A0A077Z6Y1_TRITR Loading...

RMD5 protein

AlphaFold DB , UniProt , Accession A0A077Z6Y1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 451 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	52.3	Low	76.6	Confident	205 Å²	205	82.9 Å²	82.9	100%	1.01	43%	0.434	S	S	*	.				0	-45.9	0	-68.6	-150.2	-71.6	0	0	111.1	G3 V4 T5	M1-G3 VanDerWaalsContact C-N 3.29Å; M1-G3 PolarHBondContact O-N 2.89Å; M1-G3 VanDerWaalsContact O-N 3.11Å; M1-V4 PolarHBondContact O-N 3.15Å; M1-T5 PolarHBondContact O-N 3.23Å; M1-T5 PolarHBondContact O-OG1 3.07Å
2	E	68.9	Low	77.6	Confident	155 Å²	155	83.4 Å²	83.4	72%	0.724	44%	0.438	S	S	*	.	H	α-helix	trans	-49.6	-37.5	179.9	-159.4	171.4	-160.7	0	0	116.1	T5 I6	E2-T5 VanDerWaalsContact C-OG1 3.3Å; E2-T5 VanDerWaalsContact CA-OG1 3.29Å; E2-T5 WeakPolarHBondContact CA-OG1 3.36Å; E2-T5 PolarHBondContact O-OG1 3.24Å; E2-I6 WeakPolarHBondContact O-CD1 3.2Å; E2-I6 VanDerWaalsContact O-CG1 3.26Å; E2-I6 WeakPolarHBondContact O-CG1 3.2Å; E2-I6 PolarHBondContact O-N 3.19Å
3	G	68.5	Low	78.3	Confident	23 Å²	23	87.3 Å²	87.3	24%	0.237	44%	0.443	C	S	.	.	H	α-helix	trans	-68.4	-34.7	175.3	0	0	0	0	0	114.2	M1 V7 V114	M1-G3 VanDerWaalsContact C-N 3.29Å; M1-G3 PolarHBondContact O-N 2.89Å; M1-G3 VanDerWaalsContact O-N 3.11Å; G3-V7 PolarHBondContact O-N 3.2Å; G3-V114 WeakPolarHBondContact O-CG1 3.3Å; G3-V114 WeakPolarHBondContact O-CG2 3.47Å
4	V	74.3	Confident	79	Confident	81 Å²	81	83 Å²	83	49%	0.491	42%	0.421	S	S	.	.	H	α-helix	trans	-72.7	-42.9	179.9	177.5	0	0	0	0	109.9	M1 I6 V7 E8	M1-V4 PolarHBondContact O-N 3.15Å; V4-I6 VanDerWaalsContact C-N 3.25Å; V4-I6 PolarHBondContact O-N 3.13Å; V4-V7 PolarHBondContact O-N 3.21Å; V4-E8 HydrophobicContact CG1-CG 4.38Å; V4-E8 WeakPolarHBondContact O-CG 3.42Å; V4-E8 PolarHBondContact O-N 3.43Å
5	T	79.7	Confident	79.7	Confident	58 Å²	58	83.9 Å²	83.9	36%	0.356	43%	0.427	S	S	.	.	H	α-helix	trans	-60	-35.6	177.7	48.9	0	0	0	0	112	M1 E2 V7 E8 E9	M1-T5 PolarHBondContact O-N 3.23Å; M1-T5 PolarHBondContact O-OG1 3.07Å; E2-T5 VanDerWaalsContact C-OG1 3.3Å; E2-T5 VanDerWaalsContact CA-OG1 3.29Å; E2-T5 WeakPolarHBondContact CA-OG1 3.36Å; E2-T5 PolarHBondContact O-OG1 3.24Å; T5-V7 VanDerWaalsContact C-N 3.35Å; T5-V7 PolarHBondContact O-N 3.24Å; T5-E8 PolarHBondContact O-N 3.19Å; T5-E9 WeakPolarHBondContact O-CG 3.45Å; T5-E9 PolarHBondContact O-N 3.13Å
6	I	79.5	Confident	80.4	Confident	64 Å²	64	85 Å²	85	33%	0.328	43%	0.434	S	S	.	.	H	α-helix	trans	-64.6	-40	175.2	-67.7	164.2	0	0	0	111.3	E2 V4 H10	E2-I6 WeakPolarHBondContact O-CD1 3.2Å; E2-I6 VanDerWaalsContact O-CG1 3.26Å; E2-I6 WeakPolarHBondContact O-CG1 3.2Å; E2-I6 PolarHBondContact O-N 3.19Å; V4-I6 VanDerWaalsContact C-N 3.25Å; V4-I6 PolarHBondContact O-N 3.13Å; I6-H10 PolarHBondContact O-N 2.9Å; I6-H10 PolarHBondContact O-ND1 3.14Å
7	V	79.8	Confident	80.8	Confident	27 Å²	27	83.9 Å²	83.9	16%	0.164	43%	0.426	C	S	.	.	H	α-helix	trans	-67.9	-44.5	177.8	177.5	0	0	0	0	110.2	G3 V4 T5 E9 H10 V11 I111 V114	G3-V7 PolarHBondContact O-N 3.2Å; V4-V7 PolarHBondContact O-N 3.21Å; T5-V7 VanDerWaalsContact C-N 3.35Å; T5-V7 PolarHBondContact O-N 3.24Å; V7-E9 PolarHBondContact O-N 3.49Å; V7-H10 PolarHBondContact O-N 3.17Å; V7-H10 VanDerWaalsContact O-N 3.09Å; V7-V11 HydrophobicContact CG1-CG2 4.25Å; V7-V11 WeakPolarHBondContact O-CG2 3.25Å; V7-V11 PolarHBondContact O-N 3.21Å; V7-I111 HydrophobicContact CG1-CD1 4.26Å; V7-I111 HydrophobicContact CG1-CG1 3.71Å; V7-I111 HydrophobicContact CG2-CG1 4.16Å; V7-V114 HydrophobicContact CG2-CB 4.21Å; V7-V114 HydrophobicContact CG2-CG1 4.43Å; V7-V114 HydrophobicContact CG2-CG2 3.89Å
8	E	82.8	Confident	81.3	Confident	106 Å²	106	82 Å²	82	50%	0.495	41%	0.413	S	S	.	.	H	α-helix	trans	-55.1	-49.7	176.1	-71.2	172.5	163.1	0	0	111.1	V4 T5 H10 V11 D12	V4-E8 HydrophobicContact CG1-CG 4.38Å; V4-E8 WeakPolarHBondContact O-CG 3.42Å; V4-E8 PolarHBondContact O-N 3.43Å; T5-E8 PolarHBondContact O-N 3.19Å; E8-H10 VanDerWaalsContact C-N 3.26Å; E8-H10 PolarHBondContact O-N 3.11Å; E8-V11 PolarHBondContact O-N 2.99Å; E8-V11 VanDerWaalsContact O-N 3.08Å; E8-D12 PolarHBondContact O-N 2.66Å
9	E	85.2	Confident	81.8	Confident	111 Å²	111	80.7 Å²	80.7	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-59.8	-31.9	176.5	-73.8	177.4	-177.3	0	0	114.1	T5 V7 R13	T5-E9 WeakPolarHBondContact O-CG 3.45Å; T5-E9 PolarHBondContact O-N 3.13Å; V7-E9 PolarHBondContact O-N 3.49Å; E9-R13 WeakPolarHBondContact O-CB 3.3Å; E9-R13 VanDerWaalsContact O-CG 3.29Å; E9-R13 WeakPolarHBondContact O-CG 3.47Å; E9-R13 PolarHBondContact O-N 3.35Å; E9-R13 PolarHBondContact O-NE 3.05Å
10	H	84.3	Confident	82.3	Confident	30 Å²	30	83.5 Å²	83.5	14%	0.139	43%	0.427	C	S	.	.	H	α-helix	trans	-76.5	-37.4	176.1	-78.7	89	0	0	0	111.9	I6 V7 E8 R13 L14 V107	I6-H10 PolarHBondContact O-N 2.9Å; I6-H10 PolarHBondContact O-ND1 3.14Å; V7-H10 PolarHBondContact O-N 3.17Å; V7-H10 VanDerWaalsContact O-N 3.09Å; E8-H10 VanDerWaalsContact C-N 3.26Å; E8-H10 PolarHBondContact O-N 3.11Å; H10-R13 PolarHBondContact CD2-NH2 3.47Å; H10-R13 PolarHBondContact CE1-NH2 3.46Å; H10-R13 PolarHBondContact ND1-NH2 2.89Å; H10-R13 PolarHBondContact NE2-NH2 2.91Å; H10-R13 VanDerWaalsContact NE2-NH2 3.17Å; H10-L14 WeakPolarHBondContact O-CB 3.45Å; H10-L14 PolarHBondContact O-N 3.3Å; H10-V107 HydrophobicContact CB-CG2 4.31Å
11	V	86.9	Confident	82.6	Confident	52 Å²	52	80.9 Å²	80.9	32%	0.315	41%	0.412	S	S	.	.	H	α-helix	trans	-66	-44.7	174.3	172.7	0	0	0	0	110.1	V7 E8 R13 L14 L15 V107	V7-V11 HydrophobicContact CG1-CG2 4.25Å; V7-V11 WeakPolarHBondContact O-CG2 3.25Å; V7-V11 PolarHBondContact O-N 3.21Å; E8-V11 PolarHBondContact O-N 2.99Å; E8-V11 VanDerWaalsContact O-N 3.08Å; V11-R13 VanDerWaalsContact C-N 3.34Å; V11-R13 PolarHBondContact O-N 2.95Å; V11-L14 WeakPolarHBondContact O-CA 3.44Å; V11-L14 VanDerWaalsContact O-CB 3.28Å; V11-L14 WeakPolarHBondContact O-CB 3.48Å; V11-L14 PolarHBondContact O-N 2.87Å; V11-L15 HydrophobicContact CG1-CD1 4.08Å; V11-L15 HydrophobicContact CG1-CG 4.34Å; V11-L15 WeakPolarHBondContact O-CG 3.49Å; V11-L15 PolarHBondContact O-N 3.49Å; V11-V107 HydrophobicContact CG2-CG1 4.02Å
12	D	88.8	Confident	84.4	Confident	89 Å²	89	76 Å²	76	48%	0.476	39%	0.389	S	S	.	.	H	α-helix	trans	-62.4	-41.7	177.8	-71.4	-21	0	0	0	111.7	E8 L14 L15 N16	E8-D12 PolarHBondContact O-N 2.66Å; D12-L14 VanDerWaalsContact C-N 3.31Å; D12-L14 PolarHBondContact O-N 3.07Å; D12-L15 PolarHBondContact O-N 3.2Å; D12-N16 WeakPolarHBondContact O-CB 3.36Å; D12-N16 VanDerWaalsContact O-CG 3.29Å; D12-N16 PolarHBondContact O-N 2.91Å; D12-N16 PolarHBondContact O-ND2 3.2Å
13	R	86.9	Confident	85.4	Confident	134 Å²	134	73.8 Å²	73.8	51%	0.506	38%	0.382	S	S	.	.	H	α-helix	trans	-61.9	-38.1	172.5	-79.4	-177.3	-73.5	179.1	-5.6	112.6	E9 H10 V11 K17	E9-R13 WeakPolarHBondContact O-CB 3.3Å; E9-R13 VanDerWaalsContact O-CG 3.29Å; E9-R13 WeakPolarHBondContact O-CG 3.47Å; E9-R13 PolarHBondContact O-N 3.35Å; E9-R13 PolarHBondContact O-NE 3.05Å; H10-R13 PolarHBondContact CD2-NH2 3.47Å; H10-R13 PolarHBondContact CE1-NH2 3.46Å; H10-R13 PolarHBondContact ND1-NH2 2.89Å; H10-R13 PolarHBondContact NE2-NH2 2.91Å; H10-R13 VanDerWaalsContact NE2-NH2 3.17Å; V11-R13 VanDerWaalsContact C-N 3.34Å; V11-R13 PolarHBondContact O-N 2.95Å; R13-K17 WeakPolarHBondContact O-CB 3.5Å; R13-K17 PolarHBondContact O-N 2.96Å; R13-K17 VanDerWaalsContact O-N 3.07Å
14	L	88.3	Confident	86.4	Confident	27 Å²	27	74.7 Å²	74.7	14%	0.141	39%	0.388	C	S	.	.	H	α-helix	trans	-64.8	-47.6	175.8	-172.1	98.7	0	0	0	110.9	H10 V11 D12 K17 Y18 V104 V107	H10-L14 WeakPolarHBondContact O-CB 3.45Å; H10-L14 PolarHBondContact O-N 3.3Å; V11-L14 WeakPolarHBondContact O-CA 3.44Å; V11-L14 VanDerWaalsContact O-CB 3.28Å; V11-L14 WeakPolarHBondContact O-CB 3.48Å; V11-L14 PolarHBondContact O-N 2.87Å; D12-L14 VanDerWaalsContact C-N 3.31Å; D12-L14 PolarHBondContact O-N 3.07Å; L14-K17 PolarHBondContact O-N 3.42Å; L14-Y18 HydrophobicContact CD1-CE1 4.47Å; L14-Y18 HydrophobicContact CD1-CE2 4.33Å; L14-Y18 HydrophobicContact CD2-CD2 4.13Å; L14-Y18 HydrophobicContact CD2-CE2 3.4Å; L14-Y18 HydrophobicContact CG-CD2 4.12Å; L14-Y18 HydrophobicContact CG-CE1 4.34Å; L14-Y18 HydrophobicContact CG-CE2 3.61Å; L14-Y18 PolarHBondContact O-N 3.02Å; L14-V104 HydrophobicContact CD1-CG2 4.08Å; L14-V104 HydrophobicContact CD2-CG2 4.43Å; L14-V107 HydrophobicContact CB-CG2 4.46Å; L14-V107 HydrophobicContact CD1-CG2 4.12Å
15	L	89.3	Confident	87.2	Confident	96 Å²	96	73 Å²	73	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-61.5	-44.8	178.9	-69.8	175.1	0	0	0	111.6	V11 D12 K17 Y18 A19	V11-L15 HydrophobicContact CG1-CD1 4.08Å; V11-L15 HydrophobicContact CG1-CG 4.34Å; V11-L15 WeakPolarHBondContact O-CG 3.49Å; V11-L15 PolarHBondContact O-N 3.49Å; D12-L15 PolarHBondContact O-N 3.2Å; L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 3.29Å; L15-Y18 PolarHBondContact O-N 3.22Å; L15-A19 PolarHBondContact O-N 3.31Å
16	N	90.3	Very high	87.7	Confident	102 Å²	102	73.2 Å²	73.2	55%	0.545	38%	0.376	S	S	.	.	H	α-helix	trans	-60.9	-41.4	175.8	-74.7	-28.1	0	0	0	112.1	D12 Y18 A19 Q20	D12-N16 WeakPolarHBondContact O-CB 3.36Å; D12-N16 VanDerWaalsContact O-CG 3.29Å; D12-N16 PolarHBondContact O-N 2.91Å; D12-N16 PolarHBondContact O-ND2 3.2Å; N16-Y18 VanDerWaalsContact C-N 3.34Å; N16-A19 PolarHBondContact O-N 2.86Å; N16-Q20 WeakPolarHBondContact O-CG 3.49Å; N16-Q20 PolarHBondContact O-N 3.38Å; N16-Q20 VanDerWaalsContact O-N 3.07Å
17	K	88.2	Confident	88.3	Confident	67 Å²	67	74.1 Å²	74.1	29%	0.291	38%	0.384	S	S	.	.	H	α-helix	trans	-65.3	-38.3	176.4	-170.4	174.9	176.5	-176	0	111.8	R13 L14 L15 Q20 Y21 S103	R13-K17 WeakPolarHBondContact O-CB 3.5Å; R13-K17 PolarHBondContact O-N 2.96Å; R13-K17 VanDerWaalsContact O-N 3.07Å; L14-K17 PolarHBondContact O-N 3.42Å; L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 3.29Å; K17-Q20 PolarHBondContact O-N 3.15Å; K17-Y21 HydrophobicContact CD-CE2 4.18Å; K17-Y21 WeakPolarHBondContact CE-OH 3.4Å; K17-Y21 HydrophobicContact CG-CD2 4.26Å; K17-Y21 HydrophobicContact CG-CE2 3.7Å; K17-Y21 VanDerWaalsContact O-CD2 3.27Å; K17-Y21 WeakPolarHBondContact O-CD2 3.48Å; K17-Y21 PolarHBondContact O-N 3.15Å; K17-S103 PolarHBondContact NZ-OG 3.31Å; K17-S103 VanDerWaalsContact NZ-OG 3.11Å
18	Y	89.8	Confident	88.9	Confident	49 Å²	49	74.6 Å²	74.6	19%	0.192	39%	0.389	C	S	.	.	H	α-helix	trans	-67.2	-41.2	174.6	-68.3	-20	0	0	0	113	L14 L15 N16 Q20 Y21 I22 M100 V104	L14-Y18 HydrophobicContact CD1-CE1 4.47Å; L14-Y18 HydrophobicContact CD1-CE2 4.33Å; L14-Y18 HydrophobicContact CD2-CD2 4.13Å; L14-Y18 HydrophobicContact CD2-CE2 3.4Å; L14-Y18 HydrophobicContact CG-CD2 4.12Å; L14-Y18 HydrophobicContact CG-CE1 4.34Å; L14-Y18 HydrophobicContact CG-CE2 3.61Å; L14-Y18 PolarHBondContact O-N 3.02Å; L15-Y18 PolarHBondContact O-N 3.22Å; N16-Y18 VanDerWaalsContact C-N 3.34Å; Y18-Q20 VanDerWaalsContact C-N 3.3Å; Y18-Q20 PolarHBondContact O-N 2.94Å; Y18-Y21 HydrophobicContact CD1-CD2 4.21Å; Y18-Y21 PolarHBondContact O-N 2.91Å; Y18-I22 VanDerWaalsContact O-CG1 3.31Å; Y18-I22 WeakPolarHBondContact O-CG1 3.41Å; Y18-I22 PolarHBondContact O-N 3.15Å; Y18-M100 HydrophobicContact CD1-CE 3.34Å; Y18-M100 HydrophobicContact CD1-CG 3.91Å; Y18-M100 HydrophobicContact CD1-SD 4.21Å; Y18-M100 HydrophobicContact CE1-CB 3.61Å; Y18-M100 HydrophobicContact CE1-CE 3.17Å; Y18-M100 HydrophobicContact CE1-CG 3.44Å; Y18-M100 VanDerWaalsContact CE1-CG 3.44Å; Y18-M100 HydrophobicContact CE1-SD 4.05Å; Y18-M100 HydrophobicContact CE2-CE 4.44Å; Y18-M100 HydrophobicContact CG-CE 4.08Å; Y18-V104 WeakPolarHBondContact OH-CG2 3.32Å
19	A	91	Very high	89.2	Confident	57 Å²	57	73.9 Å²	73.9	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-58.5	-43.7	174.1	0	0	0	0	0	111.4	L15 N16 Y21 I22 D23	L15-A19 PolarHBondContact O-N 3.31Å; N16-A19 PolarHBondContact O-N 2.86Å; A19-Y21 PolarHBondContact O-N 3.36Å; A19-I22 PolarHBondContact O-N 3.27Å; A19-D23 PolarHBondContact O-N 2.96Å
20	Q	90.3	Very high	89.5	Confident	136 Å²	136	72.4 Å²	72.4	64%	0.636	38%	0.384	S	S	*	.	H	α-helix	trans	-62.5	-40	175.2	-70.6	172	6.6	0	0	112.9	N16 K17 Y18 D23 A24	N16-Q20 WeakPolarHBondContact O-CG 3.49Å; N16-Q20 PolarHBondContact O-N 3.38Å; N16-Q20 VanDerWaalsContact O-N 3.07Å; K17-Q20 PolarHBondContact O-N 3.15Å; Y18-Q20 VanDerWaalsContact C-N 3.3Å; Y18-Q20 PolarHBondContact O-N 2.94Å; Q20-D23 PolarHBondContact O-N 3.34Å; Q20-A24 WeakPolarHBondContact O-CB 3.39Å; Q20-A24 PolarHBondContact O-N 3.18Å
21	Y	89.8	Confident	89.7	Confident	30 Å²	30	71.9 Å²	71.9	12%	0.118	38%	0.384	C	S	.	.	H	α-helix	trans	-65.1	-42.4	175.8	-72.1	-42.3	0	0	0	112.2	K17 Y18 A19 D23 A24 Y25 N96 D99 M100	K17-Y21 HydrophobicContact CD-CE2 4.18Å; K17-Y21 WeakPolarHBondContact CE-OH 3.4Å; K17-Y21 HydrophobicContact CG-CD2 4.26Å; K17-Y21 HydrophobicContact CG-CE2 3.7Å; K17-Y21 VanDerWaalsContact O-CD2 3.27Å; K17-Y21 WeakPolarHBondContact O-CD2 3.48Å; K17-Y21 PolarHBondContact O-N 3.15Å; Y18-Y21 HydrophobicContact CD1-CD2 4.21Å; Y18-Y21 PolarHBondContact O-N 2.91Å; A19-Y21 PolarHBondContact O-N 3.36Å; Y21-D23 VanDerWaalsContact C-N 3.35Å; Y21-A24 PolarHBondContact O-N 3.26Å; Y21-Y25 WeakPolarHBondContact O-CB 3.43Å; Y21-Y25 WeakPolarHBondContact O-CD1 3.3Å; Y21-Y25 WeakPolarHBondContact O-CD2 3.42Å; Y21-Y25 PolarHBondContact O-N 3.33Å; Y21-N96 HydrophobicContact CD1-CB 3.78Å; Y21-N96 VanDerWaalsContact CD1-ND2 3.33Å; Y21-N96 WeakPolarHBondContact CD1-ND2 3.25Å; Y21-N96 HydrophobicContact CE1-CB 3.59Å; Y21-N96 WeakPolarHBondContact CE1-OD1 3.37Å; Y21-N96 HydrophobicContact CG-CB 4.36Å; Y21-D99 WeakPolarHBondContact OH-CB 3.36Å; Y21-M100 HydrophobicContact CD2-CG 3.7Å; Y21-M100 HydrophobicContact CD2-SD 4.01Å; Y21-M100 HydrophobicContact CE2-CG 3.57Å; Y21-M100 HydrophobicContact CE2-SD 4.44Å
22	I	89	Confident	89.9	Confident	103 Å²	103	70.1 Å²	70.1	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-59.7	-48	176.7	-68.1	165.6	0	0	0	110	Y18 A19 A24 Y25 C26	Y18-I22 VanDerWaalsContact O-CG1 3.31Å; Y18-I22 WeakPolarHBondContact O-CG1 3.41Å; Y18-I22 PolarHBondContact O-N 3.15Å; A19-I22 PolarHBondContact O-N 3.27Å; I22-A24 PolarHBondContact O-N 2.89Å; I22-Y25 PolarHBondContact O-N 3.46Å; I22-Y25 VanDerWaalsContact O-N 3.16Å; I22-C26 PolarHBondContact O-N 2.88Å; I22-C26 PolarHBondContact O-SG 3.48Å; I22-C26 VanDerWaalsContact O-SG 3.38Å
23	D	91.2	Very high	89.9	Confident	108 Å²	108	70 Å²	70	58%	0.578	37%	0.372	S	S	*	.	H	α-helix	trans	-60.7	-43.5	178.7	-173.4	61.5	0	0	0	112.6	A19 Q20 Y21 Y25 C26 T27	A19-D23 PolarHBondContact O-N 2.96Å; Q20-D23 PolarHBondContact O-N 3.34Å; Y21-D23 VanDerWaalsContact C-N 3.35Å; D23-Y25 VanDerWaalsContact C-N 3.33Å; D23-Y25 PolarHBondContact O-N 3.34Å; D23-C26 PolarHBondContact O-N 3.17Å; D23-T27 WeakPolarHBondContact O-CB 3.48Å; D23-T27 PolarHBondContact O-N 2.95Å; D23-T27 PolarHBondContact O-OG1 2.89Å
24	A	89.3	Confident	90	Very high	42 Å²	42	71.4 Å²	71.4	35%	0.347	38%	0.377	S	S	.	.	H	α-helix	trans	-63	-37.6	175.4	0	0	0	0	0	112.5	Q20 Y21 I22 S28	Q20-A24 WeakPolarHBondContact O-CB 3.39Å; Q20-A24 PolarHBondContact O-N 3.18Å; Y21-A24 PolarHBondContact O-N 3.26Å; I22-A24 PolarHBondContact O-N 2.89Å; A24-S28 VanDerWaalsContact O-CB 3.31Å; A24-S28 WeakPolarHBondContact O-CB 3.44Å; A24-S28 PolarHBondContact O-N 2.64Å; A24-S28 PolarHBondContact O-OG 2.88Å
25	Y	90.6	Very high	90	Very high	45 Å²	45	71.5 Å²	71.5	18%	0.176	38%	0.377	C	S	.	.	H	α-helix	trans	-69.3	-45.9	176.4	-61.6	-24.6	0	0	0	112	Y21 I22 D23 T27 S28 L29 I93 N96	Y21-Y25 WeakPolarHBondContact O-CB 3.43Å; Y21-Y25 WeakPolarHBondContact O-CD1 3.3Å; Y21-Y25 WeakPolarHBondContact O-CD2 3.42Å; Y21-Y25 PolarHBondContact O-N 3.33Å; I22-Y25 PolarHBondContact O-N 3.46Å; I22-Y25 VanDerWaalsContact O-N 3.16Å; D23-Y25 VanDerWaalsContact C-N 3.33Å; D23-Y25 PolarHBondContact O-N 3.34Å; Y25-T27 VanDerWaalsContact C-N 3.34Å; Y25-T27 PolarHBondContact O-N 3.05Å; Y25-S28 PolarHBondContact O-N 3.44Å; Y25-L29 WeakPolarHBondContact O-CB 3.41Å; Y25-L29 WeakPolarHBondContact O-CG 3.16Å; Y25-L29 PolarHBondContact O-N 3.25Å; Y25-I93 HydrophobicContact CD1-CD1 4.37Å; Y25-I93 HydrophobicContact CD1-CG1 3.52Å; Y25-I93 HydrophobicContact CE1-CB 3.98Å; Y25-I93 HydrophobicContact CE1-CG1 3.41Å; Y25-I93 VanDerWaalsContact CE1-CG1 3.41Å; Y25-I93 HydrophobicContact CE1-CG2 4.24Å; Y25-I93 HydrophobicContact CG-CG1 4.32Å; Y25-I93 PolarHBondContact OH-O 2.74Å; Y25-N96 HydrophobicContact CE1-CB 4.26Å; Y25-N96 WeakPolarHBondContact CE1-ND2 3.44Å; Y25-N96 WeakPolarHBondContact OH-CB 3.49Å
26	C	91.5	Very high	89.9	Confident	63 Å²	63	70.3 Å²	70.3	43%	0.426	37%	0.37	S	S	.	.	H	α-helix	trans	-56.8	-48.9	175.3	-71.6	0	0	0	0	110.8	I22 D23 S28 L29 D30	I22-C26 PolarHBondContact O-N 2.88Å; I22-C26 PolarHBondContact O-SG 3.48Å; I22-C26 VanDerWaalsContact O-SG 3.38Å; D23-C26 PolarHBondContact O-N 3.17Å; C26-S28 VanDerWaalsContact C-N 3.32Å; C26-S28 PolarHBondContact O-N 2.78Å; C26-L29 PolarHBondContact O-N 3.28Å; C26-D30 WeakPolarHBondContact O-CB 3.47Å; C26-D30 PolarHBondContact O-N 3.34Å
27	T	91.7	Very high	89.8	Confident	82 Å²	82	69.3 Å²	69.3	50%	0.503	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-39.6	178	-57.9	0	0	0	0	112.5	D23 Y25 S31	D23-T27 WeakPolarHBondContact O-CB 3.48Å; D23-T27 PolarHBondContact O-N 2.95Å; D23-T27 PolarHBondContact O-OG1 2.89Å; Y25-T27 VanDerWaalsContact C-N 3.34Å; Y25-T27 PolarHBondContact O-N 3.05Å; T27-S31 WeakPolarHBondContact O-CB 3.38Å; T27-S31 PolarHBondContact O-N 3.39Å
28	S	91.3	Very high	89.7	Confident	38 Å²	38	69 Å²	69	27%	0.266	37%	0.369	S	S	.	.	H	α-helix	trans	-67.8	-43.5	178.5	-62.7	0	0	0	0	111.9	A24 Y25 C26 S31 L32	A24-S28 VanDerWaalsContact O-CB 3.31Å; A24-S28 WeakPolarHBondContact O-CB 3.44Å; A24-S28 PolarHBondContact O-N 2.64Å; A24-S28 PolarHBondContact O-OG 2.88Å; Y25-S28 PolarHBondContact O-N 3.44Å; C26-S28 VanDerWaalsContact C-N 3.32Å; C26-S28 PolarHBondContact O-N 2.78Å; S28-S31 PolarHBondContact O-N 3.48Å; S28-L32 WeakPolarHBondContact O-CG 3.31Å; S28-L32 PolarHBondContact O-N 3.1Å
29	L	89.9	Confident	89.4	Confident	90 Å²	90	67.4 Å²	67.4	47%	0.471	36%	0.364	S	S	.	.	H	α-helix	trans	-65.5	-43.7	176.6	-73.1	171.6	0	0	0	111.5	Y25 C26 S31 L32 N33	Y25-L29 WeakPolarHBondContact O-CB 3.41Å; Y25-L29 WeakPolarHBondContact O-CG 3.16Å; Y25-L29 PolarHBondContact O-N 3.25Å; C26-L29 PolarHBondContact O-N 3.28Å; L29-S31 VanDerWaalsContact C-N 3.26Å; L29-S31 PolarHBondContact O-N 3.26Å; L29-L32 WeakPolarHBondContact O-CB 3.32Å; L29-L32 PolarHBondContact O-N 3.17Å; L29-L32 VanDerWaalsContact O-N 3.12Å; L29-N33 PolarHBondContact O-N 3Å
30	D	91.4	Very high	89.1	Confident	80 Å²	80	70 Å²	70	43%	0.428	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-40.9	175.4	-77.8	-16.5	0	0	0	111.5	C26 L32 N33 R34	C26-D30 WeakPolarHBondContact O-CB 3.47Å; C26-D30 PolarHBondContact O-N 3.34Å; D30-L32 VanDerWaalsContact C-N 3.35Å; D30-N33 PolarHBondContact O-N 3.19Å; D30-R34 WeakPolarHBondContact O-CG 3.27Å; D30-R34 PolarHBondContact O-N 3.03Å
31	S	89.2	Confident	88.7	Confident	20 Å²	20	71.7 Å²	71.7	14%	0.14	37%	0.366	C	S	.	.	H	α-helix	trans	-70.7	-30.9	177.9	-165.7	0	0	0	0	113.4	T27 S28 L29 Q35 R85	T27-S31 WeakPolarHBondContact O-CB 3.38Å; T27-S31 PolarHBondContact O-N 3.39Å; S28-S31 PolarHBondContact O-N 3.48Å; L29-S31 VanDerWaalsContact C-N 3.26Å; L29-S31 PolarHBondContact O-N 3.26Å; S31-Q35 PolarHBondContact O-N 3.18Å; S31-R85 VanDerWaalsContact CB-NH2 3.34Å; S31-R85 PolarHBondContact OG-NH1 2.91Å; S31-R85 PolarHBondContact OG-NH2 2.99Å
32	L	89.8	Confident	88.3	Confident	14 Å²	14	74 Å²	74	7%	0.073	38%	0.378	C	S	.	.	H	α-helix	trans	-69.6	-41.9	172.1	-75.3	174	0	0	0	111	S28 L29 D30 R34 Q35 L36 F82 R85 V89	S28-L32 WeakPolarHBondContact O-CG 3.31Å; S28-L32 PolarHBondContact O-N 3.1Å; L29-L32 WeakPolarHBondContact O-CB 3.32Å; L29-L32 PolarHBondContact O-N 3.17Å; L29-L32 VanDerWaalsContact O-N 3.12Å; D30-L32 VanDerWaalsContact C-N 3.35Å; L32-R34 VanDerWaalsContact C-N 3.35Å; L32-R34 PolarHBondContact O-N 3.38Å; L32-Q35 WeakPolarHBondContact O-CB 3.49Å; L32-Q35 PolarHBondContact O-N 2.74Å; L32-Q35 VanDerWaalsContact O-N 3.13Å; L32-L36 PolarHBondContact O-N 2.68Å; L32-F82 HydrophobicContact CB-CE2 4.06Å; L32-F82 HydrophobicContact CD2-CD2 4.03Å; L32-F82 HydrophobicContact CD2-CE2 3.87Å; L32-R85 HydrophobicContact CD2-CB 4Å; L32-R85 HydrophobicContact CD2-CG 3.89Å; L32-V89 HydrophobicContact CD1-CB 4.12Å; L32-V89 HydrophobicContact CD1-CG1 4.1Å; L32-V89 HydrophobicContact CD1-CG2 4.07Å; L32-V89 HydrophobicContact CG-CG2 4.44Å
