T144-V148 PolarHBondContact O-N 3.48Å
145	P	84.9	Confident	85.6	Confident	113 Å²	113	72.6 Å²	72.6	73%	0.734	39%	0.39	S	S	*	.	H	α-helix	trans	-54.6	-35.6	-179.3	-28.2	34.9	0	0	0	114.3	Q149	P145-Q149 WeakPolarHBondContact O-CB 3.42Å; P145-Q149 PolarHBondContact O-N 3.49Å
146	S	85.4	Confident	85.9	Confident	82 Å²	82	65.4 Å²	65.4	57%	0.573	36%	0.359	S	S	*	.	H	α-helix	trans	-69.9	-37.9	176.7	54.9	0	0	0	0	112.8	T144 Q149 L150	T144-S146 PolarHBondContact O-N 3.21Å; T144-S146 VanDerWaalsContact O-N 3.13Å; T144-S146 PolarHBondContact OG1-OG 3.09Å; S146-Q149 PolarHBondContact O-N 2.84Å; S146-L150 PolarHBondContact O-N 2.98Å
147	Q	87.2	Confident	86.3	Confident	102 Å²	102	61.3 Å²	61.3	48%	0.477	35%	0.346	S	S	.	.	H	α-helix	trans	-67.4	-41.2	173.9	-73.9	167.9	-27.3	0	0	111.5	M143 T144 Q149 L150 F151	M143-Q147 HydrophobicContact CB-CB 4.26Å; T144-Q147 WeakPolarHBondContact O-CB 3.34Å; T144-Q147 PolarHBondContact O-N 3.49Å; T144-Q147 WeakPolarHBondContact OG1-CB 3.41Å; T144-Q147 WeakPolarHBondContact OG1-CG 3.21Å; T144-Q147 PolarHBondContact OG1-OE1 3.28Å; Q147-Q149 VanDerWaalsContact C-N 3.34Å; Q147-Q149 PolarHBondContact O-N 3.49Å; Q147-L150 PolarHBondContact O-N 3.48Å; Q147-F151 VanDerWaalsContact O-CB 3.29Å; Q147-F151 WeakPolarHBondContact O-CB 3.15Å; Q147-F151 PolarHBondContact O-N 3.48Å
148	V	88.9	Confident	86.1	Confident	10 Å²	10	66.9 Å²	66.9	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-59.7	-46.7	174.5	175.4	0	0	0	0	110.4	P134 F140 M143 T144 L150 F151 L152	P134-V148 HydrophobicContact CB-CG1 3.85Å; P134-V148 HydrophobicContact CG-CG1 3.63Å; F140-V148 HydrophobicContact CB-CG2 4.16Å; F140-V148 HydrophobicContact CD1-CG2 4.44Å; F140-V148 HydrophobicContact CG-CG1 4.44Å; F140-V148 HydrophobicContact CG-CG2 4.48Å; M143-V148 HydrophobicContact CB-CG2 3.51Å; M143-V148 HydrophobicContact SD-CG2 4.49Å; T144-V148 WeakPolarHBondContact O-CG2 3.15Å; T144-V148 PolarHBondContact O-N 3.48Å; V148-L150 PolarHBondContact O-N 2.94Å; V148-F151 PolarHBondContact O-N 3.01Å; V148-L152 HydrophobicContact CG1-CD1 3.87Å; V148-L152 HydrophobicContact CG1-CG 4.15Å; V148-L152 WeakPolarHBondContact O-CB 3.41Å; V148-L152 VanDerWaalsContact O-CG 3.29Å; V148-L152 WeakPolarHBondContact O-CG 3.32Å; V148-L152 PolarHBondContact O-N 3.45Å
149	Q	88.4	Confident	86.1	Confident	104 Å²	104	66.9 Å²	66.9	49%	0.486	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-43.4	178.9	-166.8	179.7	25.3	0	0	112.3	N130 P145 S146 Q147 A153	N130-Q149 WeakPolarHBondContact OD1-CG 3.36Å; P145-Q149 WeakPolarHBondContact O-CB 3.42Å; P145-Q149 PolarHBondContact O-N 3.49Å; S146-Q149 PolarHBondContact O-N 2.84Å; Q147-Q149 VanDerWaalsContact C-N 3.34Å; Q147-Q149 PolarHBondContact O-N 3.49Å; Q149-A153 WeakPolarHBondContact O-CB 3.39Å; Q149-A153 PolarHBondContact O-N 3.38Å
150	L	89	Confident	86.1	Confident	92 Å²	92	65.1 Å²	65.1	48%	0.482	36%	0.356	S	S	.	.	H	α-helix	trans	-65.3	-40.6	176.3	-172.4	68.8	0	0	0	111.6	S146 Q147 V148 A153 K154 M162	S146-L150 PolarHBondContact O-N 2.98Å; Q147-L150 PolarHBondContact O-N 3.48Å; V148-L150 PolarHBondContact O-N 2.94Å; L150-A153 PolarHBondContact O-N 3.42Å; L150-K154 WeakPolarHBondContact O-CG 3.48Å; L150-K154 PolarHBondContact O-N 3.28Å; L150-M162 HydrophobicContact CD2-CE 4.37Å; L150-M162 HydrophobicContact CD2-SD 3.94Å; L150-M162 HydrophobicContact CG-CE 4.07Å; L150-M162 HydrophobicContact CG-SD 4.29Å
151	F	90.4	Very high	85.7	Confident	5 Å²	5	72.3 Å²	72.3	2%	0.022	39%	0.39	C	S	.	.	H	α-helix	trans	-61.8	-52.1	176	-177.1	-84	0	0	0	111.4	F140 M143 Q147 V148 A153 K154 V155 M162 V163 S166 A168 R169	F140-F151 AromaticContact CE1-CD1 3.36Å; F140-F151 HydrophobicContact CE1-CD1 3.36Å; F140-F151 AromaticContact CE1-CE1 3.47Å; F140-F151 HydrophobicContact CE1-CE1 3.47Å; F140-F151 VanDerWaalsContact CE1-CE1 3.47Å; F140-F151 HydrophobicContact CE1-CG 4.1Å; F140-F151 HydrophobicContact CE1-CZ 4.27Å; F140-F151 AromaticContact CZ-CD1 3.71Å; F140-F151 HydrophobicContact CZ-CD1 3.71Å; F140-F151 AromaticContact CZ-CE1 3.63Å; F140-F151 HydrophobicContact CZ-CE1 3.63Å; M143-F151 HydrophobicContact CE-CD2 4.37Å; Q147-F151 VanDerWaalsContact O-CB 3.29Å; Q147-F151 WeakPolarHBondContact O-CB 3.15Å; Q147-F151 PolarHBondContact O-N 3.48Å; V148-F151 PolarHBondContact O-N 3.01Å; F151-A153 VanDerWaalsContact C-N 3.31Å; F151-A153 PolarHBondContact O-N 3.49Å; F151-K154 CarbonylContact O-C 3.6Å; F151-K154 PolarHBondContact O-N 3.29Å; F151-V155 HydrophobicContact CD1-CG2 3.98Å; F151-V155 HydrophobicContact CE1-CG2 3.8Å; F151-V155 WeakPolarHBondContact O-CG2 3.49Å; F151-V155 PolarHBondContact O-N 3.3Å; F151-M162 HydrophobicContact CB-CE 3.96Å; F151-M162 HydrophobicContact CD2-CE 4.22Å; F151-V163 HydrophobicContact CD2-CG1 4.25Å; F151-V163 HydrophobicContact CD2-CG2 4.42Å; F151-V163 HydrophobicContact CE1-CG1 4.21Å; F151-V163 HydrophobicContact CE2-CB 4.37Å; F151-V163 HydrophobicContact CE2-CG1 3.63Å; F151-V163 HydrophobicContact CE2-CG2 4.44Å; F151-V163 HydrophobicContact CZ-CG1 3.61Å; F151-S166 WeakPolarHBondContact CZ-OG 3.34Å; F151-A168 HydrophobicContact CE1-CB 4.16Å; F151-A168 HydrophobicContact CZ-CB 3.95Å; F151-R169 HydrophobicContact CZ-CB 4.13Å
152	L	90.6	Very high	85.5	Confident	5 Å²	5	72.1 Å²	72.1	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-56.7	-44.3	178	-74.3	-179.7	0	0	0	111.4	S129 V132 F140 V148 K154 V155 V172	S129-L152 VanDerWaalsContact CB-O 3.27Å; S129-L152 WeakPolarHBondContact CB-O 3.28Å; S129-L152 WeakPolarHBondContact O-CB 3.47Å; V132-L152 HydrophobicContact CB-CD2 4.16Å; V132-L152 WeakPolarHBondContact O-CD1 3.35Å; F140-L152 HydrophobicContact CE2-CD2 4.25Å; F140-L152 HydrophobicContact CZ-CD2 4.11Å; V148-L152 HydrophobicContact CG1-CD1 3.87Å; V148-L152 HydrophobicContact CG1-CG 4.15Å; V148-L152 WeakPolarHBondContact O-CB 3.41Å; V148-L152 VanDerWaalsContact O-CG 3.29Å; V148-L152 WeakPolarHBondContact O-CG 3.32Å; V148-L152 PolarHBondContact O-N 3.45Å; L152-K154 PolarHBondContact O-N 3.48Å; L152-V155 HydrophobicContact CD2-CG2 4.48Å; L152-V155 WeakPolarHBondContact O-CB 3.33Å; L152-V155 PolarHBondContact O-N 2.93Å; L152-V172 HydrophobicContact CD2-CG1 4.28Å; L152-V172 HydrophobicContact CD2-CG2 4.43Å
153	A	91.7	Very high	85.4	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-59.6	-30	176.4	0	0	0	0	0	113.7	C43 A45 N48 Q149 L150 F151 P156	C43-A153 CarbonylContact C-O 3.44Å; C43-A153 VanDerWaalsContact CA-O 3.27Å; C43-A153 WeakPolarHBondContact CA-O 3.08Å; A45-A153 HydrophobicContact CB-CB 3.93Å; N48-A153 PolarHBondContact ND2-O 2.84Å; Q149-A153 WeakPolarHBondContact O-CB 3.39Å; Q149-A153 PolarHBondContact O-N 3.38Å; L150-A153 PolarHBondContact O-N 3.42Å; F151-A153 VanDerWaalsContact C-N 3.31Å; F151-A153 PolarHBondContact O-N 3.49Å; A153-P156 WeakPolarHBondContact O-CD 3.4Å
154	K	91.8	Very high	85	Confident	46 Å²	46	65.2 Å²	65.2	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-95	-8.8	-178.4	-71	176	161.3	-156.5	0	114.4	C43 L150 F151 L152 P156 C157 D160 M162 V163	C43-K154 HydrophobicContact CB-CG 4.45Å; L150-K154 WeakPolarHBondContact O-CG 3.48Å; L150-K154 PolarHBondContact O-N 3.28Å; F151-K154 CarbonylContact O-C 3.6Å; F151-K154 PolarHBondContact O-N 3.29Å; L152-K154 PolarHBondContact O-N 3.48Å; K154-P156 VanDerWaalsContact C-N 3.27Å; K154-P156 VanDerWaalsContact O-N 3.13Å; K154-C157 PolarHBondContact O-N 3.04Å; K154-D160 VanDerWaalsContact CD-OD2 3.29Å; K154-D160 WeakPolarHBondContact CD-OD2 3.46Å; K154-D160 WeakPolarHBondContact CE-OD2 3.41Å; K154-D160 VanDerWaalsContact NZ-CG 3.3Å; K154-D160 IonicContact NZ-OD1 2.78Å; K154-D160 PolarHBondContact NZ-OD1 3.27Å; K154-D160 IonicContact NZ-OD2 3.76Å; K154-D160 PolarHBondContact NZ-OD2 2.94Å; K154-M162 HydrophobicContact CB-CE 4.38Å; K154-M162 HydrophobicContact CD-CE 3.56Å; K154-M162 HydrophobicContact CD-SD 4.32Å; K154-M162 HydrophobicContact CG-CE 4.48Å; K154-V163 HydrophobicContact CB-CG2 3.54Å; K154-V163 HydrophobicContact CD-CG2 4.47Å
155	V	91.4	Very high	84.4	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.018	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.4	-41.3	175	169.3	0	0	0	0	114.2	F151 L152 C157 R169 V172	F151-V155 HydrophobicContact CD1-CG2 3.98Å; F151-V155 HydrophobicContact CE1-CG2 3.8Å; F151-V155 WeakPolarHBondContact O-CG2 3.49Å; F151-V155 PolarHBondContact O-N 3.3Å; L152-V155 HydrophobicContact CD2-CG2 4.48Å; L152-V155 WeakPolarHBondContact O-CB 3.33Å; L152-V155 PolarHBondContact O-N 2.93Å; V155-C157 VanDerWaalsContact C-N 3.28Å; V155-C157 PolarHBondContact O-N 2.84Å; V155-R169 HydrophobicContact CG1-CG 4.21Å; V155-V172 HydrophobicContact CG1-CB 4.3Å; V155-V172 HydrophobicContact CG1-CG1 4.03Å; V155-V172 HydrophobicContact CG2-CB 4.48Å; V155-V172 HydrophobicContact CG2-CG1 4.29Å
156	P	90.6	Very high	84.2	Confident	29 Å²	29	64.4 Å²	64.4	19%	0.188	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.1	179.1	-19.3	33.1	0	0	0	114.2	C41 V125 C126 A153 K154	C41-P156 HydrophobicContact CB-CB 3.84Å; C41-P156 VanDerWaalsContact SG-CB 3.58Å; V125-P156 HydrophobicContact CG1-CB 4.43Å; V125-P156 HydrophobicContact CG1-CG 4.33Å; C126-P156 HydrophobicContact CB-CB 4.43Å; C126-P156 HydrophobicContact CB-CG 4.4Å; A153-P156 WeakPolarHBondContact O-CD 3.4Å; K154-P156 VanDerWaalsContact C-N 3.27Å; K154-P156 VanDerWaalsContact O-N 3.13Å
157	C	90.7	Very high	84.2	Confident	36 Å²	36	64.6 Å²	64.6	24%	0.243	32%	0.324	C	S	.	.			trans	-93	107.3	-177.5	-71.8	0	0	0	0	111	C43 K154 V155 E159	C43-C157 HydrophobicContact CB-CB 3.97Å; C43-C157 WeakPolarHBondContact CB-SG 3.39Å; C43-C157 WeakPolarHBondContact SG-CB 3.34Å; C43-C157 PolarHBondContact SG-N 2.88Å; C43-C157 CovalentContact SG-SG 2.01Å; C43-C157 PolarHBondContact SG-SG 3.39Å; K154-C157 PolarHBondContact O-N 3.04Å; V155-C157 VanDerWaalsContact C-N 3.28Å; V155-C157 PolarHBondContact O-N 2.84Å; C157-E159 VanDerWaalsContact C-N 3.32Å; C157-E159 PolarHBondContact O-N 3.4Å
158	K	81.6	Confident	84.1	Confident	146 Å²	146	59.8 Å²	59.8	64%	0.635	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.9	-175.5	-57.1	-174.2	-179.3	168.9	0	114.1
159	E	76.8	Confident	84.1	Confident	163 Å²	163	60.9 Å²	60.9	76%	0.762	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-14.9	-174	-63.7	-76.3	146.5	0	0	113	C157 E161	C157-E159 VanDerWaalsContact C-N 3.32Å; C157-E159 PolarHBondContact O-N 3.4Å; E159-E161 PolarHBondContact O-N 2.92Å
160	D	80.1	Confident	84.2	Confident	43 Å²	43	60.9 Å²	60.9	23%	0.23	30%	0.303	C	S	.	.			trans	-71	122.1	-175.1	-163.4	-67.8	0	0	0	110.9	K154 M162 V163 K164	K154-D160 VanDerWaalsContact CD-OD2 3.29Å; K154-D160 WeakPolarHBondContact CD-OD2 3.46Å; K154-D160 WeakPolarHBondContact CE-OD2 3.41Å; K154-D160 VanDerWaalsContact NZ-CG 3.3Å; K154-D160 IonicContact NZ-OD1 2.78Å; K154-D160 PolarHBondContact NZ-OD1 3.27Å; K154-D160 IonicContact NZ-OD2 3.76Å; K154-D160 PolarHBondContact NZ-OD2 2.94Å; D160-M162 PolarHBondContact O-N 2.91Å; D160-M162 VanDerWaalsContact OD1-CB 3.24Å; D160-M162 WeakPolarHBondContact OD1-CB 3.34Å; D160-M162 PolarHBondContact OD1-N 3.06Å; D160-M162 VanDerWaalsContact OD1-N 3.11Å; D160-V163 HydrophobicContact CB-CG2 4.34Å; D160-V163 PolarHBondContact O-N 2.88Å; D160-K164 WeakPolarHBondContact O-CB 3.46Å; D160-K164 PolarHBondContact O-N 3.42Å
161	E	73.9	Confident	84.3	Confident	159 Å²	159	58.1 Å²	58.1	74%	0.743	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-36	-179.8	-72.9	-77.3	128	0	0	112.7	E159 V163 K164	E159-E161 PolarHBondContact O-N 2.92Å; E161-V163 PolarHBondContact O-N 2.87Å; E161-K164 IonicContact OE1-NZ 3.44Å