33	N	90.2	Very high	87.7	Confident	87 Å²	87	72.4 Å²	72.4	47%	0.465	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-43.5	174.9	-77.8	-18.1	0	0	0	111.7	L29 D30 Q35 L36 D37	L29-N33 PolarHBondContact O-N 3Å; D30-N33 PolarHBondContact O-N 3.19Å; N33-Q35 VanDerWaalsContact C-N 3.28Å; N33-Q35 PolarHBondContact O-N 3.07Å; N33-L36 WeakPolarHBondContact O-CB 3.45Å; N33-L36 PolarHBondContact O-N 2.9Å; N33-D37 PolarHBondContact O-N 3.14Å
34	R	88.9	Confident	87	Confident	163 Å²	163	70.9 Å²	70.9	62%	0.615	36%	0.362	S	S	*	.	H	α-helix	trans	-61.1	-35.5	174.9	-70.2	177.4	-154.6	156.8	7.7	113	D30 L32 T38	D30-R34 WeakPolarHBondContact O-CG 3.27Å; D30-R34 PolarHBondContact O-N 3.03Å; L32-R34 VanDerWaalsContact C-N 3.35Å; L32-R34 PolarHBondContact O-N 3.38Å; R34-T38 PolarHBondContact O-N 3.26Å; R34-T38 PolarHBondContact O-OG1 3.49Å
35	Q	86.8	Confident	86.1	Confident	29 Å²	29	71.1 Å²	71.1	14%	0.136	36%	0.363	C	S	.	.	H	α-helix	trans	-69.9	-41.4	175.3	-76.2	-175.8	-25	0	0	111.6	S31 L32 N33 T38 L39 F82	S31-Q35 PolarHBondContact O-N 3.18Å; L32-Q35 WeakPolarHBondContact O-CB 3.49Å; L32-Q35 PolarHBondContact O-N 2.74Å; L32-Q35 VanDerWaalsContact O-N 3.13Å; N33-Q35 VanDerWaalsContact C-N 3.28Å; N33-Q35 PolarHBondContact O-N 3.07Å; Q35-T38 WeakPolarHBondContact O-CB 3.4Å; Q35-T38 PolarHBondContact O-N 3.32Å; Q35-L39 PolarHBondContact O-N 3.3Å; Q35-F82 HydrophobicContact CB-CD2 4.08Å
36	L	87.9	Confident	84.9	Confident	71 Å²	71	70.3 Å²	70.3	37%	0.372	37%	0.369	S	S	.	.	H	α-helix	trans	-59.5	-44	172.1	-92.5	159.9	0	0	0	112	L32 N33 T38 L39 H40 F82	L32-L36 PolarHBondContact O-N 2.68Å; N33-L36 WeakPolarHBondContact O-CB 3.45Å; N33-L36 PolarHBondContact O-N 2.9Å; L36-T38 VanDerWaalsContact C-N 3.29Å; L36-T38 PolarHBondContact O-N 3.13Å; L36-L39 WeakPolarHBondContact O-CB 3.34Å; L36-L39 PolarHBondContact O-N 3.4Å; L36-H40 WeakPolarHBondContact O-CB 3.28Å; L36-H40 PolarHBondContact O-N 3Å; L36-F82 HydrophobicContact CD1-CE1 4.43Å; L36-F82 HydrophobicContact CD1-CE2 3.53Å; L36-F82 HydrophobicContact CD1-CZ 3.46Å; L36-F82 VanDerWaalsContact CD1-CZ 3.46Å; L36-F82 HydrophobicContact CD2-CE1 4.38Å; L36-F82 HydrophobicContact CD2-CE2 4.4Å; L36-F82 HydrophobicContact CD2-CZ 4.15Å; L36-F82 HydrophobicContact CG-CD2 4.06Å; L36-F82 HydrophobicContact CG-CE1 4.3Å; L36-F82 HydrophobicContact CG-CE2 3.48Å; L36-F82 VanDerWaalsContact CG-CE2 3.48Å; L36-F82 HydrophobicContact CG-CZ 3.63Å
37	D	88.2	Confident	83.6	Confident	81 Å²	81	71 Å²	71	43%	0.433	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-39	176.2	-73.5	-29.3	0	0	0	111.7	N33 H40 R41	N33-D37 PolarHBondContact O-N 3.14Å; D37-H40 PolarHBondContact O-N 3.02Å; D37-R41 WeakPolarHBondContact O-CG 3.32Å; D37-R41 PolarHBondContact O-N 3.15Å
38	T	86.3	Confident	82	Confident	62 Å²	62	72.2 Å²	72.2	38%	0.38	37%	0.373	S	S	.	.	H	α-helix	trans	-65.4	-45.8	176.5	-54.4	0	0	0	0	110.5	R34 Q35 L36 H40 R41 E42 I78	R34-T38 PolarHBondContact O-N 3.26Å; R34-T38 PolarHBondContact O-OG1 3.49Å; Q35-T38 WeakPolarHBondContact O-CB 3.4Å; Q35-T38 PolarHBondContact O-N 3.32Å; L36-T38 VanDerWaalsContact C-N 3.29Å; L36-T38 PolarHBondContact O-N 3.13Å; T38-H40 VanDerWaalsContact C-N 3.32Å; T38-H40 PolarHBondContact O-N 3.13Å; T38-R41 PolarHBondContact O-N 2.96Å; T38-E42 WeakPolarHBondContact O-CG 3.2Å; T38-E42 PolarHBondContact O-N 2.91Å; T38-I78 HydrophobicContact CG2-CD1 4.47Å
39	L	84.3	Confident	80.3	Confident	15 Å²	15	77.4 Å²	77.4	8%	0.079	39%	0.393	C	S	.	.	H	α-helix	trans	-58.5	-45.2	174.2	-177.4	68.3	0	0	0	111.3	Q35 L36 R41 E42 L43 A75 I78 F79	Q35-L39 PolarHBondContact O-N 3.3Å; L36-L39 WeakPolarHBondContact O-CB 3.34Å; L36-L39 PolarHBondContact O-N 3.4Å; L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 3.14Å; L39-E42 PolarHBondContact O-N 3.45Å; L39-L43 HydrophobicContact CG-CD1 4.12Å; L39-L43 VanDerWaalsContact O-CG 3.29Å; L39-L43 WeakPolarHBondContact O-CG 3.5Å; L39-L43 PolarHBondContact O-N 2.92Å; L39-A75 HydrophobicContact CD1-CB 4.24Å; L39-A75 VanDerWaalsContact CD1-O 3.28Å; L39-A75 WeakPolarHBondContact CD1-O 3.37Å; L39-I78 HydrophobicContact CB-CG2 3.85Å; L39-I78 HydrophobicContact CD1-CB 4.06Å; L39-I78 HydrophobicContact CD1-CG2 3.92Å; L39-I78 HydrophobicContact CG-CG2 4.46Å; L39-F79 HydrophobicContact CD1-CB 4.14Å; L39-F79 HydrophobicContact CD2-CB 4.26Å; L39-F79 HydrophobicContact CD2-CD2 3.71Å; L39-F79 HydrophobicContact CD2-CG 4.45Å
40	H	83.3	Confident	78.6	Confident	111 Å²	111	77.1 Å²	77.1	51%	0.514	39%	0.388	S	S	.	.	H	α-helix	trans	-61.6	-42.7	179.3	-173.6	-163.6	0	0	0	111.7	L36 D37 T38 L43 I44	L36-H40 WeakPolarHBondContact O-CB 3.28Å; L36-H40 PolarHBondContact O-N 3Å; D37-H40 PolarHBondContact O-N 3.02Å; T38-H40 VanDerWaalsContact C-N 3.32Å; T38-H40 PolarHBondContact O-N 3.13Å; H40-L43 PolarHBondContact O-N 3.33Å; H40-I44 WeakPolarHBondContact NE2-CD1 3.45Å; H40-I44 WeakPolarHBondContact O-CG1 3.3Å; H40-I44 PolarHBondContact O-N 2.95Å
41	R	82.7	Confident	76.8	Confident	171 Å²	171	80.4 Å²	80.4	65%	0.645	40%	0.399	S	S	*	.	H	α-helix	trans	-61.3	-43.5	174.6	-72.2	177.4	-149.4	172.9	5.9	112.4	D37 T38 L39 I44 A45	D37-R41 WeakPolarHBondContact O-CG 3.32Å; D37-R41 PolarHBondContact O-N 3.15Å; T38-R41 PolarHBondContact O-N 2.96Å; L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 3.14Å; R41-I44 PolarHBondContact O-N 3.19Å; R41-A45 WeakPolarHBondContact O-CB 3.18Å; R41-A45 PolarHBondContact O-N 2.92Å
42	E	80.3	Confident	75.1	Confident	78 Å²	78	82 Å²	82	36%	0.364	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-39.8	178	-72.5	-63	146.5	0	0	112.1	T38 L39 A45 G46 I78	T38-E42 WeakPolarHBondContact O-CG 3.2Å; T38-E42 PolarHBondContact O-N 2.91Å; L39-E42 PolarHBondContact O-N 3.45Å; E42-A45 PolarHBondContact O-N 2.82Å; E42-G46 PolarHBondContact O-N 3.24Å; E42-I78 HydrophobicContact CG-CD1 3.76Å
43	L	77.2	Confident	73.1	Confident	70 Å²	70	84.2 Å²	84.2	37%	0.366	43%	0.43	S	S	.	.	H	α-helix	trans	-64.7	-42.5	175	-68.8	171.8	0	0	0	112.1	L39 H40 T47 L71 A75	L39-L43 HydrophobicContact CG-CD1 4.12Å; L39-L43 VanDerWaalsContact O-CG 3.29Å; L39-L43 WeakPolarHBondContact O-CG 3.5Å; L39-L43 PolarHBondContact O-N 2.92Å; H40-L43 PolarHBondContact O-N 3.33Å; L43-T47 PolarHBondContact O-N 3.36Å; L43-T47 VanDerWaalsContact O-N 3.12Å; L43-T47 PolarHBondContact O-OG1 2.92Å; L43-L71 HydrophobicContact CD2-CD2 3.42Å; L43-L71 VanDerWaalsContact CD2-CD2 3.42Å; L43-A75 HydrophobicContact CD2-CB 4.15Å
44	I	76.7	Confident	71.2	Confident	77 Å²	77	85.4 Å²	85.4	40%	0.395	44%	0.436	S	S	.	.	H	α-helix	trans	-64.5	-46.7	175.2	-68.8	166.1	0	0	0	110.5	H40 R41 G46 T47 I48	H40-I44 WeakPolarHBondContact NE2-CD1 3.45Å; H40-I44 WeakPolarHBondContact O-CG1 3.3Å; H40-I44 PolarHBondContact O-N 2.95Å; R41-I44 PolarHBondContact O-N 3.19Å; I44-G46 VanDerWaalsContact C-N 3.33Å; I44-G46 PolarHBondContact O-N 3.28Å; I44-T47 WeakPolarHBondContact O-CA 3.18Å; I44-T47 WeakPolarHBondContact O-CB 3.46Å; I44-T47 PolarHBondContact O-N 3.03Å; I44-I48 HydrophobicContact CG2-CD1 3.64Å; I44-I48 HydrophobicContact CG2-CG1 4.16Å; I44-I48 WeakPolarHBondContact O-CG1 3.49Å; I44-I48 PolarHBondContact O-N 2.96Å
45	A	71	Confident	69.2	Low	46 Å²	46	85.5 Å²	85.5	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-59	-44.1	180	0	0	0	0	0	111.8	R41 E42 T47 I48 Q49	R41-A45 WeakPolarHBondContact O-CB 3.18Å; R41-A45 PolarHBondContact O-N 2.92Å; E42-A45 PolarHBondContact O-N 2.82Å; A45-T47 VanDerWaalsContact C-N 3.28Å; A45-T47 PolarHBondContact O-N 2.83Å; A45-I48 PolarHBondContact O-N 3.37Å; A45-Q49 PolarHBondContact O-N 3.42Å
46	G	65.2	Low	67.1	Low	28 Å²	28	93.7 Å²	93.7	29%	0.289	48%	0.475	S	S	.	.	H	α-helix	trans	-61.3	-35.8	173.5	0	0	0	0	0	113.1	E42 I44 K50	E42-G46 PolarHBondContact O-N 3.24Å; I44-G46 VanDerWaalsContact C-N 3.33Å; I44-G46 PolarHBondContact O-N 3.28Å; G46-K50 PolarHBondContact O-N 3.29Å
47	T	64	Low	64.7	Low	79 Å²	79	101 Å²	101	49%	0.485	50%	0.498	S	S	.	.	H	α-helix	trans	-72.2	-39.6	177.4	-52.3	0	0	0	0	112.2	L43 I44 A45 K50 K51	L43-T47 PolarHBondContact O-N 3.36Å; L43-T47 VanDerWaalsContact O-N 3.12Å; L43-T47 PolarHBondContact O-OG1 2.92Å; I44-T47 WeakPolarHBondContact O-CA 3.18Å; I44-T47 WeakPolarHBondContact O-CB 3.46Å; I44-T47 PolarHBondContact O-N 3.03Å; A45-T47 VanDerWaalsContact C-N 3.28Å; A45-T47 PolarHBondContact O-N 2.83Å; T47-K50 PolarHBondContact O-N 3.46Å; T47-K51 PolarHBondContact O-N 2.96Å
48	I	58.4	Low	62.7	Low	106 Å²	106	102.7 Å²	102.7	54%	0.544	51%	0.513	S	S	.	.	H	α-helix	trans	-66.6	-42.7	177.5	-66.8	171.3	0	0	0	110.6	I44 A45 K50 K51 S52	I44-I48 HydrophobicContact CG2-CD1 3.64Å; I44-I48 HydrophobicContact CG2-CG1 4.16Å; I44-I48 WeakPolarHBondContact O-CG1 3.49Å; I44-I48 PolarHBondContact O-N 2.96Å; A45-I48 PolarHBondContact O-N 3.37Å; I48-K50 VanDerWaalsContact C-N 3.29Å; I48-K50 PolarHBondContact O-N 3.44Å; I48-K51 PolarHBondContact O-N 2.94Å; I48-S52 WeakPolarHBondContact O-CB 3.45Å; I48-S52 PolarHBondContact O-N 3.48Å
49	Q	54.4	Low	60.6	Low	147 Å²	147	106.3 Å²	106.3	69%	0.687	53%	0.528	S	S	*	.	H	α-helix	trans	-56.7	-44.3	172.9	-82.5	-175.4	-15.1	0	0	111.1	A45 S52 A53	A45-Q49 PolarHBondContact O-N 3.42Å; Q49-S52 PolarHBondContact O-N 2.86Å; Q49-S52 PolarHBondContact O-OG 3.08Å; Q49-A53 PolarHBondContact O-N 3.03Å; Q49-A53 VanDerWaalsContact O-N 3.1Å
50	K	54.6	Low	58.5	Low	84 Å²	84	112.6 Å²	112.6	37%	0.365	56%	0.561	S	S	.	*	H	α-helix	trans	-64.5	-44.7	175.7	-74.2	-176.2	-178.5	-178.4	0	113	G46 T47 I48 S52 A53 I54	G46-K50 PolarHBondContact O-N 3.29Å; T47-K50 PolarHBondContact O-N 3.46Å; I48-K50 VanDerWaalsContact C-N 3.29Å; I48-K50 PolarHBondContact O-N 3.44Å; K50-S52 VanDerWaalsContact C-N 3.3Å; K50-S52 PolarHBondContact O-N 3.47Å; K50-A53 PolarHBondContact O-N 3.01Å; K50-A53 VanDerWaalsContact O-N 3.12Å; K50-I54 VanDerWaalsContact O-CG1 3.28Å; K50-I54 WeakPolarHBondContact O-CG1 3.44Å; K50-I54 PolarHBondContact O-N 3Å
51	K	53.8	Low	56.2	Low	149 Å²	149	112.4 Å²	112.4	65%	0.648	57%	0.573	S	S	*	*	H	α-helix	trans	-60.3	-38.8	175.4	-84.8	-172.3	176.2	-179.5	0	112.5	T47 I48 A53 I54 M55	T47-K51 PolarHBondContact O-N 2.96Å; I48-K51 PolarHBondContact O-N 2.94Å; K51-A53 VanDerWaalsContact C-N 3.29Å; K51-A53 PolarHBondContact O-N 2.96Å; K51-I54 PolarHBondContact O-N 3.28Å; K51-M55 WeakPolarHBondContact O-CB 3.29Å; K51-M55 PolarHBondContact O-N 3.45Å
52	S	52.6	Low	54.1	Low	53 Å²	53	111.1 Å²	111.1	37%	0.371	58%	0.578	S	S	.	*	H	α-helix	trans	-69.3	-26.1	176.7	78.7	0	0	0	0	113.6	I48 Q49 K50 R56	I48-S52 WeakPolarHBondContact O-CB 3.45Å; I48-S52 PolarHBondContact O-N 3.48Å; Q49-S52 PolarHBondContact O-N 2.86Å; Q49-S52 PolarHBondContact O-OG 3.08Å; K50-S52 VanDerWaalsContact C-N 3.3Å; K50-S52 PolarHBondContact O-N 3.47Å; S52-R56 PolarHBondContact O-NE 3.42Å
53	A	48.8	Very low	52.2	Low	61 Å²	61	114 Å²	114	50%	0.504	60%	0.595	S	S	.	*	H	α-helix	trans	-78.4	-42.6	172.8	0	0	0	0	0	111.3	Q49 K50 K51 M55 R56	Q49-A53 PolarHBondContact O-N 3.03Å; Q49-A53 VanDerWaalsContact O-N 3.1Å; K50-A53 PolarHBondContact O-N 3.01Å; K50-A53 VanDerWaalsContact O-N 3.12Å; K51-A53 VanDerWaalsContact C-N 3.29Å; K51-A53 PolarHBondContact O-N 2.96Å; A53-M55 PolarHBondContact O-N 3.15Å; A53-R56 PolarHBondContact O-N 3.2Å
54	I	50.6	Low	50.5	Low	112 Å²	112	119.2 Å²	119.2	57%	0.574	62%	0.623	S	S	*	*	H	α-helix	trans	-64.4	-40.2	177.6	-65.8	162.4	0	0	0	111	K50 K51 R56 W57	K50-I54 VanDerWaalsContact O-CG1 3.28Å; K50-I54 WeakPolarHBondContact O-CG1 3.44Å; K50-I54 PolarHBondContact O-N 3Å; K51-I54 PolarHBondContact O-N 3.28Å; I54-R56 PolarHBondContact O-N 3.15Å; I54-R56 VanDerWaalsContact O-N 3.16Å; I54-W57 PolarHBondContact O-N 3.17Å
55	M	45.7	Very low	48.8	Very low	166 Å²	166	118.6 Å²	118.6	82%	0.818	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-19.3	178.3	-164.4	175.1	-113.3	0	0	113	K51 A53	K51-M55 WeakPolarHBondContact O-CB 3.29Å; K51-M55 PolarHBondContact O-N 3.45Å; A53-M55 PolarHBondContact O-N 3.15Å
56	R	42.4	Very low	47.4	Very low	201 Å²	201	124.8 Å²	124.8	76%	0.758	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-7.3	174.6	-82.5	-174	-106.2	-149.1	-1.9	114.1	S52 A53 I54	S52-R56 PolarHBondContact O-NE 3.42Å; A53-R56 PolarHBondContact O-N 3.2Å; I54-R56 PolarHBondContact O-N 3.15Å; I54-R56 VanDerWaalsContact O-N 3.16Å
57	W	38.2	Very low	46.5	Very low	225 Å²	225	128.1 Å²	128.1	85%	0.852	67%	0.667	S	S	*	*			trans	-138.8	79.8	-178	-126.9	-9.4	0	0	0	113.2	I54 I59	I54-W57 PolarHBondContact O-N 3.17Å; W57-I59 PolarHBondContact O-N 3.17Å
58	P	45.4	Very low	45.6	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	68%	0.682	S	S	*	*			trans	-99	57.3	178.7	37.4	-30.5	0	0	0	111.3
59	I	42.5	Very low	45.5	Very low	138 Å²	138	132.1 Å²	132.1	71%	0.708	69%	0.689	S	S	*	*			trans	-149.2	81.8	170.7	-46.4	173.9	0	0	0	109.1	W57	W57-I59 PolarHBondContact O-N 3.17Å
60	L	39.7	Very low	45.9	Very low	148 Å²	148	130.2 Å²	130.2	78%	0.775	69%	0.687	S	S	*	*			trans	-177.7	102.2	138.5	-120	79.9	0	0	0	108.4
61	S	36.8	Very low	46.5	Very low	107 Å²	107	131.1 Å²	131.1	75%	0.748	70%	0.696	S	S	*	*			trans	-63.9	138.7	153.7	48.8	0	0	0	0	108.8
62	N	36.8	Very low	47.7	Very low	144 Å²	144	126.4 Å²	126.4	77%	0.77	68%	0.681	S	S	*	*			trans	89.2	85.5	-170.9	-57.2	-15.3	0	0	0	112.7
63	I	41.9	Very low	49	Very low	138 Å²	138	129.2 Å²	129.2	71%	0.708	70%	0.696	S	S	*	*			trans	-173.3	101.8	136.6	-88.6	147.1	0	0	0	103.8	A65	I63-A65 HydrophobicContact CG2-CB 3.15Å; I63-A65 PolarHBondContact O-N 3.43Å
64	D	41	Very low	50.7	Low	179 Å²	179	128.5 Å²	128.5	96%	0.957	69%	0.69	S	S	*	*			trans	-69.7	30.4	163.1	-68.6	-48.4	0	0	0	111	E66	D64-E66 VanDerWaalsContact C-N 3.28Å; D64-E66 PolarHBondContact O-N 3.09Å
65	A	41.8	Very low	52.2	Low	64 Å²	64	123.2 Å²	123.2	53%	0.529	66%	0.663	S	S	.	*			trans	-77.3	94.6	163.4	0	0	0	0	0	105.3	I63 P67	I63-A65 HydrophobicContact CG2-CB 3.15Å; I63-A65 PolarHBondContact O-N 3.43Å; A65-P67 VanDerWaalsContact O-CD 3.29Å; A65-P67 WeakPolarHBondContact O-CD 3.48Å
66	E	40.5	Very low	54.1	Low	177 Å²	177	118 Å²	118	83%	0.827	64%	0.641	S	S	*	*			trans	-38.7	113.3	152.7	-69.9	-175.8	157.5	0	0	106.5	D64 E68	D64-E66 VanDerWaalsContact C-N 3.28Å; D64-E66 PolarHBondContact O-N 3.09Å; E66-E68 PolarHBondContact O-N 3.34Å
67	P	46.5	Very low	56.2	Low	97 Å²	97	113.4 Å²	113.4	63%	0.63	63%	0.63	S	S	*	*			trans	-62.7	109.3	-178	22.5	-29.9	0	0	0	105.1	A65 S69	A65-P67 VanDerWaalsContact O-CD 3.29Å; A65-P67 WeakPolarHBondContact O-CD 3.48Å; P67-S69 VanDerWaalsContact C-N 3.32Å; P67-S69 WeakPolarHBondContact O-CA 3.44Å; P67-S69 PolarHBondContact O-N 3.12Å
68	E	46.1	Very low	58.6	Low	171 Å²	171	104.2 Å²	104.2	80%	0.799	60%	0.598	S	S	*	*			trans	-41	104.9	177.9	-79.6	-174.3	163.8	0	0	106.5	E66 T70	E66-E68 PolarHBondContact O-N 3.34Å; E68-T70 PolarHBondContact O-N 3.45Å
69	S	55.8	Low	60.6	Low	98 Å²	98	103.4 Å²	103.4	69%	0.685	58%	0.583	S	S	*	*			trans	-82.3	71.9	-166.8	54.9	0	0	0	0	106.3	P67 L71	P67-S69 VanDerWaalsContact C-N 3.32Å; P67-S69 WeakPolarHBondContact O-CA 3.44Å; P67-S69 PolarHBondContact O-N 3.12Å; S69-L71 PolarHBondContact O-N 3.34Å
70	T	61.7	Low	62.8	Low	107 Å²	107	102.3 Å²	102.3	66%	0.656	57%	0.574	S	S	*	*			trans	-58.6	115.4	176.3	51.1	0	0	0	0	107.2	E68	E68-T70 PolarHBondContact O-N 3.45Å
71	L	67.9	Low	65.2	Low	104 Å²	104	100.9 Å²	100.9	55%	0.545	56%	0.564	S	S	.	*			trans	-57.4	142.7	172	-85.5	132.2	0	0	0	108.3	L43 S69 V73 A75 V76	L43-L71 HydrophobicContact CD2-CD2 3.42Å; L43-L71 VanDerWaalsContact CD2-CD2 3.42Å; S69-L71 PolarHBondContact O-N 3.34Å; L71-V73 PolarHBondContact O-N 2.84Å; L71-A75 HydrophobicContact CD2-CB 3.93Å; L71-V76 HydrophobicContact CB-CG2 3.74Å
72	S	78.2	Confident	67.8	Low	49 Å²	49	97.1 Å²	97.1	34%	0.343	53%	0.534	S	S	.	.			trans	-61	142.9	172.2	73.1	0	0	0	0	109.1	A74 A75 V76	S72-A74 PolarHBondContact O-N 3.15Å; S72-A74 VanDerWaalsContact O-N 3.12Å; S72-A75 PolarHBondContact O-N 3.27Å; S72-A75 WeakPolarHBondContact OG-CB 3.24Å; S72-A75 PolarHBondContact OG-N 3.04Å; S72-V76 PolarHBondContact O-N 3.42Å; S72-V76 VanDerWaalsContact O-N 3.09Å
73	V	81.7	Confident	70.4	Confident	113 Å²	113	94 Å²	94	69%	0.685	52%	0.517	S	S	*	.	H	α-helix	trans	-52.6	-36.2	175.5	178.4	0	0	0	0	110.5	L71 V76 L77	L71-V73 PolarHBondContact O-N 2.84Å; V73-V76 PolarHBondContact O-N 3.36Å; V73-L77 HydrophobicContact CG1-CD1 4.1Å; V73-L77 HydrophobicContact CG1-CG 4.46Å; V73-L77 VanDerWaalsContact O-CG 3.3Å; V73-L77 WeakPolarHBondContact O-CG 3.27Å; V73-L77 PolarHBondContact O-N 3.17Å
74	A	82.6	Confident	72.8	Confident	45 Å²	45	93.9 Å²	93.9	37%	0.372	51%	0.511	S	S	.	.	H	α-helix	trans	-61.1	-46.8	173.9	0	0	0	0	0	112.9	S72 V76 L77 I78	S72-A74 PolarHBondContact O-N 3.15Å; S72-A74 VanDerWaalsContact O-N 3.12Å; A74-V76 VanDerWaalsContact C-N 3.34Å; A74-V76 PolarHBondContact O-N 2.99Å; A74-L77 PolarHBondContact O-N 2.73Å; A74-I78 WeakPolarHBondContact O-CD1 3.45Å; A74-I78 VanDerWaalsContact O-CG1 3.22Å; A74-I78 WeakPolarHBondContact O-CG1 3.3Å; A74-I78 PolarHBondContact O-N 3.28Å
75	A	83.5	Confident	75.2	Confident	1 Å²	1	89.4 Å²	89.4	1%	0.008	48%	0.481	C	S	.	.	H	α-helix	trans	-63.2	-39.9	178.4	0	0	0	0	0	112.1	L39 L43 L71 S72 I78 F79	L39-A75 HydrophobicContact CD1-CB 4.24Å; L39-A75 VanDerWaalsContact CD1-O 3.28Å; L39-A75 WeakPolarHBondContact CD1-O 3.37Å; L43-A75 HydrophobicContact CD2-CB 4.15Å; L71-A75 HydrophobicContact CD2-CB 3.93Å; S72-A75 PolarHBondContact O-N 3.27Å; S72-A75 WeakPolarHBondContact OG-CB 3.24Å; S72-A75 PolarHBondContact OG-N 3.04Å; A75-I78 PolarHBondContact O-N 2.8Å; A75-F79 WeakPolarHBondContact O-CB 3.44Å; A75-F79 PolarHBondContact O-N 3.4Å
76	V	85.3	Confident	77.6	Confident	58 Å²	58	87.4 Å²	87.4	35%	0.352	46%	0.463	S	S	.	.	H	α-helix	trans	-62.5	-48	175.7	179.6	0	0	0	0	110.7	L71 S72 V73 A74 I78 F79 E80	L71-V76 HydrophobicContact CB-CG2 3.74Å; S72-V76 PolarHBondContact O-N 3.42Å; S72-V76 VanDerWaalsContact O-N 3.09Å; V73-V76 PolarHBondContact O-N 3.36Å; A74-V76 VanDerWaalsContact C-N 3.34Å; A74-V76 PolarHBondContact O-N 2.99Å; V76-I78 PolarHBondContact O-N 3.46Å; V76-F79 PolarHBondContact O-N 3.47Å; V76-E80 WeakPolarHBondContact O-CG 3.32Å; V76-E80 PolarHBondContact O-N 3.31Å
77	L	87.3	Confident	80.1	Confident	103 Å²	103	86.8 Å²	86.8	54%	0.539	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-41.3	178.6	-70.8	173.4	0	0	0	112.6	V73 A74 F79 E80 Q81	V73-L77 HydrophobicContact CG1-CD1 4.1Å; V73-L77 HydrophobicContact CG1-CG 4.46Å; V73-L77 VanDerWaalsContact O-CG 3.3Å; V73-L77 WeakPolarHBondContact O-CG 3.27Å; V73-L77 PolarHBondContact O-N 3.17Å; A74-L77 PolarHBondContact O-N 2.73Å; L77-F79 VanDerWaalsContact C-N 3.34Å; L77-E80 PolarHBondContact O-N 2.74Å; L77-Q81 WeakPolarHBondContact O-CB 3.4Å; L77-Q81 PolarHBondContact O-N 3.3Å
78	I	87	Confident	82.3	Confident	33 Å²	33	86.9 Å²	86.9	17%	0.169	45%	0.445	C	S	.	.	H	α-helix	trans	-64.3	-41.3	176.2	-67.1	164	0	0	0	110.3	T38 L39 E42 A74 A75 V76 Q81 F82	T38-I78 HydrophobicContact CG2-CD1 4.47Å; L39-I78 HydrophobicContact CB-CG2 3.85Å; L39-I78 HydrophobicContact CD1-CB 4.06Å; L39-I78 HydrophobicContact CD1-CG2 3.92Å; L39-I78 HydrophobicContact CG-CG2 4.46Å; E42-I78 HydrophobicContact CG-CD1 3.76Å; A74-I78 WeakPolarHBondContact O-CD1 3.45Å; A74-I78 VanDerWaalsContact O-CG1 3.22Å; A74-I78 WeakPolarHBondContact O-CG1 3.3Å; A74-I78 PolarHBondContact O-N 3.28Å; A75-I78 PolarHBondContact O-N 2.8Å; V76-I78 PolarHBondContact O-N 3.46Å; I78-Q81 PolarHBondContact O-N 3.26Å; I78-F82 WeakPolarHBondContact O-CB 3.46Å; I78-F82 PolarHBondContact O-N 3.1Å