162	M	72.1	Confident	84.3	Confident	78 Å²	78	57.9 Å²	57.9	38%	0.384	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.2	-177.7	-160.1	-178	79.4	0	0	113.3	L150 F151 K154 D160	L150-M162 HydrophobicContact CD2-CE 4.37Å; L150-M162 HydrophobicContact CD2-SD 3.94Å; L150-M162 HydrophobicContact CG-CE 4.07Å; L150-M162 HydrophobicContact CG-SD 4.29Å; F151-M162 HydrophobicContact CB-CE 3.96Å; F151-M162 HydrophobicContact CD2-CE 4.22Å; K154-M162 HydrophobicContact CB-CE 4.38Å; K154-M162 HydrophobicContact CD-CE 3.56Å; K154-M162 HydrophobicContact CD-SD 4.32Å; K154-M162 HydrophobicContact CG-CE 4.48Å; D160-M162 PolarHBondContact O-N 2.91Å; D160-M162 VanDerWaalsContact OD1-CB 3.24Å; D160-M162 WeakPolarHBondContact OD1-CB 3.34Å; D160-M162 PolarHBondContact OD1-N 3.06Å; D160-M162 VanDerWaalsContact OD1-N 3.11Å
163	V	78.3	Confident	84.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-16	-167.2	-149.1	0	0	0	0	113	F151 K154 D160 E161 D165 S166 R169	F151-V163 HydrophobicContact CD2-CG1 4.25Å; F151-V163 HydrophobicContact CD2-CG2 4.42Å; F151-V163 HydrophobicContact CE1-CG1 4.21Å; F151-V163 HydrophobicContact CE2-CB 4.37Å; F151-V163 HydrophobicContact CE2-CG1 3.63Å; F151-V163 HydrophobicContact CE2-CG2 4.44Å; F151-V163 HydrophobicContact CZ-CG1 3.61Å; K154-V163 HydrophobicContact CB-CG2 3.54Å; K154-V163 HydrophobicContact CD-CG2 4.47Å; D160-V163 HydrophobicContact CB-CG2 4.34Å; D160-V163 PolarHBondContact O-N 2.88Å; E161-V163 PolarHBondContact O-N 2.87Å; V163-D165 PolarHBondContact O-N 3.42Å; V163-S166 PolarHBondContact O-N 2.9Å; V163-R169 HydrophobicContact CB-CG 4.49Å; V163-R169 HydrophobicContact CG1-CB 3.58Å; V163-R169 HydrophobicContact CG1-CG 3.38Å; V163-R169 WeakPolarHBondContact O-CD 3.27Å; V163-R169 PolarHBondContact O-NE 3.48Å
164	K	74	Confident	84.5	Confident	84 Å²	84	67.9 Å²	67.9	37%	0.365	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-52.9	-174.1	-166.1	169.9	178.8	176.2	0	113.6	D160 E161 R169	D160-K164 WeakPolarHBondContact O-CB 3.46Å; D160-K164 PolarHBondContact O-N 3.42Å; E161-K164 IonicContact OE1-NZ 3.44Å; K164-R169 PolarHBondContact O-NH2 2.95Å
165	D	75.2	Confident	84.6	Confident	140 Å²	140	70 Å²	70	75%	0.749	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	7.8	-175.3	-66.1	-45	0	0	0	114.9	V163	V163-D165 PolarHBondContact O-N 3.42Å
166	S	80.9	Confident	84.8	Confident	25 Å²	25	70.1 Å²	70.1	18%	0.175	34%	0.343	C	S	.	.			trans	-74.9	127.9	-177.2	176.9	0	0	0	0	112.6	F151 V163 A168 R169	F151-S166 WeakPolarHBondContact CZ-OG 3.34Å; V163-S166 PolarHBondContact O-N 2.9Å; S166-A168 VanDerWaalsContact C-N 3.28Å; S166-A168 PolarHBondContact O-N 2.94Å; S166-A168 WeakPolarHBondContact OG-CB 3.29Å; S166-A168 PolarHBondContact OG-N 3.3Å; S166-R169 WeakPolarHBondContact O-CB 3.29Å; S166-R169 PolarHBondContact O-N 3.37Å
167	P	84.3	Confident	85	Confident	86 Å²	86	73.1 Å²	73.1	56%	0.558	35%	0.35	S	S	*	.	H	α-helix	trans	-63.7	-34.9	170.7	26.4	-32.7	0	0	0	111.7	R169 K170 A171	P167-R169 VanDerWaalsContact C-N 3.27Å; P167-R169 PolarHBondContact O-N 3.48Å; P167-K170 WeakPolarHBondContact O-CB 3.28Å; P167-K170 PolarHBondContact O-N 3.31Å; P167-K170 VanDerWaalsContact O-N 3.07Å; P167-A171 PolarHBondContact O-N 3.42Å
168	A	85.9	Confident	85.3	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.008	37%	0.365	C	S	.	.	H	α-helix	trans	-57	-40.8	176.9	0	0	0	0	0	111.7	D139 F140 F151 S166 K170 A171 V172	D139-A168 HydrophobicContact CB-CB 3.58Å; D139-A168 WeakPolarHBondContact OD2-CA 3.37Å; D139-A168 WeakPolarHBondContact OD2-CB 3.42Å; D139-A168 PolarHBondContact OD2-N 3.49Å; F140-A168 HydrophobicContact CE1-CB 4.05Å; F140-A168 HydrophobicContact CZ-CB 4.11Å; F151-A168 HydrophobicContact CE1-CB 4.16Å; F151-A168 HydrophobicContact CZ-CB 3.95Å; S166-A168 VanDerWaalsContact C-N 3.28Å; S166-A168 PolarHBondContact O-N 2.94Å; S166-A168 WeakPolarHBondContact OG-CB 3.29Å; S166-A168 PolarHBondContact OG-N 3.3Å; A168-K170 PolarHBondContact O-N 2.94Å; A168-A171 PolarHBondContact O-N 3.35Å; A168-V172 WeakPolarHBondContact O-CG2 3.29Å; A168-V172 PolarHBondContact O-N 2.89Å
169	R	89.2	Confident	86	Confident	32 Å²	32	71.7 Å²	71.7	12%	0.121	35%	0.352	C	S	.	.	H	α-helix	trans	-58.3	-49.2	175.2	-171.3	-171.2	50.1	121.1	-9.4	112	F151 V155 V163 K164 S166 P167 A171 V172 S173	F151-R169 HydrophobicContact CZ-CB 4.13Å; V155-R169 HydrophobicContact CG1-CG 4.21Å; V163-R169 HydrophobicContact CB-CG 4.49Å; V163-R169 HydrophobicContact CG1-CB 3.58Å; V163-R169 HydrophobicContact CG1-CG 3.38Å; V163-R169 WeakPolarHBondContact O-CD 3.27Å; V163-R169 PolarHBondContact O-NE 3.48Å; K164-R169 PolarHBondContact O-NH2 2.95Å; S166-R169 WeakPolarHBondContact O-CB 3.29Å; S166-R169 PolarHBondContact O-N 3.37Å; P167-R169 VanDerWaalsContact C-N 3.27Å; P167-R169 PolarHBondContact O-N 3.48Å; R169-A171 VanDerWaalsContact C-N 3.27Å; R169-A171 PolarHBondContact O-N 3.01Å; R169-V172 PolarHBondContact O-N 3.38Å; R169-S173 WeakPolarHBondContact O-CB 3.44Å; R169-S173 PolarHBondContact O-N 3.5Å
170	K	88.9	Confident	87	Confident	104 Å²	104	63.9 Å²	63.9	45%	0.452	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-39.8	-178.8	-66.8	176.1	-176.9	168.2	0	109.6	P167 A168 R174	P167-K170 WeakPolarHBondContact O-CB 3.28Å; P167-K170 PolarHBondContact O-N 3.31Å; P167-K170 VanDerWaalsContact O-N 3.07Å; A168-K170 PolarHBondContact O-N 2.94Å; K170-R174 VanDerWaalsContact O-CB 3.27Å; K170-R174 WeakPolarHBondContact O-CB 3.44Å; K170-R174 WeakPolarHBondContact O-CD 3.48Å; K170-R174 WeakPolarHBondContact O-CG 3.38Å; K170-R174 PolarHBondContact O-N 3.33Å
171	A	91.1	Very high	87.8	Confident	35 Å²	35	65.4 Å²	65.4	29%	0.289	32%	0.322	S	S	.	.	H	α-helix	trans	-63.2	-53.5	176.4	0	0	0	0	0	112.1	F137 P167 A168 R169 S173 R174 Y175	F137-A171 HydrophobicContact CD1-CB 3.89Å; F137-A171 HydrophobicContact CE1-CB 3.82Å; P167-A171 PolarHBondContact O-N 3.42Å; A168-A171 PolarHBondContact O-N 3.35Å; R169-A171 VanDerWaalsContact C-N 3.27Å; R169-A171 PolarHBondContact O-N 3.01Å; A171-S173 PolarHBondContact O-N 2.89Å; A171-R174 PolarHBondContact O-N 2.61Å; A171-Y175 WeakPolarHBondContact O-CB 3.3Å; A171-Y175 PolarHBondContact O-N 3.46Å
172	V	91.9	Very high	89	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-45.5	179.5	176.2	0	0	0	0	111.4	V132 F137 F140 L152 V155 A168 R169 R174 Y175 L176	V132-V172 HydrophobicContact CG1-CG1 4.35Å; V132-V172 HydrophobicContact CG2-CG1 4.06Å; F137-V172 HydrophobicContact CD1-CG2 4.11Å; F137-V172 HydrophobicContact CD2-CG2 4.05Å; F137-V172 HydrophobicContact CE1-CG2 3.9Å; F137-V172 HydrophobicContact CE2-CG2 3.86Å; F137-V172 HydrophobicContact CG-CG2 4.19Å; F137-V172 HydrophobicContact CZ-CB 4.38Å; F137-V172 HydrophobicContact CZ-CG2 3.78Å; F140-V172 HydrophobicContact CE2-CG2 3.86Å; F140-V172 HydrophobicContact CZ-CG2 3.86Å; L152-V172 HydrophobicContact CD2-CG1 4.28Å; L152-V172 HydrophobicContact CD2-CG2 4.43Å; V155-V172 HydrophobicContact CG1-CB 4.3Å; V155-V172 HydrophobicContact CG1-CG1 4.03Å; V155-V172 HydrophobicContact CG2-CB 4.48Å; V155-V172 HydrophobicContact CG2-CG1 4.29Å; A168-V172 WeakPolarHBondContact O-CG2 3.29Å; A168-V172 PolarHBondContact O-N 2.89Å; R169-V172 PolarHBondContact O-N 3.38Å; V172-R174 PolarHBondContact O-N 2.79Å; V172-Y175 PolarHBondContact O-N 3.36Å; V172-L176 HydrophobicContact CG1-CD1 4.03Å; V172-L176 PolarHBondContact O-N 3.13Å
173	S	92.3	Very high	90.2	Very high	30 Å²	30	59.4 Å²	59.4	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-42.3	178.2	-178.7	0	0	0	0	112.1	R169 A171 R177	R169-S173 WeakPolarHBondContact O-CB 3.44Å; R169-S173 PolarHBondContact O-N 3.5Å; A171-S173 PolarHBondContact O-N 2.89Å; S173-R177 VanDerWaalsContact O-CB 3.24Å; S173-R177 WeakPolarHBondContact O-CB 3.39Å; S173-R177 PolarHBondContact O-N 2.99Å
174	R	93.1	Very high	91.1	Very high	186 Å²	186	59.4 Å²	59.4	70%	0.702	30%	0.302	S	S	*	.	H	α-helix	trans	-65.2	-43.6	175.2	-76.7	173.1	-174.8	171.8	0.6	111.9	K170 A171 V172 R177 C178	K170-R174 VanDerWaalsContact O-CB 3.27Å; K170-R174 WeakPolarHBondContact O-CB 3.44Å; K170-R174 WeakPolarHBondContact O-CD 3.48Å; K170-R174 WeakPolarHBondContact O-CG 3.38Å; K170-R174 PolarHBondContact O-N 3.33Å; A171-R174 PolarHBondContact O-N 2.61Å; V172-R174 PolarHBondContact O-N 2.79Å; R174-R177 PolarHBondContact O-N 3.24Å; R174-C178 VanDerWaalsContact O-CB 3.24Å; R174-C178 WeakPolarHBondContact O-CB 3.28Å; R174-C178 PolarHBondContact O-N 3.29Å
175	Y	94.2	Very high	92.2	Very high	91 Å²	91	63 Å²	63	36%	0.357	31%	0.313	S	S	.	.	H	α-helix	trans	-57.7	-52.7	177.4	170.8	-110.3	0	0	0	111.3	K136 F137 A171 V172 R177 C178 L179	K136-Y175 PolarHBondContact NZ-OH 3.29Å; F137-Y175 HydrophobicContact CZ-CD1 4.13Å; F137-Y175 HydrophobicContact CZ-CG 4.15Å; A171-Y175 WeakPolarHBondContact O-CB 3.3Å; A171-Y175 PolarHBondContact O-N 3.46Å; V172-Y175 PolarHBondContact O-N 3.36Å; Y175-R177 PolarHBondContact O-N 2.95Å; Y175-C178 WeakPolarHBondContact O-CB 3.35Å; Y175-C178 PolarHBondContact O-N 3Å; Y175-L179 PolarHBondContact O-N 3.16Å
176	L	95.6	Very high	93.2	Very high	5 Å²	5	60 Å²	60	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-40.2	179.6	-73.4	175.2	0	0	0	112.6	F124 V125 F128 V132 V172 L179 S180	F124-L176 WeakPolarHBondContact CD1-O 3.33Å; F124-L176 HydrophobicContact CE1-CD2 4.14Å; V125-L176 HydrophobicContact CG1-CD1 4.4Å; V125-L176 HydrophobicContact CG2-CB 3.81Å; F128-L176 HydrophobicContact CB-CD2 3.96Å; V132-L176 HydrophobicContact CG2-CD1 3.8Å; V132-L176 HydrophobicContact CG2-CD2 3.75Å; V132-L176 HydrophobicContact CG2-CG 3.93Å; V172-L176 HydrophobicContact CG1-CD1 4.03Å; V172-L176 PolarHBondContact O-N 3.13Å; L176-L179 PolarHBondContact O-N 3.06Å; L176-S180 WeakPolarHBondContact O-CB 3.32Å; L176-S180 PolarHBondContact O-N 3.4Å
177	R	95.9	Very high	93.9	Very high	91 Å²	91	60.9 Å²	60.9	34%	0.343	31%	0.305	S	S	.	.	H	α-helix	trans	-66	-40.4	176.7	-178.6	175.5	-94.9	161.5	-10.9	111.7	D120 V125 S173 R174 Y175 L179 S180 Q181	D120-R177 PolarHBondContact O-NE 3.34Å; D120-R177 VanDerWaalsContact O-NE 3.1Å; D120-R177 PolarHBondContact O-NH2 3.44Å; V125-R177 HydrophobicContact CG2-CB 4.36Å; S173-R177 VanDerWaalsContact O-CB 3.24Å; S173-R177 WeakPolarHBondContact O-CB 3.39Å; S173-R177 PolarHBondContact O-N 2.99Å; R174-R177 PolarHBondContact O-N 3.24Å; Y175-R177 PolarHBondContact O-N 2.95Å; R177-L179 VanDerWaalsContact C-N 3.34Å; R177-S180 PolarHBondContact O-N 3.26Å; R177-Q181 HydrophobicContact CG-CG 4.43Å; R177-Q181 WeakPolarHBondContact O-CB 3.4Å; R177-Q181 VanDerWaalsContact O-CG 3.32Å; R177-Q181 WeakPolarHBondContact O-CG 3.4Å; R177-Q181 PolarHBondContact O-N 3.03Å
178	C	96.6	Very high	94.3	Very high	81 Å²	81	58.2 Å²	58.2	55%	0.547	29%	0.288	S	S	.	.	H	α-helix	trans	-59.3	-46.6	174.2	-177.8	0	0	0	0	110.8	R174 Y175 S180 Q181 A182	R174-C178 VanDerWaalsContact O-CB 3.24Å; R174-C178 WeakPolarHBondContact O-CB 3.28Å; R174-C178 PolarHBondContact O-N 3.29Å; Y175-C178 WeakPolarHBondContact O-CB 3.35Å; Y175-C178 PolarHBondContact O-N 3Å; C178-S180 PolarHBondContact O-N 3.17Å; C178-Q181 PolarHBondContact O-N 2.89Å; C178-A182 WeakPolarHBondContact O-CB 3.49Å; C178-A182 PolarHBondContact O-N 3.31Å
179	L	96.5	Very high	94.8	Very high	71 Å²	71	63.5 Å²	63.5	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-44.7	177.1	-174.1	61	0	0	0	112	F124 Y175 L176 R177 Q181 A182 I183	F124-L179 HydrophobicContact CE1-CB 4.21Å; F124-L179 HydrophobicContact CE1-CD2 3.95Å; F124-L179 HydrophobicContact CE1-CG 4.13Å; F124-L179 HydrophobicContact CZ-CD2 3.87Å; F124-L179 HydrophobicContact CZ-CG 4.01Å; Y175-L179 PolarHBondContact O-N 3.16Å; L176-L179 PolarHBondContact O-N 3.06Å; R177-L179 VanDerWaalsContact C-N 3.34Å; L179-Q181 PolarHBondContact O-N 3.45Å; L179-A182 PolarHBondContact O-N 3.37Å; L179-I183 HydrophobicContact CG-CD1 4.22Å; L179-I183 VanDerWaalsContact O-CG1 3.3Å; L179-I183 WeakPolarHBondContact O-CG1 3.47Å; L179-I183 PolarHBondContact O-N 3.2Å
180	S	97.4	Very high	95.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-58.7	-46.3	176.1	-169.9	0	0	0	0	112.2	L118 G121 F124 L176 R177 C178 I183 G184	L118-S180 WeakPolarHBondContact CA-OG 3.27Å; L118-S180 CarbonylContact O-C 3.59Å; L118-S180 WeakPolarHBondContact O-CB 3.33Å; L118-S180 PolarHBondContact O-OG 2.82Å; G121-S180 WeakPolarHBondContact CA-OG 3.45Å; F124-S180 VanDerWaalsContact CB-OG 3.23Å; F124-S180 WeakPolarHBondContact CB-OG 3.36Å; L176-S180 WeakPolarHBondContact O-CB 3.32Å; L176-S180 PolarHBondContact O-N 3.4Å; R177-S180 PolarHBondContact O-N 3.26Å; C178-S180 PolarHBondContact O-N 3.17Å; S180-I183 PolarHBondContact O-N 3.13Å; S180-G184 PolarHBondContact O-N 3.04Å
181	Q	97.3	Very high	95	Very high	75 Å²	75	65.8 Å²	65.8	35%	0.35	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-39.4	178.4	-73.6	176.9	-13	0	0	111.9	L119 R177 C178 L179 G184 W185	L119-Q181 WeakPolarHBondContact O-CG 3.48Å; L119-Q181 PolarHBondContact O-NE2 3.48Å; L119-Q181 VanDerWaalsContact O-NE2 3.08Å; R177-Q181 HydrophobicContact CG-CG 4.43Å; R177-Q181 WeakPolarHBondContact O-CB 3.4Å; R177-Q181 VanDerWaalsContact O-CG 3.32Å; R177-Q181 WeakPolarHBondContact O-CG 3.4Å; R177-Q181 PolarHBondContact O-N 3.03Å; C178-Q181 PolarHBondContact O-N 2.89Å; L179-Q181 PolarHBondContact O-N 3.45Å; Q181-G184 PolarHBondContact O-N 2.87Å; Q181-W185 WeakPolarHBondContact O-CB 3.24Å; Q181-W185 PolarHBondContact O-N 2.97Å
182	A	97.9	Very high	94.8	Very high	47 Å²	47	69.1 Å²	69.1	39%	0.388	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-48.1	174	0	0	0	0	0	110.7	C178 L179 G184 W185 S186	C178-A182 WeakPolarHBondContact O-CB 3.49Å; C178-A182 PolarHBondContact O-N 3.31Å; L179-A182 PolarHBondContact O-N 3.37Å; A182-G184 PolarHBondContact O-N 3.29Å; A182-W185 PolarHBondContact O-N 3.1Å; A182-S186 WeakPolarHBondContact O-CB 3.29Å; A182-S186 PolarHBondContact O-N 3.07Å; A182-S186 PolarHBondContact O-OG 3.44Å
183	I	97.5	Very high	94.9	Very high	63 Å²	63	72.2 Å²	72.2	32%	0.323	37%	0.365	S	S	.	.	H	α-helix	trans	-60	-46.4	175.5	-64.3	164.6	0	0	0	110.8	L118 F124 L179 S180 W185 S186 I187	L118-I183 HydrophobicContact CD1-CG2 4.07Å; F124-I183 HydrophobicContact CE2-CD1 3.67Å; F124-I183 HydrophobicContact CZ-CD1 3.88Å; L179-I183 HydrophobicContact CG-CD1 4.22Å; L179-I183 VanDerWaalsContact O-CG1 3.3Å; L179-I183 WeakPolarHBondContact O-CG1 3.47Å; L179-I183 PolarHBondContact O-N 3.2Å; S180-I183 PolarHBondContact O-N 3.13Å; I183-W185 PolarHBondContact O-N 2.9Å; I183-S186 PolarHBondContact O-N 3.49Å; I183-I187 HydrophobicContact CG2-CD1 3.92Å; I183-I187 HydrophobicContact CG2-CG1 4.49Å; I183-I187 WeakPolarHBondContact O-CG1 3.29Å; I183-I187 PolarHBondContact O-N 3.43Å
184	G	96.4	Very high	94.5	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-59.2	-44.4	178	0	0	0	0	0	113.2	L115 S180 Q181 A182 I187 T188	L115-G184 WeakPolarHBondContact CD2-O 3.43Å; S180-G184 PolarHBondContact O-N 3.04Å; Q181-G184 PolarHBondContact O-N 2.87Å; A182-G184 PolarHBondContact O-N 3.29Å; G184-I187 PolarHBondContact O-N 3.5Å; G184-T188 WeakPolarHBondContact O-CB 3.36Å; G184-T188 PolarHBondContact O-N 2.91Å; G184-T188 PolarHBondContact O-OG1 3.43Å
185	W	97.4	Very high	93.9	Very high	161 Å²	161	67.8 Å²	67.8	61%	0.61	36%	0.361	S	S	*	.	H	α-helix	trans	-69.5	-36.9	175.8	-79.2	115.2	0	0	0	112.7	L119 Q181 A182 I183 T188 L189	L119-W185 HydrophobicContact CD2-CD2 4.44Å; L119-W185 HydrophobicContact CD2-CG 4.34Å; Q181-W185 WeakPolarHBondContact O-CB 3.24Å; Q181-W185 PolarHBondContact O-N 2.97Å; A182-W185 PolarHBondContact O-N 3.1Å; I183-W185 PolarHBondContact O-N 2.9Å; W185-T188 HydrophobicContact CE3-CG2 4.35Å; W185-T188 HydrophobicContact CZ3-CG2 4.38Å; W185-T188 PolarHBondContact O-N 2.81Å; W185-L189 WeakPolarHBondContact O-CB 3.42Å; W185-L189 PolarHBondContact O-N 3.08Å
186	S	97.8	Very high	93.4	Very high	77 Å²	77	69.5 Å²	69.5	54%	0.538	37%	0.37	S	S	.	.	H	α-helix	trans	-61.6	-44.4	173.4	-64.4	0	0	0	0	111.7	A182 I183 T188 L189 L190	A182-S186 WeakPolarHBondContact O-CB 3.29Å; A182-S186 PolarHBondContact O-N 3.07Å; A182-S186 PolarHBondContact O-OG 3.44Å; I183-S186 PolarHBondContact O-N 3.49Å; S186-T188 VanDerWaalsContact C-N 3.35Å; S186-L189 PolarHBondContact O-N 3.2Å; S186-L190 WeakPolarHBondContact O-CB 3.44Å; S186-L190 PolarHBondContact O-N 3.15Å
187	I	95.3	Very high	92.8	Very high	42 Å²	42	73.1 Å²	73.1	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-63	-43.8	174.7	-66	167.4	0	0	0	110.2	M111 L115 L118 I183 G184 L189 L190 L191	M111-I187 HydrophobicContact CE-CG2 3.77Å; L115-I187 HydrophobicContact CD2-CB 4.01Å; L115-I187 HydrophobicContact CD2-CG2 3.79Å; L118-I187 HydrophobicContact CD1-CD1 3.67Å; I183-I187 HydrophobicContact CG2-CD1 3.92Å; I183-I187 HydrophobicContact CG2-CG1 4.49Å; I183-I187 WeakPolarHBondContact O-CG1 3.29Å; I183-I187 PolarHBondContact O-N 3.43Å; G184-I187 PolarHBondContact O-N 3.5Å; I187-L189 PolarHBondContact O-N 3.07Å; I187-L190 PolarHBondContact O-N 2.98Å; I187-L191 HydrophobicContact CG2-CD1 4.17Å; I187-L191 HydrophobicContact CG2-CG 4.42Å; I187-L191 VanDerWaalsContact O-CG 3.32Å; I187-L191 WeakPolarHBondContact O-CG 3.23Å; I187-L191 PolarHBondContact O-N 2.94Å
188	T	92.5	Very high	91.8	Very high	31 Å²	31	71.2 Å²	71.2	19%	0.19	39%	0.393	C	S	.	.	H	α-helix	trans	-59.6	-48.4	178.2	-58.4	0	0	0	0	111.5	L115 G184 W185 S186 L190 L191 I192	L115-T188 WeakPolarHBondContact CD2-OG1 3.28Å; G184-T188 WeakPolarHBondContact O-CB 3.36Å; G184-T188 PolarHBondContact O-N 2.91Å; G184-T188 PolarHBondContact O-OG1 3.43Å; W185-T188 HydrophobicContact CE3-CG2 4.35Å; W185-T188 HydrophobicContact CZ3-CG2 4.38Å; W185-T188 PolarHBondContact O-N 2.81Å; S186-T188 VanDerWaalsContact C-N 3.35Å; T188-L190 PolarHBondContact O-N 2.92Å; T188-L191 PolarHBondContact O-N 2.87Å; T188-I192 HydrophobicContact CG2-CD1 4.06Å; T188-I192 WeakPolarHBondContact O-CG1 3.22Å; T188-I192 PolarHBondContact O-N 3.02Å
189	L	96.4	Very high	90.7	Very high	111 Å²	111	74.9 Å²	74.9	58%	0.581	40%	0.395	S	S	*	.	H	α-helix	trans	-60.8	-44.9	177.2	-179.4	63.3	0	0	0	111.3	W185 S186 I187 L191 I192 V193	W185-L189 WeakPolarHBondContact O-CB 3.42Å; W185-L189 PolarHBondContact O-N 3.08Å; S186-L189 PolarHBondContact O-N 3.2Å; I187-L189 PolarHBondContact O-N 3.07Å; L189-L191 VanDerWaalsContact C-N 3.34Å; L189-L191 PolarHBondContact O-N 2.87Å; L189-I192 PolarHBondContact O-N 3.49Å; L189-V193 HydrophobicContact CD1-CG2 4.4Å; L189-V193 WeakPolarHBondContact O-CG2 3.38Å; L189-V193 PolarHBondContact O-N 2.97Å
190	L	95.2	Very high	89.8	Confident	109 Å²	109	74.4 Å²	74.4	57%	0.571	40%	0.397	S	S	*	.	H	α-helix	trans	-57.6	-46.4	176.6	179.2	66.7	0	0	0	111.5	S186 I187 T188 I192 V193 V194	S186-L190 WeakPolarHBondContact O-CB 3.44Å; S186-L190 PolarHBondContact O-N 3.15Å; I187-L190 PolarHBondContact O-N 2.98Å; T188-L190 PolarHBondContact O-N 2.92Å; L190-I192 VanDerWaalsContact C-N 3.33Å; L190-I192 PolarHBondContact O-N 3.3Å; L190-V193 PolarHBondContact O-N 3.46Å; L190-V194 HydrophobicContact CD1-CG2 4.35Å; L190-V194 HydrophobicContact CG-CG2 4.5Å; L190-V194 WeakPolarHBondContact O-CB 3.21Å; L190-V194 VanDerWaalsContact O-CG2 3.29Å; L190-V194 WeakPolarHBondContact O-CG2 3.33Å; L190-V194 PolarHBondContact O-N 3.46Å
191	L	86.8	Confident	88.8	Confident	76 Å²	76	78 Å²	78	40%	0.398	42%	0.416	S	S	.	.	H	α-helix	trans	-61.7	-40.5	177.6	-69.9	173.5	0	0	0	112.2	M111 L115 I187 T188 L189 V194 A195	M111-L191 HydrophobicContact CE-CD1 3.81Å; M111-L191 HydrophobicContact CE-CD2 4.21Å; M111-L191 HydrophobicContact CE-CG 4.4Å; L115-L191 HydrophobicContact CD1-CD1 4.18Å; I187-L191 HydrophobicContact CG2-CD1 4.17Å; I187-L191 HydrophobicContact CG2-CG 4.42Å; I187-L191 VanDerWaalsContact O-CG 3.32Å; I187-L191 WeakPolarHBondContact O-CG 3.23Å; I187-L191 PolarHBondContact O-N 2.94Å; T188-L191 PolarHBondContact O-N 2.87Å; L189-L191 VanDerWaalsContact C-N 3.34Å; L189-L191 PolarHBondContact O-N 2.87Å; L191-V194 PolarHBondContact O-N 3.48Å; L191-A195 VanDerWaalsContact O-CB 3.29Å; L191-A195 WeakPolarHBondContact O-CB 3.31Å; L191-A195 PolarHBondContact O-N 3.38Å
192	I	87.4	Confident	87.3	Confident	104 Å²	104	80.7 Å²	80.7	53%	0.533	42%	0.423	S	S	.	.	H	α-helix	trans	-63.5	-47.1	176.2	-67.7	165.6	0	0	0	110.4	T188 L189 L190 A195 F196	T188-I192 HydrophobicContact CG2-CD1 4.06Å; T188-I192 WeakPolarHBondContact O-CG1 3.22Å; T188-I192 PolarHBondContact O-N 3.02Å; L189-I192 PolarHBondContact O-N 3.49Å; L190-I192 VanDerWaalsContact C-N 3.33Å; L190-I192 PolarHBondContact O-N 3.3Å; I192-A195 PolarHBondContact O-N 2.9Å; I192-F196 VanDerWaalsContact O-CB 3.31Å; I192-F196 WeakPolarHBondContact O-CB 3.43Å; I192-F196 PolarHBondContact O-N 2.97Å
193	V	92.9	Very high	85.8	Confident	66 Å²	66	83.1 Å²	83.1	40%	0.4	44%	0.435	S	S	.	.	H	α-helix	trans	-61.6	-45.9	178.2	171.3	0	0	0	0	110.7	L189 L190 A195 F196 L197	L189-V193 HydrophobicContact CD1-CG2 4.4Å; L189-V193 WeakPolarHBondContact O-CG2 3.38Å; L189-V193 PolarHBondContact O-N 2.97Å; L190-V193 PolarHBondContact O-N 3.46Å; V193-A195 VanDerWaalsContact C-N 3.35Å; V193-A195 PolarHBondContact O-N 2.93Å; V193-F196 PolarHBondContact O-N 3.28Å; V193-L197 HydrophobicContact CG1-CD1 3.83Å; V193-L197 HydrophobicContact CG1-CG 4.22Å; V193-L197 WeakPolarHBondContact O-CB 3.5Å; V193-L197 VanDerWaalsContact O-CG 3.28Å; V193-L197 WeakPolarHBondContact O-CG 3.47Å; V193-L197 PolarHBondContact O-N 3.46Å
194	V	84.9	Confident	84.4	Confident	81 Å²	81	85 Å²	85	49%	0.491	45%	0.452	S	S	.	.	H	α-helix	trans	-60.2	-44.7	175.9	169.8	0	0	0	0	111	L190 L191 F196 A198	L190-V194 HydrophobicContact CD1-CG2 4.35Å; L190-V194 HydrophobicContact CG-CG2 4.5Å; L190-V194 WeakPolarHBondContact O-CB 3.21Å; L190-V194 VanDerWaalsContact O-CG2 3.29Å; L190-V194 WeakPolarHBondContact O-CG2 3.33Å; L190-V194 PolarHBondContact O-N 3.46Å; L191-V194 PolarHBondContact O-N 3.48Å; V194-F196 VanDerWaalsContact C-N 3.34Å; V194-F196 PolarHBondContact O-N 3.32Å; V194-A198 WeakPolarHBondContact O-CB 3.39Å; V194-A198 PolarHBondContact O-N 3.29Å
195	A	80.4	Confident	82.8	Confident	41 Å²	41	91 Å²	91	34%	0.339	48%	0.478	S	S	.	.	H	α-helix	trans	-66.1	-35.5	177.5	0	0	0	0	0	112.7	L191 I192 V193 R199	L191-A195 VanDerWaalsContact O-CB 3.29Å; L191-A195 WeakPolarHBondContact O-CB 3.31Å; L191-A195 PolarHBondContact O-N 3.38Å; I192-A195 PolarHBondContact O-N 2.9Å; V193-A195 VanDerWaalsContact C-N 3.35Å; V193-A195 PolarHBondContact O-N 2.93Å; A195-R199 WeakPolarHBondContact O-CG 3.49Å; A195-R199 PolarHBondContact O-N 3.16Å; A195-R199 VanDerWaalsContact O-N 3.15Å
196	F	83	Confident	81.1	Confident	128 Å²	128	88.2 Å²	88.2	56%	0.561	48%	0.476	S	S	*	.	H	α-helix	trans	-68	-51.3	175.2	177.4	-99.1	0	0	0	111	I192 V193 V194 A198 R199 C200	I192-F196 VanDerWaalsContact O-CB 3.31Å; I192-F196 WeakPolarHBondContact O-CB 3.43Å; I192-F196 PolarHBondContact O-N 2.97Å; V193-F196 PolarHBondContact O-N 3.28Å; V194-F196 VanDerWaalsContact C-N 3.34Å; V194-F196 PolarHBondContact O-N 3.32Å; F196-A198 VanDerWaalsContact C-N 3.29Å; F196-A198 PolarHBondContact O-N 2.96Å; F196-R199 CarbonylContact O-C 3.55Å; F196-R199 WeakPolarHBondContact O-CA 3.39Å; F196-R199 WeakPolarHBondContact O-CB 3.41Å; F196-R199 PolarHBondContact O-N 3.46Å; F196-C200 HydrophobicContact CE1-CB 4.46Å; F196-C200 VanDerWaalsContact CE1-SG 3.58Å; F196-C200 WeakPolarHBondContact CE2-SG 3.36Å; F196-C200 WeakPolarHBondContact CZ-SG 3.35Å; F196-C200 PolarHBondContact O-N 3.4Å; F196-C200 PolarHBondContact O-SG 2.91Å