79	F	87.6	Confident	84.5	Confident	98 Å²	98	79.5 Å²	79.5	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-66.2	-44.2	178.3	-175.3	-111.7	0	0	0	112.1	L39 A75 V76 L77 Q81 F82 L83	L39-F79 HydrophobicContact CD1-CB 4.14Å; L39-F79 HydrophobicContact CD2-CB 4.26Å; L39-F79 HydrophobicContact CD2-CD2 3.71Å; L39-F79 HydrophobicContact CD2-CG 4.45Å; A75-F79 WeakPolarHBondContact O-CB 3.44Å; A75-F79 PolarHBondContact O-N 3.4Å; V76-F79 PolarHBondContact O-N 3.47Å; L77-F79 VanDerWaalsContact C-N 3.34Å; F79-Q81 VanDerWaalsContact C-N 3.31Å; F79-Q81 PolarHBondContact O-N 3.07Å; F79-F82 WeakPolarHBondContact O-CB 3.27Å; F79-F82 PolarHBondContact O-N 2.95Å; F79-L83 HydrophobicContact CD1-CD1 3.95Å; F79-L83 HydrophobicContact CD1-CG 4.39Å; F79-L83 HydrophobicContact CE1-CD1 3.49Å; F79-L83 VanDerWaalsContact CE1-CD1 3.49Å; F79-L83 HydrophobicContact CE1-CG 4.07Å; F79-L83 HydrophobicContact CE2-CD2 4.43Å; F79-L83 HydrophobicContact CE2-CG 4.38Å; F79-L83 HydrophobicContact CZ-CD1 3.88Å; F79-L83 HydrophobicContact CZ-CD2 4.12Å; F79-L83 HydrophobicContact CZ-CG 4.06Å; F79-L83 WeakPolarHBondContact O-CG 3.4Å; F79-L83 PolarHBondContact O-N 3.19Å
80	E	89.9	Confident	86.2	Confident	114 Å²	114	80 Å²	80	53%	0.533	41%	0.406	S	S	.	.	H	α-helix	trans	-59.8	-42.7	173.9	-74.1	-177	171.2	0	0	111.8	V76 L77 L83 K84	V76-E80 WeakPolarHBondContact O-CG 3.32Å; V76-E80 PolarHBondContact O-N 3.31Å; L77-E80 PolarHBondContact O-N 2.74Å; E80-L83 PolarHBondContact O-N 2.9Å; E80-K84 WeakPolarHBondContact O-CB 3.29Å; E80-K84 PolarHBondContact O-N 3.11Å
81	Q	89.5	Confident	87.7	Confident	118 Å²	118	80.8 Å²	80.8	55%	0.551	40%	0.403	S	S	*	.	H	α-helix	trans	-64.1	-41	175.9	-169.9	178.4	17.5	0	0	111.9	L77 I78 F79 K84 R85	L77-Q81 WeakPolarHBondContact O-CB 3.4Å; L77-Q81 PolarHBondContact O-N 3.3Å; I78-Q81 PolarHBondContact O-N 3.26Å; F79-Q81 VanDerWaalsContact C-N 3.31Å; F79-Q81 PolarHBondContact O-N 3.07Å; Q81-K84 PolarHBondContact O-N 3.23Å; Q81-R85 WeakPolarHBondContact O-CB 3.33Å; Q81-R85 PolarHBondContact O-N 3.42Å
82	F	90.5	Very high	88.8	Confident	28 Å²	28	80.9 Å²	80.9	12%	0.123	40%	0.4	C	S	.	.	H	α-helix	trans	-62.2	-45.2	175.2	171.4	-98.9	0	0	0	111.8	L32 Q35 L36 I78 F79 R85 S86	L32-F82 HydrophobicContact CB-CE2 4.06Å; L32-F82 HydrophobicContact CD2-CD2 4.03Å; L32-F82 HydrophobicContact CD2-CE2 3.87Å; Q35-F82 HydrophobicContact CB-CD2 4.08Å; L36-F82 HydrophobicContact CD1-CE1 4.43Å; L36-F82 HydrophobicContact CD1-CE2 3.53Å; L36-F82 HydrophobicContact CD1-CZ 3.46Å; L36-F82 VanDerWaalsContact CD1-CZ 3.46Å; L36-F82 HydrophobicContact CD2-CE1 4.38Å; L36-F82 HydrophobicContact CD2-CE2 4.4Å; L36-F82 HydrophobicContact CD2-CZ 4.15Å; L36-F82 HydrophobicContact CG-CD2 4.06Å; L36-F82 HydrophobicContact CG-CE1 4.3Å; L36-F82 HydrophobicContact CG-CE2 3.48Å; L36-F82 VanDerWaalsContact CG-CE2 3.48Å; L36-F82 HydrophobicContact CG-CZ 3.63Å; I78-F82 WeakPolarHBondContact O-CB 3.46Å; I78-F82 PolarHBondContact O-N 3.1Å; F79-F82 WeakPolarHBondContact O-CB 3.27Å; F79-F82 PolarHBondContact O-N 2.95Å; F82-R85 PolarHBondContact O-N 2.95Å; F82-S86 WeakPolarHBondContact CZ-OG 3.39Å; F82-S86 VanDerWaalsContact O-CB 3.29Å; F82-S86 WeakPolarHBondContact O-CB 3.34Å; F82-S86 PolarHBondContact O-N 3.17Å; F82-S86 PolarHBondContact O-OG 3.44Å
83	L	91.9	Very high	89.4	Confident	80 Å²	80	81 Å²	81	42%	0.419	40%	0.396	S	S	.	.	H	α-helix	trans	-63.3	-42.8	177	-72.5	-179.5	0	0	0	111.8	F79 E80 S86 R87	F79-L83 HydrophobicContact CD1-CD1 3.95Å; F79-L83 HydrophobicContact CD1-CG 4.39Å; F79-L83 HydrophobicContact CE1-CD1 3.49Å; F79-L83 VanDerWaalsContact CE1-CD1 3.49Å; F79-L83 HydrophobicContact CE1-CG 4.07Å; F79-L83 HydrophobicContact CE2-CD2 4.43Å; F79-L83 HydrophobicContact CE2-CG 4.38Å; F79-L83 HydrophobicContact CZ-CD1 3.88Å; F79-L83 HydrophobicContact CZ-CD2 4.12Å; F79-L83 HydrophobicContact CZ-CG 4.06Å; F79-L83 WeakPolarHBondContact O-CG 3.4Å; F79-L83 PolarHBondContact O-N 3.19Å; E80-L83 PolarHBondContact O-N 2.9Å; L83-S86 PolarHBondContact O-N 2.89Å; L83-R87 PolarHBondContact O-N 3.33Å
84	K	92.5	Very high	89.8	Confident	134 Å²	134	78.8 Å²	78.8	58%	0.583	39%	0.385	S	S	*	.	H	α-helix	trans	-60.2	-49.6	175.9	-175.5	-179.3	176.7	-176.4	0	110.8	E80 Q81 S86 R87 E88	E80-K84 WeakPolarHBondContact O-CB 3.29Å; E80-K84 PolarHBondContact O-N 3.11Å; Q81-K84 PolarHBondContact O-N 3.23Å; K84-S86 PolarHBondContact O-N 3.04Å; K84-R87 WeakPolarHBondContact O-CB 3.3Å; K84-R87 PolarHBondContact O-N 2.92Å; K84-E88 VanDerWaalsContact CE-OE1 3.24Å; K84-E88 WeakPolarHBondContact CE-OE1 3.15Å; K84-E88 WeakPolarHBondContact O-CG 3.44Å; K84-E88 PolarHBondContact O-N 3.28Å
85	R	90.6	Very high	90.2	Very high	86 Å²	86	79.1 Å²	79.1	33%	0.325	39%	0.385	S	S	.	.	H	α-helix	trans	-64.9	-39.9	179.7	-166.3	176.9	-169.8	174	-2.7	112.5	S31 L32 Q81 F82 R87 E88 V89	S31-R85 VanDerWaalsContact CB-NH2 3.34Å; S31-R85 PolarHBondContact OG-NH1 2.91Å; S31-R85 PolarHBondContact OG-NH2 2.99Å; L32-R85 HydrophobicContact CD2-CB 4Å; L32-R85 HydrophobicContact CD2-CG 3.89Å; Q81-R85 WeakPolarHBondContact O-CB 3.33Å; Q81-R85 PolarHBondContact O-N 3.42Å; F82-R85 PolarHBondContact O-N 2.95Å; R85-R87 VanDerWaalsContact C-N 3.28Å; R85-R87 PolarHBondContact O-N 3.46Å; R85-E88 PolarHBondContact O-N 2.85Å; R85-V89 HydrophobicContact CG-CG2 4.49Å; R85-V89 WeakPolarHBondContact O-CG2 3.43Å; R85-V89 PolarHBondContact O-N 2.73Å
86	S	92.1	Very high	90.5	Very high	22 Å²	22	79.7 Å²	79.7	15%	0.154	39%	0.388	C	S	.	.	H	α-helix	trans	-59.9	-41.5	176.1	-63.5	0	0	0	0	111.3	F82 L83 K84 V89 L90	F82-S86 WeakPolarHBondContact CZ-OG 3.39Å; F82-S86 VanDerWaalsContact O-CB 3.29Å; F82-S86 WeakPolarHBondContact O-CB 3.34Å; F82-S86 PolarHBondContact O-N 3.17Å; F82-S86 PolarHBondContact O-OG 3.44Å; L83-S86 PolarHBondContact O-N 2.89Å; K84-S86 PolarHBondContact O-N 3.04Å; S86-V89 PolarHBondContact O-N 3.34Å; S86-L90 WeakPolarHBondContact O-CB 3.49Å; S86-L90 WeakPolarHBondContact O-CG 3.36Å; S86-L90 PolarHBondContact O-N 3.21Å
87	R	93.9	Very high	90.6	Very high	164 Å²	164	81.6 Å²	81.6	62%	0.619	39%	0.393	S	S	*	.	H	α-helix	trans	-64.5	-43.9	175.6	-171.5	-178.1	-64	158.9	1.5	112	L83 K84 R85 L90 Q91	L83-R87 PolarHBondContact O-N 3.33Å; K84-R87 WeakPolarHBondContact O-CB 3.3Å; K84-R87 PolarHBondContact O-N 2.92Å; R85-R87 VanDerWaalsContact C-N 3.28Å; R85-R87 PolarHBondContact O-N 3.46Å; R87-L90 PolarHBondContact O-N 3.29Å; R87-Q91 WeakPolarHBondContact O-CB 3.34Å; R87-Q91 WeakPolarHBondContact O-CG 3.33Å; R87-Q91 PolarHBondContact O-N 2.87Å
88	E	92.8	Very high	90.6	Very high	98 Å²	98	85.3 Å²	85.3	46%	0.458	40%	0.399	S	S	.	.	H	α-helix	trans	-61.4	-45.4	176.7	-70.9	167.5	-177.2	0	0	111.5	K84 R85 Q91 Q92	K84-E88 VanDerWaalsContact CE-OE1 3.24Å; K84-E88 WeakPolarHBondContact CE-OE1 3.15Å; K84-E88 WeakPolarHBondContact O-CG 3.44Å; K84-E88 PolarHBondContact O-N 3.28Å; R85-E88 PolarHBondContact O-N 2.85Å; E88-Q91 PolarHBondContact O-N 3.15Å; E88-Q92 PolarHBondContact O-N 2.77Å
89	V	91.6	Very high	90.7	Very high	17 Å²	17	87.1 Å²	87.1	10%	0.103	41%	0.41	C	S	.	.	H	α-helix	trans	-61.7	-45.4	176.4	171.3	0	0	0	0	111.2	L32 R85 S86 Q91 Q92 I93	L32-V89 HydrophobicContact CD1-CB 4.12Å; L32-V89 HydrophobicContact CD1-CG1 4.1Å; L32-V89 HydrophobicContact CD1-CG2 4.07Å; L32-V89 HydrophobicContact CG-CG2 4.44Å; R85-V89 HydrophobicContact CG-CG2 4.49Å; R85-V89 WeakPolarHBondContact O-CG2 3.43Å; R85-V89 PolarHBondContact O-N 2.73Å; S86-V89 PolarHBondContact O-N 3.34Å; V89-Q91 VanDerWaalsContact C-N 3.34Å; V89-Q91 PolarHBondContact O-N 3.2Å; V89-Q92 PolarHBondContact O-N 2.84Å; V89-I93 HydrophobicContact CG1-CD1 3.74Å; V89-I93 HydrophobicContact CG1-CG1 4.4Å; V89-I93 VanDerWaalsContact O-CG1 3.28Å; V89-I93 WeakPolarHBondContact O-CG1 2.89Å; V89-I93 PolarHBondContact O-N 3.42Å
90	L	91.9	Very high	90.6	Very high	107 Å²	107	84.5 Å²	84.5	56%	0.56	40%	0.399	S	S	*	.	H	α-helix	trans	-62.8	-38.8	176.7	-76.3	171	0	0	0	112.6	S86 R87 I93 C94	S86-L90 WeakPolarHBondContact O-CB 3.49Å; S86-L90 WeakPolarHBondContact O-CG 3.36Å; S86-L90 PolarHBondContact O-N 3.21Å; R87-L90 PolarHBondContact O-N 3.29Å; L90-I93 PolarHBondContact O-N 2.85Å; L90-C94 WeakPolarHBondContact O-CB 3.37Å; L90-C94 PolarHBondContact O-N 3.08Å; L90-C94 PolarHBondContact O-SG 2.87Å
91	Q	93.8	Very high	90.5	Very high	125 Å²	125	84.3 Å²	84.3	58%	0.584	40%	0.398	S	S	*	.	H	α-helix	trans	-64.8	-42.2	174.9	-76.3	176.7	-10	0	0	111.4	R87 E88 V89 C94 S95	R87-Q91 WeakPolarHBondContact O-CB 3.34Å; R87-Q91 WeakPolarHBondContact O-CG 3.33Å; R87-Q91 PolarHBondContact O-N 2.87Å; E88-Q91 PolarHBondContact O-N 3.15Å; V89-Q91 VanDerWaalsContact C-N 3.34Å; V89-Q91 PolarHBondContact O-N 3.2Å; Q91-C94 PolarHBondContact O-N 2.86Å; Q91-S95 WeakPolarHBondContact O-CB 3.26Å; Q91-S95 PolarHBondContact O-N 3.41Å
92	Q	91.2	Very high	90.3	Very high	106 Å²	106	81.5 Å²	81.5	50%	0.495	40%	0.395	S	S	.	.	H	α-helix	trans	-63.9	-44.2	176.1	-170	62.3	42.9	0	0	111.8	E88 V89 C94 S95 N96	E88-Q92 PolarHBondContact O-N 2.77Å; V89-Q92 PolarHBondContact O-N 2.84Å; Q92-C94 PolarHBondContact O-N 3.05Å; Q92-S95 PolarHBondContact O-N 3.46Å; Q92-N96 PolarHBondContact NE2-OD1 2.47Å; Q92-N96 WeakPolarHBondContact O-CB 3.44Å; Q92-N96 PolarHBondContact O-N 2.98Å; Q92-N96 PolarHBondContact O-OD1 3.35Å
93	I	89.9	Confident	90.1	Very high	50 Å²	50	81.4 Å²	81.4	26%	0.256	40%	0.398	S	S	.	.	H	α-helix	trans	-59.1	-46.7	175.1	-67.9	163	0	0	0	110.6	Y25 V89 L90 S95 N96 H97	Y25-I93 HydrophobicContact CD1-CD1 4.37Å; Y25-I93 HydrophobicContact CD1-CG1 3.52Å; Y25-I93 HydrophobicContact CE1-CB 3.98Å; Y25-I93 HydrophobicContact CE1-CG1 3.41Å; Y25-I93 VanDerWaalsContact CE1-CG1 3.41Å; Y25-I93 HydrophobicContact CE1-CG2 4.24Å; Y25-I93 HydrophobicContact CG-CG1 4.32Å; Y25-I93 PolarHBondContact OH-O 2.74Å; V89-I93 HydrophobicContact CG1-CD1 3.74Å; V89-I93 HydrophobicContact CG1-CG1 4.4Å; V89-I93 VanDerWaalsContact O-CG1 3.28Å; V89-I93 WeakPolarHBondContact O-CG1 2.89Å; V89-I93 PolarHBondContact O-N 3.42Å; L90-I93 PolarHBondContact O-N 2.85Å; I93-S95 VanDerWaalsContact C-N 3.33Å; I93-S95 PolarHBondContact O-N 2.9Å; I93-N96 PolarHBondContact O-N 2.91Å; I93-H97 WeakPolarHBondContact O-CB 3.47Å; I93-H97 PolarHBondContact O-N 3.31Å
94	C	91.2	Very high	89.9	Confident	67 Å²	67	81 Å²	81	45%	0.453	40%	0.398	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177.2	-73.4	0	0	0	0	112.3	L90 Q91 Q92 R98	L90-C94 WeakPolarHBondContact O-CB 3.37Å; L90-C94 PolarHBondContact O-N 3.08Å; L90-C94 PolarHBondContact O-SG 2.87Å; Q91-C94 PolarHBondContact O-N 2.86Å; Q92-C94 PolarHBondContact O-N 3.05Å; C94-R98 WeakPolarHBondContact O-CG 3.4Å; C94-R98 PolarHBondContact O-N 3.26Å
95	S	90.6	Very high	89.6	Confident	53 Å²	53	77.5 Å²	77.5	37%	0.371	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-51.2	177.6	-169.6	0	0	0	0	111.2	Q91 Q92 I93 H97 R98 D99	Q91-S95 WeakPolarHBondContact O-CB 3.26Å; Q91-S95 PolarHBondContact O-N 3.41Å; Q92-S95 PolarHBondContact O-N 3.46Å; I93-S95 VanDerWaalsContact C-N 3.33Å; I93-S95 PolarHBondContact O-N 2.9Å; S95-H97 VanDerWaalsContact C-N 3.32Å; S95-H97 PolarHBondContact O-N 2.88Å; S95-R98 WeakPolarHBondContact O-CB 3.39Å; S95-R98 PolarHBondContact O-N 2.92Å; S95-R98 VanDerWaalsContact O-N 3.09Å; S95-D99 PolarHBondContact O-N 3.2Å; S95-D99 VanDerWaalsContact O-N 3.07Å
96	N	89.5	Confident	89.3	Confident	13 Å²	13	78.5 Å²	78.5	7%	0.07	40%	0.398	C	S	.	.	H	α-helix	trans	-57.1	-44.9	177.9	-72.5	-4.6	0	0	0	111.1	Y21 Y25 Q92 I93 R98 D99 M100	Y21-N96 HydrophobicContact CD1-CB 3.78Å; Y21-N96 VanDerWaalsContact CD1-ND2 3.33Å; Y21-N96 WeakPolarHBondContact CD1-ND2 3.25Å; Y21-N96 HydrophobicContact CE1-CB 3.59Å; Y21-N96 WeakPolarHBondContact CE1-OD1 3.37Å; Y21-N96 HydrophobicContact CG-CB 4.36Å; Y25-N96 HydrophobicContact CE1-CB 4.26Å; Y25-N96 WeakPolarHBondContact CE1-ND2 3.44Å; Y25-N96 WeakPolarHBondContact OH-CB 3.49Å; Q92-N96 PolarHBondContact NE2-OD1 2.47Å; Q92-N96 WeakPolarHBondContact O-CB 3.44Å; Q92-N96 PolarHBondContact O-N 2.98Å; Q92-N96 PolarHBondContact O-OD1 3.35Å; I93-N96 PolarHBondContact O-N 2.91Å; N96-R98 VanDerWaalsContact C-N 3.32Å; N96-R98 PolarHBondContact O-N 2.66Å; N96-D99 WeakPolarHBondContact O-CB 3.44Å; N96-D99 PolarHBondContact O-N 2.78Å; N96-D99 VanDerWaalsContact O-N 3.09Å; N96-M100 VanDerWaalsContact O-CG 3.27Å; N96-M100 WeakPolarHBondContact O-CG 3.43Å; N96-M100 PolarHBondContact O-N 2.86Å
97	H	86.7	Confident	88.9	Confident	97 Å²	97	78.3 Å²	78.3	45%	0.449	40%	0.395	S	S	.	.	H	α-helix	trans	-59	-39.5	176.5	176.3	-99.9	0	0	0	112.7	I93 S95 M100 H101	I93-H97 WeakPolarHBondContact O-CB 3.47Å; I93-H97 PolarHBondContact O-N 3.31Å; S95-H97 VanDerWaalsContact C-N 3.32Å; S95-H97 PolarHBondContact O-N 2.88Å; H97-M100 WeakPolarHBondContact O-CB 3.36Å; H97-M100 PolarHBondContact O-N 2.93Å; H97-H101 AromaticContact CE1-CD2 3.43Å; H97-H101 PolarHBondContact CE1-CD2 3.38Å; H97-H101 VanDerWaalsContact CE1-CD2 3.43Å; H97-H101 AromaticContact CE1-NE2 3.07Å; H97-H101 PolarHBondContact CE1-NE2 3.37Å; H97-H101 AromaticContact ND1-CD2 3.8Å; H97-H101 AromaticContact ND1-NE2 3.9Å; H97-H101 AromaticContact NE2-CD2 3.72Å; H97-H101 AromaticContact NE2-NE2 3.17Å; H97-H101 PolarHBondContact NE2-NE2 2.9Å; H97-H101 VanDerWaalsContact NE2-NE2 3.17Å; H97-H101 PolarHBondContact O-CD2 3.25Å; H97-H101 VanDerWaalsContact O-CD2 3.28Å; H97-H101 PolarHBondContact O-N 3Å
98	R	88.8	Confident	88.4	Confident	181 Å²	181	72 Å²	72	68%	0.683	38%	0.381	S	S	*	.	H	α-helix	trans	-64	-41	173.8	-68	175	-162.8	171.2	4.6	111.8	C94 S95 N96 M100 H101 A102	C94-R98 WeakPolarHBondContact O-CG 3.4Å; C94-R98 PolarHBondContact O-N 3.26Å; S95-R98 WeakPolarHBondContact O-CB 3.39Å; S95-R98 PolarHBondContact O-N 2.92Å; S95-R98 VanDerWaalsContact O-N 3.09Å; N96-R98 VanDerWaalsContact C-N 3.32Å; N96-R98 PolarHBondContact O-N 2.66Å; R98-M100 VanDerWaalsContact C-N 3.26Å; R98-M100 PolarHBondContact O-N 3.39Å; R98-H101 WeakPolarHBondContact O-CB 3.4Å; R98-H101 PolarHBondContact O-N 3.22Å; R98-A102 PolarHBondContact O-N 3.47Å
99	D	88.3	Confident	88	Confident	72 Å²	72	73.5 Å²	73.5	39%	0.385	38%	0.383	S	S	.	.	H	α-helix	trans	-64.3	-32	176.1	-67.1	-22	0	0	0	112.4	Y21 S95 N96 A102 S103	Y21-D99 WeakPolarHBondContact OH-CB 3.36Å; S95-D99 PolarHBondContact O-N 3.2Å; S95-D99 VanDerWaalsContact O-N 3.07Å; N96-D99 WeakPolarHBondContact O-CB 3.44Å; N96-D99 PolarHBondContact O-N 2.78Å; N96-D99 VanDerWaalsContact O-N 3.09Å; D99-A102 PolarHBondContact O-N 3.4Å; D99-S103 WeakPolarHBondContact O-CB 3.31Å; D99-S103 PolarHBondContact O-N 3.44Å; D99-S103 PolarHBondContact O-OG 3.41Å
100	M	85.8	Confident	87.4	Confident	43 Å²	43	74.2 Å²	74.2	21%	0.212	39%	0.385	C	S	.	.	H	α-helix	trans	-61.8	-48.2	172.7	-63.6	173.7	68.4	0	0	110.8	Y18 Y21 N96 H97 R98 A102 S103 V104	Y18-M100 HydrophobicContact CD1-CE 3.34Å; Y18-M100 HydrophobicContact CD1-CG 3.91Å; Y18-M100 HydrophobicContact CD1-SD 4.21Å; Y18-M100 HydrophobicContact CE1-CB 3.61Å; Y18-M100 HydrophobicContact CE1-CE 3.17Å; Y18-M100 HydrophobicContact CE1-CG 3.44Å; Y18-M100 VanDerWaalsContact CE1-CG 3.44Å; Y18-M100 HydrophobicContact CE1-SD 4.05Å; Y18-M100 HydrophobicContact CE2-CE 4.44Å; Y18-M100 HydrophobicContact CG-CE 4.08Å; Y21-M100 HydrophobicContact CD2-CG 3.7Å; Y21-M100 HydrophobicContact CD2-SD 4.01Å; Y21-M100 HydrophobicContact CE2-CG 3.57Å; Y21-M100 HydrophobicContact CE2-SD 4.44Å; N96-M100 VanDerWaalsContact O-CG 3.27Å; N96-M100 WeakPolarHBondContact O-CG 3.43Å; N96-M100 PolarHBondContact O-N 2.86Å; H97-M100 WeakPolarHBondContact O-CB 3.36Å; H97-M100 PolarHBondContact O-N 2.93Å; R98-M100 VanDerWaalsContact C-N 3.26Å; R98-M100 PolarHBondContact O-N 3.39Å; M100-A102 VanDerWaalsContact C-N 3.32Å; M100-A102 PolarHBondContact O-N 3.13Å; M100-S103 WeakPolarHBondContact O-CB 3.42Å; M100-S103 PolarHBondContact O-N 3.41Å; M100-V104 WeakPolarHBondContact O-CG2 3.48Å; M100-V104 PolarHBondContact O-N 3.2Å
101	H	86.6	Confident	86.8	Confident	110 Å²	110	72.7 Å²	72.7	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-57.2	-42.8	176.7	-83	-77.1	0	0	0	112.8	H97 R98 S103 S105	H97-H101 AromaticContact CE1-CD2 3.43Å; H97-H101 PolarHBondContact CE1-CD2 3.38Å; H97-H101 VanDerWaalsContact CE1-CD2 3.43Å; H97-H101 AromaticContact CE1-NE2 3.07Å; H97-H101 PolarHBondContact CE1-NE2 3.37Å; H97-H101 AromaticContact ND1-CD2 3.8Å; H97-H101 AromaticContact ND1-NE2 3.9Å; H97-H101 AromaticContact NE2-CD2 3.72Å; H97-H101 AromaticContact NE2-NE2 3.17Å; H97-H101 PolarHBondContact NE2-NE2 2.9Å; H97-H101 VanDerWaalsContact NE2-NE2 3.17Å; H97-H101 PolarHBondContact O-CD2 3.25Å; H97-H101 VanDerWaalsContact O-CD2 3.28Å; H97-H101 PolarHBondContact O-N 3Å; R98-H101 WeakPolarHBondContact O-CB 3.4Å; R98-H101 PolarHBondContact O-N 3.22Å; H101-S103 VanDerWaalsContact C-N 3.31Å; H101-S103 PolarHBondContact O-N 3.37Å; H101-S105 WeakPolarHBondContact O-CB 3.26Å; H101-S105 PolarHBondContact O-N 2.91Å; H101-S105 PolarHBondContact O-OG 3.43Å
102	A	86.5	Confident	86	Confident	59 Å²	59	73.3 Å²	73.3	49%	0.488	38%	0.379	S	S	.	.	H	α-helix	trans	-63.9	-38.3	176.5	0	0	0	0	0	112	R98 D99 M100 K106	R98-A102 PolarHBondContact O-N 3.47Å; D99-A102 PolarHBondContact O-N 3.4Å; M100-A102 VanDerWaalsContact C-N 3.32Å; M100-A102 PolarHBondContact O-N 3.13Å; A102-K106 PolarHBondContact O-N 2.81Å; A102-K106 VanDerWaalsContact O-N 3.08Å
103	S	85.7	Confident	85.3	Confident	26 Å²	26	74.1 Å²	74.1	18%	0.182	38%	0.381	C	S	.	.	H	α-helix	trans	-69.3	-45.3	179.9	-52.7	0	0	0	0	111.7	K17 D99 M100 H101 S105 K106 V107	K17-S103 PolarHBondContact NZ-OG 3.31Å; K17-S103 VanDerWaalsContact NZ-OG 3.11Å; D99-S103 WeakPolarHBondContact O-CB 3.31Å; D99-S103 PolarHBondContact O-N 3.44Å; D99-S103 PolarHBondContact O-OG 3.41Å; M100-S103 WeakPolarHBondContact O-CB 3.42Å; M100-S103 PolarHBondContact O-N 3.41Å; H101-S103 VanDerWaalsContact C-N 3.31Å; H101-S103 PolarHBondContact O-N 3.37Å; S103-S105 VanDerWaalsContact C-N 3.33Å; S103-S105 PolarHBondContact O-N 3.35Å; S103-K106 WeakPolarHBondContact O-CB 3.47Å; S103-K106 PolarHBondContact O-N 2.91Å; S103-K106 VanDerWaalsContact O-N 3.13Å; S103-V107 PolarHBondContact O-N 3.25Å; S103-V107 VanDerWaalsContact O-N 3.14Å
104	V	87.2	Confident	84.5	Confident	71 Å²	71	72.6 Å²	72.6	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-60.1	-44.8	174.1	176.9	0	0	0	0	111	L14 Y18 M100 K106 V107 G108	L14-V104 HydrophobicContact CD1-CG2 4.08Å; L14-V104 HydrophobicContact CD2-CG2 4.43Å; Y18-V104 WeakPolarHBondContact OH-CG2 3.32Å; M100-V104 WeakPolarHBondContact O-CG2 3.48Å; M100-V104 PolarHBondContact O-N 3.2Å; V104-K106 PolarHBondContact O-N 2.91Å; V104-V107 PolarHBondContact O-N 3.19Å; V104-V107 VanDerWaalsContact O-N 3.12Å; V104-G108 PolarHBondContact O-N 3.24Å
105	S	87.7	Confident	83.4	Confident	60 Å²	60	73 Å²	73	42%	0.42	38%	0.378	S	S	.	.	H	α-helix	trans	-60	-33.9	177.5	-60.8	0	0	0	0	112.1	H101 S103 R109	H101-S105 WeakPolarHBondContact O-CB 3.26Å; H101-S105 PolarHBondContact O-N 2.91Å; H101-S105 PolarHBondContact O-OG 3.43Å; S103-S105 VanDerWaalsContact C-N 3.33Å; S103-S105 PolarHBondContact O-N 3.35Å; S105-R109 WeakPolarHBondContact O-CG 3.49Å; S105-R109 PolarHBondContact O-N 3.34Å; S105-R109 VanDerWaalsContact O-N 3.12Å
106	K	83.6	Confident	82.3	Confident	108 Å²	108	74.8 Å²	74.8	47%	0.47	38%	0.38	S	S	.	.	H	α-helix	trans	-67.6	-43.8	175.2	-170.3	178.4	178.9	-179.4	0	111.6	A102 S103 V104 G108 R109 E110	A102-K106 PolarHBondContact O-N 2.81Å; A102-K106 VanDerWaalsContact O-N 3.08Å; S103-K106 WeakPolarHBondContact O-CB 3.47Å; S103-K106 PolarHBondContact O-N 2.91Å; S103-K106 VanDerWaalsContact O-N 3.13Å; V104-K106 PolarHBondContact O-N 2.91Å; K106-G108 VanDerWaalsContact C-N 3.31Å; K106-G108 PolarHBondContact O-N 3.08Å; K106-R109 PolarHBondContact O-N 3.09Å; K106-E110 PolarHBondContact O-N 3.25Å
107	V	84.7	Confident	81.3	Confident	17 Å²	17	76.9 Å²	76.9	10%	0.103	40%	0.395	C	S	.	.	H	α-helix	trans	-59	-45	174.5	178.9	0	0	0	0	110.4	H10 V11 L14 S103 V104 R109 E110 I111	H10-V107 HydrophobicContact CB-CG2 4.31Å; V11-V107 HydrophobicContact CG2-CG1 4.02Å; L14-V107 HydrophobicContact CB-CG2 4.46Å; L14-V107 HydrophobicContact CD1-CG2 4.12Å; S103-V107 PolarHBondContact O-N 3.25Å; S103-V107 VanDerWaalsContact O-N 3.14Å; V104-V107 PolarHBondContact O-N 3.19Å; V104-V107 VanDerWaalsContact O-N 3.12Å; V107-R109 VanDerWaalsContact C-N 3.35Å; V107-R109 PolarHBondContact O-N 3.45Å; V107-E110 PolarHBondContact O-N 3.22Å; V107-E110 VanDerWaalsContact O-N 3.14Å; V107-I111 HydrophobicContact CG1-CD1 3.95Å; V107-I111 HydrophobicContact CG1-CG1 4.45Å; V107-I111 WeakPolarHBondContact O-CG1 3.25Å; V107-I111 PolarHBondContact O-N 3.47Å
108	G	83	Confident	80.3	Confident	32 Å²	32	75.5 Å²	75.5	33%	0.33	39%	0.391	S	S	.	.	H	α-helix	trans	-54.7	-47	175	0	0	0	0	0	113	V104 K106 E110 I111 E112	V104-G108 PolarHBondContact O-N 3.24Å; K106-G108 VanDerWaalsContact C-N 3.31Å; K106-G108 PolarHBondContact O-N 3.08Å; G108-E110 PolarHBondContact O-N 3.47Å; G108-I111 PolarHBondContact O-N 3.35Å; G108-E112 WeakPolarHBondContact O-CG 3.21Å; G108-E112 PolarHBondContact O-N 3.5Å
109	R	83.1	Confident	78.8	Confident	130 Å²	130	70.1 Å²	70.1	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-35.4	176.7	-72.3	-171.9	-64.4	-92.4	2.5	113.6	S105 K106 V107 E112 K113	S105-R109 WeakPolarHBondContact O-CG 3.49Å; S105-R109 PolarHBondContact O-N 3.34Å; S105-R109 VanDerWaalsContact O-N 3.12Å; K106-R109 PolarHBondContact O-N 3.09Å; V107-R109 VanDerWaalsContact C-N 3.35Å; V107-R109 PolarHBondContact O-N 3.45Å; R109-E112 PolarHBondContact O-N 2.85Å; R109-K113 WeakPolarHBondContact O-CG 3.28Å; R109-K113 PolarHBondContact O-N 3.05Å
110	E	80.1	Confident	77.2	Confident	32 Å²	32	70.5 Å²	70.5	15%	0.15	37%	0.371	C	S	.	.	H	α-helix	trans	-70.7	-38.5	176.3	-68.2	-53.3	138.8	0	0	111.9	K106 V107 G108 E112 K113 V114	K106-E110 PolarHBondContact O-N 3.25Å; V107-E110 PolarHBondContact O-N 3.22Å; V107-E110 VanDerWaalsContact O-N 3.14Å; G108-E110 PolarHBondContact O-N 3.47Å; E110-E112 VanDerWaalsContact C-N 3.3Å; E110-E112 PolarHBondContact O-N 3.18Å; E110-K113 PolarHBondContact O-N 3.01Å; E110-K113 IonicContact OE1-NZ 2.69Å; E110-K113 PolarHBondContact OE1-NZ 2.96Å; E110-K113 WeakPolarHBondContact OE2-CD 3.5Å; E110-K113 IonicContact OE2-NZ 2.82Å; E110-V114 WeakPolarHBondContact O-CG2 3.19Å; E110-V114 PolarHBondContact O-N 3.44Å
111	I	78.2	Confident	76.1	Confident	74 Å²	74	74.6 Å²	74.6	38%	0.379	39%	0.389	S	S	.	.	H	α-helix	trans	-58.4	-45	171.4	-67.5	166.9	0	0	0	110.2	V7 V107 G108 K113 V114 C115	V7-I111 HydrophobicContact CG1-CD1 4.26Å; V7-I111 HydrophobicContact CG1-CG1 3.71Å; V7-I111 HydrophobicContact CG2-CG1 4.16Å; V107-I111 HydrophobicContact CG1-CD1 3.95Å; V107-I111 HydrophobicContact CG1-CG1 4.45Å; V107-I111 WeakPolarHBondContact O-CG1 3.25Å; V107-I111 PolarHBondContact O-N 3.47Å; G108-I111 PolarHBondContact O-N 3.35Å; I111-K113 PolarHBondContact O-N 3.03Å; I111-V114 PolarHBondContact O-N 3.03Å; I111-C115 VanDerWaalsContact O-CB 3.3Å; I111-C115 WeakPolarHBondContact O-CB 3.48Å; I111-C115 PolarHBondContact O-N 3.38Å; I111-C115 PolarHBondContact O-SG 2.8Å
112	E	77	Confident	74.4	Confident	138 Å²	138	75.6 Å²	75.6	65%	0.645	39%	0.389	S	S	*	.	H	α-helix	trans	-59.8	-44.1	175.6	-73.1	176.7	173.9	0	0	112.3	G108 R109 E110 C115 H116	G108-E112 WeakPolarHBondContact O-CG 3.21Å; G108-E112 PolarHBondContact O-N 3.5Å; R109-E112 PolarHBondContact O-N 2.85Å; E110-E112 VanDerWaalsContact C-N 3.3Å; E110-E112 PolarHBondContact O-N 3.18Å; E112-C115 PolarHBondContact O-N 3.45Å; E112-H116 VanDerWaalsContact O-CB 3.31Å; E112-H116 WeakPolarHBondContact O-CB 3.39Å; E112-H116 PolarHBondContact O-N 3.37Å
113	K	77.7	Confident	72.8	Confident	123 Å²	123	77 Å²	77	54%	0.535	39%	0.391	S	S	.	.	H	α-helix	trans	-64.2	-42.8	176.8	-74.2	173.9	-174.9	173.3	0	112.6	R109 E110 I111 H116 S117	R109-K113 WeakPolarHBondContact O-CG 3.28Å; R109-K113 PolarHBondContact O-N 3.05Å; E110-K113 PolarHBondContact O-N 3.01Å; E110-K113 IonicContact OE1-NZ 2.69Å; E110-K113 PolarHBondContact OE1-NZ 2.96Å; E110-K113 WeakPolarHBondContact OE2-CD 3.5Å; E110-K113 IonicContact OE2-NZ 2.82Å; I111-K113 PolarHBondContact O-N 3.03Å; K113-H116 CarbonylContact O-C 3.57Å; K113-H116 WeakPolarHBondContact O-CB 3.16Å; K113-H116 PolarHBondContact O-N 3.34Å; K113-S117 WeakPolarHBondContact O-CB 3.24Å; K113-S117 PolarHBondContact O-N 3.24Å
114	V	73.8	Confident	71.1	Confident	18 Å²	18	85.8 Å²	85.8	11%	0.109	42%	0.42	C	S	.	.	H	α-helix	trans	-65.3	-45.6	178.2	168	0	0	0	0	110.2	G3 V7 E110 I111 H116 S117 I118	G3-V114 WeakPolarHBondContact O-CG1 3.3Å; G3-V114 WeakPolarHBondContact O-CG2 3.47Å; V7-V114 HydrophobicContact CG2-CB 4.21Å; V7-V114 HydrophobicContact CG2-CG1 4.43Å; V7-V114 HydrophobicContact CG2-CG2 3.89Å; E110-V114 WeakPolarHBondContact O-CG2 3.19Å; E110-V114 PolarHBondContact O-N 3.44Å; I111-V114 PolarHBondContact O-N 3.03Å; V114-H116 VanDerWaalsContact C-N 3.25Å; V114-H116 PolarHBondContact O-N 3.43Å; V114-S117 PolarHBondContact O-N 2.91Å; V114-S117 VanDerWaalsContact O-N 3.15Å; V114-I118 HydrophobicContact CG1-CD1 3.87Å; V114-I118 HydrophobicContact CG1-CG1 4.46Å; V114-I118 VanDerWaalsContact O-CG1 3.32Å; V114-I118 WeakPolarHBondContact O-CG1 3.31Å; V114-I118 PolarHBondContact O-N 3.19Å
115	C	67.8	Low	69.5	Low	77 Å²	77	85.7 Å²	85.7	52%	0.52	43%	0.427	S	S	.	.	H	α-helix	trans	-56.6	-41.3	171.6	-73.6	0	0	0	0	111.6	I111 E112 R119	I111-C115 VanDerWaalsContact O-CB 3.3Å; I111-C115 WeakPolarHBondContact O-CB 3.48Å; I111-C115 PolarHBondContact O-N 3.38Å; I111-C115 PolarHBondContact O-SG 2.8Å; E112-C115 PolarHBondContact O-N 3.45Å; C115-R119 VanDerWaalsContact O-CB 3.31Å; C115-R119 WeakPolarHBondContact O-CB 3.33Å; C115-R119 PolarHBondContact O-N 3.02Å
116	H	67.5	Low	67.5	Low	90 Å²	90	89.8 Å²	89.8	42%	0.417	44%	0.444	S	S	.	.	H	α-helix	trans	-67.2	-38.4	175.6	-168.4	91.6	0	0	0	113.2	E112 K113 V114 R119 M120	E112-H116 VanDerWaalsContact O-CB 3.31Å; E112-H116 WeakPolarHBondContact O-CB 3.39Å; E112-H116 PolarHBondContact O-N 3.37Å; K113-H116 CarbonylContact O-C 3.57Å; K113-H116 WeakPolarHBondContact O-CB 3.16Å; K113-H116 PolarHBondContact O-N 3.34Å; V114-H116 VanDerWaalsContact C-N 3.25Å; V114-H116 PolarHBondContact O-N 3.43Å; H116-R119 VanDerWaalsContact O-CB 3.28Å; H116-R119 WeakPolarHBondContact O-CB 3.46Å; H116-R119 PolarHBondContact O-N 2.87Å; H116-M120 WeakPolarHBondContact NE2-CE 3.13Å; H116-M120 WeakPolarHBondContact O-CG 3.12Å; H116-M120 PolarHBondContact O-N 2.82Å
117	S	67.6	Low	65.6	Low	57 Å²	57	93.7 Å²	93.7	40%	0.399	46%	0.456	S	S	.	.	H	α-helix	trans	-67.7	-46.1	176.9	-176.8	0	0	0	0	111.6	K113 V114 R119 M120 Q121	K113-S117 WeakPolarHBondContact O-CB 3.24Å; K113-S117 PolarHBondContact O-N 3.24Å; V114-S117 PolarHBondContact O-N 2.91Å; V114-S117 VanDerWaalsContact O-N 3.15Å; S117-R119 PolarHBondContact O-N 3.47Å; S117-M120 PolarHBondContact O-N 3.33Å; S117-Q121 PolarHBondContact O-N 3.2Å
118	I	64.9	Low	63.5	Low	68 Å²	68	104 Å²	104	35%	0.349	49%	0.493	S	S	.	.	H	α-helix	trans	-57	-39.4	172.6	-66.9	168.5	0	0	0	110.1	V114 R122	V114-I118 HydrophobicContact CG1-CD1 3.87Å; V114-I118 HydrophobicContact CG1-CG1 4.46Å; V114-I118 VanDerWaalsContact O-CG1 3.32Å; V114-I118 WeakPolarHBondContact O-CG1 3.31Å; V114-I118 PolarHBondContact O-N 3.19Å; I118-R122 WeakPolarHBondContact O-CB 3.27Å; I118-R122 PolarHBondContact O-N 3.24Å
119	R	57.4	Low	61.6	Low	67 Å²	67	105.9 Å²	105.9	25%	0.253	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-49.2	171.9	167.4	-179.7	177.9	175.1	-4.1	112.2	C115 H116 S117 R122 V123 C131 Q133	C115-R119 VanDerWaalsContact O-CB 3.31Å; C115-R119 WeakPolarHBondContact O-CB 3.33Å; C115-R119 PolarHBondContact O-N 3.02Å; H116-R119 VanDerWaalsContact O-CB 3.28Å; H116-R119 WeakPolarHBondContact O-CB 3.46Å; H116-R119 PolarHBondContact O-N 2.87Å; S117-R119 PolarHBondContact O-N 3.47Å; R119-R122 PolarHBondContact O-N 2.94Å; R119-V123 VanDerWaalsContact O-CG2 3.31Å; R119-V123 WeakPolarHBondContact O-CG2 3.45Å; R119-V123 PolarHBondContact O-N 2.95Å; R119-V123 VanDerWaalsContact O-N 3.08Å; R119-C131 HydrophobicContact CB-CB 4.23Å; R119-C131 HydrophobicContact CG-CB 4.22Å; R119-Q133 PolarHBondContact NH1-O 3.46Å
120	M	56.5	Low	59.7	Low	80 Å²	80	106.7 Å²	106.7	39%	0.394	50%	0.502	S	S	.	.	H	α-helix	trans	-68.2	-37.6	-179	-73.9	-64.4	179.1	0	0	113.6	H116 S117 R124	H116-M120 WeakPolarHBondContact NE2-CE 3.13Å; H116-M120 WeakPolarHBondContact O-CG 3.12Å; H116-M120 PolarHBondContact O-N 2.82Å; S117-M120 PolarHBondContact O-N 3.33Å; M120-R124 PolarHBondContact O-N 3.12Å; M120-R124 VanDerWaalsContact O-N 3.15Å
121	Q	61.4	Low	58	Low	129 Å²	129	106.6 Å²	106.6	60%	0.603	50%	0.504	S	S	*	.	H	α-helix	trans	-64.3	-40.8	175.6	-73.6	-177.3	-5.5	0	0	111.5	S117 R124 A125	S117-Q121 PolarHBondContact O-N 3.2Å; Q121-R124 PolarHBondContact O-N 2.72Å; Q121-A125 PolarHBondContact O-N 3.19Å; Q121-A125 VanDerWaalsContact O-N 3.17Å
122	R	51.2	Low	56.3	Low	132 Å²	132	107.3 Å²	107.3	50%	0.498	51%	0.505	S	S	.	.	H	α-helix	trans	-72.4	-33.4	178.6	-77.4	-176.1	166.4	167.2	-2.5	113.6	I118 R119 A125	I118-R122 WeakPolarHBondContact O-CB 3.27Å; I118-R122 PolarHBondContact O-N 3.24Å; R119-R122 PolarHBondContact O-N 2.94Å; R122-A125 PolarHBondContact O-N 3Å
123	V	53.7	Low	54.9	Low	88 Å²	88	104.7 Å²	104.7	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-64.8	-40.3	172.5	172.9	0	0	0	0	111.2	R119 A125 N126	R119-V123 VanDerWaalsContact O-CG2 3.31Å; R119-V123 WeakPolarHBondContact O-CG2 3.45Å; R119-V123 PolarHBondContact O-N 2.95Å; R119-V123 VanDerWaalsContact O-N 3.08Å; V123-A125 VanDerWaalsContact C-N 3.32Å; V123-A125 PolarHBondContact O-N 3.49Å; V123-N126 PolarHBondContact O-N 3.05Å
124	R	50.1	Low	53.6	Low	211 Å²	211	103.9 Å²	103.9	80%	0.796	49%	0.494	S	S	*	.	H	α-helix	trans	-66.5	-29.9	175.2	-79.1	-172.3	172.3	104	-3.2	113.6	M120 Q121 N126	M120-R124 PolarHBondContact O-N 3.12Å; M120-R124 VanDerWaalsContact O-N 3.15Å; Q121-R124 PolarHBondContact O-N 2.72Å; R124-N126 PolarHBondContact O-N 2.85Å
125	A	52.3	Low	52.6	Low	69 Å²	69	111.9 Å²	111.9	57%	0.57	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	12.4	178.3	0	0	0	0	0	114.4	Q121 R122 V123 R127	Q121-A125 PolarHBondContact O-N 3.19Å; Q121-A125 VanDerWaalsContact O-N 3.17Å; R122-A125 PolarHBondContact O-N 3Å; V123-A125 VanDerWaalsContact C-N 3.32Å; V123-A125 PolarHBondContact O-N 3.49Å; A125-R127 PolarHBondContact O-N 3.44Å
126	N	46.9	Very low	52.1	Low	145 Å²	145	110.6 Å²	110.6	78%	0.775	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	14.5	176.5	-148.5	17.5	0	0	0	115.6	V123 R124	V123-N126 PolarHBondContact O-N 3.05Å; R124-N126 PolarHBondContact O-N 2.85Å
127	R	43.5	Very low	51.6	Low	190 Å²	190	111.4 Å²	111.4	72%	0.717	53%	0.533	S	S	*	.			trans	-86.8	113.4	160.2	-68.3	-171.2	-172	-158.3	1.9	105.5	A125 I129	A125-R127 PolarHBondContact O-N 3.44Å; R127-I129 HydrophobicContact CB-CD1 3.95Å; R127-I129 HydrophobicContact CB-CG1 3.86Å; R127-I129 PolarHBondContact O-N 3.03Å
128	R	40.2	Very low	51.4	Low	234 Å²	234	112 Å²	112	88%	0.883	53%	0.532	S	S	*	.			trans	-61.8	61.4	170.5	-65	178.7	-174.7	177.7	0.5	110.9	F130	R128-F130 PolarHBondContact O-N 2.91Å
129	I	42.6	Very low	51.5	Low	72 Å²	72	112.4 Å²	112.4	37%	0.369	53%	0.534	S	S	.	.			trans	-88	100.5	172.9	-58.3	173.8	0	0	0	105	R127 C131	R127-I129 HydrophobicContact CB-CD1 3.95Å; R127-I129 HydrophobicContact CB-CG1 3.86Å; R127-I129 PolarHBondContact O-N 3.03Å; I129-C131 VanDerWaalsContact CG2-SG 3.55Å; I129-C131 PolarHBondContact O-N 3.17Å
130	F	43.3	Very low	52	Low	147 Å²	147	116.1 Å²	116.1	65%	0.645	56%	0.555	S	S	*	*			trans	-61.2	84.4	166.1	-93.8	-95.8	0	0	0	108.5	R128 T347	R128-F130 PolarHBondContact O-N 2.91Å; F130-T347 HydrophobicContact CB-CG2 3.9Å; F130-T347 HydrophobicContact CD1-CG2 4.24Å
131	C	44.1	Very low	52.3	Low	29 Å²	29	117.8 Å²	117.8	20%	0.196	56%	0.561	C	S	.	*			trans	-76.8	133	174.7	-69.5	0	0	0	0	109.8	R119 I129 Q133	R119-C131 HydrophobicContact CB-CB 4.23Å; R119-C131 HydrophobicContact CG-CB 4.22Å; I129-C131 VanDerWaalsContact CG2-SG 3.55Å; I129-C131 PolarHBondContact O-N 3.17Å; C131-Q133 PolarHBondContact O-N 3.3Å
132	F	43.1	Very low	52.5	Low	90 Å²	90	112.4 Å²	112.4	40%	0.395	54%	0.537	S	S	.	.			trans	-28.6	116.7	179.8	-73.7	-89.9	0	0	0	113.5	N134 I343 V346	F132-N134 PolarHBondContact O-N 3.17Å; F132-I343 HydrophobicContact CE2-CG1 4.5Å; F132-I343 HydrophobicContact CE2-CG2 3.68Å; F132-I343 HydrophobicContact CZ-CG1 4.32Å; F132-I343 HydrophobicContact CZ-CG2 3.95Å; F132-V346 HydrophobicContact CE1-CG1 4.31Å
133	Q	47.1	Very low	53.2	Low	83 Å²	83	109.7 Å²	109.7	39%	0.388	54%	0.538	S	S	.	.	S	Bend	trans	-67	-24.5	179.5	-92.1	-174.4	-2.5	0	0	112.9	R119 C131	R119-Q133 PolarHBondContact NH1-O 3.46Å; C131-Q133 PolarHBondContact O-N 3.3Å
134	N	49.8	Very low	53.6	Low	106 Å²	106	109.3 Å²	109.3	57%	0.567	53%	0.531	S	S	*	.	S	Bend	trans	-152.7	144.8	174.5	-71.3	-40.1	0	0	0	107	F132 V136	F132-N134 PolarHBondContact O-N 3.17Å; N134-V136 PolarHBondContact O-N 3.16Å
135	F	53.1	Low	54.3	Low	186 Å²	186	105.6 Å²	105.6	82%	0.816	52%	0.517	S	S	*	.			trans	-62	110	164.1	-175.6	-94.9	0	0	0	107
136	V	56.9	Low	55.1	Low	49 Å²	49	112.1 Å²	112.1	30%	0.297	53%	0.533	S	S	.	.			trans	-95	101.7	177.4	178.5	0	0	0	0	106.7	N134 N138 L139 L350	N134-V136 PolarHBondContact O-N 3.16Å; V136-N138 WeakPolarHBondContact CG1-O 3.49Å; V136-N138 PolarHBondContact O-N 3.39Å; V136-L139 HydrophobicContact CG1-CD2 4.4Å; V136-L350 HydrophobicContact CB-CD1 4.47Å; V136-L350 HydrophobicContact CG1-CD2 4.4Å; V136-L350 HydrophobicContact CG2-CD1 3.76Å; V136-L350 HydrophobicContact CG2-CD2 3.96Å
137	S	57.8	Low	56.3	Low	107 Å²	107	108.2 Å²	108.2	75%	0.748	51%	0.511	S	S	*	.	S	Bend	trans	-65.7	-26.1	-177.4	-30.7	0	0	0	0	112.8
138	N	62.8	Low	58	Low	70 Å²	70	102.8 Å²	102.8	37%	0.374	50%	0.499	S	S	.	.			trans	-125.4	110.3	179.3	-167.6	-11.4	0	0	0	111.5	V136 E140	V136-N138 WeakPolarHBondContact CG1-O 3.49Å; V136-N138 PolarHBondContact O-N 3.39Å; N138-E140 PolarHBondContact ND2-OE2 2.89Å; N138-E140 WeakPolarHBondContact OD1-CB 3.46Å; N138-E140 WeakPolarHBondContact OD1-CG 3.21Å; N138-E140 PolarHBondContact OD1-N 3.45Å; N138-E140 PolarHBondContact OD1-OE2 2.86Å
139	L	68.6	Low	59.8	Low	76 Å²	76	98.1 Å²	98.1	40%	0.398	48%	0.482	S	S	.	.			trans	-88.6	-8.2	176.5	-69.6	168.6	0	0	0	113.4	V136 E141 V142 C143 V346	V136-L139 HydrophobicContact CG1-CD2 4.4Å; L139-E141 PolarHBondContact O-N 3.31Å; L139-E141 VanDerWaalsContact O-N 3.11Å; L139-V142 PolarHBondContact O-N 3.33Å; L139-C143 PolarHBondContact O-N 3.07Å; L139-C143 VanDerWaalsContact O-N 3.16Å; L139-C143 PolarHBondContact O-SG 3.43Å; L139-V346 HydrophobicContact CD2-CG1 3.53Å
140	E	66.5	Low	61.5	Low	146 Å²	146	102 Å²	102	68%	0.682	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-33.1	179.7	-67.2	172.8	158.1	0	0	111.9	N138 V142 C143	N138-E140 PolarHBondContact ND2-OE2 2.89Å; N138-E140 WeakPolarHBondContact OD1-CB 3.46Å; N138-E140 WeakPolarHBondContact OD1-CG 3.21Å; N138-E140 PolarHBondContact OD1-N 3.45Å; N138-E140 PolarHBondContact OD1-OE2 2.86Å; E140-V142 VanDerWaalsContact C-N 3.28Å; E140-V142 PolarHBondContact O-N 2.98Å; E140-C143 PolarHBondContact O-N 2.91Å
141	E	62.3	Low	63.3	Low	114 Å²	114	103 Å²	103	53%	0.533	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-12.4	179.9	-55.8	-172.2	162.5	0	0	114.3	L139 R353	L139-E141 PolarHBondContact O-N 3.31Å; L139-E141 VanDerWaalsContact O-N 3.11Å; E141-R353 VanDerWaalsContact CB-NH1 3.25Å; E141-R353 IonicContact OE2-CZ 2.68Å; E141-R353 IonicContact OE2-NH1 2.73Å; E141-R353 PolarHBondContact OE2-NH1 3.09Å; E141-R353 IonicContact OE2-NH2 3.77Å; E141-R353 PolarHBondContact OE2-NH2 3.4Å
142	V	67.2	Low	65.2	Low	17 Å²	17	104 Å²	104	10%	0.103	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-29.9	175.5	-171.6	0	0	0	0	110.5	L139 E140 M144 M349 L350	L139-V142 PolarHBondContact O-N 3.33Å; E140-V142 VanDerWaalsContact C-N 3.28Å; E140-V142 PolarHBondContact O-N 2.98Å; V142-M144 PolarHBondContact O-N 3.29Å; V142-M349 HydrophobicContact CG1-CB 3.44Å; V142-M349 VanDerWaalsContact CG1-CB 3.44Å; V142-M349 HydrophobicContact CG1-CG 4.37Å; V142-L350 HydrophobicContact CG2-CD2 3.47Å; V142-L350 VanDerWaalsContact CG2-CD2 3.47Å; V142-L350 HydrophobicContact CG2-CG 4.11Å
143	C	64.7	Low	67.1	Low	75 Å²	75	105 Å²	105	51%	0.507	52%	0.522	S	S	.	.			trans	-66.5	103.1	174.9	-67	0	0	0	0	110.3	L139 E140 R145	L139-C143 PolarHBondContact O-N 3.07Å; L139-C143 VanDerWaalsContact O-N 3.16Å; L139-C143 PolarHBondContact O-SG 3.43Å; E140-C143 PolarHBondContact O-N 2.91Å; C143-R145 PolarHBondContact O-N 3.49Å
144	M	62.9	Low	68.9	Low	80 Å²	80	107.8 Å²	107.8	39%	0.394	54%	0.539	S	S	.	.	S	Bend	trans	-64	-27.4	178.2	-63.7	-147.4	167.4	0	0	112.6	V142 M349 L365 P372	V142-M144 PolarHBondContact O-N 3.29Å; M144-M349 HydrophobicContact CE-CE 3.8Å; M144-M349 HydrophobicContact CG-CE 4.3Å; M144-L365 HydrophobicContact CE-CB 3.78Å; M144-L365 VanDerWaalsContact SD-C 3.54Å; M144-L365 HydrophobicContact SD-CB 3.95Å; M144-P372 HydrophobicContact CE-CG 4.18Å
145	R	65.3	Low	70.7	Confident	133 Å²	133	105.3 Å²	105.3	50%	0.502	53%	0.525	S	S	.	.	S	Bend	trans	-102.2	126.7	170.3	-64.9	-172.5	-179.7	175.2	2.8	110	C143 I147 D369	C143-R145 PolarHBondContact O-N 3.49Å; R145-I147 HydrophobicContact CB-CD1 3.87Å; R145-I147 HydrophobicContact CB-CG1 3.98Å; R145-I147 HydrophobicContact CG-CD1 4.45Å; R145-I147 PolarHBondContact O-N 3.24Å; R145-D369 IonicContact CZ-OD1 3.85Å; R145-D369 IonicContact NH1-OD1 2.68Å; R145-D369 IonicContact NH2-OD1 3.33Å; R145-D369 PolarHBondContact NH2-OD1 3.29Å
146	K	67.6	Low	72.3	Confident	206 Å²	206	103 Å²	103	90%	0.896	51%	0.511	S	S	*	.			trans	-78.3	51.3	172.7	-64.3	-175.5	179.5	-179.3	0	111.5
147	I	72.5	Confident	73.7	Confident	63 Å²	63	103.1 Å²	103.1	32%	0.323	51%	0.513	S	S	.	.			trans	-86.7	119.1	176.5	-64.7	166.4	0	0	0	107.9	R145 Y149 L155	R145-I147 HydrophobicContact CB-CD1 3.87Å; R145-I147 HydrophobicContact CB-CG1 3.98Å; R145-I147 HydrophobicContact CG-CD1 4.45Å; R145-I147 PolarHBondContact O-N 3.24Å; I147-Y149 HydrophobicContact CB-CE2 4.49Å; I147-Y149 HydrophobicContact CG2-CD1 4.13Å; I147-Y149 HydrophobicContact CG2-CD2 4.27Å; I147-Y149 HydrophobicContact CG2-CE1 4.11Å; I147-Y149 HydrophobicContact CG2-CE2 4.24Å; I147-Y149 HydrophobicContact CG2-CG 4.21Å; I147-Y149 PolarHBondContact O-N 3.27Å; I147-L155 HydrophobicContact CG2-CD1 3.6Å
148	V	79.2	Confident	75.1	Confident	76 Å²	76	104.1 Å²	104.1	46%	0.461	51%	0.505	S	S	.	.			trans	-97.1	90.3	171.6	-173.2	0	0	0	0	107.7	E150 K151 D152	V148-E150 PolarHBondContact O-N 2.83Å; V148-K151 HydrophobicContact CB-CB 4.19Å; V148-K151 HydrophobicContact CB-CD 4.44Å; V148-K151 HydrophobicContact CB-CG 4.43Å; V148-K151 HydrophobicContact CG1-CB 3.97Å; V148-K151 HydrophobicContact CG1-CD 3.88Å; V148-K151 HydrophobicContact CG1-CG 3.72Å; V148-K151 PolarHBondContact O-N 3.35Å; V148-D152 PolarHBondContact O-N 3.23Å; V148-D152 VanDerWaalsContact O-N 3.07Å
149	Y	79.3	Confident	76.4	Confident	136 Å²	136	102.7 Å²	102.7	53%	0.533	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-31.4	-175.5	-69.5	-83.8	0	0	0	114	I147 L155 V159	I147-Y149 HydrophobicContact CB-CE2 4.49Å; I147-Y149 HydrophobicContact CG2-CD1 4.13Å; I147-Y149 HydrophobicContact CG2-CD2 4.27Å; I147-Y149 HydrophobicContact CG2-CE1 4.11Å; I147-Y149 HydrophobicContact CG2-CE2 4.24Å; I147-Y149 HydrophobicContact CG2-CG 4.21Å; I147-Y149 PolarHBondContact O-N 3.27Å; Y149-L155 HydrophobicContact CD1-CB 4.32Å; Y149-L155 HydrophobicContact CD1-CD1 3.77Å; Y149-L155 HydrophobicContact CE1-CD1 3.96Å; Y149-V159 HydrophobicContact CD1-CG2 4.44Å
150	E	77.5	Confident	77.4	Confident	152 Å²	152	100.1 Å²	100.1	71%	0.71	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-24.9	179	-63.3	178.2	176.3	0	0	113.9	V148 R156	V148-E150 PolarHBondContact O-N 2.83Å; E150-R156 WeakPolarHBondContact O-CD 3.35Å
151	K	80.5	Confident	78.4	Confident	169 Å²	169	95 Å²	95	74%	0.735	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-20.1	-177.4	-66.2	-175.7	-177.3	177.8	0	112.9	V148 P153	V148-K151 HydrophobicContact CB-CB 4.19Å; V148-K151 HydrophobicContact CB-CD 4.44Å; V148-K151 HydrophobicContact CB-CG 4.43Å; V148-K151 HydrophobicContact CG1-CB 3.97Å; V148-K151 HydrophobicContact CG1-CD 3.88Å; V148-K151 HydrophobicContact CG1-CG 3.72Å; V148-K151 PolarHBondContact O-N 3.35Å; K151-P153 VanDerWaalsContact O-CD 3.32Å; K151-P153 WeakPolarHBondContact O-CD 3.4Å