197	L	83.6	Confident	79.4	Confident	80 Å²	80	90.9 Å²	90.9	42%	0.419	48%	0.48	S	S	.	.	H	α-helix	trans	-57.7	-43.8	174.9	-69.7	173.6	0	0	0	111.1	V193 R199 C200 L201	V193-L197 HydrophobicContact CG1-CD1 3.83Å; V193-L197 HydrophobicContact CG1-CG 4.22Å; V193-L197 WeakPolarHBondContact O-CB 3.5Å; V193-L197 VanDerWaalsContact O-CG 3.28Å; V193-L197 WeakPolarHBondContact O-CG 3.47Å; V193-L197 PolarHBondContact O-N 3.46Å; L197-R199 PolarHBondContact O-N 3.16Å; L197-R199 VanDerWaalsContact O-N 3.16Å; L197-C200 PolarHBondContact O-N 2.87Å; L197-L201 HydrophobicContact CB-CD1 4.29Å; L197-L201 HydrophobicContact CD2-CD1 4.48Å; L197-L201 WeakPolarHBondContact O-CB 3.21Å; L197-L201 VanDerWaalsContact O-CG 3.31Å; L197-L201 WeakPolarHBondContact O-CG 3.38Å; L197-L201 PolarHBondContact O-N 2.99Å
198	A	73.8	Confident	78	Confident	51 Å²	51	93 Å²	93	42%	0.421	50%	0.495	S	S	.	.	H	α-helix	trans	-65.8	-13.5	175.1	0	0	0	0	0	113.8	V194 F196 R202	V194-A198 WeakPolarHBondContact O-CB 3.39Å; V194-A198 PolarHBondContact O-N 3.29Å; F196-A198 VanDerWaalsContact C-N 3.29Å; F196-A198 PolarHBondContact O-N 2.96Å; A198-R202 WeakPolarHBondContact O-CD 3.24Å; A198-R202 WeakPolarHBondContact O-CG 3.35Å; A198-R202 PolarHBondContact O-NE 2.96Å
199	R	74.2	Confident	76.7	Confident	158 Å²	158	94.1 Å²	94.1	60%	0.596	50%	0.501	S	S	*	.	H	α-helix	trans	-96.1	-43.9	170.4	-76.7	-168.4	-176.6	97.5	-4.9	112.2	A195 F196 L197 R202	A195-R199 WeakPolarHBondContact O-CG 3.49Å; A195-R199 PolarHBondContact O-N 3.16Å; A195-R199 VanDerWaalsContact O-N 3.15Å; F196-R199 CarbonylContact O-C 3.55Å; F196-R199 WeakPolarHBondContact O-CA 3.39Å; F196-R199 WeakPolarHBondContact O-CB 3.41Å; F196-R199 PolarHBondContact O-N 3.46Å; L197-R199 PolarHBondContact O-N 3.16Å; L197-R199 VanDerWaalsContact O-N 3.16Å; R199-R202 WeakPolarHBondContact O-CB 3.4Å; R199-R202 PolarHBondContact O-N 2.96Å
200	C	78	Confident	75.1	Confident	62 Å²	62	93.2 Å²	93.2	42%	0.419	49%	0.493	S	S	.	.	H	α-helix	trans	-72.3	-33.3	-177.3	-67.3	0	0	0	0	112.9	F196 L197 R202 P203	F196-C200 HydrophobicContact CE1-CB 4.46Å; F196-C200 VanDerWaalsContact CE1-SG 3.58Å; F196-C200 WeakPolarHBondContact CE2-SG 3.36Å; F196-C200 WeakPolarHBondContact CZ-SG 3.35Å; F196-C200 PolarHBondContact O-N 3.4Å; F196-C200 PolarHBondContact O-SG 2.91Å; L197-C200 PolarHBondContact O-N 2.87Å; C200-R202 VanDerWaalsContact C-N 3.35Å; C200-P203 VanDerWaalsContact O-CD 3.25Å; C200-P203 WeakPolarHBondContact O-CD 3.33Å
201	L	76.4	Confident	73.7	Confident	74 Å²	74	92.9 Å²	92.9	39%	0.387	49%	0.491	S	S	.	.	S	Bend	trans	-85.8	-6.7	177.4	-58.8	175	0	0	0	112.6	L197 P203 C204 F205	L197-L201 HydrophobicContact CB-CD1 4.29Å; L197-L201 HydrophobicContact CD2-CD1 4.48Å; L197-L201 WeakPolarHBondContact O-CB 3.21Å; L197-L201 VanDerWaalsContact O-CG 3.31Å; L197-L201 WeakPolarHBondContact O-CG 3.38Å; L197-L201 PolarHBondContact O-N 2.99Å; L201-P203 VanDerWaalsContact C-CD 3.45Å; L201-P203 VanDerWaalsContact C-N 3.33Å; L201-C204 WeakPolarHBondContact O-CB 3.44Å; L201-C204 PolarHBondContact O-N 3.36Å; L201-F205 HydrophobicContact CB-CD2 4.19Å; L201-F205 HydrophobicContact CB-CE2 3.55Å; L201-F205 HydrophobicContact CB-CZ 4.29Å; L201-F205 WeakPolarHBondContact O-CD2 3.21Å; L201-F205 PolarHBondContact O-N 3.43Å
202	R	64.9	Low	72.7	Confident	133 Å²	133	92 Å²	92	50%	0.502	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-49.7	-46	176.2	-89.8	164.1	-163.1	-160.3	-4	113.3	A198 R199 C200 C204	A198-R202 WeakPolarHBondContact O-CD 3.24Å; A198-R202 WeakPolarHBondContact O-CG 3.35Å; A198-R202 PolarHBondContact O-NE 2.96Å; R199-R202 WeakPolarHBondContact O-CB 3.4Å; R199-R202 PolarHBondContact O-N 2.96Å; C200-R202 VanDerWaalsContact C-N 3.35Å; R202-C204 VanDerWaalsContact C-N 3.27Å; R202-C204 PolarHBondContact O-N 3.06Å
203	P	66	Low	71.5	Confident	98 Å²	98	92.6 Å²	92.6	64%	0.636	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-73.9	-18	179.4	-15.5	32.5	0	0	0	113.5	C200 L201	C200-P203 VanDerWaalsContact O-CD 3.25Å; C200-P203 WeakPolarHBondContact O-CD 3.33Å; L201-P203 VanDerWaalsContact C-CD 3.45Å; L201-P203 VanDerWaalsContact C-N 3.33Å
204	C	69.1	Low	70.2	Confident	102 Å²	102	95.1 Å²	95.1	69%	0.689	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-85.5	-15.4	179.8	-55	0	0	0	0	112.7	L201 R202	L201-C204 WeakPolarHBondContact O-CB 3.44Å; L201-C204 PolarHBondContact O-N 3.36Å; R202-C204 VanDerWaalsContact C-N 3.27Å; R202-C204 PolarHBondContact O-N 3.06Å
205	F	63.3	Low	69.3	Low	125 Å²	125	97.3 Å²	97.3	55%	0.548	48%	0.483	S	S	.	.	S	Bend	trans	-87	147.4	172.9	-68.1	-67.5	0	0	0	110.4	L201 Q207	L201-F205 HydrophobicContact CB-CD2 4.19Å; L201-F205 HydrophobicContact CB-CE2 3.55Å; L201-F205 HydrophobicContact CB-CZ 4.29Å; L201-F205 WeakPolarHBondContact O-CD2 3.21Å; L201-F205 PolarHBondContact O-N 3.43Å; F205-Q207 PolarHBondContact O-N 3.43Å
206	D	61.1	Low	68.6	Low	103 Å²	103	96.4 Å²	96.4	55%	0.551	47%	0.471	S	S	*	.			trans	-48.7	108.9	179.9	-163.3	-16	0	0	0	110.9	T208 V209 F210	D206-T208 PolarHBondContact O-N 2.9Å; D206-T208 VanDerWaalsContact O-N 3.1Å; D206-T208 PolarHBondContact OD1-N 3.49Å; D206-T208 PolarHBondContact OD1-OG1 3.44Å; D206-T208 PolarHBondContact OD2-OG1 2.92Å; D206-V209 HydrophobicContact CB-CB 4.38Å; D206-V209 HydrophobicContact CB-CG2 4.01Å; D206-V209 WeakPolarHBondContact O-CB 3.42Å; D206-V209 PolarHBondContact O-N 3.48Å; D206-F210 PolarHBondContact O-N 3.4Å
207	Q	62.6	Low	67.6	Low	134 Å²	134	90.6 Å²	90.6	63%	0.626	45%	0.447	S	S	*	.	H	α-helix	trans	-60.8	-25.7	-171.6	-170.4	154.8	-46.4	0	0	111.4	F205 F210 L211	F205-Q207 PolarHBondContact O-N 3.43Å; Q207-F210 PolarHBondContact O-N 3.01Å; Q207-L211 HydrophobicContact CG-CD1 4.43Å; Q207-L211 WeakPolarHBondContact O-CG 3.43Å; Q207-L211 PolarHBondContact O-N 2.89Å
208	T	65.8	Low	66.7	Low	86 Å²	86	88.9 Å²	88.9	53%	0.528	44%	0.438	S	S	.	.	H	α-helix	trans	-64.7	-46.6	174.5	63.8	0	0	0	0	111.7	D206 F210 L211 Q212	D206-T208 PolarHBondContact O-N 2.9Å; D206-T208 VanDerWaalsContact O-N 3.1Å; D206-T208 PolarHBondContact OD1-N 3.49Å; D206-T208 PolarHBondContact OD1-OG1 3.44Å; D206-T208 PolarHBondContact OD2-OG1 2.92Å; T208-F210 VanDerWaalsContact C-N 3.3Å; T208-F210 PolarHBondContact O-N 3.44Å; T208-L211 PolarHBondContact O-N 3.32Å; T208-Q212 VanDerWaalsContact O-CB 3.25Å; T208-Q212 WeakPolarHBondContact O-CB 2.99Å; T208-Q212 PolarHBondContact O-N 3.07Å
209	V	64.9	Low	66.5	Low	55 Å²	55	89.6 Å²	89.6	33%	0.333	43%	0.43	S	S	.	.	H	α-helix	trans	-65.2	-35.3	177.9	176.7	0	0	0	0	110.9	D206 R213	D206-V209 HydrophobicContact CB-CB 4.38Å; D206-V209 HydrophobicContact CB-CG2 4.01Å; D206-V209 WeakPolarHBondContact O-CB 3.42Å; D206-V209 PolarHBondContact O-N 3.48Å; V209-R213 WeakPolarHBondContact O-CB 3.38Å; V209-R213 VanDerWaalsContact O-CG 3.24Å; V209-R213 WeakPolarHBondContact O-CG 3.36Å; V209-R213 PolarHBondContact O-N 3.4Å
210	F	63.5	Low	66.1	Low	91 Å²	91	82.5 Å²	82.5	40%	0.399	40%	0.404	S	S	.	.	H	α-helix	trans	-69.1	-47.3	175.2	176.6	-98.2	0	0	0	112.6	D206 Q207 T208 Q212 R213 R214	D206-F210 PolarHBondContact O-N 3.4Å; Q207-F210 PolarHBondContact O-N 3.01Å; T208-F210 VanDerWaalsContact C-N 3.3Å; T208-F210 PolarHBondContact O-N 3.44Å; F210-Q212 VanDerWaalsContact C-N 3.29Å; F210-Q212 PolarHBondContact O-N 3.33Å; F210-R213 WeakPolarHBondContact O-CB 3.19Å; F210-R213 PolarHBondContact O-N 2.57Å; F210-R214 PolarHBondContact O-N 2.73Å
211	L	65.5	Low	65.4	Low	103 Å²	103	80.5 Å²	80.5	54%	0.539	39%	0.389	S	S	.	.	H	α-helix	trans	-61.1	-40.9	176.2	-74.4	169.7	0	0	0	111.1	Q207 T208 R214 Y215	Q207-L211 HydrophobicContact CG-CD1 4.43Å; Q207-L211 WeakPolarHBondContact O-CG 3.43Å; Q207-L211 PolarHBondContact O-N 2.89Å; T208-L211 PolarHBondContact O-N 3.32Å; L211-R214 PolarHBondContact O-N 3.44Å; L211-Y215 VanDerWaalsContact O-CB 3.28Å; L211-Y215 WeakPolarHBondContact O-CB 3.14Å; L211-Y215 PolarHBondContact O-N 2.87Å
212	Q	65.4	Low	65	Low	58 Å²	58	82.3 Å²	82.3	27%	0.271	40%	0.399	S	S	.	.	H	α-helix	trans	-60.4	-43.4	173.6	176.2	168.4	19.1	0	0	112.2	T208 F210 W216 L311	T208-Q212 VanDerWaalsContact O-CB 3.25Å; T208-Q212 WeakPolarHBondContact O-CB 2.99Å; T208-Q212 PolarHBondContact O-N 3.07Å; F210-Q212 VanDerWaalsContact C-N 3.29Å; F210-Q212 PolarHBondContact O-N 3.33Å; Q212-W216 WeakPolarHBondContact O-CB 3.28Å; Q212-W216 PolarHBondContact O-N 3.1Å; Q212-L311 HydrophobicContact CB-CD1 4.05Å; Q212-L311 HydrophobicContact CG-CD1 3.58Å
213	R	62	Low	65.3	Low	116 Å²	116	78 Å²	78	44%	0.438	38%	0.384	S	S	.	.	H	α-helix	trans	-60.5	-47.5	174.6	-78.5	176.8	-152.8	-170.4	14.2	112.3	Y97 V209 F210 W216 S217	Y97-R213 HydrophobicContact CD1-CB 4.38Å; Y97-R213 HydrophobicContact CD1-CG 4.05Å; Y97-R213 HydrophobicContact CD2-CB 4.15Å; Y97-R213 VanDerWaalsContact CD2-CD 3.42Å; Y97-R213 HydrophobicContact CD2-CG 3.5Å; Y97-R213 HydrophobicContact CE1-CB 3.92Å; Y97-R213 HydrophobicContact CE1-CG 4.1Å; Y97-R213 WeakPolarHBondContact CE1-O 3.47Å; Y97-R213 HydrophobicContact CE2-CB 3.68Å; Y97-R213 VanDerWaalsContact CE2-CD 3.49Å; Y97-R213 HydrophobicContact CE2-CG 3.56Å; Y97-R213 HydrophobicContact CG-CB 4.46Å; Y97-R213 HydrophobicContact CG-CG 3.75Å; Y97-R213 PolarHBondContact OH-O 3.36Å; V209-R213 WeakPolarHBondContact O-CB 3.38Å; V209-R213 VanDerWaalsContact O-CG 3.24Å; V209-R213 WeakPolarHBondContact O-CG 3.36Å; V209-R213 PolarHBondContact O-N 3.4Å; F210-R213 WeakPolarHBondContact O-CB 3.19Å; F210-R213 PolarHBondContact O-N 2.57Å; R213-W216 PolarHBondContact O-N 3.32Å; R213-S217 WeakPolarHBondContact O-CB 3.41Å; R213-S217 PolarHBondContact O-N 3.06Å
214	R	64.9	Low	65.3	Low	118 Å²	118	75.7 Å²	75.7	45%	0.445	37%	0.365	S	S	.	.	H	α-helix	trans	-65.8	-42.7	179.7	-176	172.2	-176.3	76.1	1.1	111.8	E16 F210 L211 W216 N218	E16-R214 IonicContact OE2-CZ 3.02Å; E16-R214 IonicContact OE2-NH1 2.65Å; E16-R214 PolarHBondContact OE2-NH1 2.87Å; E16-R214 IonicContact OE2-NH2 2.72Å; F210-R214 PolarHBondContact O-N 2.73Å; L211-R214 PolarHBondContact O-N 3.44Å; R214-W216 VanDerWaalsContact C-N 3.33Å; R214-N218 PolarHBondContact O-N 3.45Å; R214-N218 VanDerWaalsContact O-N 3.12Å; R214-N218 PolarHBondContact O-ND2 2.81Å; R214-N218 VanDerWaalsContact O-ND2 3.08Å
215	Y	66.6	Low	65.4	Low	127 Å²	127	77.7 Å²	77.7	50%	0.498	36%	0.362	S	S	.	.	H	α-helix	trans	-59.5	-46	173.9	175.9	-96.7	0	0	0	110.8	L211 N218 Y219 L311	L211-Y215 VanDerWaalsContact O-CB 3.28Å; L211-Y215 WeakPolarHBondContact O-CB 3.14Å; L211-Y215 PolarHBondContact O-N 2.87Å; Y215-N218 PolarHBondContact O-N 2.84Å; Y215-Y219 VanDerWaalsContact O-CB 3.29Å; Y215-Y219 WeakPolarHBondContact O-CB 3.28Å; Y215-Y219 PolarHBondContact O-N 3.23Å; Y215-L311 HydrophobicContact CD1-CD1 4.41Å; Y215-L311 HydrophobicContact CE1-CD2 4.25Å
216	W	65.4	Low	65.8	Low	22 Å²	22	77 Å²	77	8%	0.083	36%	0.364	C	S	.	.	H	α-helix	trans	-64.9	-44.2	-178.8	-171.7	-110.5	0	0	0	113.1	I94 M98 Q212 R213 R214 N218 Y219 V220 L309	I94-W216 HydrophobicContact CG2-CD2 4.31Å; I94-W216 HydrophobicContact CG2-CG 4.31Å; M98-W216 HydrophobicContact SD-CZ2 4.5Å; M98-W216 PolarHBondContact SD-NE1 3.11Å; Q212-W216 WeakPolarHBondContact O-CB 3.28Å; Q212-W216 PolarHBondContact O-N 3.1Å; R213-W216 PolarHBondContact O-N 3.32Å; R214-W216 VanDerWaalsContact C-N 3.33Å; W216-N218 PolarHBondContact O-N 3.48Å; W216-Y219 AromaticContact CE3-CD1 3.91Å; W216-Y219 HydrophobicContact CE3-CD1 3.91Å; W216-Y219 HydrophobicContact CE3-CG 4.47Å; W216-Y219 AromaticContact CH2-CD1 3.53Å; W216-Y219 HydrophobicContact CH2-CD1 3.53Å; W216-Y219 AromaticContact CH2-CE1 3.64Å; W216-Y219 HydrophobicContact CH2-CE1 3.64Å; W216-Y219 AromaticContact CZ3-CD1 3.19Å; W216-Y219 HydrophobicContact CZ3-CD1 3.19Å; W216-Y219 AromaticContact CZ3-CE1 3.56Å; W216-Y219 HydrophobicContact CZ3-CE1 3.56Å; W216-Y219 HydrophobicContact CZ3-CG 4.06Å; W216-Y219 PolarHBondContact O-N 3.19Å; W216-V220 HydrophobicContact CD2-CG2 4.2Å; W216-V220 HydrophobicContact CH2-CG2 3.96Å; W216-V220 HydrophobicContact CZ2-CG2 3.4Å; W216-V220 WeakPolarHBondContact O-CG2 3.4Å; W216-V220 PolarHBondContact O-N 3.15Å; W216-L309 HydrophobicContact CD2-CD1 4.22Å; W216-L309 HydrophobicContact CE3-CD1 4.07Å; W216-L309 HydrophobicContact CE3-CD2 4.2Å; W216-L309 HydrophobicContact CH2-CD1 3.05Å; W216-L309 HydrophobicContact CH2-CD2 3.21Å; W216-L309 HydrophobicContact CH2-CG 3.71Å; W216-L309 HydrophobicContact CZ2-CD1 3.12Å; W216-L309 HydrophobicContact CZ2-CD2 4.21Å; W216-L309 HydrophobicContact CZ2-CG 4.25Å; W216-L309 HydrophobicContact CZ3-CD1 3.53Å; W216-L309 HydrophobicContact CZ3-CD2 3.17Å; W216-L309 HydrophobicContact CZ3-CG 3.88Å