152	D	83.9	Confident	79.6	Confident	51 Å²	51	91.9 Å²	91.9	27%	0.273	45%	0.449	S	S	.	.			trans	-71.6	117.3	180	-172.8	-44	0	0	0	110.7	V148 L154 L155 R156	V148-D152 PolarHBondContact O-N 3.23Å; V148-D152 VanDerWaalsContact O-N 3.07Å; D152-L154 PolarHBondContact O-N 3.41Å; D152-L154 WeakPolarHBondContact OD1-CA 3.29Å; D152-L154 WeakPolarHBondContact OD1-CB 3.36Å; D152-L154 PolarHBondContact OD1-N 2.9Å; D152-L155 HydrophobicContact CB-CB 4.03Å; D152-L155 HydrophobicContact CB-CD1 4.22Å; D152-L155 HydrophobicContact CB-CG 4.27Å; D152-L155 PolarHBondContact O-N 2.99Å; D152-L155 PolarHBondContact OD1-N 3.44Å; D152-R156 WeakPolarHBondContact O-CB 3.5Å; D152-R156 PolarHBondContact O-N 3.42Å
153	P	84.3	Confident	80.7	Confident	111 Å²	111	93.5 Å²	93.5	72%	0.721	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.1	-179.1	-23.4	34.5	0	0	0	114.5	K151 P157	K151-P153 VanDerWaalsContact O-CD 3.32Å; K151-P153 WeakPolarHBondContact O-CD 3.4Å; P153-P157 WeakPolarHBondContact O-CD 3.38Å
154	L	85.1	Confident	81.8	Confident	141 Å²	141	90 Å²	90	74%	0.738	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-40.2	179.4	-63.7	172.1	0	0	0	110.9	D152 H158	D152-L154 PolarHBondContact O-N 3.41Å; D152-L154 WeakPolarHBondContact OD1-CA 3.29Å; D152-L154 WeakPolarHBondContact OD1-CB 3.36Å; D152-L154 PolarHBondContact OD1-N 2.9Å; L154-H158 PolarHBondContact O-CD2 3.16Å
155	L	86	Confident	82.9	Confident	53 Å²	53	90.6 Å²	90.6	28%	0.277	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-31.8	-175.6	-59.4	174.4	0	0	0	113.6	I147 Y149 D152 H158 V159	I147-L155 HydrophobicContact CG2-CD1 3.6Å; Y149-L155 HydrophobicContact CD1-CB 4.32Å; Y149-L155 HydrophobicContact CD1-CD1 3.77Å; Y149-L155 HydrophobicContact CE1-CD1 3.96Å; D152-L155 HydrophobicContact CB-CB 4.03Å; D152-L155 HydrophobicContact CB-CD1 4.22Å; D152-L155 HydrophobicContact CB-CG 4.27Å; D152-L155 PolarHBondContact O-N 2.99Å; D152-L155 PolarHBondContact OD1-N 3.44Å; L155-H158 WeakPolarHBondContact O-CA 3.43Å; L155-H158 WeakPolarHBondContact O-CB 3.46Å; L155-H158 PolarHBondContact O-N 3.07Å; L155-V159 WeakPolarHBondContact O-CG2 3.35Å; L155-V159 PolarHBondContact O-N 3.19Å
156	R	86.8	Confident	83.9	Confident	137 Å²	137	85.8 Å²	85.8	52%	0.517	42%	0.417	S	S	.	.	H	α-helix	trans	-53.3	-44.5	-177.5	179.2	-175.9	-175.2	-165.9	-3.3	113.3	E150 D152 H158 V159 N160	E150-R156 WeakPolarHBondContact O-CD 3.35Å; D152-R156 WeakPolarHBondContact O-CB 3.5Å; D152-R156 PolarHBondContact O-N 3.42Å; R156-H158 VanDerWaalsContact C-N 3.31Å; R156-H158 PolarHBondContact O-N 2.94Å; R156-V159 PolarHBondContact O-N 3.06Å; R156-N160 WeakPolarHBondContact O-CB 3.43Å; R156-N160 VanDerWaalsContact O-CG 3.29Å; R156-N160 PolarHBondContact O-N 3.42Å; R156-N160 PolarHBondContact O-ND2 2.89Å
157	P	87.9	Confident	84.8	Confident	52 Å²	52	79.4 Å²	79.4	34%	0.338	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-38.9	175.4	-25	35.8	0	0	0	113.2	P153 L161 V185	P153-P157 WeakPolarHBondContact O-CD 3.38Å; P157-L161 WeakPolarHBondContact O-CB 3.41Å; P157-L161 PolarHBondContact O-N 3.11Å; P157-V185 HydrophobicContact CB-CG2 3.92Å
158	H	86.6	Confident	85.3	Confident	129 Å²	129	76.5 Å²	76.5	60%	0.597	37%	0.373	S	S	*	.	H	α-helix	trans	-69	-39.7	178.8	-63.8	-61.8	0	0	0	112.2	L154 L155 R156 L161 L162	L154-H158 PolarHBondContact O-CD2 3.16Å; L155-H158 WeakPolarHBondContact O-CA 3.43Å; L155-H158 WeakPolarHBondContact O-CB 3.46Å; L155-H158 PolarHBondContact O-N 3.07Å; R156-H158 VanDerWaalsContact C-N 3.31Å; R156-H158 PolarHBondContact O-N 2.94Å; H158-L161 PolarHBondContact O-N 3.05Å; H158-L162 WeakPolarHBondContact O-CB 3.36Å; H158-L162 PolarHBondContact O-N 3.02Å
159	V	89	Confident	85.3	Confident	39 Å²	39	74.7 Å²	74.7	24%	0.236	36%	0.364	C	S	.	.	H	α-helix	trans	-64	-47.6	174.9	177.3	0	0	0	0	110.4	Y149 L155 R156 L161 L162 L163	Y149-V159 HydrophobicContact CD1-CG2 4.44Å; L155-V159 WeakPolarHBondContact O-CG2 3.35Å; L155-V159 PolarHBondContact O-N 3.19Å; R156-V159 PolarHBondContact O-N 3.06Å; V159-L161 VanDerWaalsContact C-N 3.31Å; V159-L161 PolarHBondContact O-N 3.24Å; V159-L162 WeakPolarHBondContact O-CB 3.22Å; V159-L162 PolarHBondContact O-N 3.07Å; V159-L162 VanDerWaalsContact O-N 3.13Å; V159-L163 HydrophobicContact CG1-CD1 4.09Å; V159-L163 HydrophobicContact CG1-CG 4.39Å; V159-L163 WeakPolarHBondContact O-CG 3.37Å; V159-L163 PolarHBondContact O-N 2.86Å
160	N	90.1	Very high	85.4	Confident	23 Å²	23	73.2 Å²	73.2	12%	0.123	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-41.1	177.5	-71.2	-21.6	0	0	0	111.7	R156 L163 A164 S183 V185	R156-N160 WeakPolarHBondContact O-CB 3.43Å; R156-N160 VanDerWaalsContact O-CG 3.29Å; R156-N160 PolarHBondContact O-N 3.42Å; R156-N160 PolarHBondContact O-ND2 2.89Å; N160-L163 PolarHBondContact O-N 3.38Å; N160-A164 VanDerWaalsContact O-CB 3.31Å; N160-A164 WeakPolarHBondContact O-CB 3.3Å; N160-A164 PolarHBondContact O-N 2.7Å; N160-S183 VanDerWaalsContact ND2-CB 3.27Å; N160-S183 WeakPolarHBondContact ND2-CB 3.3Å; N160-V185 HydrophobicContact CB-CG2 4.3Å
161	L	88.4	Confident	85.5	Confident	38 Å²	38	67.2 Å²	67.2	20%	0.199	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-40.8	174.8	-174.8	60	0	0	0	112.2	P157 H158 V159 K165 V185 C187	P157-L161 WeakPolarHBondContact O-CB 3.41Å; P157-L161 PolarHBondContact O-N 3.11Å; H158-L161 PolarHBondContact O-N 3.05Å; V159-L161 VanDerWaalsContact C-N 3.31Å; V159-L161 PolarHBondContact O-N 3.24Å; L161-K165 HydrophobicContact CD1-CG 4.5Å; L161-K165 HydrophobicContact CG-CD 4.35Å; L161-K165 WeakPolarHBondContact O-CB 3.2Å; L161-K165 VanDerWaalsContact O-CG 3.29Å; L161-K165 WeakPolarHBondContact O-CG 3.31Å; L161-K165 PolarHBondContact O-N 3.05Å; L161-V185 HydrophobicContact CB-CG1 4.11Å; L161-V185 HydrophobicContact CD1-CG1 4.27Å; L161-C187 HydrophobicContact CD1-CB 4.16Å
162	L	87.7	Confident	85.7	Confident	49 Å²	49	62.4 Å²	62.4	26%	0.257	32%	0.324	S	S	.	.	H	α-helix	trans	-63	-45.5	177	178.6	64.6	0	0	0	111.1	H158 V159 K165 H166 P334 L335 I338	H158-L162 WeakPolarHBondContact O-CB 3.36Å; H158-L162 PolarHBondContact O-N 3.02Å; V159-L162 WeakPolarHBondContact O-CB 3.22Å; V159-L162 PolarHBondContact O-N 3.07Å; V159-L162 VanDerWaalsContact O-N 3.13Å; L162-K165 PolarHBondContact O-N 3.05Å; L162-H166 WeakPolarHBondContact O-CB 3.46Å; L162-H166 PolarHBondContact O-N 2.92Å; L162-P334 HydrophobicContact CD1-CB 4Å; L162-L335 HydrophobicContact CD1-CB 4.2Å; L162-L335 HydrophobicContact CD2-CD1 3.86Å; L162-L335 HydrophobicContact CG-CB 4.19Å; L162-L335 HydrophobicContact CG-CD1 4.21Å; L162-I338 HydrophobicContact CD2-CD1 3.99Å
163	L	89.9	Confident	85.7	Confident	51 Å²	51	61 Å²	61	27%	0.267	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-47	176.3	-69.9	175.2	0	0	0	111.6	V159 N160 K165 H166 Y167 L179 L335	V159-L163 HydrophobicContact CG1-CD1 4.09Å; V159-L163 HydrophobicContact CG1-CG 4.39Å; V159-L163 WeakPolarHBondContact O-CG 3.37Å; V159-L163 PolarHBondContact O-N 2.86Å; N160-L163 PolarHBondContact O-N 3.38Å; L163-K165 VanDerWaalsContact C-N 3.34Å; L163-K165 PolarHBondContact O-N 3.46Å; L163-H166 WeakPolarHBondContact O-CA 3.49Å; L163-H166 WeakPolarHBondContact O-CB 3.4Å; L163-H166 PolarHBondContact O-N 3.14Å; L163-Y167 HydrophobicContact CB-CE2 4.43Å; L163-Y167 VanDerWaalsContact O-CD2 3.26Å; L163-Y167 WeakPolarHBondContact O-CD2 3.07Å; L163-Y167 PolarHBondContact O-N 3.03Å; L163-L179 HydrophobicContact CB-CD2 3.68Å; L163-L335 HydrophobicContact CD2-CD2 3.81Å
164	A	88	Confident	85.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.6	-44.8	177.3	0	0	0	0	0	111.5	N160 H166 Y167 L168 L179 L180	N160-A164 VanDerWaalsContact O-CB 3.31Å; N160-A164 WeakPolarHBondContact O-CB 3.3Å; N160-A164 PolarHBondContact O-N 2.7Å; A164-H166 VanDerWaalsContact C-N 3.28Å; A164-H166 PolarHBondContact O-N 3.13Å; A164-Y167 PolarHBondContact O-N 2.96Å; A164-L168 WeakPolarHBondContact O-CB 3.49Å; A164-L168 VanDerWaalsContact O-CG 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.49Å; A164-L168 PolarHBondContact O-N 3.12Å; A164-L179 HydrophobicContact CB-CD2 4.26Å; A164-L180 HydrophobicContact CB-CD1 4.16Å; A164-L180 HydrophobicContact CB-CD2 3.67Å; A164-L180 HydrophobicContact CB-CG 3.74Å
165	K	84.3	Confident	86	Confident	94 Å²	94	59.4 Å²	59.4	41%	0.409	30%	0.302	S	S	.	.	H	α-helix	trans	-61.6	-36.5	174.2	-75.9	177.9	178.7	-179.2	0	112.3	L161 L162 L163 S169	L161-K165 HydrophobicContact CD1-CG 4.5Å; L161-K165 HydrophobicContact CG-CD 4.35Å; L161-K165 WeakPolarHBondContact O-CB 3.2Å; L161-K165 VanDerWaalsContact O-CG 3.29Å; L161-K165 WeakPolarHBondContact O-CG 3.31Å; L161-K165 PolarHBondContact O-N 3.05Å; L162-K165 PolarHBondContact O-N 3.05Å; L163-K165 VanDerWaalsContact C-N 3.34Å; L163-K165 PolarHBondContact O-N 3.46Å; K165-S169 WeakPolarHBondContact O-CB 3.47Å; K165-S169 PolarHBondContact O-N 3.47Å; K165-S169 PolarHBondContact O-OG 3.29Å
166	H	86.6	Confident	86.1	Confident	31 Å²	31	56.9 Å²	56.9	14%	0.144	29%	0.289	C	S	.	.	H	α-helix	trans	-65.3	-48.2	175.2	-177	75	0	0	0	111.7	L162 L163 A164 L168 S169 M170 S333 L335 S336	L162-H166 WeakPolarHBondContact O-CB 3.46Å; L162-H166 PolarHBondContact O-N 2.92Å; L163-H166 WeakPolarHBondContact O-CA 3.49Å; L163-H166 WeakPolarHBondContact O-CB 3.4Å; L163-H166 PolarHBondContact O-N 3.14Å; A164-H166 VanDerWaalsContact C-N 3.28Å; A164-H166 PolarHBondContact O-N 3.13Å; H166-L168 VanDerWaalsContact C-N 3.35Å; H166-L168 PolarHBondContact O-N 3.45Å; H166-S169 WeakPolarHBondContact CA-OG 3.42Å; H166-S169 CarbonylContact O-C 3Å; H166-S169 WeakPolarHBondContact O-CA 3.46Å; H166-S169 WeakPolarHBondContact O-CB 3.17Å; H166-S169 PolarHBondContact O-N 3.08Å; H166-S169 PolarHBondContact O-OG 2.57Å; H166-M170 PolarHBondContact NE2-SD 3.21Å; H166-M170 WeakPolarHBondContact O-CG 3.27Å; H166-M170 PolarHBondContact O-N 3.28Å; H166-S333 WeakPolarHBondContact ND1-CB 3.27Å; H166-S333 PolarHBondContact ND1-OG 3.26Å; H166-L335 HydrophobicContact CB-CB 4.11Å; H166-L335 HydrophobicContact CB-CD2 3.7Å; H166-S336 PolarHBondContact CE1-OG 3.12Å
167	Y	87.2	Confident	86.1	Confident	73 Å²	73	52.5 Å²	52.5	29%	0.286	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-41.8	176.4	-69.9	-48.7	0	0	0	112.7	L163 A164 S169 M170 G171 L172 I175 L179	L163-Y167 HydrophobicContact CB-CE2 4.43Å; L163-Y167 VanDerWaalsContact O-CD2 3.26Å; L163-Y167 WeakPolarHBondContact O-CD2 3.07Å; L163-Y167 PolarHBondContact O-N 3.03Å; A164-Y167 PolarHBondContact O-N 2.96Å; Y167-S169 VanDerWaalsContact C-N 3.29Å; Y167-S169 PolarHBondContact O-N 3.38Å; Y167-M170 CarbonylContact O-C 3.56Å; Y167-M170 WeakPolarHBondContact O-CA 3.11Å; Y167-M170 PolarHBondContact O-N 3.14Å; Y167-G171 PolarHBondContact O-N 2.96Å; Y167-G171 VanDerWaalsContact O-N 3.08Å; Y167-L172 HydrophobicContact CD1-CB 4.41Å; Y167-L172 HydrophobicContact CD1-CD1 3.95Å; Y167-L172 HydrophobicContact CE1-CD1 4.5Å; Y167-L172 PolarHBondContact O-N 3.46Å; Y167-I175 HydrophobicContact CD1-CG2 4.37Å; Y167-I175 HydrophobicContact CD2-CG2 3.94Å; Y167-I175 HydrophobicContact CE1-CG2 4.38Å; Y167-I175 HydrophobicContact CE2-CG2 3.94Å; Y167-I175 HydrophobicContact CG-CG2 4.16Å; Y167-L179 HydrophobicContact CD2-CD2 4.24Å; Y167-L179 HydrophobicContact CE2-CD2 4.16Å
168	L	83.6	Confident	86.2	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-58.8	-42.2	171.1	-71.5	173.5	0	0	0	111.5	A164 H166 M170 G171 V173 A176 F195 Y199	A164-L168 WeakPolarHBondContact O-CB 3.49Å; A164-L168 VanDerWaalsContact O-CG 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.49Å; A164-L168 PolarHBondContact O-N 3.12Å; H166-L168 VanDerWaalsContact C-N 3.35Å; H166-L168 PolarHBondContact O-N 3.45Å; L168-M170 PolarHBondContact O-N 3.17Å; L168-G171 PolarHBondContact O-N 3.03Å; L168-G171 VanDerWaalsContact O-N 3.15Å; L168-V173 HydrophobicContact CD2-CG1 4.38Å; L168-V173 HydrophobicContact CD2-CG2 4.39Å; L168-A176 HydrophobicContact CD2-CB 3.83Å; L168-A176 HydrophobicContact CG-CB 3.74Å; L168-F195 HydrophobicContact CB-CB 4.39Å; L168-F195 HydrophobicContact CB-CD2 3.8Å; L168-F195 HydrophobicContact CB-CE2 4.22Å; L168-F195 HydrophobicContact CB-CG 4.03Å; L168-F195 HydrophobicContact CD1-CD2 4.3Å; L168-F195 WeakPolarHBondContact O-CD1 3.22Å; L168-Y199 WeakPolarHBondContact O-CE2 3.27Å
169	S	79.4	Confident	86.3	Confident	38 Å²	38	50.7 Å²	50.7	27%	0.266	26%	0.264	S	S	.	.	H	α-helix	trans	-67.8	-14.7	176.3	75.9	0	0	0	0	114	K165 H166 Y167 Y199	K165-S169 WeakPolarHBondContact O-CB 3.47Å; K165-S169 PolarHBondContact O-N 3.47Å; K165-S169 PolarHBondContact O-OG 3.29Å; H166-S169 WeakPolarHBondContact CA-OG 3.42Å; H166-S169 CarbonylContact O-C 3Å; H166-S169 WeakPolarHBondContact O-CA 3.46Å; H166-S169 WeakPolarHBondContact O-CB 3.17Å; H166-S169 PolarHBondContact O-N 3.08Å; H166-S169 PolarHBondContact O-OG 2.57Å; Y167-S169 VanDerWaalsContact C-N 3.29Å; Y167-S169 PolarHBondContact O-N 3.38Å; S169-Y199 VanDerWaalsContact C-OH 3.23Å; S169-Y199 PolarHBondContact O-OH 3.46Å
170	M	81.3	Confident	86.3	Confident	104 Å²	104	50 Å²	50	51%	0.512	26%	0.259	S	S	.	.	H	α-helix	trans	-99.6	-4.5	173.6	-67.3	-174.6	74.1	0	0	113.8	H166 Y167 L168 L172 Y199	H166-M170 PolarHBondContact NE2-SD 3.21Å; H166-M170 WeakPolarHBondContact O-CG 3.27Å; H166-M170 PolarHBondContact O-N 3.28Å; Y167-M170 CarbonylContact O-C 3.56Å; Y167-M170 WeakPolarHBondContact O-CA 3.11Å; Y167-M170 PolarHBondContact O-N 3.14Å; L168-M170 PolarHBondContact O-N 3.17Å; M170-L172 VanDerWaalsContact C-N 3.32Å; M170-L172 HydrophobicContact CB-CD1 4.27Å; M170-L172 HydrophobicContact CB-CG 4.33Å; M170-Y199 VanDerWaalsContact CA-OH 3.31Å; M170-Y199 WeakPolarHBondContact CA-OH 3.37Å
171	G	78.2	Confident	86.2	Confident	26 Å²	26	55.9 Å²	55.9	27%	0.268	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	5.9	-178.3	0	0	0	0	0	114.2	Y167 L168 V173 Y199	Y167-G171 PolarHBondContact O-N 2.96Å; Y167-G171 VanDerWaalsContact O-N 3.08Å; L168-G171 PolarHBondContact O-N 3.03Å; L168-G171 VanDerWaalsContact O-N 3.15Å; G171-V173 PolarHBondContact O-N 3.46Å; G171-Y199 PolarHBondContact N-OH 2.88Å
172	L	85.1	Confident	86.2	Confident	69 Å²	69	60.8 Å²	60.8	36%	0.361	31%	0.307	S	S	.	.			trans	-84.9	67.5	177.6	-62	171.3	0	0	0	109.8	Y167 M170 I175 A176	Y167-L172 HydrophobicContact CD1-CB 4.41Å; Y167-L172 HydrophobicContact CD1-CD1 3.95Å; Y167-L172 HydrophobicContact CE1-CD1 4.5Å; Y167-L172 PolarHBondContact O-N 3.46Å; M170-L172 VanDerWaalsContact C-N 3.32Å; M170-L172 HydrophobicContact CB-CD1 4.27Å; M170-L172 HydrophobicContact CB-CG 4.33Å; L172-I175 HydrophobicContact CB-CB 4.35Å; L172-I175 HydrophobicContact CB-CD1 4.24Å; L172-I175 HydrophobicContact CD1-CD1 4.29Å; L172-I175 HydrophobicContact CD2-CD1 4.28Å; L172-A176 PolarHBondContact O-N 3.03Å; L172-A176 VanDerWaalsContact O-N 3.12Å
173	V	83.7	Confident	86.1	Confident	22 Å²	22	60 Å²	60	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-44.2	-173.9	-176.9	0	0	0	0	111.5	L168 G171 I175 A176 D177	L168-V173 HydrophobicContact CD2-CG1 4.38Å; L168-V173 HydrophobicContact CD2-CG2 4.39Å; G171-V173 PolarHBondContact O-N 3.46Å; V173-I175 VanDerWaalsContact C-N 3.32Å; V173-I175 PolarHBondContact O-N 2.94Å; V173-A176 WeakPolarHBondContact O-CB 3.49Å; V173-A176 PolarHBondContact O-N 3.32Å; V173-A176 VanDerWaalsContact O-N 3.17Å; V173-D177 PolarHBondContact O-N 2.9Å
174	D	86.9	Confident	85.7	Confident	135 Å²	135	60.7 Å²	60.7	72%	0.722	33%	0.325	S	S	*	.	H	α-helix	trans	-61.5	-41.9	-177.9	-54.4	-29.3	0	0	0	111.6	D177 E178	D174-D177 PolarHBondContact O-N 3.19Å; D174-E178 WeakPolarHBondContact O-CB 3.41Å; D174-E178 PolarHBondContact O-N 2.9Å
175	I	90	Very high	85.4	Confident	83 Å²	83	62 Å²	62	43%	0.426	33%	0.333	S	S	.	.	H	α-helix	trans	-67.7	-40.9	177.6	-58.9	179.7	0	0	0	110.7	Y167 L172 V173 D177 L179	Y167-I175 HydrophobicContact CD1-CG2 4.37Å; Y167-I175 HydrophobicContact CD2-CG2 3.94Å; Y167-I175 HydrophobicContact CE1-CG2 4.38Å; Y167-I175 HydrophobicContact CE2-CG2 3.94Å; Y167-I175 HydrophobicContact CG-CG2 4.16Å; L172-I175 HydrophobicContact CB-CB 4.35Å; L172-I175 HydrophobicContact CB-CD1 4.24Å; L172-I175 HydrophobicContact CD1-CD1 4.29Å; L172-I175 HydrophobicContact CD2-CD1 4.28Å; V173-I175 VanDerWaalsContact C-N 3.32Å; V173-I175 PolarHBondContact O-N 2.94Å; I175-D177 VanDerWaalsContact C-N 3.31Å; I175-L179 WeakPolarHBondContact O-CB 3.39Å; I175-L179 PolarHBondContact O-N 2.84Å
176	A	87.3	Confident	84.9	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.1	-40.7	176.2	0	0	0	0	0	111.5	L168 L172 V173 L179 L180	L168-A176 HydrophobicContact CD2-CB 3.83Å; L168-A176 HydrophobicContact CG-CB 3.74Å; L172-A176 PolarHBondContact O-N 3.03Å; L172-A176 VanDerWaalsContact O-N 3.12Å; V173-A176 WeakPolarHBondContact O-CB 3.49Å; V173-A176 PolarHBondContact O-N 3.32Å; V173-A176 VanDerWaalsContact O-N 3.17Å; A176-L179 PolarHBondContact O-N 3.46Å; A176-L180 WeakPolarHBondContact O-CB 3.37Å; A176-L180 WeakPolarHBondContact O-CG 2.96Å; A176-L180 PolarHBondContact O-N 3.21Å
177	D	86.5	Confident	84.3	Confident	45 Å²	45	65.8 Å²	65.8	24%	0.241	36%	0.355	C	S	.	.	H	α-helix	trans	-65.7	-48.4	178.5	-80.7	-23.3	0	0	0	112.2	V173 D174 I175 L179 L180 Q181 K192	V173-D177 PolarHBondContact O-N 2.9Å; D174-D177 PolarHBondContact O-N 3.19Å; I175-D177 VanDerWaalsContact C-N 3.31Å; D177-L179 VanDerWaalsContact C-N 3.29Å; D177-L179 PolarHBondContact O-N 3.19Å; D177-L180 PolarHBondContact O-N 2.91Å; D177-Q181 WeakPolarHBondContact O-CB 3.28Å; D177-Q181 PolarHBondContact O-N 3.32Å; D177-K192 WeakPolarHBondContact OD1-CE 3.39Å; D177-K192 IonicContact OD1-NZ 3.54Å; D177-K192 PolarHBondContact OD1-NZ 3.41Å; D177-K192 WeakPolarHBondContact OD2-CE 3.46Å; D177-K192 IonicContact OD2-NZ 3.54Å; D177-K192 PolarHBondContact OD2-NZ 3.07Å
178	E	89.8	Confident	83.5	Confident	99 Å²	99	66.1 Å²	66.1	46%	0.463	36%	0.362	S	S	.	.	H	α-helix	trans	-57.2	-47.2	176.4	-166.4	65.1	-162.6	0	0	109.7	D174 L180 Q181 H182	D174-E178 WeakPolarHBondContact O-CB 3.41Å; D174-E178 PolarHBondContact O-N 2.9Å; E178-L180 PolarHBondContact O-N 3.45Å; E178-Q181 PolarHBondContact O-N 3.32Å; E178-H182 PolarHBondContact O-CD2 3.34Å; E178-H182 PolarHBondContact O-N 3.34Å; E178-H182 IonicContact OE1-CD2 2.66Å; E178-H182 PolarHBondContact OE1-CD2 2.89Å; E178-H182 IonicContact OE1-CE1 3.35Å; E178-H182 IonicContact OE1-NE2 3.22Å; E178-H182 PolarHBondContact OE1-NE2 3.02Å
179	L	89.8	Confident	82.3	Confident	43 Å²	43	71.1 Å²	71.1	23%	0.225	39%	0.392	C	S	.	.	H	α-helix	trans	-60.7	-42.5	177.4	-178.6	64.4	0	0	0	112.8	L163 A164 Y167 I175 A176 D177 S183	L163-L179 HydrophobicContact CB-CD2 3.68Å; A164-L179 HydrophobicContact CB-CD2 4.26Å; Y167-L179 HydrophobicContact CD2-CD2 4.24Å; Y167-L179 HydrophobicContact CE2-CD2 4.16Å; I175-L179 WeakPolarHBondContact O-CB 3.39Å; I175-L179 PolarHBondContact O-N 2.84Å; A176-L179 PolarHBondContact O-N 3.46Å; D177-L179 VanDerWaalsContact C-N 3.29Å; D177-L179 PolarHBondContact O-N 3.19Å; L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 3.32Å; L179-S183 PolarHBondContact O-OG 3.21Å
180	L	87.9	Confident	81.7	Confident	24 Å²	24	73.6 Å²	73.6	13%	0.126	40%	0.402	C	S	.	.	H	α-helix	trans	-67	-39.6	178.3	-72.4	170.3	0	0	0	111.6	A164 A176 D177 E178 S183 G184 V185 C187	A164-L180 HydrophobicContact CB-CD1 4.16Å; A164-L180 HydrophobicContact CB-CD2 3.67Å; A164-L180 HydrophobicContact CB-CG 3.74Å; A176-L180 WeakPolarHBondContact O-CB 3.37Å; A176-L180 WeakPolarHBondContact O-CG 2.96Å; A176-L180 PolarHBondContact O-N 3.21Å; D177-L180 PolarHBondContact O-N 2.91Å; E178-L180 PolarHBondContact O-N 3.45Å; L180-S183 WeakPolarHBondContact CA-OG 3.46Å; L180-S183 PolarHBondContact O-N 3.4Å; L180-S183 PolarHBondContact O-OG 3.35Å; L180-G184 PolarHBondContact O-N 2.88Å; L180-V185 HydrophobicContact CD2-CB 4.35Å; L180-C187 HydrophobicContact CD1-CB 3.72Å; L180-C187 HydrophobicContact CD2-CB 4Å
181	Q	88.3	Confident	81	Confident	148 Å²	148	70.2 Å²	70.2	69%	0.692	39%	0.386	S	S	*	.	H	α-helix	trans	-64.1	-47.4	177.3	-174.8	174.7	4.2	0	0	111.7	D177 E178 S183	D177-Q181 WeakPolarHBondContact O-CB 3.28Å; D177-Q181 PolarHBondContact O-N 3.32Å; E178-Q181 PolarHBondContact O-N 3.32Å; Q181-S183 VanDerWaalsContact C-N 3.34Å
182	H	88.5	Confident	80.6	Confident	140 Å²	140	72.6 Å²	72.6	65%	0.648	39%	0.389	S	S	*	.	H	α-helix	trans	-70.7	-29.2	178.6	-77.2	-75.1	0	0	0	113.4	E178	E178-H182 PolarHBondContact O-CD2 3.34Å; E178-H182 PolarHBondContact O-N 3.34Å; E178-H182 IonicContact OE1-CD2 2.66Å; E178-H182 PolarHBondContact OE1-CD2 2.89Å; E178-H182 IonicContact OE1-CE1 3.35Å; E178-H182 IonicContact OE1-NE2 3.22Å; E178-H182 PolarHBondContact OE1-NE2 3.02Å
183	S	85.9	Confident	80.1	Confident	32 Å²	32	72.9 Å²	72.9	22%	0.224	39%	0.394	C	S	.	.	H	α-helix	trans	-85.3	-17.2	-179.6	63.2	0	0	0	0	114.1	N160 L179 L180 Q181 V185	N160-S183 VanDerWaalsContact ND2-CB 3.27Å; N160-S183 WeakPolarHBondContact ND2-CB 3.3Å; L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 3.32Å; L179-S183 PolarHBondContact O-OG 3.21Å; L180-S183 WeakPolarHBondContact CA-OG 3.46Å; L180-S183 PolarHBondContact O-N 3.4Å; L180-S183 PolarHBondContact O-OG 3.35Å; Q181-S183 VanDerWaalsContact C-N 3.34Å; S183-V185 PolarHBondContact O-N 3.09Å
184	G	81.5	Confident	79.8	Confident	66 Å²	66	75.5 Å²	75.5	68%	0.68	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	12.1	-174.5	0	0	0	0	0	114	L180	L180-G184 PolarHBondContact O-N 2.88Å
185	V	82	Confident	79.4	Confident	27 Å²	27	69.9 Å²	69.9	16%	0.164	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-84.1	128	-177.6	-179.9	0	0	0	0	109.7	P157 N160 L161 L180 S183 C187	P157-V185 HydrophobicContact CB-CG2 3.92Å; N160-V185 HydrophobicContact CB-CG2 4.3Å; L161-V185 HydrophobicContact CB-CG1 4.11Å; L161-V185 HydrophobicContact CD1-CG1 4.27Å; L180-V185 HydrophobicContact CD2-CB 4.35Å; S183-V185 PolarHBondContact O-N 3.09Å; V185-C187 PolarHBondContact O-N 3.19Å
186	Q	74.4	Confident	78.9	Confident	185 Å²	185	67.7 Å²	67.7	86%	0.864	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-79.4	117.9	173.3	-63.9	-165.6	-1.5	0	0	110.4
187	C	73	Confident	78.6	Confident	21 Å²	21	71.2 Å²	71.2	14%	0.142	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-92.4	146	163.9	-163.3	0	0	0	0	109	L161 L180 V185 V189	L161-C187 HydrophobicContact CD1-CB 4.16Å; L180-C187 HydrophobicContact CD1-CB 3.72Å; L180-C187 HydrophobicContact CD2-CB 4Å; V185-C187 PolarHBondContact O-N 3.19Å; C187-V189 PolarHBondContact O-N 3.26Å
188	D	70.2	Confident	78.4	Confident	80 Å²	80	69.3 Å²	69.3	43%	0.428	37%	0.37	S	S	.	.			trans	-56.9	111.1	171.8	177.4	6.8	0	0	0	109.1	N190 N191	D188-N190 PolarHBondContact O-N 3.37Å; D188-N190 WeakPolarHBondContact OD1-CB 3.49Å; D188-N190 PolarHBondContact OD1-N 3.45Å; D188-N190 VanDerWaalsContact OD1-N 3.1Å; D188-N190 PolarHBondContact OD1-ND2 3.15Å; D188-N190 VanDerWaalsContact OD1-ND2 3.13Å; D188-N191 WeakPolarHBondContact O-CB 3.38Å; D188-N191 PolarHBondContact O-N 2.91Å
189	V	58.8	Low	78	Confident	106 Å²	106	66.8 Å²	66.8	64%	0.642	36%	0.356	S	S	*	.	H	α-helix	trans	-53	-30.3	-177.2	-179.9	0	0	0	0	111.2	C187 N191 K192 T193	C187-V189 PolarHBondContact O-N 3.26Å; V189-N191 VanDerWaalsContact C-N 3.29Å; V189-N191 PolarHBondContact O-N 3.37Å; V189-K192 PolarHBondContact O-N 3.47Å; V189-T193 PolarHBondContact O-N 2.96Å
190	N	65.9	Low	77.7	Confident	91 Å²	91	71.1 Å²	71.1	49%	0.487	37%	0.373	S	S	.	.	H	α-helix	trans	-63.1	-35.3	177.3	-67.2	-49.8	0	0	0	112.6	D188 R194	D188-N190 PolarHBondContact O-N 3.37Å; D188-N190 WeakPolarHBondContact OD1-CB 3.49Å; D188-N190 PolarHBondContact OD1-N 3.45Å; D188-N190 VanDerWaalsContact OD1-N 3.1Å; D188-N190 PolarHBondContact OD1-ND2 3.15Å; D188-N190 VanDerWaalsContact OD1-ND2 3.13Å; N190-R194 VanDerWaalsContact O-CB 3.3Å; N190-R194 WeakPolarHBondContact O-CB 3.3Å; N190-R194 VanDerWaalsContact O-CD 3.25Å; N190-R194 WeakPolarHBondContact O-CD 3.36Å; N190-R194 WeakPolarHBondContact O-CG 3.5Å; N190-R194 PolarHBondContact O-N 2.93Å; N190-R194 VanDerWaalsContact O-N 3.11Å
191	N	68.4	Low	77.5	Confident	33 Å²	33	70.5 Å²	70.5	18%	0.176	37%	0.37	C	S	.	.	H	α-helix	trans	-68.4	-37.7	179.9	-70	-27.4	0	0	0	111.3	D188 V189 R194 F195	D188-N191 WeakPolarHBondContact O-CB 3.38Å; D188-N191 PolarHBondContact O-N 2.91Å; V189-N191 VanDerWaalsContact C-N 3.29Å; V189-N191 PolarHBondContact O-N 3.37Å; N191-R194 WeakPolarHBondContact O-CB 3.46Å; N191-R194 PolarHBondContact O-N 2.94Å; N191-R194 PolarHBondContact OD1-NH1 3.28Å; N191-F195 HydrophobicContact CB-CD2 4.47Å; N191-F195 HydrophobicContact CB-CE2 4.46Å; N191-F195 WeakPolarHBondContact O-CD2 3.35Å; N191-F195 PolarHBondContact O-N 3.39Å
192	K	69.8	Low	77.4	Confident	75 Å²	75	63.8 Å²	63.8	33%	0.326	34%	0.339	S	S	.	.	H	α-helix	trans	-58.4	-58.1	176.8	179.3	178.3	175.6	168.5	0	111.3	D177 V189 R194 F195 T196	D177-K192 WeakPolarHBondContact OD1-CE 3.39Å; D177-K192 IonicContact OD1-NZ 3.54Å; D177-K192 PolarHBondContact OD1-NZ 3.41Å; D177-K192 WeakPolarHBondContact OD2-CE 3.46Å; D177-K192 IonicContact OD2-NZ 3.54Å; D177-K192 PolarHBondContact OD2-NZ 3.07Å; V189-K192 PolarHBondContact O-N 3.47Å; K192-R194 PolarHBondContact O-N 3.49Å; K192-F195 PolarHBondContact O-N 3.43Å; K192-F195 VanDerWaalsContact O-N 3.13Å; K192-T196 PolarHBondContact O-N 3.37Å; K192-T196 PolarHBondContact O-OG1 2.99Å; K192-T196 VanDerWaalsContact O-OG1 3.09Å
193	T	73.5	Confident	77.3	Confident	76 Å²	76	60.5 Å²	60.5	47%	0.466	33%	0.326	S	S	.	.	H	α-helix	trans	-58.1	-38.1	-179.8	-53.3	0	0	0	0	111.6	V189 N197	V189-T193 PolarHBondContact O-N 2.96Å; T193-N197 WeakPolarHBondContact O-CB 3.38Å; T193-N197 PolarHBondContact O-N 3.45Å; T193-N197 PolarHBondContact O-ND2 3.01Å
194	R	77.6	Confident	77.3	Confident	77 Å²	77	59.6 Å²	59.6	29%	0.291	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-52	175.3	-75.2	169.9	-169.2	167.4	1.8	111.8	N190 N191 K192 N197 M198 W323 Y327	N190-R194 VanDerWaalsContact O-CB 3.3Å; N190-R194 WeakPolarHBondContact O-CB 3.3Å; N190-R194 VanDerWaalsContact O-CD 3.25Å; N190-R194 WeakPolarHBondContact O-CD 3.36Å; N190-R194 WeakPolarHBondContact O-CG 3.5Å; N190-R194 PolarHBondContact O-N 2.93Å; N190-R194 VanDerWaalsContact O-N 3.11Å; N191-R194 WeakPolarHBondContact O-CB 3.46Å; N191-R194 PolarHBondContact O-N 2.94Å; N191-R194 PolarHBondContact OD1-NH1 3.28Å; K192-R194 PolarHBondContact O-N 3.49Å; R194-N197 PolarHBondContact O-N 3.47Å; R194-M198 WeakPolarHBondContact O-CB 3.43Å; R194-M198 PolarHBondContact O-N 2.94Å; R194-W323 HydrophobicContact CB-CH2 4.43Å; R194-W323 HydrophobicContact CB-CZ2 3.8Å; R194-W323 WeakPolarHBondContact O-CZ2 3.32Å; R194-Y327 HydrophobicContact CG-CD1 4.31Å; R194-Y327 HydrophobicContact CG-CE1 4.07Å
195	F	79.5	Confident	77.5	Confident	17 Å²	17	56.5 Å²	56.5	8%	0.075	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-43.9	179.7	-81.3	-69.4	0	0	0	111.7	L168 N191 K192 N197 M198 Y199 W323 I329	L168-F195 HydrophobicContact CB-CB 4.39Å; L168-F195 HydrophobicContact CB-CD2 3.8Å; L168-F195 HydrophobicContact CB-CE2 4.22Å; L168-F195 HydrophobicContact CB-CG 4.03Å; L168-F195 HydrophobicContact CD1-CD2 4.3Å; L168-F195 WeakPolarHBondContact O-CD1 3.22Å; N191-F195 HydrophobicContact CB-CD2 4.47Å; N191-F195 HydrophobicContact CB-CE2 4.46Å; N191-F195 WeakPolarHBondContact O-CD2 3.35Å; N191-F195 PolarHBondContact O-N 3.39Å; K192-F195 PolarHBondContact O-N 3.43Å; K192-F195 VanDerWaalsContact O-N 3.13Å; F195-N197 VanDerWaalsContact C-N 3.31Å; F195-N197 PolarHBondContact O-N 3.42Å; F195-M198 HydrophobicContact CD1-CE 4.3Å; F195-M198 WeakPolarHBondContact O-CB 3.31Å; F195-M198 PolarHBondContact O-N 3.31Å; F195-Y199 HydrophobicContact CD1-CE2 4.42Å; F195-Y199 WeakPolarHBondContact O-CD2 3.46Å; F195-Y199 PolarHBondContact O-N 3.48Å; F195-W323 AromaticContact CD1-CH2 3.68Å; F195-W323 HydrophobicContact CD1-CH2 3.68Å; F195-W323 HydrophobicContact CD1-CZ3 4.19Å; F195-W323 AromaticContact CE1-CH2 3.65Å; F195-W323 HydrophobicContact CE1-CH2 3.65Å; F195-W323 AromaticContact CE1-CZ3 3.79Å; F195-W323 HydrophobicContact CE1-CZ3 3.79Å; F195-W323 HydrophobicContact CE2-CH2 4.47Å; F195-W323 HydrophobicContact CG-CH2 4.12Å; F195-W323 HydrophobicContact CZ-CH2 4.06Å; F195-W323 HydrophobicContact CZ-CZ3 4.28Å; F195-I329 HydrophobicContact CE2-CD1 4.3Å; F195-I329 HydrophobicContact CZ-CD1 4.03Å; F195-I329 HydrophobicContact CZ-CG2 4.11Å
196	T	78.7	Confident	77.8	Confident	37 Å²	37	61 Å²	61	23%	0.227	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-44.1	176.4	-54.6	0	0	0	0	111.4	K192 Y199 K200	K192-T196 PolarHBondContact O-N 3.37Å; K192-T196 PolarHBondContact O-OG1 2.99Å; K192-T196 VanDerWaalsContact O-OG1 3.09Å; T196-Y199 PolarHBondContact O-N 2.87Å; T196-K200 HydrophobicContact CG2-CD 4.49Å; T196-K200 VanDerWaalsContact O-CG 3.3Å; T196-K200 WeakPolarHBondContact O-CG 3.19Å; T196-K200 PolarHBondContact O-N 3.43Å
197	N	80.6	Confident	78.5	Confident	73 Å²	73	58.5 Å²	58.5	39%	0.39	30%	0.299	S	S	.	.	H	α-helix	trans	-67.2	-39.7	177.2	-71.9	-11.3	0	0	0	112.2	T193 R194 F195 K200 I201	T193-N197 WeakPolarHBondContact O-CB 3.38Å; T193-N197 PolarHBondContact O-N 3.45Å; T193-N197 PolarHBondContact O-ND2 3.01Å; R194-N197 PolarHBondContact O-N 3.47Å; F195-N197 VanDerWaalsContact C-N 3.31Å; F195-N197 PolarHBondContact O-N 3.42Å; N197-K200 PolarHBondContact O-N 3.48Å; N197-I201 WeakPolarHBondContact O-CD1 3.4Å; N197-I201 WeakPolarHBondContact O-CG1 3.44Å; N197-I201 PolarHBondContact O-N 3.25Å
198	M	81.9	Confident	79.1	Confident	6 Å²	6	62.2 Å²	62.2	3%	0.03	31%	0.312	C	S	.	.	H	α-helix	trans	-58.7	-49.1	174.9	-171.4	-159.2	73.8	0	0	111.2	R194 F195 I201 V202 F319 W323	R194-M198 WeakPolarHBondContact O-CB 3.43Å; R194-M198 PolarHBondContact O-N 2.94Å; F195-M198 HydrophobicContact CD1-CE 4.3Å; F195-M198 WeakPolarHBondContact O-CB 3.31Å; F195-M198 PolarHBondContact O-N 3.31Å; M198-I201 PolarHBondContact O-N 2.95Å; M198-V202 WeakPolarHBondContact O-CG2 3.36Å; M198-V202 PolarHBondContact O-N 3.07Å; M198-F319 HydrophobicContact CG-CE1 3.83Å; M198-F319 HydrophobicContact CG-CZ 4.47Å; M198-W323 HydrophobicContact CB-CD2 4.17Å; M198-W323 HydrophobicContact CB-CH2 4.44Å; M198-W323 HydrophobicContact CB-CZ2 3.75Å; M198-W323 HydrophobicContact CG-CD2 3.72Å; M198-W323 HydrophobicContact CG-CE3 4.23Å; M198-W323 HydrophobicContact CG-CG 3.89Å; M198-W323 HydrophobicContact CG-CZ2 4.18Å; M198-W323 HydrophobicContact SD-CD2 3.59Å; M198-W323 VanDerWaalsContact SD-CD2 3.59Å; M198-W323 HydrophobicContact SD-CE3 3.44Å; M198-W323 HydrophobicContact SD-CG 4.19Å; M198-W323 HydrophobicContact SD-CH2 3.98Å; M198-W323 HydrophobicContact SD-CZ2 4.11Å; M198-W323 HydrophobicContact SD-CZ3 3.64Å
199	Y	83	Confident	79.7	Confident	45 Å²	45	61.6 Å²	61.6	18%	0.176	31%	0.309	C	S	.	.	H	α-helix	trans	-66.7	-37.9	-178.7	-87.6	-73.3	0	0	0	112.7	L168 S169 M170 G171 F195 T196 I201 V202 D203	L168-Y199 WeakPolarHBondContact O-CE2 3.27Å; S169-Y199 VanDerWaalsContact C-OH 3.23Å; S169-Y199 PolarHBondContact O-OH 3.46Å; M170-Y199 VanDerWaalsContact CA-OH 3.31Å; M170-Y199 WeakPolarHBondContact CA-OH 3.37Å; G171-Y199 PolarHBondContact N-OH 2.88Å; F195-Y199 HydrophobicContact CD1-CE2 4.42Å; F195-Y199 WeakPolarHBondContact O-CD2 3.46Å; F195-Y199 PolarHBondContact O-N 3.48Å; T196-Y199 PolarHBondContact O-N 2.87Å; Y199-I201 VanDerWaalsContact C-N 3.25Å; Y199-I201 PolarHBondContact O-N 3.19Å; Y199-V202 PolarHBondContact O-N 3.09Å; Y199-D203 WeakPolarHBondContact O-CB 3.43Å; Y199-D203 VanDerWaalsContact O-CG 3.3Å; Y199-D203 PolarHBondContact O-N 3.09Å
200	K	83.5	Confident	80.7	Confident	134 Å²	134	56.9 Å²	56.9	58%	0.583	28%	0.28	S	S	*	.	H	α-helix	trans	-54.8	-41.5	170.7	-76	174.2	178.3	179.4	0	112.6	T196 N197 A204	T196-K200 HydrophobicContact CG2-CD 4.49Å; T196-K200 VanDerWaalsContact O-CG 3.3Å; T196-K200 WeakPolarHBondContact O-CG 3.19Å; T196-K200 PolarHBondContact O-N 3.43Å; N197-K200 PolarHBondContact O-N 3.48Å; K200-A204 WeakPolarHBondContact O-CB 3.5Å; K200-A204 PolarHBondContact O-N 3.36Å
201	I	82.8	Confident	81.3	Confident	12 Å²	12	56.1 Å²	56.1	6%	0.062	28%	0.279	C	S	.	.	H	α-helix	trans	-72.5	-42.2	178.6	-63.5	157.7	0	0	0	111	N197 M198 Y199 D203 A204 L205 P212 A213 Y216 F319	N197-I201 WeakPolarHBondContact O-CD1 3.4Å; N197-I201 WeakPolarHBondContact O-CG1 3.44Å; N197-I201 PolarHBondContact O-N 3.25Å; M198-I201 PolarHBondContact O-N 2.95Å; Y199-I201 VanDerWaalsContact C-N 3.25Å; Y199-I201 PolarHBondContact O-N 3.19Å; I201-D203 VanDerWaalsContact C-N 3.35Å; I201-D203 PolarHBondContact O-N 3.21Å; I201-A204 PolarHBondContact O-N 2.93Å; I201-L205 HydrophobicContact CG2-CD1 4.33Å; I201-L205 WeakPolarHBondContact O-CG 3.33Å; I201-L205 PolarHBondContact O-N 3.39Å; I201-P212 HydrophobicContact CG1-CB 4.27Å; I201-A213 HydrophobicContact CG2-CB 3.74Å; I201-Y216 VanDerWaalsContact CD1-CB 3.45Å; I201-Y216 HydrophobicContact CD1-CD1 4.38Å; I201-Y216 HydrophobicContact CD1-CD2 3.35Å; I201-Y216 HydrophobicContact CD1-CE2 4.18Å; I201-Y216 HydrophobicContact CD1-CG 3.46Å; I201-Y216 VanDerWaalsContact CD1-CG 3.46Å; I201-F319 HydrophobicContact CB-CE1 3.99Å; I201-F319 HydrophobicContact CB-CE2 4.5Å; I201-F319 HydrophobicContact CB-CZ 3.76Å; I201-F319 HydrophobicContact CD1-CE2 4.24Å; I201-F319 HydrophobicContact CD1-CZ 3.65Å; I201-F319 HydrophobicContact CG1-CZ 4.33Å; I201-F319 HydrophobicContact CG2-CD1 4.34Å; I201-F319 HydrophobicContact CG2-CD2 4.34Å; I201-F319 HydrophobicContact CG2-CE1 3.79Å; I201-F319 HydrophobicContact CG2-CE2 3.78Å; I201-F319 HydrophobicContact CG2-CZ 3.5Å; I201-F319 VanDerWaalsContact CG2-CZ 3.5Å
202	V	86.6	Confident	81.8	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-43	176.7	170	0	0	0	0	111.2	M198 Y199 L205 K206 I316 F319	M198-V202 WeakPolarHBondContact O-CG2 3.36Å; M198-V202 PolarHBondContact O-N 3.07Å; Y199-V202 PolarHBondContact O-N 3.09Å; V202-L205 PolarHBondContact O-N 3.21Å; V202-K206 HydrophobicContact CG1-CD 4.44Å; V202-K206 WeakPolarHBondContact O-CG 3.44Å; V202-K206 PolarHBondContact O-N 3.34Å; V202-I316 HydrophobicContact CG1-CG2 4.01Å; V202-F319 HydrophobicContact CG2-CD1 3.86Å; V202-F319 HydrophobicContact CG2-CE1 3.93Å
203	D	86	Confident	82.1	Confident	70 Å²	70	52.6 Å²	52.6	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-70.9	-35	179.3	-67.7	-25.1	0	0	0	111.8	Y199 I201 K206 N207	Y199-D203 WeakPolarHBondContact O-CB 3.43Å; Y199-D203 VanDerWaalsContact O-CG 3.3Å; Y199-D203 PolarHBondContact O-N 3.09Å; I201-D203 VanDerWaalsContact C-N 3.35Å; I201-D203 PolarHBondContact O-N 3.21Å; D203-K206 PolarHBondContact O-N 3.23Å; D203-K206 IonicContact OD1-NZ 2.7Å; D203-K206 PolarHBondContact OD1-NZ 3.35Å; D203-N207 WeakPolarHBondContact O-CB 3.46Å; D203-N207 PolarHBondContact O-N 3.02Å; D203-N207 PolarHBondContact O-ND2 3.08Å
204	A	85.8	Confident	82.1	Confident	13 Å²	13	50.1 Å²	50.1	11%	0.107	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-45.8	169.1	0	0	0	0	0	111.7	K200 I201 K206 N207 K208 D209 P212	K200-A204 WeakPolarHBondContact O-CB 3.5Å; K200-A204 PolarHBondContact O-N 3.36Å; I201-A204 PolarHBondContact O-N 2.93Å; A204-K206 VanDerWaalsContact C-N 3.35Å; A204-K206 PolarHBondContact O-N 3.28Å; A204-N207 CarbonylContact O-C 3.52Å; A204-N207 WeakPolarHBondContact O-CA 3.46Å; A204-N207 PolarHBondContact O-N 2.96Å; A204-N207 VanDerWaalsContact O-N 3.1Å; A204-K208 PolarHBondContact O-N 3.15Å; A204-D209 CarbonylContact C-O 3.5Å; A204-D209 VanDerWaalsContact C-O 3.26Å; A204-D209 HydrophobicContact CB-CB 4.33Å; A204-D209 WeakPolarHBondContact O-CA 3.42Å; A204-D209 PolarHBondContact O-N 3.26Å; A204-P212 HydrophobicContact CB-CB 4.09Å; A204-P212 HydrophobicContact CB-CG 3.6Å
205	L	86.1	Confident	81.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-40.2	176.1	-72.5	172.9	0	0	0	112.1	I201 V202 N207 K208 D209 A213 L247 W312 I316	I201-L205 HydrophobicContact CG2-CD1 4.33Å; I201-L205 WeakPolarHBondContact O-CG 3.33Å; I201-L205 PolarHBondContact O-N 3.39Å; V202-L205 PolarHBondContact O-N 3.21Å; L205-N207 VanDerWaalsContact C-N 3.28Å; L205-N207 PolarHBondContact O-N 3.02Å; L205-K208 PolarHBondContact O-N 3.09Å; L205-D209 PolarHBondContact N-O 3.22Å; L205-A213 HydrophobicContact CD1-CB 4.18Å; L205-A213 HydrophobicContact CD2-CB 3.86Å; L205-A213 HydrophobicContact CG-CB 4.14Å; L205-L247 HydrophobicContact CD2-CD2 4.06Å; L205-W312 HydrophobicContact CD2-CE3 4.41Å; L205-W312 HydrophobicContact CD2-CZ3 4.18Å; L205-W312 WeakPolarHBondContact O-CZ3 3.29Å; L205-I316 HydrophobicContact CB-CD1 4.15Å; L205-I316 HydrophobicContact CB-CG1 3.73Å; L205-I316 HydrophobicContact CD1-CG1 4.01Å
206	K	87.9	Confident	81.3	Confident	121 Å²	121	52.5 Å²	52.5	53%	0.526	26%	0.263	S	S	.	.	H	α-helix	trans	-62.4	-36	173.5	-72.2	174	-174.4	163.5	0	112.2	V202 D203 A204 K208 I316	V202-K206 HydrophobicContact CG1-CD 4.44Å; V202-K206 WeakPolarHBondContact O-CG 3.44Å; V202-K206 PolarHBondContact O-N 3.34Å; D203-K206 PolarHBondContact O-N 3.23Å; D203-K206 IonicContact OD1-NZ 2.7Å; D203-K206 PolarHBondContact OD1-NZ 3.35Å; A204-K206 VanDerWaalsContact C-N 3.35Å; A204-K206 PolarHBondContact O-N 3.28Å; K206-K208 PolarHBondContact O-N 2.8Å; K206-I316 HydrophobicContact CG-CD1 3.82Å
207	N	88.3	Confident	80.5	Confident	134 Å²	134	51.3 Å²	51.3	72%	0.717	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	13.4	174.8	-68	-30.3	0	0	0	113.6	D203 A204 L205 D209	D203-N207 WeakPolarHBondContact O-CB 3.46Å; D203-N207 PolarHBondContact O-N 3.02Å; D203-N207 PolarHBondContact O-ND2 3.08Å; A204-N207 CarbonylContact O-C 3.52Å; A204-N207 WeakPolarHBondContact O-CA 3.46Å; A204-N207 PolarHBondContact O-N 2.96Å; A204-N207 VanDerWaalsContact O-N 3.1Å; L205-N207 VanDerWaalsContact C-N 3.28Å; L205-N207 PolarHBondContact O-N 3.02Å; N207-D209 PolarHBondContact O-N 3.41Å
208	K	85.5	Confident	79.6	Confident	99 Å²	99	50.1 Å²	50.1	43%	0.43	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	23.8	-179.9	-55.8	-173	176.8	-174.4	0	114.6	A204 L205 K206 Q254 D309 W312	A204-K208 PolarHBondContact O-N 3.15Å; L205-K208 PolarHBondContact O-N 3.09Å; K206-K208 PolarHBondContact O-N 2.8Å; K208-Q254 PolarHBondContact O-NE2 2.86Å; K208-D309 WeakPolarHBondContact CE-OD1 3.48Å; K208-D309 IonicContact NZ-OD1 3.91Å; K208-D309 PolarHBondContact NZ-OD1 2.93Å; K208-W312 VanDerWaalsContact CA-CZ3 3.5Å; K208-W312 HydrophobicContact CB-CH2 3.76Å; K208-W312 HydrophobicContact CB-CZ2 3.64Å; K208-W312 HydrophobicContact CB-CZ3 4.33Å; K208-W312 HydrophobicContact CD-CZ2 4.42Å; K208-W312 HydrophobicContact CG-CD2 4.29Å; K208-W312 HydrophobicContact CG-CH2 4.34Å; K208-W312 HydrophobicContact CG-CZ2 3.87Å; K208-W312 VanDerWaalsContact O-CH2 3.27Å; K208-W312 WeakPolarHBondContact O-CH2 3.43Å
209	D	83.3	Confident	78.6	Confident	67 Å²	67	53.9 Å²	53.9	36%	0.358	28%	0.275	S	S	.	.			trans	-101.2	117.1	171.7	-174.9	12	0	0	0	111.3	A204 L205 N207 T211 P212	A204-D209 CarbonylContact C-O 3.5Å; A204-D209 VanDerWaalsContact C-O 3.26Å; A204-D209 HydrophobicContact CB-CB 4.33Å; A204-D209 WeakPolarHBondContact O-CA 3.42Å; A204-D209 PolarHBondContact O-N 3.26Å; L205-D209 PolarHBondContact N-O 3.22Å; N207-D209 PolarHBondContact O-N 3.41Å; D209-T211 VanDerWaalsContact OD1-CB 3.25Å; D209-T211 WeakPolarHBondContact OD1-CB 3.46Å; D209-T211 PolarHBondContact OD1-N 3.37Å; D209-T211 PolarHBondContact OD1-OG1 3.41Å; D209-P212 WeakPolarHBondContact OD2-CD 3.49Å
210	I	80.9	Confident	77.4	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.031	29%	0.288	C	S	.	.			trans	-91.4	-15.4	-178.3	-43	177	0	0	0	110.8	A213 L214 L247 L250 Q251 Q254 W312	I210-A213 PolarHBondContact O-N 3Å; I210-A213 VanDerWaalsContact O-N 3.17Å; I210-L214 HydrophobicContact CB-CD1 4.44Å; I210-L214 HydrophobicContact CG2-CD1 3.98Å; I210-L214 HydrophobicContact CG2-CG 3.97Å; I210-L214 WeakPolarHBondContact O-CG 3.47Å; I210-L214 PolarHBondContact O-N 3.02Å; I210-L247 HydrophobicContact CG2-CB 4.34Å; I210-L247 HydrophobicContact CG2-CD2 3.83Å; I210-L250 HydrophobicContact CD1-CB 3.51Å; I210-L250 HydrophobicContact CG1-CB 4.45Å; I210-Q251 HydrophobicContact CD1-CB 4.16Å; I210-Q254 HydrophobicContact CD1-CG 4.39Å; I210-W312 HydrophobicContact CD1-CH2 3.91Å; I210-W312 HydrophobicContact CD1-CZ3 4.44Å; I210-W312 HydrophobicContact CG1-CH2 3.49Å; I210-W312 VanDerWaalsContact CG1-CH2 3.49Å; I210-W312 HydrophobicContact CG1-CZ3 3.73Å
211	T	78.7	Confident	75.7	Confident	75 Å²	75	49.4 Å²	49.4	46%	0.46	27%	0.268	S	S	.	.	H	α-helix	trans	-57.7	-48.8	-171.1	-42.9	0	0	0	0	112	D209 A213 L214 E215	D209-T211 VanDerWaalsContact OD1-CB 3.25Å; D209-T211 WeakPolarHBondContact OD1-CB 3.46Å; D209-T211 PolarHBondContact OD1-N 3.37Å; D209-T211 PolarHBondContact OD1-OG1 3.41Å; T211-A213 VanDerWaalsContact C-N 3.31Å; T211-A213 PolarHBondContact O-N 3.34Å; T211-L214 PolarHBondContact O-N 3.31Å; T211-E215 HydrophobicContact CG2-CG 4.47Å; T211-E215 WeakPolarHBondContact O-CG 3.47Å; T211-E215 PolarHBondContact O-N 3.43Å