217	S	62.6	Low	66.4	Low	7 Å²	7	75.1 Å²	75.1	5%	0.049	35%	0.351	C	S	.	.	H	α-helix	trans	-54.3	-51.4	173.2	-177	0	0	0	0	110.9	E16 R213 D221	E16-S217 PolarHBondContact OE1-OG 3.27Å; R213-S217 WeakPolarHBondContact O-CB 3.41Å; R213-S217 PolarHBondContact O-N 3.06Å; S217-D221 PolarHBondContact O-N 3.4Å
218	N	65.4	Low	66.8	Low	44 Å²	44	71.7 Å²	71.7	24%	0.235	34%	0.337	C	S	.	.	H	α-helix	trans	-66.7	-39.3	178.4	-72.5	-42.1	0	0	0	113.1	R214 Y215 W216 D221 L222	R214-N218 PolarHBondContact O-N 3.45Å; R214-N218 VanDerWaalsContact O-N 3.12Å; R214-N218 PolarHBondContact O-ND2 2.81Å; R214-N218 VanDerWaalsContact O-ND2 3.08Å; Y215-N218 PolarHBondContact O-N 2.84Å; W216-N218 PolarHBondContact O-N 3.48Å; N218-D221 PolarHBondContact O-N 3.19Å; N218-L222 WeakPolarHBondContact O-CB 3.4Å; N218-L222 VanDerWaalsContact O-CG 3.31Å; N218-L222 WeakPolarHBondContact O-CG 3.4Å; N218-L222 PolarHBondContact O-N 3.01Å
219	Y	68.3	Low	67.4	Low	66 Å²	66	72.4 Å²	72.4	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-47.8	-179.7	171.6	-92.4	0	0	0	111.5	Y215 W216 D221 L222 E223	Y215-Y219 VanDerWaalsContact O-CB 3.29Å; Y215-Y219 WeakPolarHBondContact O-CB 3.28Å; Y215-Y219 PolarHBondContact O-N 3.23Å; W216-Y219 AromaticContact CE3-CD1 3.91Å; W216-Y219 HydrophobicContact CE3-CD1 3.91Å; W216-Y219 HydrophobicContact CE3-CG 4.47Å; W216-Y219 AromaticContact CH2-CD1 3.53Å; W216-Y219 HydrophobicContact CH2-CD1 3.53Å; W216-Y219 AromaticContact CH2-CE1 3.64Å; W216-Y219 HydrophobicContact CH2-CE1 3.64Å; W216-Y219 AromaticContact CZ3-CD1 3.19Å; W216-Y219 HydrophobicContact CZ3-CD1 3.19Å; W216-Y219 AromaticContact CZ3-CE1 3.56Å; W216-Y219 HydrophobicContact CZ3-CE1 3.56Å; W216-Y219 HydrophobicContact CZ3-CG 4.06Å; W216-Y219 PolarHBondContact O-N 3.19Å; Y219-D221 VanDerWaalsContact C-N 3.29Å; Y219-D221 PolarHBondContact O-N 2.79Å; Y219-L222 PolarHBondContact O-N 2.88Å; Y219-E223 HydrophobicContact CE1-CB 4.35Å; Y219-E223 VanDerWaalsContact O-CB 3.32Å; Y219-E223 WeakPolarHBondContact O-CB 3.09Å; Y219-E223 PolarHBondContact O-N 2.86Å
220	V	65.4	Low	68	Low	9 Å²	9	73.6 Å²	73.6	6%	0.055	34%	0.342	C	S	.	.	H	α-helix	trans	-60.1	-43.1	-179.7	169.9	0	0	0	0	110.8	W216 Q224	W216-V220 HydrophobicContact CD2-CG2 4.2Å; W216-V220 HydrophobicContact CH2-CG2 3.96Å; W216-V220 HydrophobicContact CZ2-CG2 3.4Å; W216-V220 WeakPolarHBondContact O-CG2 3.4Å; W216-V220 PolarHBondContact O-N 3.15Å; V220-Q224 WeakPolarHBondContact O-CB 3.48Å; V220-Q224 PolarHBondContact O-N 3.15Å; V220-Q224 VanDerWaalsContact O-N 3.1Å
221	D	65	Low	68.5	Low	19 Å²	19	71.8 Å²	71.8	10%	0.102	34%	0.34	C	S	.	.	H	α-helix	trans	-69	-38.5	179.9	-66.4	-31.8	0	0	0	112.5	S15 Q73 S217 N218 Y219 K225	S15-D221 WeakPolarHBondContact CB-OD2 3.22Å; S15-D221 WeakPolarHBondContact OG-CB 3.49Å; S15-D221 PolarHBondContact OG-OD2 3.37Å; Q73-D221 PolarHBondContact NE2-OD1 3.3Å; Q73-D221 PolarHBondContact NE2-OD2 3.35Å; S217-D221 PolarHBondContact O-N 3.4Å; N218-D221 PolarHBondContact O-N 3.19Å; Y219-D221 VanDerWaalsContact C-N 3.29Å; Y219-D221 PolarHBondContact O-N 2.79Å; D221-K225 WeakPolarHBondContact O-CB 3.33Å; D221-K225 PolarHBondContact O-N 3.12Å; D221-K225 VanDerWaalsContact O-N 3.07Å
222	L	68.1	Low	69.3	Low	113 Å²	113	70.7 Å²	70.7	59%	0.592	34%	0.339	S	S	*	.	H	α-helix	trans	-68.7	-44	175.7	-77.8	168.8	0	0	0	112.3	N218 Y219 Q224 K225 L226	N218-L222 WeakPolarHBondContact O-CB 3.4Å; N218-L222 VanDerWaalsContact O-CG 3.31Å; N218-L222 WeakPolarHBondContact O-CG 3.4Å; N218-L222 PolarHBondContact O-N 3.01Å; Y219-L222 PolarHBondContact O-N 2.88Å; L222-Q224 VanDerWaalsContact C-N 3.31Å; L222-Q224 PolarHBondContact O-N 3.43Å; L222-K225 PolarHBondContact O-N 3.28Å; L222-L226 WeakPolarHBondContact O-CB 3.41Å; L222-L226 PolarHBondContact O-N 2.97Å
223	E	70.3	Confident	70.3	Confident	42 Å²	42	72.9 Å²	72.9	20%	0.196	35%	0.35	C	S	.	.	H	α-helix	trans	-56.9	-47.5	176.7	-175.2	-171.7	-161.1	0	0	110.2	Y219 L226 F227 K306	Y219-E223 HydrophobicContact CE1-CB 4.35Å; Y219-E223 VanDerWaalsContact O-CB 3.32Å; Y219-E223 WeakPolarHBondContact O-CB 3.09Å; Y219-E223 PolarHBondContact O-N 2.86Å; E223-L226 PolarHBondContact O-N 2.83Å; E223-F227 VanDerWaalsContact O-CB 3.25Å; E223-F227 WeakPolarHBondContact O-CB 2.9Å; E223-F227 PolarHBondContact O-N 3.05Å; E223-K306 WeakPolarHBondContact OE1-CE 3.37Å; E223-K306 IonicContact OE1-NZ 2.61Å; E223-K306 PolarHBondContact OE1-NZ 3.4Å; E223-K306 IonicContact OE2-NZ 3.33Å; E223-K306 PolarHBondContact OE2-NZ 3.36Å
224	Q	66.2	Low	71.3	Confident	50 Å²	50	72.4 Å²	72.4	23%	0.234	35%	0.352	C	S	.	.	H	α-helix	trans	-66.1	-42.3	-179.7	-172.5	164	-0.9	0	0	112.2	V220 L222 F227 D228	V220-Q224 WeakPolarHBondContact O-CB 3.48Å; V220-Q224 PolarHBondContact O-N 3.15Å; V220-Q224 VanDerWaalsContact O-N 3.1Å; L222-Q224 VanDerWaalsContact C-N 3.31Å; L222-Q224 PolarHBondContact O-N 3.43Å; Q224-F227 PolarHBondContact O-N 3.47Å; Q224-D228 WeakPolarHBondContact O-CB 3.45Å; Q224-D228 PolarHBondContact O-N 2.82Å
225	K	71.4	Confident	72	Confident	143 Å²	143	69.6 Å²	69.6	62%	0.622	35%	0.354	S	S	*	.	H	α-helix	trans	-61.1	-47.2	176.5	-174.8	-178.8	176.7	-173.5	0	111.6	D221 L222 F227 D228 E229	D221-K225 WeakPolarHBondContact O-CB 3.33Å; D221-K225 PolarHBondContact O-N 3.12Å; D221-K225 VanDerWaalsContact O-N 3.07Å; L222-K225 PolarHBondContact O-N 3.28Å; K225-F227 VanDerWaalsContact C-N 3.32Å; K225-F227 PolarHBondContact O-N 3.2Å; K225-D228 PolarHBondContact O-N 3.24Å; K225-E229 WeakPolarHBondContact O-CB 3.42Å; K225-E229 PolarHBondContact O-N 3.41Å
226	L	72.3	Confident	73	Confident	112 Å²	112	71.6 Å²	71.6	59%	0.586	36%	0.361	S	S	*	.	H	α-helix	trans	-67.5	-36.4	-178.2	-159.1	72.7	0	0	0	111.5	L222 E223 T230	L222-L226 WeakPolarHBondContact O-CB 3.41Å; L222-L226 PolarHBondContact O-N 2.97Å; E223-L226 PolarHBondContact O-N 2.83Å; L226-T230 WeakPolarHBondContact O-CB 3.03Å; L226-T230 PolarHBondContact O-N 3.44Å; L226-T230 PolarHBondContact O-OG1 3.17Å
227	F	71.9	Confident	73.9	Confident	62 Å²	62	75 Å²	75	27%	0.272	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-49.9	174.3	-176	-93.5	0	0	0	111.9	E223 Q224 K225 E229 T230 C231 L299 W302	E223-F227 VanDerWaalsContact O-CB 3.25Å; E223-F227 WeakPolarHBondContact O-CB 2.9Å; E223-F227 PolarHBondContact O-N 3.05Å; Q224-F227 PolarHBondContact O-N 3.47Å; K225-F227 VanDerWaalsContact C-N 3.32Å; K225-F227 PolarHBondContact O-N 3.2Å; F227-E229 VanDerWaalsContact C-N 3.29Å; F227-E229 PolarHBondContact O-N 2.7Å; F227-T230 PolarHBondContact O-N 2.83Å; F227-C231 VanDerWaalsContact CE1-SG 3.55Å; F227-C231 VanDerWaalsContact CZ-SG 3.56Å; F227-C231 WeakPolarHBondContact O-CB 3.15Å; F227-C231 PolarHBondContact O-N 2.86Å; F227-C231 PolarHBondContact O-SG 3.37Å; F227-L299 HydrophobicContact CZ-CD2 4.08Å; F227-W302 AromaticContact CD2-CH2 3.81Å; F227-W302 HydrophobicContact CD2-CH2 3.81Å; F227-W302 AromaticContact CD2-CZ2 3.57Å; F227-W302 HydrophobicContact CD2-CZ2 3.57Å; F227-W302 HydrophobicContact CD2-CZ3 4.47Å; F227-W302 HydrophobicContact CE2-CD2 4.14Å; F227-W302 AromaticContact CE2-CE2 3.96Å; F227-W302 HydrophobicContact CE2-CE3 4.18Å; F227-W302 AromaticContact CE2-CH2 3.84Å; F227-W302 HydrophobicContact CE2-CH2 3.84Å; F227-W302 AromaticContact CE2-CZ2 3.83Å; F227-W302 HydrophobicContact CE2-CZ2 3.83Å; F227-W302 HydrophobicContact CE2-CZ3 4.03Å; F227-W302 HydrophobicContact CG-CH2 4.37Å; F227-W302 HydrophobicContact CG-CZ2 4.38Å; F227-W302 HydrophobicContact CZ-CH2 4.42Å; F227-W302 HydrophobicContact CZ-CZ3 4.37Å
228	D	71.6	Confident	74.7	Confident	62 Å²	62	79 Å²	79	33%	0.332	40%	0.397	S	S	.	.	H	α-helix	trans	-57.1	-44	177.9	-78.5	-9.3	0	0	0	111.1	R72 Q224 K225 C232	R72-D228 IonicContact NH1-OD2 3.48Å; R72-D228 PolarHBondContact NH1-OD2 3.01Å; Q224-D228 WeakPolarHBondContact O-CB 3.45Å; Q224-D228 PolarHBondContact O-N 2.82Å; K225-D228 PolarHBondContact O-N 3.24Å; D228-C232 WeakPolarHBondContact O-CB 3.43Å; D228-C232 PolarHBondContact O-N 3Å; D228-C232 PolarHBondContact O-SG 2.7Å
229	E	78.4	Confident	75.5	Confident	102 Å²	102	79.3 Å²	79.3	48%	0.477	41%	0.406	S	S	.	.	H	α-helix	trans	-63.5	-49.8	178.4	-172.1	164.8	-159.4	0	0	111.6	K225 F227 C231 C232 E233	K225-E229 WeakPolarHBondContact O-CB 3.42Å; K225-E229 PolarHBondContact O-N 3.41Å; F227-E229 VanDerWaalsContact C-N 3.29Å; F227-E229 PolarHBondContact O-N 2.7Å; E229-C231 VanDerWaalsContact C-N 3.34Å; E229-C231 PolarHBondContact O-N 2.63Å; E229-C232 PolarHBondContact O-N 3.32Å; E229-C232 VanDerWaalsContact O-N 3.16Å; E229-E233 PolarHBondContact O-N 3.3Å
230	T	76.8	Confident	76.1	Confident	80 Å²	80	81.7 Å²	81.7	49%	0.491	42%	0.419	S	S	.	.	H	α-helix	trans	-61.2	-42.2	178.3	-52.8	0	0	0	0	111.7	L226 F227 E233 H234	L226-T230 WeakPolarHBondContact O-CB 3.03Å; L226-T230 PolarHBondContact O-N 3.44Å; L226-T230 PolarHBondContact O-OG1 3.17Å; F227-T230 PolarHBondContact O-N 2.83Å; T230-E233 PolarHBondContact O-N 2.97Å; T230-H234 WeakPolarHBondContact O-CB 3.36Å; T230-H234 PolarHBondContact O-N 2.92Å
231	C	75.1	Confident	76.6	Confident	53 Å²	53	89.5 Å²	89.5	36%	0.358	45%	0.448	S	S	.	.	H	α-helix	trans	-65	-39.3	176.4	-78.5	0	0	0	0	112.2	F227 E229 H234 A235	F227-C231 VanDerWaalsContact CE1-SG 3.55Å; F227-C231 VanDerWaalsContact CZ-SG 3.56Å; F227-C231 WeakPolarHBondContact O-CB 3.15Å; F227-C231 PolarHBondContact O-N 2.86Å; F227-C231 PolarHBondContact O-SG 3.37Å; E229-C231 VanDerWaalsContact C-N 3.34Å; E229-C231 PolarHBondContact O-N 2.63Å; C231-H234 PolarHBondContact O-N 3.48Å; C231-A235 WeakPolarHBondContact O-CB 3.25Å; C231-A235 PolarHBondContact O-N 3.44Å
232	C	82.3	Confident	76.9	Confident	79 Å²	79	91.4 Å²	91.4	53%	0.534	46%	0.461	S	S	.	.	H	α-helix	trans	-66.3	-41.8	177.3	-74.1	0	0	0	0	112	D228 E229 A235 R236	D228-C232 WeakPolarHBondContact O-CB 3.43Å; D228-C232 PolarHBondContact O-N 3Å; D228-C232 PolarHBondContact O-SG 2.7Å; E229-C232 PolarHBondContact O-N 3.32Å; E229-C232 VanDerWaalsContact O-N 3.16Å; C232-A235 PolarHBondContact O-N 3.1Å; C232-R236 VanDerWaalsContact O-CB 3.3Å; C232-R236 WeakPolarHBondContact O-CB 3.32Å; C232-R236 PolarHBondContact O-N 3.34Å
233	E	87.1	Confident	77.3	Confident	104 Å²	104	89.6 Å²	89.6	49%	0.486	46%	0.455	S	S	.	.	H	α-helix	trans	-61.5	-49.5	174.5	-72.3	-175.7	162.3	0	0	111	E229 T230 A235 R236 D237	E229-E233 PolarHBondContact O-N 3.3Å; T230-E233 PolarHBondContact O-N 2.97Å; E233-A235 VanDerWaalsContact C-N 3.34Å; E233-A235 PolarHBondContact O-N 3.43Å; E233-R236 WeakPolarHBondContact O-CB 3.39Å; E233-R236 PolarHBondContact O-N 3.49Å; E233-R236 VanDerWaalsContact O-N 3.16Å; E233-D237 PolarHBondContact O-N 3.19Å
234	H	81.6	Confident	77.5	Confident	107 Å²	107	92.4 Å²	92.4	50%	0.495	47%	0.471	S	S	.	.	H	α-helix	trans	-60.6	-42.6	178.1	-168	72.3	0	0	0	112.6	T230 C231 R236 D237 F238	T230-H234 WeakPolarHBondContact O-CB 3.36Å; T230-H234 PolarHBondContact O-N 2.92Å; C231-H234 PolarHBondContact O-N 3.48Å; H234-R236 VanDerWaalsContact C-N 3.35Å; H234-D237 PolarHBondContact O-N 3.5Å; H234-F238 WeakPolarHBondContact O-CB 3.45Å; H234-F238 PolarHBondContact O-N 2.94Å
235	A	80	Confident	77.7	Confident	58 Å²	58	96.6 Å²	96.6	48%	0.479	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-38	176.6	0	0	0	0	0	112.2	C231 C232 E233 A239	C231-A235 WeakPolarHBondContact O-CB 3.25Å; C231-A235 PolarHBondContact O-N 3.44Å; C232-A235 PolarHBondContact O-N 3.1Å; E233-A235 VanDerWaalsContact C-N 3.34Å; E233-A235 PolarHBondContact O-N 3.43Å; A235-A239 VanDerWaalsContact O-CB 3.29Å; A235-A239 WeakPolarHBondContact O-CB 3.36Å; A235-A239 PolarHBondContact O-N 2.95Å