212	P	77.7	Confident	73.7	Confident	34 Å²	34	53.6 Å²	53.6	22%	0.221	30%	0.304	C	S	.	.	H	α-helix	trans	-66.5	-32.2	-179.5	-24.5	38.9	0	0	0	113.1	I201 A204 D209 Y216	I201-P212 HydrophobicContact CG1-CB 4.27Å; A204-P212 HydrophobicContact CB-CB 4.09Å; A204-P212 HydrophobicContact CB-CG 3.6Å; D209-P212 WeakPolarHBondContact OD2-CD 3.49Å; P212-Y216 VanDerWaalsContact O-CB 3.22Å; P212-Y216 WeakPolarHBondContact O-CB 3.43Å; P212-Y216 PolarHBondContact O-N 3.03Å
213	A	75.7	Confident	71	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-69.8	-38.2	176	0	0	0	0	0	111.7	I201 L205 I210 T211 L217 L247	I201-A213 HydrophobicContact CG2-CB 3.74Å; L205-A213 HydrophobicContact CD1-CB 4.18Å; L205-A213 HydrophobicContact CD2-CB 3.86Å; L205-A213 HydrophobicContact CG-CB 4.14Å; I210-A213 PolarHBondContact O-N 3Å; I210-A213 VanDerWaalsContact O-N 3.17Å; T211-A213 VanDerWaalsContact C-N 3.31Å; T211-A213 PolarHBondContact O-N 3.34Å; A213-L217 WeakPolarHBondContact O-CG 3.19Å; A213-L217 PolarHBondContact O-N 2.84Å; A213-L247 HydrophobicContact CB-CD1 4.22Å; A213-L247 HydrophobicContact CB-CD2 3.99Å
214	L	74.1	Confident	68.4	Low	23 Å²	23	57.4 Å²	57.4	12%	0.12	33%	0.33	C	S	.	.	H	α-helix	trans	-68.1	-45.5	173.7	-70.4	169.5	0	0	0	111.4	I210 T211 Y216 L217 I218 F225 L247	I210-L214 HydrophobicContact CB-CD1 4.44Å; I210-L214 HydrophobicContact CG2-CD1 3.98Å; I210-L214 HydrophobicContact CG2-CG 3.97Å; I210-L214 WeakPolarHBondContact O-CG 3.47Å; I210-L214 PolarHBondContact O-N 3.02Å; T211-L214 PolarHBondContact O-N 3.31Å; L214-Y216 VanDerWaalsContact C-N 3.31Å; L214-Y216 PolarHBondContact O-N 3.44Å; L214-L217 WeakPolarHBondContact O-CB 3.45Å; L214-L217 PolarHBondContact O-N 3.25Å; L214-I218 WeakPolarHBondContact O-CD1 3.49Å; L214-I218 WeakPolarHBondContact O-CG1 3.38Å; L214-I218 PolarHBondContact O-N 2.64Å; L214-F225 HydrophobicContact CD2-CD2 4.2Å; L214-F225 HydrophobicContact CD2-CE2 3.65Å; L214-F225 HydrophobicContact CD2-CZ 4.29Å; L214-L247 HydrophobicContact CD2-CB 4.35Å; L214-L247 HydrophobicContact CD2-CD1 4.47Å
215	E	71.8	Confident	66.2	Low	118 Å²	118	58.1 Å²	58.1	55%	0.551	33%	0.331	S	S	*	.	H	α-helix	trans	-61.7	-38.6	174.4	-74.3	-179.3	176.6	0	0	112.1	T211 I218 S219	T211-E215 HydrophobicContact CG2-CG 4.47Å; T211-E215 WeakPolarHBondContact O-CG 3.47Å; T211-E215 PolarHBondContact O-N 3.43Å; E215-I218 CarbonylContact O-C 3.38Å; E215-I218 WeakPolarHBondContact O-CB 2.98Å; E215-I218 PolarHBondContact O-N 3.46Å; E215-S219 VanDerWaalsContact O-CB 3.3Å; E215-S219 WeakPolarHBondContact O-CB 2.82Å; E215-S219 PolarHBondContact O-N 3.31Å; E215-S219 PolarHBondContact O-OG 2.9Å; E215-S219 VanDerWaalsContact O-OG 3.12Å
216	Y	68.3	Low	64.1	Low	26 Å²	26	63.1 Å²	63.1	10%	0.102	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-47.5	173.3	176.4	-93.2	0	0	0	111.5	I201 P212 L214 I218 S219 C220 F319 W323 Y327	I201-Y216 VanDerWaalsContact CD1-CB 3.45Å; I201-Y216 HydrophobicContact CD1-CD1 4.38Å; I201-Y216 HydrophobicContact CD1-CD2 3.35Å; I201-Y216 HydrophobicContact CD1-CE2 4.18Å; I201-Y216 HydrophobicContact CD1-CG 3.46Å; I201-Y216 VanDerWaalsContact CD1-CG 3.46Å; P212-Y216 VanDerWaalsContact O-CB 3.22Å; P212-Y216 WeakPolarHBondContact O-CB 3.43Å; P212-Y216 PolarHBondContact O-N 3.03Å; L214-Y216 VanDerWaalsContact C-N 3.31Å; L214-Y216 PolarHBondContact O-N 3.44Å; Y216-I218 PolarHBondContact O-N 2.92Å; Y216-S219 WeakPolarHBondContact CA-OG 3.47Å; Y216-S219 PolarHBondContact O-N 2.91Å; Y216-S219 PolarHBondContact O-OG 2.91Å; Y216-C220 WeakPolarHBondContact CE1-SG 3.38Å; Y216-C220 PolarHBondContact O-N 3.11Å; Y216-C220 PolarHBondContact O-SG 3.36Å; Y216-F319 HydrophobicContact CD1-CD2 4.5Å; Y216-F319 AromaticContact CD1-CE2 3.51Å; Y216-F319 HydrophobicContact CD1-CE2 3.51Å; Y216-F319 HydrophobicContact CD1-CZ 4.23Å; Y216-F319 AromaticContact CE1-CE2 3.66Å; Y216-F319 HydrophobicContact CE1-CE2 3.66Å; Y216-F319 HydrophobicContact CE1-CZ 4.27Å; Y216-F319 HydrophobicContact CG-CE2 4.11Å; Y216-W323 AromaticContact CZ-CD1 3.76Å; Y216-Y327 VanDerWaalsContact OH-CE2 3.27Å; Y216-Y327 WeakPolarHBondContact OH-CE2 3.43Å
217	L	62.7	Low	61.6	Low	13 Å²	13	63.1 Å²	63.1	7%	0.068	36%	0.359	C	S	.	.	H	α-helix	trans	-58.1	-37.8	174	-76.3	-177.5	0	0	0	112.4	A213 L214 W228 L243 L247	A213-L217 WeakPolarHBondContact O-CG 3.19Å; A213-L217 PolarHBondContact O-N 2.84Å; L214-L217 WeakPolarHBondContact O-CB 3.45Å; L214-L217 PolarHBondContact O-N 3.25Å; L217-W228 HydrophobicContact CB-CH2 4.47Å; L217-W228 HydrophobicContact CD1-CH2 4.47Å; L217-W228 HydrophobicContact CD2-CH2 3.68Å; L217-W228 HydrophobicContact CD2-CZ2 4Å; L217-W228 HydrophobicContact CG-CH2 4.44Å; L217-W228 PolarHBondContact O-NE1 3.34Å; L217-L243 HydrophobicContact CD2-CD2 4.02Å; L217-L247 HydrophobicContact CD1-CD1 3.39Å; L217-L247 HydrophobicContact CG-CD1 4.28Å
218	I	61.2	Low	59.4	Low	48 Å²	48	57.9 Å²	57.9	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-70	-41.6	175.9	-65.7	162.5	0	0	0	111.5	L214 E215 Y216 A221 A222 F225	L214-I218 WeakPolarHBondContact O-CD1 3.49Å; L214-I218 WeakPolarHBondContact O-CG1 3.38Å; L214-I218 PolarHBondContact O-N 2.64Å; E215-I218 CarbonylContact O-C 3.38Å; E215-I218 WeakPolarHBondContact O-CB 2.98Å; E215-I218 PolarHBondContact O-N 3.46Å; Y216-I218 PolarHBondContact O-N 2.92Å; I218-A221 CarbonylContact O-C 3.59Å; I218-A221 PolarHBondContact O-N 2.99Å; I218-A221 VanDerWaalsContact O-N 3.16Å; I218-A221 VanDerWaalsContact O-O 3.06Å; I218-A222 PolarHBondContact O-N 3.29Å; I218-F225 HydrophobicContact CD1-CB 4.14Å; I218-F225 HydrophobicContact CG1-CB 4.18Å
219	S	61	Low	57.3	Low	85 Å²	85	54.6 Å²	54.6	59%	0.594	32%	0.32	S	S	*	.	H	α-helix	trans	-77.7	-30.9	-174.4	65.5	0	0	0	0	113.6	E215 Y216 A221	E215-S219 VanDerWaalsContact O-CB 3.3Å; E215-S219 WeakPolarHBondContact O-CB 2.82Å; E215-S219 PolarHBondContact O-N 3.31Å; E215-S219 PolarHBondContact O-OG 2.9Å; E215-S219 VanDerWaalsContact O-OG 3.12Å; Y216-S219 WeakPolarHBondContact CA-OG 3.47Å; Y216-S219 PolarHBondContact O-N 2.91Å; Y216-S219 PolarHBondContact O-OG 2.91Å; S219-A221 PolarHBondContact O-N 3.43Å
220	C	57.6	Low	55.4	Low	66 Å²	66	57.9 Å²	57.9	45%	0.446	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-10.5	166.7	-75.4	0	0	0	0	112.6	Y216	Y216-C220 WeakPolarHBondContact CE1-SG 3.38Å; Y216-C220 PolarHBondContact O-N 3.11Å; Y216-C220 PolarHBondContact O-SG 3.36Å
221	A	47.9	Very low	53.4	Low	19 Å²	19	63.4 Å²	63.4	16%	0.157	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-161.2	67	-176.7	0	0	0	0	0	112.2	I218 S219 G223 W228 N232	I218-A221 CarbonylContact O-C 3.59Å; I218-A221 PolarHBondContact O-N 2.99Å; I218-A221 VanDerWaalsContact O-N 3.16Å; I218-A221 VanDerWaalsContact O-O 3.06Å; S219-A221 PolarHBondContact O-N 3.43Å; A221-G223 PolarHBondContact O-N 2.86Å; A221-W228 HydrophobicContact CB-CG 4.35Å; A221-N232 WeakPolarHBondContact CB-ND2 3.35Å
222	A	40.5	Very low	51.7	Low	100 Å²	100	61.3 Å²	61.3	83%	0.826	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	28.8	57.4	150.5	0	0	0	0	0	118.3	I218	I218-A222 PolarHBondContact O-N 3.29Å
223	G	30.9	Very low	50.3	Low	26 Å²	26	64.2 Å²	64.2	27%	0.268	36%	0.358	S	S	.	.	S	Bend	trans	137.8	152.2	161.3	0	0	0	0	0	115.7	A221	A221-G223 PolarHBondContact O-N 2.86Å
224	L	31.2	Very low	48.9	Very low	131 Å²	131	71 Å²	71	69%	0.686	39%	0.389	S	S	*	.			trans	-18.2	132.2	-176.7	-78.2	103.3	0	0	0	116	N226 Q227	L224-N226 PolarHBondContact O-N 3.14Å; L224-Q227 PolarHBondContact O-N 3.09Å
225	F	39.3	Very low	47.7	Very low	28 Å²	28	75.9 Å²	75.9	12%	0.123	41%	0.41	C	S	.	.	H	α-helix	trans	-37.1	-29.6	178.8	-173	-102.9	0	0	0	116.4	L214 I218 R275	L214-F225 HydrophobicContact CD2-CD2 4.2Å; L214-F225 HydrophobicContact CD2-CE2 3.65Å; L214-F225 HydrophobicContact CD2-CZ 4.29Å; I218-F225 HydrophobicContact CD1-CB 4.14Å; I218-F225 HydrophobicContact CG1-CB 4.18Å; F225-R275 VanDerWaalsContact CZ-NH2 3.3Å
226	N	41.3	Very low	46.7	Very low	106 Å²	106	72.5 Å²	72.5	57%	0.567	40%	0.395	S	S	*	.	H	α-helix	trans	-77.4	-33.8	179.6	-64.1	-20.9	0	0	0	114.3	L224	L224-N226 PolarHBondContact O-N 3.14Å
227	Q	36	Very low	45.9	Very low	121 Å²	121	77 Å²	77	57%	0.565	42%	0.417	S	S	*	.	H	α-helix	trans	-81.3	-23	176.8	-71.3	179.7	-2.9	0	0	111.6	L224 L231	L224-Q227 PolarHBondContact O-N 3.09Å; Q227-L231 HydrophobicContact CB-CD1 3.87Å; Q227-L231 VanDerWaalsContact O-CB 3.24Å; Q227-L231 WeakPolarHBondContact O-CB 3.17Å; Q227-L231 WeakPolarHBondContact O-CD1 3.5Å; Q227-L231 WeakPolarHBondContact O-CG 3.47Å; Q227-L231 PolarHBondContact O-N 3.43Å
228	W	41.1	Very low	45.3	Very low	24 Å²	24	85.2 Å²	85.2	9%	0.091	45%	0.447	C	S	.	.	H	α-helix	trans	-68.1	-46.5	-174.4	-175.7	73.6	0	0	0	115.9	L217 A221 E230 L231 N232 L236	L217-W228 HydrophobicContact CB-CH2 4.47Å; L217-W228 HydrophobicContact CD1-CH2 4.47Å; L217-W228 HydrophobicContact CD2-CH2 3.68Å; L217-W228 HydrophobicContact CD2-CZ2 4Å; L217-W228 HydrophobicContact CG-CH2 4.44Å; L217-W228 PolarHBondContact O-NE1 3.34Å; A221-W228 HydrophobicContact CB-CG 4.35Å; W228-E230 PolarHBondContact O-N 2.79Å; W228-L231 PolarHBondContact O-N 2.77Å; W228-N232 VanDerWaalsContact CD1-ND2 3.28Å; W228-N232 PolarHBondContact NE1-ND2 2.88Å; W228-N232 PolarHBondContact O-N 3.26Å; W228-L236 HydrophobicContact CD2-CD1 4.38Å; W228-L236 HydrophobicContact CE3-CD1 4.05Å; W228-L236 HydrophobicContact CH2-CD1 3.08Å; W228-L236 HydrophobicContact CH2-CD2 3.84Å; W228-L236 HydrophobicContact CH2-CG 4.04Å; W228-L236 HydrophobicContact CZ2-CD1 3.45Å; W228-L236 VanDerWaalsContact CZ2-CD1 3.45Å; W228-L236 HydrophobicContact CZ2-CD2 4.06Å; W228-L236 HydrophobicContact CZ2-CG 4.21Å; W228-L236 HydrophobicContact CZ3-CD1 3.4Å; W228-L236 VanDerWaalsContact CZ3-CD1 3.4Å
229	A	42.1	Very low	45	Very low	29 Å²	29	85.9 Å²	85.9	24%	0.24	45%	0.451	C	S	.	.	H	α-helix	trans	-64	-27.5	-177.5	0	0	0	0	0	111.9	K233	A229-K233 WeakPolarHBondContact O-CA 3.33Å; A229-K233 VanDerWaalsContact O-CB 3.27Å; A229-K233 WeakPolarHBondContact O-CB 3.44Å; A229-K233 PolarHBondContact O-N 3.37Å
230	E	42.4	Very low	45.1	Very low	136 Å²	136	87.8 Å²	87.8	64%	0.636	46%	0.455	S	S	*	.	H	α-helix	trans	-83.9	-44.7	172.3	-69.5	-59.9	148	0	0	111.8	W228 N232 K233	W228-E230 PolarHBondContact O-N 2.79Å; E230-N232 PolarHBondContact O-N 3.29Å; E230-K233 WeakPolarHBondContact O-CB 3.02Å
231	L	38.9	Very low	45.8	Very low	123 Å²	123	86.1 Å²	86.1	64%	0.644	44%	0.444	S	S	*	.	H	α-helix	trans	-68.3	-31.8	-177.6	-76.2	167.2	0	0	0	114.3	Q227 W228	Q227-L231 HydrophobicContact CB-CD1 3.87Å; Q227-L231 VanDerWaalsContact O-CB 3.24Å; Q227-L231 WeakPolarHBondContact O-CB 3.17Å; Q227-L231 WeakPolarHBondContact O-CD1 3.5Å; Q227-L231 WeakPolarHBondContact O-CG 3.47Å; Q227-L231 PolarHBondContact O-N 3.43Å; W228-L231 PolarHBondContact O-N 2.77Å
232	N	42.9	Very low	47.3	Very low	31 Å²	31	88.1 Å²	88.1	17%	0.166	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	13.5	179.4	-71.7	-68.5	0	0	0	113.7	A221 W228 E230 E234 K235 L236	A221-N232 WeakPolarHBondContact CB-ND2 3.35Å; W228-N232 VanDerWaalsContact CD1-ND2 3.28Å; W228-N232 PolarHBondContact NE1-ND2 2.88Å; W228-N232 PolarHBondContact O-N 3.26Å; E230-N232 PolarHBondContact O-N 3.29Å; N232-E234 PolarHBondContact O-N 2.78Å; N232-E234 VanDerWaalsContact O-N 3.13Å; N232-K235 HydrophobicContact CB-CB 4.45Å; N232-K235 PolarHBondContact O-N 3.44Å; N232-L236 HydrophobicContact CB-CD1 4.3Å; N232-L236 PolarHBondContact O-N 3.22Å
233	K	48.4	Very low	49.3	Very low	95 Å²	95	83.7 Å²	83.7	41%	0.413	41%	0.414	S	S	.	.	H	α-helix	trans	-41.1	-50.1	171.6	-170.5	167.5	175.7	179.8	0	110.9	A229 E230 K235 L236 E237	A229-K233 WeakPolarHBondContact O-CA 3.33Å; A229-K233 VanDerWaalsContact O-CB 3.27Å; A229-K233 WeakPolarHBondContact O-CB 3.44Å; A229-K233 PolarHBondContact O-N 3.37Å; E230-K233 WeakPolarHBondContact O-CB 3.02Å; K233-K235 PolarHBondContact O-N 3.27Å; K233-L236 PolarHBondContact O-N 3.48Å; K233-E237 WeakPolarHBondContact CE-OE1 2.87Å; K233-E237 HydrophobicContact CG-CG 4.12Å; K233-E237 WeakPolarHBondContact CG-OE1 3.27Å; K233-E237 WeakPolarHBondContact O-CB 3.31Å; K233-E237 WeakPolarHBondContact O-CG 3.46Å; K233-E237 PolarHBondContact O-N 2.91Å
234	E	47.7	Very low	51.6	Low	143 Å²	143	83.3 Å²	83.3	67%	0.668	41%	0.41	S	S	*	.	H	α-helix	trans	-66.7	-31.4	179.6	-61.3	-176.9	172.8	0	0	115.6	N232 R238	N232-E234 PolarHBondContact O-N 2.78Å; N232-E234 VanDerWaalsContact O-N 3.13Å; E234-R238 WeakPolarHBondContact O-CB 3.36Å; E234-R238 WeakPolarHBondContact O-CG 3.48Å; E234-R238 PolarHBondContact O-N 3.39Å; E234-R238 PolarHBondContact O-NE 3.41Å
235	K	49.1	Very low	54.1	Low	125 Å²	125	77.1 Å²	77.1	54%	0.543	38%	0.378	S	S	.	.	H	α-helix	trans	-79.4	-33.9	178.8	-88.2	-179.6	-175.6	167	0	111.6	N232 K233 L239	N232-K235 HydrophobicContact CB-CB 4.45Å; N232-K235 PolarHBondContact O-N 3.44Å; K233-K235 PolarHBondContact O-N 3.27Å; K235-L239 WeakPolarHBondContact O-CG 3.42Å; K235-L239 PolarHBondContact O-N 3.15Å
236	L	49.8	Very low	56.4	Low	47 Å²	47	77.6 Å²	77.6	25%	0.246	38%	0.379	C	S	.	.	H	α-helix	trans	-86.3	-35.8	-179.8	-64.1	162.8	0	0	0	112.4	W228 N232 K233 R238 L239 N240	W228-L236 HydrophobicContact CD2-CD1 4.38Å; W228-L236 HydrophobicContact CE3-CD1 4.05Å; W228-L236 HydrophobicContact CH2-CD1 3.08Å; W228-L236 HydrophobicContact CH2-CD2 3.84Å; W228-L236 HydrophobicContact CH2-CG 4.04Å; W228-L236 HydrophobicContact CZ2-CD1 3.45Å; W228-L236 VanDerWaalsContact CZ2-CD1 3.45Å; W228-L236 HydrophobicContact CZ2-CD2 4.06Å; W228-L236 HydrophobicContact CZ2-CG 4.21Å; W228-L236 HydrophobicContact CZ3-CD1 3.4Å; W228-L236 VanDerWaalsContact CZ3-CD1 3.4Å; N232-L236 HydrophobicContact CB-CD1 4.3Å; N232-L236 PolarHBondContact O-N 3.22Å; K233-L236 PolarHBondContact O-N 3.48Å; L236-R238 PolarHBondContact O-N 3.27Å; L236-L239 CarbonylContact O-C 3.45Å; L236-L239 WeakPolarHBondContact O-CA 3.46Å; L236-L239 PolarHBondContact O-N 3.47Å; L236-N240 PolarHBondContact O-N 2.88Å
237	E	52.2	Low	58.5	Low	122 Å²	122	72.6 Å²	72.6	57%	0.57	35%	0.352	S	S	*	.	H	α-helix	trans	-59	-37.3	167.7	-76	175.6	167	0	0	110.2	K233 L239 N240	K233-E237 WeakPolarHBondContact CE-OE1 2.87Å; K233-E237 HydrophobicContact CG-CG 4.12Å; K233-E237 WeakPolarHBondContact CG-OE1 3.27Å; K233-E237 WeakPolarHBondContact O-CB 3.31Å; K233-E237 WeakPolarHBondContact O-CG 3.46Å; K233-E237 PolarHBondContact O-N 2.91Å; E237-L239 VanDerWaalsContact C-N 3.27Å; E237-L239 PolarHBondContact O-N 3.31Å; E237-N240 PolarHBondContact O-N 2.88Å
238	R	49.1	Very low	60.8	Low	184 Å²	184	67 Å²	67	69%	0.694	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.4	170	-85.4	-174.9	-78.8	-178.3	-11.9	114.1	E234 L236	E234-R238 WeakPolarHBondContact O-CB 3.36Å; E234-R238 WeakPolarHBondContact O-CG 3.48Å; E234-R238 PolarHBondContact O-N 3.39Å; E234-R238 PolarHBondContact O-NE 3.41Å; L236-R238 PolarHBondContact O-N 3.27Å
239	L	55.6	Low	63.1	Low	62 Å²	62	66 Å²	66	33%	0.325	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-11.9	-179.2	-71.4	171.7	0	0	0	113.6	K235 L236 E237 S241 K325 V326	K235-L239 WeakPolarHBondContact O-CG 3.42Å; K235-L239 PolarHBondContact O-N 3.15Å; L236-L239 CarbonylContact O-C 3.45Å; L236-L239 WeakPolarHBondContact O-CA 3.46Å; L236-L239 PolarHBondContact O-N 3.47Å; E237-L239 VanDerWaalsContact C-N 3.27Å; E237-L239 PolarHBondContact O-N 3.31Å; L239-S241 PolarHBondContact O-N 2.92Å; L239-K325 HydrophobicContact CD2-CB 4.39Å; L239-K325 HydrophobicContact CD2-CD 4.26Å; L239-V326 HydrophobicContact CD1-CG2 4.39Å
240	N	63.6	Low	65.3	Low	126 Å²	126	64.8 Å²	64.8	67%	0.674	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	44.6	-173.8	-162.3	36.7	0	0	0	112.6	L236 E237	L236-N240 PolarHBondContact O-N 2.88Å; E237-N240 PolarHBondContact O-N 2.88Å
241	S	70.8	Confident	67.3	Low	31 Å²	31	60.7 Å²	60.7	22%	0.217	29%	0.293	C	S	.	.			trans	-82.1	129.4	-175.1	165.4	0	0	0	0	112.1	L239 L243 D322	L239-S241 PolarHBondContact O-N 2.92Å; S241-L243 WeakPolarHBondContact OG-CB 3.34Å; S241-L243 PolarHBondContact OG-N 3.25Å; S241-L243 VanDerWaalsContact OG-N 3.12Å; S241-D322 WeakPolarHBondContact CB-OD2 3.48Å; S241-D322 PolarHBondContact OG-OD2 3.39Å
242	N	80.8	Confident	69.6	Low	61 Å²	61	54.9 Å²	54.9	33%	0.326	26%	0.262	S	S	.	.			trans	-87.4	-0.6	172.8	-68.6	-32.9	0	0	0	113.6	G244 F245 Y246	N242-G244 VanDerWaalsContact C-N 3.34Å; N242-G244 PolarHBondContact O-N 3.49Å; N242-F245 WeakPolarHBondContact O-CB 3.48Å; N242-F245 PolarHBondContact O-N 3.36Å; N242-F245 VanDerWaalsContact O-N 3.09Å; N242-Y246 HydrophobicContact CB-CD2 4.35Å; N242-Y246 HydrophobicContact CB-CE1 4.16Å; N242-Y246 HydrophobicContact CB-CE2 3.79Å; N242-Y246 PolarHBondContact O-N 3.31Å
243	L	82.2	Confident	71.8	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-58.3	-44.8	-174.6	175.8	63	0	0	0	112.1	L217 S241 F245 Y246 L247 A318 F319	L217-L243 HydrophobicContact CD2-CD2 4.02Å; S241-L243 WeakPolarHBondContact OG-CB 3.34Å; S241-L243 PolarHBondContact OG-N 3.25Å; S241-L243 VanDerWaalsContact OG-N 3.12Å; L243-F245 PolarHBondContact O-N 2.89Å; L243-Y246 PolarHBondContact O-N 2.79Å; L243-Y246 VanDerWaalsContact O-N 3.15Å; L243-L247 HydrophobicContact CD1-CD1 4.02Å; L243-L247 HydrophobicContact CD1-CD2 4.42Å; L243-L247 HydrophobicContact CD1-CG 3.98Å; L243-L247 HydrophobicContact CG-CD1 4.06Å; L243-L247 HydrophobicContact CG-CG 4.4Å; L243-L247 WeakPolarHBondContact O-CG 3.46Å; L243-L247 PolarHBondContact O-N 3.17Å; L243-A318 HydrophobicContact CB-CB 4.3Å; L243-A318 HydrophobicContact CD1-CB 4.22Å; L243-F319 HydrophobicContact CD1-CB 3.83Å; L243-F319 HydrophobicContact CD2-CB 4.35Å; L243-F319 HydrophobicContact CD2-CD2 4.05Å
244	G	79	Confident	73.7	Confident	17 Å²	17	52 Å²	52	18%	0.175	25%	0.25	C	C	.	.	H	α-helix	trans	-60.5	-33.7	179.1	0	0	0	0	0	112.8	N242 A248	N242-G244 VanDerWaalsContact C-N 3.34Å; N242-G244 PolarHBondContact O-N 3.49Å; G244-A248 WeakPolarHBondContact O-CB 3.46Å; G244-A248 PolarHBondContact O-N 2.8Å
245	F	84.5	Confident	75.5	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-72.3	-45.4	174.2	174.6	-98.5	0	0	0	111.4	N242 L243 L247 A248 R249 F273 F276 N280 E283 M284 L287	N242-F245 WeakPolarHBondContact O-CB 3.48Å; N242-F245 PolarHBondContact O-N 3.36Å; N242-F245 VanDerWaalsContact O-N 3.09Å; L243-F245 PolarHBondContact O-N 2.89Å; F245-L247 PolarHBondContact O-N 3.1Å; F245-A248 PolarHBondContact O-N 3.29Å; F245-R249 WeakPolarHBondContact O-CB 3.42Å; F245-R249 PolarHBondContact O-N 3.37Å; F245-F273 HydrophobicContact CD2-CD1 4.44Å; F245-F273 HydrophobicContact CD2-CE1 4.46Å; F245-F273 HydrophobicContact CE2-CD1 4.12Å; F245-F273 HydrophobicContact CE2-CE1 4.11Å; F245-F276 HydrophobicContact CB-CD1 3.95Å; F245-F276 HydrophobicContact CB-CD2 4.47Å; F245-F276 HydrophobicContact CB-CE1 3.95Å; F245-F276 HydrophobicContact CB-CE2 4.43Å; F245-F276 HydrophobicContact CB-CG 4.22Å; F245-F276 HydrophobicContact CB-CZ 4.18Å; F245-F276 HydrophobicContact CD2-CB 3.84Å; F245-F276 HydrophobicContact CD2-CD1 4.31Å; F245-F276 AromaticContact CD2-CD2 3.74Å; F245-F276 HydrophobicContact CD2-CD2 3.74Å; F245-F276 HydrophobicContact CD2-CE2 4.3Å; F245-F276 AromaticContact CD2-CG 3.73Å; F245-F276 HydrophobicContact CD2-CG 3.73Å; F245-F276 HydrophobicContact CE2-CB 4.46Å; F245-F276 HydrophobicContact CG-CG 4.43Å; F245-N280 HydrophobicContact CD1-CB 4.16Å; F245-N280 HydrophobicContact CD2-CB 3.91Å; F245-N280 HydrophobicContact CE1-CB 3.97Å; F245-N280 HydrophobicContact CE2-CB 3.69Å; F245-N280 HydrophobicContact CG-CB 4.15Å; F245-N280 HydrophobicContact CZ-CB 3.74Å; F245-E283 HydrophobicContact CE1-CB 4.03Å; F245-E283 VanDerWaalsContact CE1-OE2 3.27Å; F245-E283 WeakPolarHBondContact CE1-OE2 3.45Å; F245-E283 HydrophobicContact CZ-CB 3.59Å; F245-M284 HydrophobicContact CE2-CG 3.95Å; F245-L287 HydrophobicContact CZ-CD1 4.28Å