236	R	87.3	Confident	77.8	Confident	170 Å²	170	95.5 Å²	95.5	64%	0.642	49%	0.486	S	S	*	.	H	α-helix	trans	-64.8	-47.6	176.1	-175.6	-173.7	-66	149.3	0.8	111.1	C232 E233 H234 F238 A239 H240	C232-R236 VanDerWaalsContact O-CB 3.3Å; C232-R236 WeakPolarHBondContact O-CB 3.32Å; C232-R236 PolarHBondContact O-N 3.34Å; E233-R236 WeakPolarHBondContact O-CB 3.39Å; E233-R236 PolarHBondContact O-N 3.49Å; E233-R236 VanDerWaalsContact O-N 3.16Å; H234-R236 VanDerWaalsContact C-N 3.35Å; R236-F238 VanDerWaalsContact C-N 3.31Å; R236-F238 PolarHBondContact O-N 3.4Å; R236-A239 PolarHBondContact O-N 2.92Å; R236-H240 WeakPolarHBondContact O-CB 3.35Å; R236-H240 PolarHBondContact O-N 2.95Å
237	D	85	Confident	78	Confident	93 Å²	93	96.5 Å²	96.5	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-62	-42	178.3	-77.3	-6.8	0	0	0	111.5	E233 H234 H240 R241	E233-D237 PolarHBondContact O-N 3.19Å; H234-D237 PolarHBondContact O-N 3.5Å; D237-H240 PolarHBondContact O-N 3.26Å; D237-R241 WeakPolarHBondContact O-CG 3.06Å; D237-R241 PolarHBondContact O-N 3.38Å; D237-R241 VanDerWaalsContact O-N 3.07Å
238	F	78.6	Confident	77.9	Confident	91 Å²	91	96.1 Å²	96.1	40%	0.399	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-50.2	175.3	-177.4	-103.2	0	0	0	111.7	H234 R236 H240 R241 C242 I289	H234-F238 WeakPolarHBondContact O-CB 3.45Å; H234-F238 PolarHBondContact O-N 2.94Å; R236-F238 VanDerWaalsContact C-N 3.31Å; R236-F238 PolarHBondContact O-N 3.4Å; F238-H240 VanDerWaalsContact C-N 3.29Å; F238-H240 PolarHBondContact O-N 3.45Å; F238-R241 PolarHBondContact O-N 3.38Å; F238-C242 VanDerWaalsContact CE1-SG 3.57Å; F238-C242 VanDerWaalsContact CZ-SG 3.6Å; F238-C242 PolarHBondContact O-N 3.03Å; F238-C242 PolarHBondContact O-SG 3.34Å; F238-C242 VanDerWaalsContact O-SG 3.37Å; F238-I289 WeakPolarHBondContact CE2-O 3.34Å
239	A	82.8	Confident	77.5	Confident	50 Å²	50	95.4 Å²	95.4	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-58.6	-41.8	177.9	0	0	0	0	0	111.9	A235 R236 R241 C242 V243	A235-A239 VanDerWaalsContact O-CB 3.29Å; A235-A239 WeakPolarHBondContact O-CB 3.36Å; A235-A239 PolarHBondContact O-N 2.95Å; R236-A239 PolarHBondContact O-N 2.92Å; A239-R241 PolarHBondContact O-N 2.8Å; A239-C242 PolarHBondContact O-N 3.48Å; A239-V243 VanDerWaalsContact O-CG2 3.29Å; A239-V243 WeakPolarHBondContact O-CG2 3.31Å; A239-V243 PolarHBondContact O-N 3.12Å
240	H	80.4	Confident	76.8	Confident	116 Å²	116	93.9 Å²	93.9	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-60.1	-46.7	176.9	-174.6	-102.4	0	0	0	111.8	R236 D237 F238 V243 L244	R236-H240 WeakPolarHBondContact O-CB 3.35Å; R236-H240 PolarHBondContact O-N 2.95Å; D237-H240 PolarHBondContact O-N 3.26Å; F238-H240 VanDerWaalsContact C-N 3.29Å; F238-H240 PolarHBondContact O-N 3.45Å; H240-V243 PolarHBondContact O-N 2.99Å; H240-L244 VanDerWaalsContact CE1-CD1 3.44Å; H240-L244 WeakPolarHBondContact CE1-CD1 3.44Å; H240-L244 WeakPolarHBondContact O-CG 3.43Å; H240-L244 PolarHBondContact O-N 3.27Å
241	R	77.3	Confident	76.4	Confident	174 Å²	174	95 Å²	95	66%	0.657	49%	0.487	S	S	*	.	H	α-helix	trans	-64.3	-40	176.7	-68.7	177.3	-170.2	-150.4	3.2	112.4	D237 F238 A239 L244 H245	D237-R241 WeakPolarHBondContact O-CG 3.06Å; D237-R241 PolarHBondContact O-N 3.38Å; D237-R241 VanDerWaalsContact O-N 3.07Å; F238-R241 PolarHBondContact O-N 3.38Å; A239-R241 PolarHBondContact O-N 2.8Å; R241-L244 PolarHBondContact O-N 3.08Å; R241-H245 WeakPolarHBondContact O-CB 3.41Å; R241-H245 PolarHBondContact O-N 2.83Å
242	C	70.6	Confident	75.9	Confident	58 Å²	58	95.3 Å²	95.3	39%	0.392	49%	0.49	S	S	.	.	H	α-helix	trans	-62.6	-44.1	175.9	-71.2	0	0	0	0	112.3	F238 A239 H245 F246	F238-C242 VanDerWaalsContact CE1-SG 3.57Å; F238-C242 VanDerWaalsContact CZ-SG 3.6Å; F238-C242 PolarHBondContact O-N 3.03Å; F238-C242 PolarHBondContact O-SG 3.34Å; F238-C242 VanDerWaalsContact O-SG 3.37Å; A239-C242 PolarHBondContact O-N 3.48Å; C242-H245 PolarHBondContact O-N 3.36Å; C242-F246 WeakPolarHBondContact O-CB 3.18Å; C242-F246 PolarHBondContact O-N 3.34Å
243	V	76.1	Confident	75	Confident	76 Å²	76	96.6 Å²	96.6	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-45.4	178.3	171.5	0	0	0	0	110.8	A239 H240 H245 F246 F247	A239-V243 VanDerWaalsContact O-CG2 3.29Å; A239-V243 WeakPolarHBondContact O-CG2 3.31Å; A239-V243 PolarHBondContact O-N 3.12Å; H240-V243 PolarHBondContact O-N 2.99Å; V243-H245 PolarHBondContact O-N 2.94Å; V243-F246 PolarHBondContact O-N 2.8Å; V243-F247 HydrophobicContact CG1-CD2 3.71Å; V243-F247 HydrophobicContact CG1-CE2 3.58Å; V243-F247 VanDerWaalsContact O-CD2 3.23Å; V243-F247 WeakPolarHBondContact O-CD2 3.48Å; V243-F247 PolarHBondContact O-N 2.9Å
244	L	75.2	Confident	73.6	Confident	100 Å²	100	95.8 Å²	95.8	52%	0.524	49%	0.486	S	S	.	.	H	α-helix	trans	-60.5	-45.4	175.8	-73.5	177.7	0	0	0	112.1	H240 R241 F246 F247 A248	H240-L244 VanDerWaalsContact CE1-CD1 3.44Å; H240-L244 WeakPolarHBondContact CE1-CD1 3.44Å; H240-L244 WeakPolarHBondContact O-CG 3.43Å; H240-L244 PolarHBondContact O-N 3.27Å; R241-L244 PolarHBondContact O-N 3.08Å; L244-F246 VanDerWaalsContact C-N 3.35Å; L244-F246 PolarHBondContact O-N 3.39Å; L244-F247 PolarHBondContact O-N 2.85Å; L244-A248 WeakPolarHBondContact O-CB 3.38Å; L244-A248 PolarHBondContact O-N 3.43Å
245	H	70.6	Confident	72.8	Confident	138 Å²	138	98.1 Å²	98.1	64%	0.639	49%	0.491	S	S	*	.	H	α-helix	trans	-62.7	-41.3	177.2	-175.8	-80	0	0	0	111.9	R241 C242 V243 A248 S249	R241-H245 WeakPolarHBondContact O-CB 3.41Å; R241-H245 PolarHBondContact O-N 2.83Å; C242-H245 PolarHBondContact O-N 3.36Å; V243-H245 PolarHBondContact O-N 2.94Å; H245-A248 PolarHBondContact O-N 3.01Å; H245-S249 VanDerWaalsContact O-CB 3.27Å; H245-S249 WeakPolarHBondContact O-CB 3.42Å; H245-S249 PolarHBondContact O-N 3.15Å
246	F	73.8	Confident	72	Confident	120 Å²	120	99.5 Å²	99.5	53%	0.526	50%	0.502	S	S	.	.	H	α-helix	trans	-59.2	-49.3	176.3	176.3	-98.2	0	0	0	111.6	C242 V243 L244 S249 M250	C242-F246 WeakPolarHBondContact O-CB 3.18Å; C242-F246 PolarHBondContact O-N 3.34Å; V243-F246 PolarHBondContact O-N 2.8Å; L244-F246 VanDerWaalsContact C-N 3.35Å; L244-F246 PolarHBondContact O-N 3.39Å; F246-S249 PolarHBondContact O-N 3.16Å; F246-M250 HydrophobicContact CD1-CG 4.32Å; F246-M250 HydrophobicContact CE1-CG 3.91Å; F246-M250 HydrophobicContact CE2-CG 4.15Å; F246-M250 HydrophobicContact CE2-SD 4.45Å; F246-M250 HydrophobicContact CZ-CG 3.82Å; F246-M250 HydrophobicContact CZ-SD 4.22Å; F246-M250 WeakPolarHBondContact O-CB 3.31Å; F246-M250 WeakPolarHBondContact O-CG 3.29Å; F246-M250 PolarHBondContact O-N 3.35Å
247	F	75.1	Confident	70.8	Confident	134 Å²	134	97.8 Å²	97.8	59%	0.588	51%	0.505	S	S	*	.	H	α-helix	trans	-67.5	-38.2	178.9	-76.6	-64.7	0	0	0	112.9	V243 L244 M250 Q251	V243-F247 HydrophobicContact CG1-CD2 3.71Å; V243-F247 HydrophobicContact CG1-CE2 3.58Å; V243-F247 VanDerWaalsContact O-CD2 3.23Å; V243-F247 WeakPolarHBondContact O-CD2 3.48Å; V243-F247 PolarHBondContact O-N 2.9Å; L244-F247 PolarHBondContact O-N 2.85Å; F247-M250 PolarHBondContact O-N 2.79Å; F247-Q251 WeakPolarHBondContact O-CB 3.45Å; F247-Q251 PolarHBondContact O-N 2.81Å
248	A	69.6	Low	69.3	Low	54 Å²	54	96.1 Å²	96.1	45%	0.446	51%	0.51	S	S	.	.	H	α-helix	trans	-62.6	-43.6	174.3	0	0	0	0	0	111.7	L244 H245 Q251 S252	L244-A248 WeakPolarHBondContact O-CB 3.38Å; L244-A248 PolarHBondContact O-N 3.43Å; H245-A248 PolarHBondContact O-N 3.01Å; A248-Q251 PolarHBondContact O-N 2.81Å; A248-S252 WeakPolarHBondContact O-CB 3.27Å; A248-S252 PolarHBondContact O-N 3.35Å
249	S	64.3	Low	68	Low	46 Å²	46	98 Å²	98	32%	0.322	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-47.8	175.7	-167.5	0	0	0	0	111.3	H245 F246 Q251 S252 E253	H245-S249 VanDerWaalsContact O-CB 3.27Å; H245-S249 WeakPolarHBondContact O-CB 3.42Å; H245-S249 PolarHBondContact O-N 3.15Å; F246-S249 PolarHBondContact O-N 3.16Å; S249-Q251 VanDerWaalsContact C-N 3.34Å; S249-Q251 PolarHBondContact O-N 2.7Å; S249-S252 WeakPolarHBondContact O-CB 3.21Å; S249-S252 PolarHBondContact O-N 2.83Å; S249-S252 VanDerWaalsContact O-N 3.11Å; S249-S252 PolarHBondContact O-OG 3.44Å; S249-E253 PolarHBondContact O-N 3.25Å
250	M	63.8	Low	66.3	Low	71 Å²	71	103.3 Å²	103.3	35%	0.35	54%	0.54	S	S	.	.	H	α-helix	trans	-59.1	-42.7	175.9	-76.4	-61.9	-52	0	0	112.3	F246 F247 S252 E253 L254	F246-M250 HydrophobicContact CD1-CG 4.32Å; F246-M250 HydrophobicContact CE1-CG 3.91Å; F246-M250 HydrophobicContact CE2-CG 4.15Å; F246-M250 HydrophobicContact CE2-SD 4.45Å; F246-M250 HydrophobicContact CZ-CG 3.82Å; F246-M250 HydrophobicContact CZ-SD 4.22Å; F246-M250 WeakPolarHBondContact O-CB 3.31Å; F246-M250 WeakPolarHBondContact O-CG 3.29Å; F246-M250 PolarHBondContact O-N 3.35Å; F247-M250 PolarHBondContact O-N 2.79Å; M250-S252 VanDerWaalsContact C-N 3.29Å; M250-S252 PolarHBondContact O-N 2.88Å; M250-E253 PolarHBondContact O-N 3.44Å; M250-L254 WeakPolarHBondContact O-CB 3.31Å; M250-L254 VanDerWaalsContact O-CG 3.3Å; M250-L254 WeakPolarHBondContact O-CG 3.09Å; M250-L254 PolarHBondContact O-N 2.79Å
251	Q	67.2	Low	64.5	Low	104 Å²	104	109.4 Å²	109.4	49%	0.486	56%	0.558	S	S	.	*	H	α-helix	trans	-66.2	-34.6	177.1	-159.7	-176.6	23.4	0	0	111.6	F247 A248 S249 R255	F247-Q251 WeakPolarHBondContact O-CB 3.45Å; F247-Q251 PolarHBondContact O-N 2.81Å; A248-Q251 PolarHBondContact O-N 2.81Å; S249-Q251 VanDerWaalsContact C-N 3.34Å; S249-Q251 PolarHBondContact O-N 2.7Å; Q251-R255 VanDerWaalsContact NE2-NH2 3.12Å; Q251-R255 VanDerWaalsContact O-CG 3.29Å; Q251-R255 WeakPolarHBondContact O-CG 3.42Å; Q251-R255 PolarHBondContact O-N 3.47Å; Q251-R255 VanDerWaalsContact O-N 3.14Å
252	S	65.4	Low	62.6	Low	59 Å²	59	104.1 Å²	104.1	41%	0.413	56%	0.558	S	S	.	*	H	α-helix	trans	-68.8	-40.2	174.3	79.2	0	0	0	0	112.5	A248 S249 M250 R255 A256	A248-S252 WeakPolarHBondContact O-CB 3.27Å; A248-S252 PolarHBondContact O-N 3.35Å; S249-S252 WeakPolarHBondContact O-CB 3.21Å; S249-S252 PolarHBondContact O-N 2.83Å; S249-S252 VanDerWaalsContact O-N 3.11Å; S249-S252 PolarHBondContact O-OG 3.44Å; M250-S252 VanDerWaalsContact C-N 3.29Å; M250-S252 PolarHBondContact O-N 2.88Å; S252-R255 PolarHBondContact O-N 2.64Å; S252-A256 WeakPolarHBondContact O-CB 3.23Å; S252-A256 PolarHBondContact O-N 3.08Å
253	E	63.2	Low	61.1	Low	105 Å²	105	104.6 Å²	104.6	49%	0.491	57%	0.572	S	S	.	*	H	α-helix	trans	-68.4	-40.4	175.9	-73	-170.9	172.5	0	0	112.1	S249 M250 R255 A256 L257	S249-E253 PolarHBondContact O-N 3.25Å; M250-E253 PolarHBondContact O-N 3.44Å; E253-R255 VanDerWaalsContact C-N 3.29Å; E253-R255 PolarHBondContact O-N 2.8Å; E253-A256 PolarHBondContact O-N 2.61Å; E253-A256 VanDerWaalsContact O-N 3.14Å; E253-L257 WeakPolarHBondContact O-CB 3.11Å; E253-L257 WeakPolarHBondContact O-CG 3.32Å; E253-L257 PolarHBondContact O-N 3.33Å
254	L	57.1	Low	59	Low	87 Å²	87	108.7 Å²	108.7	46%	0.455	59%	0.59	S	S	.	*	H	α-helix	trans	-62.9	-35.6	174.5	-74	171.3	0	0	0	112.3	M250 L259	M250-L254 WeakPolarHBondContact O-CB 3.31Å; M250-L254 VanDerWaalsContact O-CG 3.3Å; M250-L254 WeakPolarHBondContact O-CG 3.09Å; M250-L254 PolarHBondContact O-N 2.79Å; L254-L259 HydrophobicContact CD2-CD1 4.23Å
255	R	64.7	Low	57.3	Low	156 Å²	156	109.4 Å²	109.4	59%	0.589	60%	0.6	S	S	*	*	H	α-helix	trans	-68.6	-41.6	171.1	-73.1	177.6	-171.7	121.5	-4.9	111.6	Q251 S252 E253 G258	Q251-R255 VanDerWaalsContact NE2-NH2 3.12Å; Q251-R255 VanDerWaalsContact O-CG 3.29Å; Q251-R255 WeakPolarHBondContact O-CG 3.42Å; Q251-R255 PolarHBondContact O-N 3.47Å; Q251-R255 VanDerWaalsContact O-N 3.14Å; S252-R255 PolarHBondContact O-N 2.64Å; E253-R255 VanDerWaalsContact C-N 3.29Å; E253-R255 PolarHBondContact O-N 2.8Å; R255-G258 PolarHBondContact O-N 3.02Å
256	A	63.6	Low	56.1	Low	88 Å²	88	111.8 Å²	111.8	73%	0.727	61%	0.611	S	S	*	*	H	α-helix	trans	-67.8	-32.4	179.6	0	0	0	0	0	113.4	S252 E253 G258	S252-A256 WeakPolarHBondContact O-CB 3.23Å; S252-A256 PolarHBondContact O-N 3.08Å; E253-A256 PolarHBondContact O-N 2.61Å; E253-A256 VanDerWaalsContact O-N 3.14Å; A256-G258 PolarHBondContact O-N 3.44Å
257	L	63.3	Low	54.2	Low	134 Å²	134	111.5 Å²	111.5	70%	0.702	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	6.2	174.3	-74.3	164.7	0	0	0	113.6	E253 L259	E253-L257 WeakPolarHBondContact O-CB 3.11Å; E253-L257 WeakPolarHBondContact O-CG 3.32Å; E253-L257 PolarHBondContact O-N 3.33Å; L257-L259 VanDerWaalsContact C-N 3.29Å; L257-L259 PolarHBondContact O-N 3.32Å
258	G	53.4	Low	52.1	Low	58 Å²	58	114.1 Å²	114.1	60%	0.598	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.1	18.7	170.8	0	0	0	0	0	114.8	R255 A256 H260	R255-G258 PolarHBondContact O-N 3.02Å; A256-G258 PolarHBondContact O-N 3.44Å; G258-H260 PolarHBondContact O-N 2.72Å
259	L	51.2	Low	50.5	Low	131 Å²	131	120.9 Å²	120.9	69%	0.686	66%	0.661	S	S	*	*			trans	-76.8	37.7	174.5	-75.4	169.6	0	0	0	112.8	L254 L257 R261	L254-L259 HydrophobicContact CD2-CD1 4.23Å; L257-L259 VanDerWaalsContact C-N 3.29Å; L257-L259 PolarHBondContact O-N 3.32Å; L259-R261 VanDerWaalsContact C-N 3.26Å; L259-R261 PolarHBondContact O-N 2.65Å; L259-R261 VanDerWaalsContact O-N 3.1Å
260	H	45.8	Very low	48.8	Very low	161 Å²	161	126.5 Å²	126.5	75%	0.745	69%	0.686	S	S	*	*			trans	-82.2	77.5	163.6	-139.4	-34	0	0	0	108.4	G258 G262	G258-H260 PolarHBondContact O-N 2.72Å; H260-G262 PolarHBondContact O-N 3.1Å
261	R	43.6	Very low	47.6	Very low	244 Å²	244	128.7 Å²	128.7	92%	0.921	71%	0.706	S	S	*	*			trans	-76.9	102.9	164.7	-169.9	171.5	-166.1	173.6	4	108.5	L259	L259-R261 VanDerWaalsContact C-N 3.26Å; L259-R261 PolarHBondContact O-N 2.65Å; L259-R261 VanDerWaalsContact O-N 3.1Å
262	G	37.2	Very low	46.1	Very low	63 Å²	63	132.1 Å²	132.1	65%	0.649	72%	0.722	S	S	*	*	S	Bend	trans	75.7	114.3	157.1	0	0	0	0	0	114.7	H260	H260-G262 PolarHBondContact O-N 3.1Å
263	G	38.9	Very low	44.6	Very low	67 Å²	67	134.2 Å²	134.2	69%	0.691	73%	0.734	S	S	*	*			trans	-68.8	160.5	-176.3	0	0	0	0	0	115.5
264	I	31.6	Very low	43.4	Very low	163 Å²	163	135 Å²	135	84%	0.836	75%	0.748	S	S	*	*			trans	-145.5	140.3	146.2	-63.7	-167.1	0	0	0	106.4
265	P	39.9	Very low	42.4	Very low	114 Å²	114	139.2 Å²	139.2	74%	0.74	77%	0.765	S	S	*	*			trans	-77.2	157	-172.9	-1.5	19.9	0	0	0	113.1
266	E	45.3	Very low	40.9	Very low	188 Å²	188	139.6 Å²	139.6	88%	0.879	78%	0.779	S	S	*	*			trans	2.2	124.4	162.3	-76.4	175.7	116.9	0	0	118.1
267	S	33.3	Very low	39.7	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	79%	0.786	S	S	*	*			trans	-154.6	119.8	144.5	-75.6	0	0	0	0	111.1
268	Q	32.2	Very low	38.3	Very low	190 Å²	190	144.9 Å²	144.9	89%	0.888	80%	0.795	S	S	*	*			trans	72.9	95.9	152.8	-74.8	169.6	-39.9	0	0	119
269	E	34.8	Very low	37.3	Very low	196 Å²	196	145.5 Å²	145.5	92%	0.916	80%	0.801	S	S	*	*			trans	-48.2	134.6	146.5	-65.9	177.4	146.4	0	0	111.1
270	L	30.2	Very low	36.4	Very low	163 Å²	163	142.8 Å²	142.8	85%	0.853	81%	0.805	S	S	*	*			trans	-107.8	139.7	166.2	-159.2	74	0	0	0	107.7
271	P	37.1	Very low	36	Very low	117 Å²	117	141.6 Å²	141.6	76%	0.76	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76	134.1	-162.4	-10.8	27.2	0	0	0	113
272	E	35.3	Very low	35.5	Very low	177 Å²	177	133.2 Å²	133.2	83%	0.827	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-58.1	140.2	159.1	-75	-84.1	153.4	0	0	110.3
273	P	34.2	Very low	35.3	Very low	102 Å²	102	139.7 Å²	139.7	66%	0.662	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74.8	156.3	172.6	32.2	-32.3	0	0	0	111.1	E275	P273-E275 PolarHBondContact O-N 3.41Å
274	P	37.8	Very low	35.2	Very low	121 Å²	121	140.6 Å²	140.6	79%	0.786	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-70.3	130.4	-159	-12.7	27.3	0	0	0	113.2	D276	P274-D276 PolarHBondContact O-N 3.44Å
275	E	37.9	Very low	35.3	Very low	176 Å²	176	140.8 Å²	140.8	82%	0.822	81%	0.813	S	S	*	*			trans	-78.1	104.4	159.4	-66.7	-168.5	141.2	0	0	108.9	P273 L277	P273-E275 PolarHBondContact O-N 3.41Å; E275-L277 PolarHBondContact O-N 3.3Å
276	D	31.9	Very low	35.3	Very low	164 Å²	164	143.3 Å²	143.3	88%	0.877	82%	0.819	S	S	*	*			trans	-72.9	109.3	163.2	-79.2	-34.8	0	0	0	108.9	P274	P274-D276 PolarHBondContact O-N 3.44Å
277	L	39.7	Very low	35	Very low	166 Å²	166	143.9 Å²	143.9	87%	0.869	81%	0.813	S	S	*	*			trans	-82.6	106.1	169.2	-78.5	160.1	0	0	0	109.4	E275	E275-L277 PolarHBondContact O-N 3.3Å
278	D	32.3	Very low	35.5	Very low	168 Å²	168	141.7 Å²	141.7	90%	0.898	80%	0.802	S	S	*	*			trans	-128.7	133.6	140.7	-163.6	16.1	0	0	0	109.4
279	G	32.5	Very low	36.2	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	77%	0.77	S	S	*	*			trans	-83.7	151.9	-156.6	0	0	0	0	0	114.8
280	G	33.3	Very low	37	Very low	75 Å²	75	130.5 Å²	130.5	77%	0.773	76%	0.763	S	S	*	*			trans	117.9	108.3	149.1	0	0	0	0	0	115.7
281	S	36.7	Very low	38.1	Very low	135 Å²	135	125 Å²	125	94%	0.944	74%	0.738	S	S	*	*	S	Bend	trans	82.5	102.7	157.3	-165.2	0	0	0	0	118
282	G	33.3	Very low	38.8	Very low	68 Å²	68	129.2 Å²	129.2	70%	0.701	74%	0.739	S	S	*	*			trans	105.3	79.5	151.3	0	0	0	0	0	115.1	A284	G282-A284 PolarHBondContact O-N 3.01Å
283	K	34.1	Very low	39.9	Very low	200 Å²	200	128.2 Å²	128.2	87%	0.87	73%	0.734	S	S	*	*			trans	-60.9	85.1	160.5	-74.8	-178.8	177.3	-179.6	0	109	H285	K283-H285 PolarHBondContact O-N 3.46Å
284	A	35	Very low	40.9	Very low	86 Å²	86	126.6 Å²	126.6	71%	0.711	72%	0.718	S	S	*	*			trans	-70.4	85.7	164.6	0	0	0	0	0	107	G282 L286	G282-A284 PolarHBondContact O-N 3.01Å; A284-L286 PolarHBondContact O-N 3.42Å
285	H	34.2	Very low	42.1	Very low	166 Å²	166	123.7 Å²	123.7	77%	0.769	70%	0.698	S	S	*	*			trans	-52.2	97.2	154.7	-99	67.4	0	0	0	106.3	K283 R287	K283-H285 PolarHBondContact O-N 3.46Å; H285-R287 PolarHBondContact O-N 3.31Å
286	L	39.4	Very low	43.4	Very low	168 Å²	168	119.1 Å²	119.1	88%	0.88	68%	0.679	S	S	*	*			trans	-65.9	89.1	162.2	-78.7	163.5	0	0	0	105	A284 A288	A284-L286 PolarHBondContact O-N 3.42Å; L286-A288 PolarHBondContact O-N 2.79Å
287	R	39	Very low	45.2	Very low	200 Å²	200	117.4 Å²	117.4	76%	0.755	67%	0.665	S	S	*	*			trans	-51.3	117.4	179.4	-81	-178.4	178.3	-177.6	-0.8	107.2	H285 I289	H285-R287 PolarHBondContact O-N 3.31Å; R287-I289 PolarHBondContact O-N 3.32Å
288	A	44.7	Very low	46.4	Very low	68 Å²	68	113.6 Å²	113.6	56%	0.562	65%	0.645	S	S	*	*			trans	-47.6	127	164.6	0	0	0	0	0	107.5	L286 S290	L286-A288 PolarHBondContact O-N 2.79Å; A288-S290 PolarHBondContact O-N 2.88Å
289	I	47.7	Very low	48.1	Very low	41 Å²	41	109.2 Å²	109.2	21%	0.21	62%	0.621	C	S	.	*			trans	-65.4	92.7	176.2	-66.2	162.4	0	0	0	106.3	F238 R287 Q294 V295 L298	F238-I289 WeakPolarHBondContact CE2-O 3.34Å; R287-I289 PolarHBondContact O-N 3.32Å; I289-Q294 HydrophobicContact CG2-CB 4.2Å; I289-V295 HydrophobicContact CG2-CB 4.32Å; I289-V295 HydrophobicContact CG2-CG2 3.22Å; I289-L298 HydrophobicContact CD1-CD1 3.5Å; I289-L298 HydrophobicContact CG1-CD1 4.09Å
290	S	51	Low	49.5	Very low	109 Å²	109	109.1 Å²	109.1	76%	0.762	61%	0.61	S	S	*	*			trans	-102.7	-14.7	-170.1	-170	0	0	0	0	111.8	A288	A288-S290 PolarHBondContact O-N 2.88Å
291	S	54.1	Low	50.9	Low	49 Å²	49	108.7 Å²	108.7	34%	0.343	59%	0.592	S	S	.	*	S	Bend	trans	-115.2	139.7	177	76.1	0	0	0	0	112	E293 Q294 V295	S291-E293 PolarHBondContact O-N 3.19Å; S291-Q294 WeakPolarHBondContact O-CB 3.29Å; S291-Q294 PolarHBondContact O-N 3.33Å; S291-Q294 PolarHBondContact OG-N 2.93Å; S291-V295 PolarHBondContact O-N 3.46Å
292	R	51.1	Low	52.1	Low	205 Å²	205	106.9 Å²	106.9	77%	0.774	57%	0.565	S	S	*	*	H	α-helix	trans	-50.4	-37.6	171.3	-178.8	177.5	-179.2	171.4	3.2	112	Q294 V295 D296	R292-Q294 VanDerWaalsContact C-N 3.29Å; R292-Q294 PolarHBondContact O-N 2.99Å; R292-V295 PolarHBondContact O-N 2.96Å; R292-D296 IonicContact NE-OD2 3.29Å; R292-D296 WeakPolarHBondContact O-CB 3.37Å; R292-D296 VanDerWaalsContact O-CG 3.24Å; R292-D296 PolarHBondContact O-N 2.99Å
293	E	57.4	Low	53.5	Low	155 Å²	155	106.9 Å²	106.9	72%	0.724	54%	0.544	S	S	*	.	H	α-helix	trans	-61.6	-34.3	178.9	-63.7	162.4	-178.5	0	0	112.8	S291 H297	S291-E293 PolarHBondContact O-N 3.19Å; E293-H297 VanDerWaalsContact O-CB 3.22Å; E293-H297 WeakPolarHBondContact O-CB 3.35Å; E293-H297 PolarHBondContact O-N 2.83Å
294	Q	56.2	Low	54.5	Low	68 Å²	68	101 Å²	101	32%	0.318	53%	0.528	S	S	.	.	H	α-helix	trans	-78.3	-35.7	-179.4	-152.3	177	17.9	0	0	111.3	I289 S291 R292 L298	I289-Q294 HydrophobicContact CG2-CB 4.2Å; S291-Q294 WeakPolarHBondContact O-CB 3.29Å; S291-Q294 PolarHBondContact O-N 3.33Å; S291-Q294 PolarHBondContact OG-N 2.93Å; R292-Q294 VanDerWaalsContact C-N 3.29Å; R292-Q294 PolarHBondContact O-N 2.99Å; Q294-L298 WeakPolarHBondContact O-CB 3.22Å; Q294-L298 VanDerWaalsContact O-CG 3.29Å; Q294-L298 WeakPolarHBondContact O-CG 3.24Å; Q294-L298 PolarHBondContact O-N 3.44Å
295	V	62.3	Low	55.4	Low	61 Å²	61	100.6 Å²	100.6	37%	0.37	52%	0.52	S	S	.	.	H	α-helix	trans	-62.4	-50.6	167.9	-178.4	0	0	0	0	110.1	I289 S291 R292 H297 L298 L299	I289-V295 HydrophobicContact CG2-CB 4.32Å; I289-V295 HydrophobicContact CG2-CG2 3.22Å; S291-V295 PolarHBondContact O-N 3.46Å; R292-V295 PolarHBondContact O-N 2.96Å; V295-H297 VanDerWaalsContact C-N 3.29Å; V295-H297 PolarHBondContact O-N 3.41Å; V295-L298 PolarHBondContact O-N 3.36Å; V295-L298 VanDerWaalsContact O-N 3.15Å; V295-L299 HydrophobicContact CG1-CD1 3.73Å; V295-L299 HydrophobicContact CG1-CG 4.12Å; V295-L299 WeakPolarHBondContact O-CB 2.98Å; V295-L299 WeakPolarHBondContact O-CG 3.25Å; V295-L299 PolarHBondContact O-N 3.41Å
296	D	65.6	Low	56.4	Low	80 Å²	80	95.5 Å²	95.5	43%	0.428	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-38.6	-178.8	-71.8	-18	0	0	0	111.1	R292 S300	R292-D296 IonicContact NE-OD2 3.29Å; R292-D296 WeakPolarHBondContact O-CB 3.37Å; R292-D296 VanDerWaalsContact O-CG 3.24Å; R292-D296 PolarHBondContact O-N 2.99Å; D296-S300 WeakPolarHBondContact O-CB 3.49Å; D296-S300 PolarHBondContact O-N 2.72Å
297	H	69.7	Low	56.9	Low	127 Å²	127	91.6 Å²	91.6	59%	0.588	48%	0.48	S	S	*	.	H	α-helix	trans	-65	-45.2	173.8	-178.7	-80.3	0	0	0	112.2	E293 V295 S300 T301	E293-H297 VanDerWaalsContact O-CB 3.22Å; E293-H297 WeakPolarHBondContact O-CB 3.35Å; E293-H297 PolarHBondContact O-N 2.83Å; V295-H297 VanDerWaalsContact C-N 3.29Å; V295-H297 PolarHBondContact O-N 3.41Å; H297-S300 PolarHBondContact O-N 2.89Å; H297-T301 PolarHBondContact CE1-OG1 3.08Å; H297-T301 VanDerWaalsContact O-CB 3.27Å; H297-T301 WeakPolarHBondContact O-CB 3.43Å; H297-T301 PolarHBondContact O-N 2.75Å; H297-T301 PolarHBondContact O-OG1 2.84Å
298	L	65.8	Low	57.4	Low	87 Å²	87	86.4 Å²	86.4	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-65.4	-43	177.5	-75.1	168.9	0	0	0	111.7	I289 Q294 V295 T301 W302	I289-L298 HydrophobicContact CD1-CD1 3.5Å; I289-L298 HydrophobicContact CG1-CD1 4.09Å; Q294-L298 WeakPolarHBondContact O-CB 3.22Å; Q294-L298 VanDerWaalsContact O-CG 3.29Å; Q294-L298 WeakPolarHBondContact O-CG 3.24Å; Q294-L298 PolarHBondContact O-N 3.44Å; V295-L298 PolarHBondContact O-N 3.36Å; V295-L298 VanDerWaalsContact O-N 3.15Å; L298-T301 PolarHBondContact O-N 2.83Å; L298-W302 VanDerWaalsContact O-CB 3.31Å; L298-W302 WeakPolarHBondContact O-CB 3.28Å; L298-W302 PolarHBondContact O-N 3.38Å
299	L	66.4	Low	57.6	Low	75 Å²	75	84.3 Å²	84.3	39%	0.393	45%	0.452	S	S	.	.	H	α-helix	trans	-63.9	-42.6	175.3	-71.3	176.4	0	0	0	111.5	F227 V295 W302 Y303	F227-L299 HydrophobicContact CZ-CD2 4.08Å; V295-L299 HydrophobicContact CG1-CD1 3.73Å; V295-L299 HydrophobicContact CG1-CG 4.12Å; V295-L299 WeakPolarHBondContact O-CB 2.98Å; V295-L299 WeakPolarHBondContact O-CG 3.25Å; V295-L299 PolarHBondContact O-N 3.41Å; L299-W302 PolarHBondContact O-N 2.87Å; L299-Y303 WeakPolarHBondContact O-CB 3.39Å; L299-Y303 PolarHBondContact O-N 3.34Å
300	S	63.3	Low	57.5	Low	69 Å²	69	86.4 Å²	86.4	48%	0.483	46%	0.464	S	S	.	.	H	α-helix	trans	-66	-38.6	176	-175	0	0	0	0	112	D296 H297 S304	D296-S300 WeakPolarHBondContact O-CB 3.49Å; D296-S300 PolarHBondContact O-N 2.72Å; H297-S300 PolarHBondContact O-N 2.89Å; S300-S304 VanDerWaalsContact O-CB 3.23Å; S300-S304 WeakPolarHBondContact O-CB 3.43Å; S300-S304 PolarHBondContact O-N 3.25Å; S300-S304 PolarHBondContact O-OG 3.1Å
301	T	61.2	Low	57.4	Low	65 Å²	65	86.1 Å²	86.1	40%	0.399	45%	0.453	S	S	.	.	H	α-helix	trans	-66.7	-48.2	175.3	-57.3	0	0	0	0	110.7	H297 L298 S304 S305	H297-T301 PolarHBondContact CE1-OG1 3.08Å; H297-T301 VanDerWaalsContact O-CB 3.27Å; H297-T301 WeakPolarHBondContact O-CB 3.43Å; H297-T301 PolarHBondContact O-N 2.75Å; H297-T301 PolarHBondContact O-OG1 2.84Å; L298-T301 PolarHBondContact O-N 2.83Å; T301-S304 PolarHBondContact O-N 3.01Å; T301-S305 WeakPolarHBondContact O-CB 3.49Å; T301-S305 PolarHBondContact O-N 2.93Å; T301-S305 PolarHBondContact O-OG 3.2Å
302	W	62.7	Low	56.9	Low	97 Å²	97	88 Å²	88	37%	0.367	47%	0.471	S	S	.	.	H	α-helix	trans	-60.1	-44.3	175	176.4	85.4	0	0	0	111.9	F227 L298 L299 S304 S305 K306	F227-W302 AromaticContact CD2-CH2 3.81Å; F227-W302 HydrophobicContact CD2-CH2 3.81Å; F227-W302 AromaticContact CD2-CZ2 3.57Å; F227-W302 HydrophobicContact CD2-CZ2 3.57Å; F227-W302 HydrophobicContact CD2-CZ3 4.47Å; F227-W302 HydrophobicContact CE2-CD2 4.14Å; F227-W302 AromaticContact CE2-CE2 3.96Å; F227-W302 HydrophobicContact CE2-CE3 4.18Å; F227-W302 AromaticContact CE2-CH2 3.84Å; F227-W302 HydrophobicContact CE2-CH2 3.84Å; F227-W302 AromaticContact CE2-CZ2 3.83Å; F227-W302 HydrophobicContact CE2-CZ2 3.83Å; F227-W302 HydrophobicContact CE2-CZ3 4.03Å; F227-W302 HydrophobicContact CG-CH2 4.37Å; F227-W302 HydrophobicContact CG-CZ2 4.38Å; F227-W302 HydrophobicContact CZ-CH2 4.42Å; F227-W302 HydrophobicContact CZ-CZ3 4.37Å; L298-W302 VanDerWaalsContact O-CB 3.31Å; L298-W302 WeakPolarHBondContact O-CB 3.28Å; L298-W302 PolarHBondContact O-N 3.38Å; L299-W302 PolarHBondContact O-N 2.87Å; W302-S304 VanDerWaalsContact C-N 3.32Å; W302-S304 PolarHBondContact O-N 3.45Å; W302-S305 WeakPolarHBondContact CA-OG 3.16Å; W302-S305 PolarHBondContact O-N 3.24Å; W302-S305 PolarHBondContact O-OG 3.28Å; W302-K306 VanDerWaalsContact CZ2-CE 3.46Å; W302-K306 PolarHBondContact O-N 2.88Å
303	Y	63.4	Low	56.4	Low	69 Å²	69	81.6 Å²	81.6	27%	0.271	46%	0.463	S	S	.	.	H	α-helix	trans	-58.7	-47.1	175.5	-174.9	-100.9	0	0	0	110.4	E79 R83 L299	E79-Y303 PolarHBondContact O-OH 3.4Å; R83-Y303 HydrophobicContact CG-CE1 3.6Å; R83-Y303 HydrophobicContact CG-CE2 4.42Å; R83-Y303 WeakPolarHBondContact CG-OH 3.25Å; R83-Y303 PolarHBondContact NE-OH 3.45Å; R83-Y303 PolarHBondContact NH1-O 2.99Å; L299-Y303 WeakPolarHBondContact O-CB 3.39Å; L299-Y303 PolarHBondContact O-N 3.34Å
304	S	53.9	Low	55.2	Low	77 Å²	77	78.9 Å²	78.9	54%	0.538	46%	0.46	S	S	.	.	H	α-helix	trans	-76	-22.5	-177.4	-55	0	0	0	0	113.8	S300 T301 W302	S300-S304 VanDerWaalsContact O-CB 3.23Å; S300-S304 WeakPolarHBondContact O-CB 3.43Å; S300-S304 PolarHBondContact O-N 3.25Å; S300-S304 PolarHBondContact O-OG 3.1Å; T301-S304 PolarHBondContact O-N 3.01Å; W302-S304 VanDerWaalsContact C-N 3.32Å; W302-S304 PolarHBondContact O-N 3.45Å
305	S	55	Low	54.4	Low	77 Å²	77	81.2 Å²	81.2	54%	0.538	48%	0.482	S	S	.	.	H	α-helix	trans	-96.5	3.4	-176.9	66.6	0	0	0	0	114.6	T301 W302	T301-S305 WeakPolarHBondContact O-CB 3.49Å; T301-S305 PolarHBondContact O-N 2.93Å; T301-S305 PolarHBondContact O-OG 3.2Å; W302-S305 WeakPolarHBondContact CA-OG 3.16Å; W302-S305 PolarHBondContact O-N 3.24Å; W302-S305 PolarHBondContact O-OG 3.28Å
306	K	54.2	Low	53	Low	59 Å²	59	88 Å²	88	26%	0.257	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-54.2	127.2	173.1	-76.2	-160.1	178.7	-159.6	0	110.2	E223 W302	E223-K306 WeakPolarHBondContact OE1-CE 3.37Å; E223-K306 IonicContact OE1-NZ 2.61Å; E223-K306 PolarHBondContact OE1-NZ 3.4Å; E223-K306 IonicContact OE2-NZ 3.33Å; E223-K306 PolarHBondContact OE2-NZ 3.36Å; W302-K306 VanDerWaalsContact CZ2-CE 3.46Å; W302-K306 PolarHBondContact O-N 2.88Å
307	P	50.3	Low	51.5	Low	85 Å²	85	91.6 Å²	91.6	55%	0.552	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-62.8	149.6	-176.1	23.5	-32.2	0	0	0	111.8
308	P	48.7	Very low	49.4	Very low	92 Å²	92	97.3 Å²	97.3	60%	0.597	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-62.5	140.1	174.8	26.3	-32.9	0	0	0	110.5	D310	P308-D310 PolarHBondContact O-N 3Å
309	L	48.9	Very low	47.6	Very low	24 Å²	24	103.9 Å²	103.9	13%	0.126	56%	0.56	C	S	.	*			trans	-85.8	46.9	-175.2	-58.2	-175.9	0	0	0	112.8	K90 I94 W216	K90-L309 HydrophobicContact CD-CD1 3.41Å; K90-L309 VanDerWaalsContact CD-CD1 3.41Å; K90-L309 HydrophobicContact CD-CG 4.1Å; K90-L309 HydrophobicContact CG-CB 4.24Å; K90-L309 HydrophobicContact CG-CD1 3.71Å; K90-L309 HydrophobicContact CG-CG 3.96Å; I94-L309 HydrophobicContact CD1-CB 3.94Å; I94-L309 HydrophobicContact CD1-CD1 4.43Å; I94-L309 HydrophobicContact CG2-CD1 4.26Å; W216-L309 HydrophobicContact CD2-CD1 4.22Å; W216-L309 HydrophobicContact CE3-CD1 4.07Å; W216-L309 HydrophobicContact CE3-CD2 4.2Å; W216-L309 HydrophobicContact CH2-CD1 3.05Å; W216-L309 HydrophobicContact CH2-CD2 3.21Å; W216-L309 HydrophobicContact CH2-CG 3.71Å; W216-L309 HydrophobicContact CZ2-CD1 3.12Å; W216-L309 HydrophobicContact CZ2-CD2 4.21Å; W216-L309 HydrophobicContact CZ2-CG 4.25Å; W216-L309 HydrophobicContact CZ3-CD1 3.53Å; W216-L309 HydrophobicContact CZ3-CD2 3.17Å; W216-L309 HydrophobicContact CZ3-CG 3.88Å
310	D	46.1	Very low	45.9	Very low	85 Å²	85	105.9 Å²	105.9	46%	0.455	58%	0.577	S	S	.	*			trans	-102.5	100.2	-177.9	-157.8	-9	0	0	0	109.3	P308 A312 A313	P308-D310 PolarHBondContact O-N 3Å; D310-A312 PolarHBondContact O-N 3.24Å; D310-A312 WeakPolarHBondContact OD1-CB 3.42Å; D310-A312 PolarHBondContact OD1-N 2.68Å; D310-A313 HydrophobicContact CB-CB 4.47Å; D310-A313 PolarHBondContact O-N 3.39Å
311	L	49.6	Very low	44.1	Very low	102 Å²	102	105.6 Å²	105.6	53%	0.534	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	-8.4	174.9	-67.2	178.6	0	0	0	112.4	Q212 Y215 A313	Q212-L311 HydrophobicContact CB-CD1 4.05Å; Q212-L311 HydrophobicContact CG-CD1 3.58Å; Y215-L311 HydrophobicContact CD1-CD1 4.41Å; Y215-L311 HydrophobicContact CE1-CD2 4.25Å; L311-A313 VanDerWaalsContact C-N 3.35Å
312	A	43	Very low	42.6	Very low	89 Å²	89	110 Å²	110	74%	0.736	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-9.5	175.5	0	0	0	0	0	112.9	D310 S314	D310-A312 PolarHBondContact O-N 3.24Å; D310-A312 WeakPolarHBondContact OD1-CB 3.42Å; D310-A312 PolarHBondContact OD1-N 2.68Å; A312-S314 PolarHBondContact O-N 3.08Å; A312-S314 VanDerWaalsContact O-N 3.08Å
313	A	41.1	Very low	40.9	Very low	71 Å²	71	112.3 Å²	112.3	59%	0.587	63%	0.625	S	S	*	*			trans	-80.8	89.9	173.9	0	0	0	0	0	109.7	D310 L311	D310-A313 HydrophobicContact CB-CB 4.47Å; D310-A313 PolarHBondContact O-N 3.39Å; L311-A313 VanDerWaalsContact C-N 3.35Å
314	S	32.4	Very low	39.3	Very low	97 Å²	97	117.5 Å²	117.5	68%	0.678	65%	0.651	S	S	*	*			trans	-45.1	136.8	161.6	-175.5	0	0	0	0	109.2	A312 K316	A312-S314 PolarHBondContact O-N 3.08Å; A312-S314 VanDerWaalsContact O-N 3.08Å; S314-K316 PolarHBondContact O-N 3.08Å
315	P	38.2	Very low	38	Very low	118 Å²	118	125.8 Å²	125.8	77%	0.766	67%	0.671	S	S	*	*			trans	-59.2	109	-178.3	26	-34.5	0	0	0	107.7	L317	P315-L317 PolarHBondContact O-N 2.85Å
316	K	34.2	Very low	36.7	Very low	204 Å²	204	126.3 Å²	126.3	89%	0.887	68%	0.68	S	S	*	*			trans	-62.5	96.8	168.5	-80.5	-173.8	178.8	178.7	0	106.6	S314 W318	S314-K316 PolarHBondContact O-N 3.08Å; K316-W318 PolarHBondContact O-N 3.11Å; K316-W318 VanDerWaalsContact O-N 3.11Å
317	L	32.5	Very low	35.4	Very low	155 Å²	155	128.8 Å²	128.8	81%	0.812	70%	0.704	S	S	*	*			trans	-0.2	97	158	-154	75.8	0	0	0	112	P315 R319	P315-L317 PolarHBondContact O-N 2.85Å; L317-R319 PolarHBondContact O-N 2.76Å; L317-R319 VanDerWaalsContact O-N 3.08Å
318	W	27	Very low	34.3	Very low	246 Å²	246	132.3 Å²	132.3	93%	0.932	72%	0.717	S	S	*	*			trans	-48.5	116.9	151.5	-101.4	66	0	0	0	106.3	K316 P320	K316-W318 PolarHBondContact O-N 3.11Å; K316-W318 VanDerWaalsContact O-N 3.11Å; W318-P320 VanDerWaalsContact O-CD 3.28Å; W318-P320 WeakPolarHBondContact O-CD 3.28Å
319	R	27.4	Very low	33.3	Very low	226 Å²	226	132.2 Å²	132.2	85%	0.853	72%	0.724	S	S	*	*			trans	-94.8	106.7	179	-171.4	-165.9	-78.6	-174.1	-4.5	107.1	L317	L317-R319 PolarHBondContact O-N 2.76Å; L317-R319 VanDerWaalsContact O-N 3.08Å
320	P	30.5	Very low	32.4	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	76%	0.757	S	S	*	*			trans	-77.3	135.6	162.2	-5.4	24.9	0	0	0	108.2	W318	W318-P320 VanDerWaalsContact O-CD 3.28Å; W318-P320 WeakPolarHBondContact O-CD 3.28Å
321	G	26.3	Very low	31.9	Very low	63 Å²	63	137.8 Å²	137.8	65%	0.649	78%	0.775	S	S	*	*			trans	-69.9	158.2	179.5	0	0	0	0	0	114.2
322	L	29.8	Very low	30.7	Very low	157 Å²	157	136.2 Å²	136.2	82%	0.822	78%	0.783	S	S	*	*			trans	54.1	108.1	146.5	-67.6	157.6	0	0	0	118.4
323	N	27.3	Very low	30.1	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	79%	0.792	S	S	*	*				-176.4	154.5	102.2	-97.3	-27.7	0	0	0	114.8
324	H	27.8	Very low	29.6	Very low	179 Å²	179	144.9 Å²	144.9	83%	0.829	80%	0.803	S	S	*	*			trans	-44	134.6	-175.7	-66.3	-74.4	0	0	0	118.8
325	R	27.4	Very low	29.5	Very low	251 Å²	251	147.9 Å²	147.9	95%	0.947	81%	0.811	S	S	*	*				-162	132.1	121.3	-140.2	171	-156.4	174.3	5.8	111.5
326	A	28	Very low	29	Very low	88 Å²	88	146.6 Å²	146.6	73%	0.727	80%	0.804	S	S	*	*			trans	-83.8	174.2	-178.8	0	0	0	0	0	113.3
327	S	26.1	Very low	28.8	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	80%	0.795	S	S	*	*			trans	87.1	132.9	164.7	-75.4	0	0	0	0	115.9
328	I	28.7	Very low	28.6	Very low	159 Å²	159	144.4 Å²	144.4	82%	0.815	79%	0.792	S	S	*	*			cis	-156.2	156.1	18.8	-101.2	145.6	0	0	0	109.9
329	A	27	Very low	28.8	Very low	91 Å²	91	137.9 Å²	137.9	75%	0.752	78%	0.779	S	S	*	*			trans	-64.9	157.9	-178.7	0	0	0	0	0	116.3
330	A	29.4	Very low	28.9	Very low	98 Å²	98	134 Å²	134	81%	0.81	78%	0.776	S	S	*	*				-175.3	155.3	127.7	0	0	0	0	0	112
331	P	36	Very low	29.1	Very low	128 Å²	128	138.9 Å²	138.9	83%	0.831	80%	0.803	S	S	*	*			trans	-123.1	165	-140.1	37.5	-22.6	0	0	0	115.7
332	G	25.5	Very low	29.3	Very low	68 Å²	68	142.7 Å²	142.7	70%	0.701	81%	0.81	S	S	*	*			trans	92.4	112.5	134.2	0	0	0	0	0	118
333	T	29.9	Very low	29.2	Very low	150 Å²	150	141.9 Å²	141.9	92%	0.92	81%	0.81	S	S	*	*				-164.3	117.9	122.4	5.4	0	0	0	0	110.2
334	K	31	Very low	29.4	Very low	192 Å²	192	141.7 Å²	141.7	84%	0.835	81%	0.811	S	S	*	*			trans	-98.1	166	162.1	-97.4	-174	171.6	179.4	0	108
335	L	29.2	Very low	29.5	Very low	160 Å²	160	139.5 Å²	139.5	84%	0.838	81%	0.81	S	S	*	*			trans	82.5	143.2	170.2	-91.4	80.5	0	0	0	115
336	C	28.7	Very low	29.6	Very low	92 Å²	92	132.5 Å²	132.5	62%	0.622	80%	0.802	S	S	*	*			cis	-178.3	159.6	-12.9	-141.5	0	0	0	0	107
337	H	29.1	Very low	29.7	Very low	152 Å²	152	135.5 Å²	135.5	70%	0.704	81%	0.807	S	S	*	*			trans	57.4	118.7	157	-74.3	-67.3	0	0	0	119.5
338	Q	28.2	Very low	29.9	Very low	160 Å²	160	137.3 Å²	137.3	75%	0.748	81%	0.809	S	S	*	*				87.6	139.5	66.3	-161.8	-179.5	-15.7	0	0	113.2
339	V	31.2	Very low	30	Very low	109 Å²	109	135.6 Å²	135.6	66%	0.661	81%	0.809	S	S	*	*			trans	109.1	103.8	157	-169.1	0	0	0	0	116.6
340	D	30.3	Very low	30.3	Very low	146 Å²	146	139.3 Å²	139.3	78%	0.781	81%	0.814	S	S	*	*			trans	41.5	121.9	130.9	-50	-28.2	0	0	0	120.8
341	V	35.2	Very low	30.4	Very low	217 Å²	217	143.1 Å²	143.1	100%	1.315	81%	0.814	S	S	*	*				-152.4	0	93.3	164.5	0	0	0	0	108.7

Retrieved 341 of 341 residues in 58.5 ms (Link to these results)

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