246	Y	86.9	Confident	77.2	Confident	38 Å²	38	40.8 Å²	40.8	15%	0.149	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-41.3	179.2	-62.1	-27.7	0	0	0	112.9	N242 L243 R249 L250 A318	N242-Y246 HydrophobicContact CB-CD2 4.35Å; N242-Y246 HydrophobicContact CB-CE1 4.16Å; N242-Y246 HydrophobicContact CB-CE2 3.79Å; N242-Y246 PolarHBondContact O-N 3.31Å; L243-Y246 PolarHBondContact O-N 2.79Å; L243-Y246 VanDerWaalsContact O-N 3.15Å; Y246-R249 WeakPolarHBondContact O-CB 3.37Å; Y246-R249 PolarHBondContact O-N 2.78Å; Y246-L250 WeakPolarHBondContact O-CG 3.5Å; Y246-L250 PolarHBondContact O-N 2.84Å; Y246-A318 HydrophobicContact CD2-CB 3.63Å; Y246-A318 HydrophobicContact CE2-CB 3.76Å
247	L	85.4	Confident	78.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-68.1	-40.7	175.9	-63.6	175	0	0	0	111.8	L205 I210 A213 L214 L217 L243 F245 R249 L250 Q251 A315	L205-L247 HydrophobicContact CD2-CD2 4.06Å; I210-L247 HydrophobicContact CG2-CB 4.34Å; I210-L247 HydrophobicContact CG2-CD2 3.83Å; A213-L247 HydrophobicContact CB-CD1 4.22Å; A213-L247 HydrophobicContact CB-CD2 3.99Å; L214-L247 HydrophobicContact CD2-CB 4.35Å; L214-L247 HydrophobicContact CD2-CD1 4.47Å; L217-L247 HydrophobicContact CD1-CD1 3.39Å; L217-L247 HydrophobicContact CG-CD1 4.28Å; L243-L247 HydrophobicContact CD1-CD1 4.02Å; L243-L247 HydrophobicContact CD1-CD2 4.42Å; L243-L247 HydrophobicContact CD1-CG 3.98Å; L243-L247 HydrophobicContact CG-CD1 4.06Å; L243-L247 HydrophobicContact CG-CG 4.4Å; L243-L247 WeakPolarHBondContact O-CG 3.46Å; L243-L247 PolarHBondContact O-N 3.17Å; F245-L247 PolarHBondContact O-N 3.1Å; L247-R249 VanDerWaalsContact C-N 3.3Å; L247-R249 PolarHBondContact O-N 3.14Å; L247-L250 PolarHBondContact O-N 3.04Å; L247-Q251 WeakPolarHBondContact O-CB 3.42Å; L247-Q251 PolarHBondContact O-N 3.19Å; L247-A315 HydrophobicContact CD2-CB 4.44Å
248	A	84.1	Confident	80.3	Confident	2 Å²	2	45.6 Å²	45.6	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-39.5	174.9	0	0	0	0	0	111.7	G244 F245 F252 F269 F273 F276	G244-A248 WeakPolarHBondContact O-CB 3.46Å; G244-A248 PolarHBondContact O-N 2.8Å; F245-A248 PolarHBondContact O-N 3.29Å; A248-F252 VanDerWaalsContact O-CB 3.24Å; A248-F252 WeakPolarHBondContact O-CB 3.48Å; A248-F252 PolarHBondContact O-N 2.88Å; A248-F269 HydrophobicContact CB-CE1 4.49Å; A248-F269 HydrophobicContact CB-CZ 4.46Å; A248-F269 WeakPolarHBondContact O-CE1 3.17Å; A248-F273 HydrophobicContact CB-CE1 4.09Å; A248-F273 HydrophobicContact CB-CZ 4.26Å; A248-F276 HydrophobicContact CB-CE2 3.99Å
249	R	88.5	Confident	81.6	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-52	173.5	178	-179.5	71.3	-173.7	6.1	111.2	F245 Y246 L247 Q251 F252 V253 E283 L287 M311 Q314	F245-R249 WeakPolarHBondContact O-CB 3.42Å; F245-R249 PolarHBondContact O-N 3.37Å; Y246-R249 WeakPolarHBondContact O-CB 3.37Å; Y246-R249 PolarHBondContact O-N 2.78Å; L247-R249 VanDerWaalsContact C-N 3.3Å; L247-R249 PolarHBondContact O-N 3.14Å; R249-Q251 PolarHBondContact O-N 2.74Å; R249-F252 PolarHBondContact O-N 2.96Å; R249-V253 WeakPolarHBondContact O-CG2 3.38Å; R249-V253 PolarHBondContact O-N 3.36Å; R249-E283 IonicContact CZ-OE2 3.82Å; R249-E283 IonicContact NH1-OE2 2.62Å; R249-E283 PolarHBondContact NH1-OE2 3.37Å; R249-L287 HydrophobicContact CB-CD1 4.22Å; R249-L287 HydrophobicContact CG-CD1 3.98Å; R249-L287 HydrophobicContact CG-CD2 3.89Å; R249-M311 VanDerWaalsContact CZ-SD 3.53Å; R249-M311 PolarHBondContact NH2-O 2.98Å; R249-Q314 VanDerWaalsContact NH1-OE1 3.13Å
250	L	89.1	Confident	82.4	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-45.2	179.3	-71.2	174.6	0	0	0	111.7	I210 Y246 L247 F252 V253 Q254 M311 W312 A315	I210-L250 HydrophobicContact CD1-CB 3.51Å; I210-L250 HydrophobicContact CG1-CB 4.45Å; Y246-L250 WeakPolarHBondContact O-CG 3.5Å; Y246-L250 PolarHBondContact O-N 2.84Å; L247-L250 PolarHBondContact O-N 3.04Å; L250-F252 VanDerWaalsContact C-N 3.3Å; L250-F252 PolarHBondContact O-N 3.4Å; L250-V253 PolarHBondContact O-N 3.29Å; L250-Q254 WeakPolarHBondContact O-CG 3.12Å; L250-Q254 PolarHBondContact O-N 2.9Å; L250-M311 HydrophobicContact CD2-CB 3.88Å; L250-W312 HydrophobicContact CD1-CD2 4.09Å; L250-W312 HydrophobicContact CD1-CE3 3.8Å; L250-W312 HydrophobicContact CD1-CZ3 4.03Å; L250-W312 HydrophobicContact CD2-CD2 3.98Å; L250-W312 HydrophobicContact CD2-CE3 4.48Å; L250-W312 HydrophobicContact CD2-CG 4.21Å; L250-W312 HydrophobicContact CD2-CZ2 4.25Å; L250-A315 HydrophobicContact CD1-CB 3.54Å
251	Q	85.4	Confident	82.9	Confident	50 Å²	50	41.4 Å²	41.4	23%	0.234	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-39.1	176.9	-174.6	173.3	24.5	0	0	111.8	I210 L247 R249 Q254 L255 F269	I210-Q251 HydrophobicContact CD1-CB 4.16Å; L247-Q251 WeakPolarHBondContact O-CB 3.42Å; L247-Q251 PolarHBondContact O-N 3.19Å; R249-Q251 PolarHBondContact O-N 2.74Å; Q251-Q254 PolarHBondContact O-N 3.23Å; Q251-L255 HydrophobicContact CG-CD1 4.5Å; Q251-L255 VanDerWaalsContact O-CG 3.29Å; Q251-L255 WeakPolarHBondContact O-CG 3.3Å; Q251-L255 PolarHBondContact O-N 2.88Å; Q251-F269 HydrophobicContact CB-CE2 4.49Å; Q251-F269 HydrophobicContact CB-CZ 3.94Å; Q251-F269 HydrophobicContact CG-CE2 3.87Å; Q251-F269 HydrophobicContact CG-CZ 3.82Å
252	F	86.7	Confident	83	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.8	-41.7	177.5	-171.3	-113.6	0	0	0	112.5	A248 R249 L250 L255 I256 I266 F269 A270 F273 L287 M288 M291	A248-F252 VanDerWaalsContact O-CB 3.24Å; A248-F252 WeakPolarHBondContact O-CB 3.48Å; A248-F252 PolarHBondContact O-N 2.88Å; R249-F252 PolarHBondContact O-N 2.96Å; L250-F252 VanDerWaalsContact C-N 3.3Å; L250-F252 PolarHBondContact O-N 3.4Å; F252-L255 PolarHBondContact O-N 3.34Å; F252-I256 HydrophobicContact CD1-CD1 3.68Å; F252-I256 HydrophobicContact CE1-CD1 3.34Å; F252-I256 HydrophobicContact CE1-CG1 4.32Å; F252-I256 HydrophobicContact CG-CD1 4.42Å; F252-I256 HydrophobicContact CZ-CD1 3.85Å; F252-I256 HydrophobicContact CZ-CG1 4.46Å; F252-I256 WeakPolarHBondContact O-CG1 3.49Å; F252-I256 PolarHBondContact O-N 3.28Å; F252-I266 HydrophobicContact CE2-CG2 3.65Å; F252-I266 HydrophobicContact CZ-CG2 4.05Å; F252-F269 HydrophobicContact CB-CD1 4.08Å; F252-F269 HydrophobicContact CB-CE1 3.9Å; F252-F269 AromaticContact CD2-CD1 3.58Å; F252-F269 HydrophobicContact CD2-CD1 3.58Å; F252-F269 HydrophobicContact CD2-CE1 4.26Å; F252-F269 HydrophobicContact CD2-CG 4.43Å; F252-F269 HydrophobicContact CE2-CD1 4.46Å; F252-F269 HydrophobicContact CG-CD1 4.27Å; F252-A270 HydrophobicContact CE2-CB 4.03Å; F252-A270 HydrophobicContact CZ-CB 4.32Å; F252-F273 HydrophobicContact CB-CE2 3.84Å; F252-F273 HydrophobicContact CB-CZ 3.69Å; F252-F273 HydrophobicContact CD1-CE2 4.12Å; F252-F273 HydrophobicContact CD1-CZ 4.27Å; F252-F273 AromaticContact CD2-CE2 3.78Å; F252-F273 HydrophobicContact CD2-CE2 3.78Å; F252-F273 HydrophobicContact CD2-CZ 4.48Å; F252-F273 HydrophobicContact CE2-CE2 4.29Å; F252-F273 AromaticContact CG-CE2 3.66Å; F252-F273 HydrophobicContact CG-CE2 3.66Å; F252-F273 AromaticContact CG-CZ 3.92Å; F252-F273 HydrophobicContact CG-CZ 3.92Å; F252-L287 HydrophobicContact CD1-CB 4.03Å; F252-L287 HydrophobicContact CD1-CD2 4.15Å; F252-L287 HydrophobicContact CD1-CG 4.5Å; F252-L287 HydrophobicContact CE1-CB 3.91Å; F252-L287 WeakPolarHBondContact CE1-O 3.27Å; F252-M288 HydrophobicContact CE1-CE 4.27Å; F252-M288 HydrophobicContact CZ-CE 4.06Å; F252-M291 HydrophobicContact CE1-CG 4.33Å; F252-M291 HydrophobicContact CZ-CG 3.86Å; F252-M291 HydrophobicContact CZ-SD 3.82Å
253	V	88.5	Confident	82.9	Confident	9 Å²	9	45 Å²	45	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-44.7	174.9	172.8	0	0	0	0	110.7	R249 L250 L255 I256 E257 L287 L298 L306 L307	R249-V253 WeakPolarHBondContact O-CG2 3.38Å; R249-V253 PolarHBondContact O-N 3.36Å; L250-V253 PolarHBondContact O-N 3.29Å; V253-L255 VanDerWaalsContact C-N 3.27Å; V253-L255 PolarHBondContact O-N 3.05Å; V253-I256 PolarHBondContact O-N 3.4Å; V253-E257 PolarHBondContact O-N 3.22Å; V253-L287 HydrophobicContact CG2-CD2 4.19Å; V253-L298 HydrophobicContact CG1-CD2 4.25Å; V253-L306 HydrophobicContact CG2-CB 4.12Å; V253-L306 HydrophobicContact CG2-CD1 4.48Å; V253-L307 HydrophobicContact CG1-CD2 3.66Å
254	Q	87.5	Confident	83	Confident	57 Å²	57	52.7 Å²	52.7	27%	0.266	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-32.5	174	-74.6	-173.9	-27.8	0	0	113.2	K208 I210 L250 Q251 K258	K208-Q254 PolarHBondContact O-NE2 2.86Å; I210-Q254 HydrophobicContact CD1-CG 4.39Å; L250-Q254 WeakPolarHBondContact O-CG 3.12Å; L250-Q254 PolarHBondContact O-N 2.9Å; Q251-Q254 PolarHBondContact O-N 3.23Å; Q254-K258 WeakPolarHBondContact O-CG 3.48Å
255	L	85.6	Confident	83.1	Confident	28 Å²	28	58.6 Å²	58.6	15%	0.147	28%	0.278	C	S	.	.	H	α-helix	trans	-72.2	-38.6	175	-74.4	171	0	0	0	111.9	Q251 F252 V253 E257 K258 I266 F269	Q251-L255 HydrophobicContact CG-CD1 4.5Å; Q251-L255 VanDerWaalsContact O-CG 3.29Å; Q251-L255 WeakPolarHBondContact O-CG 3.3Å; Q251-L255 PolarHBondContact O-N 2.88Å; F252-L255 PolarHBondContact O-N 3.34Å; V253-L255 VanDerWaalsContact C-N 3.27Å; V253-L255 PolarHBondContact O-N 3.05Å; L255-E257 VanDerWaalsContact C-N 3.35Å; L255-K258 PolarHBondContact O-N 3.35Å; L255-I266 HydrophobicContact CB-CG1 3.98Å; L255-I266 WeakPolarHBondContact O-CD1 3.05Å; L255-F269 HydrophobicContact CD1-CB 4.02Å; L255-F269 HydrophobicContact CD1-CD1 4.42Å; L255-F269 HydrophobicContact CD1-CD2 3.95Å; L255-F269 HydrophobicContact CD1-CG 3.86Å
256	I	85.6	Confident	83.1	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-66.3	-38.5	175.9	-73	172.1	0	0	0	111.2	F252 V253 K258 G259 I266 M291 M294 L298	F252-I256 HydrophobicContact CD1-CD1 3.68Å; F252-I256 HydrophobicContact CE1-CD1 3.34Å; F252-I256 HydrophobicContact CE1-CG1 4.32Å; F252-I256 HydrophobicContact CG-CD1 4.42Å; F252-I256 HydrophobicContact CZ-CD1 3.85Å; F252-I256 HydrophobicContact CZ-CG1 4.46Å; F252-I256 WeakPolarHBondContact O-CG1 3.49Å; F252-I256 PolarHBondContact O-N 3.28Å; V253-I256 PolarHBondContact O-N 3.4Å; I256-K258 PolarHBondContact O-N 3.46Å; I256-G259 WeakPolarHBondContact O-CA 3.28Å; I256-G259 PolarHBondContact O-N 2.74Å; I256-I266 HydrophobicContact CG1-CG2 4.34Å; I256-M291 HydrophobicContact CD1-CG 4.2Å; I256-M294 HydrophobicContact CG2-CG 4.07Å; I256-L298 HydrophobicContact CG2-CD1 3.46Å; I256-L298 VanDerWaalsContact CG2-CD1 3.46Å; I256-L298 HydrophobicContact CG2-CD2 4.24Å; I256-L298 HydrophobicContact CG2-CG 4.41Å
257	E	84.9	Confident	82.9	Confident	130 Å²	130	61 Å²	61	61%	0.607	29%	0.292	S	S	*	.	H	α-helix	trans	-59.4	-31.4	177.3	-171.4	178.2	-151.3	0	0	112.5	V253 L255 G259	V253-E257 PolarHBondContact O-N 3.22Å; L255-E257 VanDerWaalsContact C-N 3.35Å; E257-G259 PolarHBondContact O-N 3Å; E257-G259 VanDerWaalsContact O-N 3.15Å
258	K	82.3	Confident	82.8	Confident	139 Å²	139	66.6 Å²	66.6	60%	0.604	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-7.1	173.4	-65.5	175.9	-175.9	-177.4	0	113.8	Q254 L255 I256	Q254-K258 WeakPolarHBondContact O-CG 3.48Å; L255-K258 PolarHBondContact O-N 3.35Å; I256-K258 PolarHBondContact O-N 3.46Å
259	G	76.5	Confident	82.6	Confident	15 Å²	15	67 Å²	67	16%	0.155	32%	0.319	C	S	.	.			trans	73.1	-164.6	174.2	0	0	0	0	0	115.1	I256 E257 Q261 S262	I256-G259 WeakPolarHBondContact O-CA 3.28Å; I256-G259 PolarHBondContact O-N 2.74Å; E257-G259 PolarHBondContact O-N 3Å; E257-G259 VanDerWaalsContact O-N 3.15Å; G259-Q261 PolarHBondContact O-N 3.28Å; G259-Q261 VanDerWaalsContact O-N 3.11Å; G259-S262 PolarHBondContact O-N 3.48Å
260	C	73	Confident	82.4	Confident	76 Å²	76	67.6 Å²	67.6	51%	0.514	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-63	-19.9	-169.3	-64.7	0	0	0	0	115.4	S262 R263	C260-S262 PolarHBondContact O-N 2.93Å; C260-S262 VanDerWaalsContact O-N 3.14Å; C260-R263 WeakPolarHBondContact O-CB 3.45Å; C260-R263 PolarHBondContact O-N 3.39Å; C260-R263 VanDerWaalsContact O-N 3.17Å
261	Q	73.5	Confident	82	Confident	194 Å²	194	75 Å²	75	91%	0.907	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-61.8	-22.7	-179.6	-63.9	-177.2	4.8	0	0	112.8	G259	G259-Q261 PolarHBondContact O-N 3.28Å; G259-Q261 VanDerWaalsContact O-N 3.11Å
262	S	72.4	Confident	81.7	Confident	23 Å²	23	76.3 Å²	76.3	16%	0.161	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-106.2	19.1	-179.8	-64.8	0	0	0	0	113.6	G259 C260 E264 K265 I266	G259-S262 PolarHBondContact O-N 3.48Å; C260-S262 PolarHBondContact O-N 2.93Å; C260-S262 VanDerWaalsContact O-N 3.14Å; S262-E264 VanDerWaalsContact C-N 3.32Å; S262-E264 PolarHBondContact O-N 3.24Å; S262-K265 PolarHBondContact O-N 2.94Å; S262-I266 VanDerWaalsContact O-CG1 3.32Å; S262-I266 WeakPolarHBondContact O-CG1 3.42Å; S262-I266 PolarHBondContact O-N 2.9Å
263	R	79.8	Confident	81.3	Confident	145 Å²	145	76.4 Å²	76.4	55%	0.547	36%	0.36	S	S	.	.	H	α-helix	trans	-51.8	-44.6	-174	-177.1	176.7	178.9	157	1.8	113.8	C260 I266 M267	C260-R263 WeakPolarHBondContact O-CB 3.45Å; C260-R263 PolarHBondContact O-N 3.39Å; C260-R263 VanDerWaalsContact O-N 3.17Å; R263-I266 PolarHBondContact O-N 2.96Å; R263-M267 HydrophobicContact CG-CE 4.36Å; R263-M267 HydrophobicContact CG-SD 4.27Å; R263-M267 WeakPolarHBondContact O-CB 3.32Å; R263-M267 WeakPolarHBondContact O-CG 3.3Å; R263-M267 PolarHBondContact O-N 2.89Å
264	E	83.3	Confident	80.8	Confident	168 Å²	168	82.8 Å²	82.8	79%	0.785	39%	0.389	S	S	*	.	H	α-helix	trans	-62.3	-45.9	178.7	-67.3	-179.9	175.1	0	0	111.8	S262 I266 M267 E268	S262-E264 VanDerWaalsContact C-N 3.32Å; S262-E264 PolarHBondContact O-N 3.24Å; E264-I266 VanDerWaalsContact C-N 3.34Å; E264-I266 PolarHBondContact O-N 2.92Å; E264-M267 PolarHBondContact O-N 3.36Å; E264-E268 WeakPolarHBondContact O-CB 3.21Å; E264-E268 PolarHBondContact O-N 3.45Å
265	K	82.4	Confident	80.1	Confident	140 Å²	140	84 Å²	84	61%	0.609	39%	0.391	S	S	*	.	H	α-helix	trans	-63.7	-39.2	176.8	-65.9	-179.9	179.9	175.1	0	111.8	S262 E268 F269	S262-K265 PolarHBondContact O-N 2.94Å; K265-E268 PolarHBondContact O-N 3.16Å; K265-F269 VanDerWaalsContact O-CB 3.27Å; K265-F269 WeakPolarHBondContact O-CB 3.41Å; K265-F269 PolarHBondContact O-N 3.38Å
266	I	83.2	Confident	79.6	Confident	1 Å²	1	84 Å²	84	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-63.5	-46.1	175.6	-65.9	165.1	0	0	0	109.9	F252 L255 I256 S262 R263 E264 F269 A270 M291 M294	F252-I266 HydrophobicContact CE2-CG2 3.65Å; F252-I266 HydrophobicContact CZ-CG2 4.05Å; L255-I266 HydrophobicContact CB-CG1 3.98Å; L255-I266 WeakPolarHBondContact O-CD1 3.05Å; I256-I266 HydrophobicContact CG1-CG2 4.34Å; S262-I266 VanDerWaalsContact O-CG1 3.32Å; S262-I266 WeakPolarHBondContact O-CG1 3.42Å; S262-I266 PolarHBondContact O-N 2.9Å; R263-I266 PolarHBondContact O-N 2.96Å; E264-I266 VanDerWaalsContact C-N 3.34Å; E264-I266 PolarHBondContact O-N 2.92Å; I266-F269 PolarHBondContact O-N 2.9Å; I266-A270 VanDerWaalsContact O-CB 3.32Å; I266-A270 WeakPolarHBondContact O-CB 3.47Å; I266-A270 PolarHBondContact O-N 3.2Å; I266-M291 HydrophobicContact CG2-CG 4.46Å; I266-M291 HydrophobicContact CG2-SD 3.96Å; I266-M294 HydrophobicContact CD1-SD 3.64Å; I266-M294 HydrophobicContact CG2-SD 4.22Å
267	M	84.3	Confident	79.1	Confident	91 Å²	91	85.7 Å²	85.7	45%	0.448	40%	0.404	S	S	.	.	H	α-helix	trans	-63.9	-40.9	177.8	-76	-177.5	160.3	0	0	112.4	R263 E264 A270 K271	R263-M267 HydrophobicContact CG-CE 4.36Å; R263-M267 HydrophobicContact CG-SD 4.27Å; R263-M267 WeakPolarHBondContact O-CB 3.32Å; R263-M267 WeakPolarHBondContact O-CG 3.3Å; R263-M267 PolarHBondContact O-N 2.89Å; E264-M267 PolarHBondContact O-N 3.36Å; M267-A270 PolarHBondContact O-N 3.17Å; M267-K271 PolarHBondContact O-N 2.95Å
268	E	82.1	Confident	78.7	Confident	118 Å²	118	87.3 Å²	87.3	55%	0.551	42%	0.417	S	S	*	.	H	α-helix	trans	-64.7	-42.3	174.7	-166.5	-169.6	156.1	0	0	111.4	E264 K265 K271	E264-E268 WeakPolarHBondContact O-CB 3.21Å; E264-E268 PolarHBondContact O-N 3.45Å; K265-E268 PolarHBondContact O-N 3.16Å; E268-K271 WeakPolarHBondContact O-CB 3.37Å; E268-K271 PolarHBondContact O-N 3.43Å
269	F	81	Confident	78.5	Confident	9 Å²	9	84.8 Å²	84.8	4%	0.039	41%	0.414	C	S	.	.	H	α-helix	trans	-66.7	-38.8	176.5	-163.9	-84	0	0	0	112.1	A248 Q251 F252 L255 K265 I266 K271 R272 F273	A248-F269 HydrophobicContact CB-CE1 4.49Å; A248-F269 HydrophobicContact CB-CZ 4.46Å; A248-F269 WeakPolarHBondContact O-CE1 3.17Å; Q251-F269 HydrophobicContact CB-CE2 4.49Å; Q251-F269 HydrophobicContact CB-CZ 3.94Å; Q251-F269 HydrophobicContact CG-CE2 3.87Å; Q251-F269 HydrophobicContact CG-CZ 3.82Å; F252-F269 HydrophobicContact CB-CD1 4.08Å; F252-F269 HydrophobicContact CB-CE1 3.9Å; F252-F269 AromaticContact CD2-CD1 3.58Å; F252-F269 HydrophobicContact CD2-CD1 3.58Å; F252-F269 HydrophobicContact CD2-CE1 4.26Å; F252-F269 HydrophobicContact CD2-CG 4.43Å; F252-F269 HydrophobicContact CE2-CD1 4.46Å; F252-F269 HydrophobicContact CG-CD1 4.27Å; L255-F269 HydrophobicContact CD1-CB 4.02Å; L255-F269 HydrophobicContact CD1-CD1 4.42Å; L255-F269 HydrophobicContact CD1-CD2 3.95Å; L255-F269 HydrophobicContact CD1-CG 3.86Å; K265-F269 VanDerWaalsContact O-CB 3.27Å; K265-F269 WeakPolarHBondContact O-CB 3.41Å; K265-F269 PolarHBondContact O-N 3.38Å; I266-F269 PolarHBondContact O-N 2.9Å; F269-K271 PolarHBondContact O-N 3.47Å; F269-R272 WeakPolarHBondContact O-CA 3.24Å; F269-R272 WeakPolarHBondContact O-CB 3.39Å; F269-R272 PolarHBondContact O-N 3.48Å; F269-F273 AromaticContact CD1-CE2 3.8Å; F269-F273 HydrophobicContact CD1-CE2 3.8Å; F269-F273 AromaticContact CE1-CE2 3.77Å; F269-F273 HydrophobicContact CE1-CE2 3.77Å; F269-F273 HydrophobicContact CE1-CZ 4.08Å
270	A	83.6	Confident	78.7	Confident	17 Å²	17	84.9 Å²	84.9	14%	0.14	41%	0.411	C	S	.	.	H	α-helix	trans	-56.5	-38.2	177.7	0	0	0	0	0	111.5	F252 I266 M267 R272 F273 M288	F252-A270 HydrophobicContact CE2-CB 4.03Å; F252-A270 HydrophobicContact CZ-CB 4.32Å; I266-A270 VanDerWaalsContact O-CB 3.32Å; I266-A270 WeakPolarHBondContact O-CB 3.47Å; I266-A270 PolarHBondContact O-N 3.2Å; M267-A270 PolarHBondContact O-N 3.17Å; A270-R272 PolarHBondContact O-N 3.38Å; A270-F273 PolarHBondContact O-N 3.12Å; A270-F273 VanDerWaalsContact O-N 3.1Å; A270-M288 HydrophobicContact CB-CE 4.04Å; A270-M288 HydrophobicContact CB-SD 4.03Å
271	K	81.7	Confident	79.2	Confident	159 Å²	159	84.7 Å²	84.7	69%	0.691	41%	0.407	S	S	*	.	H	α-helix	trans	-58.2	-29.4	174.7	-67.1	174.2	-176.5	177.6	0	112.2	M267 E268 F269 F273 H274	M267-K271 PolarHBondContact O-N 2.95Å; E268-K271 WeakPolarHBondContact O-CB 3.37Å; E268-K271 PolarHBondContact O-N 3.43Å; F269-K271 PolarHBondContact O-N 3.47Å; K271-F273 PolarHBondContact O-N 3.17Å; K271-H274 PolarHBondContact O-N 3.07Å; K271-H274 PolarHBondContact O-ND1 3.43Å
272	R	77.6	Confident	79.8	Confident	78 Å²	78	83.6 Å²	83.6	29%	0.294	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-68.5	-17.3	179.8	-56.9	179.3	-179.5	-175.2	-1.1	113.6	F269 A270 H274 R275	F269-R272 WeakPolarHBondContact O-CA 3.24Å; F269-R272 WeakPolarHBondContact O-CB 3.39Å; F269-R272 PolarHBondContact O-N 3.48Å; A270-R272 PolarHBondContact O-N 3.38Å; R272-H274 PolarHBondContact O-N 2.97Å; R272-R275 WeakPolarHBondContact O-CD 3.45Å; R272-R275 VanDerWaalsContact O-CG 3.3Å; R272-R275 WeakPolarHBondContact O-CG 3.46Å; R272-R275 PolarHBondContact O-NE 3.35Å
273	F	79.7	Confident	80.5	Confident	2 Å²	2	85.8 Å²	85.8	1%	0.009	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-72.6	-13.6	178.3	-75.7	-86	0	0	0	113.7	F245 A248 F252 F269 A270 K271 R275 F276 M284 L287 M288	F245-F273 HydrophobicContact CD2-CD1 4.44Å; F245-F273 HydrophobicContact CD2-CE1 4.46Å; F245-F273 HydrophobicContact CE2-CD1 4.12Å; F245-F273 HydrophobicContact CE2-CE1 4.11Å; A248-F273 HydrophobicContact CB-CE1 4.09Å; A248-F273 HydrophobicContact CB-CZ 4.26Å; F252-F273 HydrophobicContact CB-CE2 3.84Å; F252-F273 HydrophobicContact CB-CZ 3.69Å; F252-F273 HydrophobicContact CD1-CE2 4.12Å; F252-F273 HydrophobicContact CD1-CZ 4.27Å; F252-F273 AromaticContact CD2-CE2 3.78Å; F252-F273 HydrophobicContact CD2-CE2 3.78Å; F252-F273 HydrophobicContact CD2-CZ 4.48Å; F252-F273 HydrophobicContact CE2-CE2 4.29Å; F252-F273 AromaticContact CG-CE2 3.66Å; F252-F273 HydrophobicContact CG-CE2 3.66Å; F252-F273 AromaticContact CG-CZ 3.92Å; F252-F273 HydrophobicContact CG-CZ 3.92Å; F269-F273 AromaticContact CD1-CE2 3.8Å; F269-F273 HydrophobicContact CD1-CE2 3.8Å; F269-F273 AromaticContact CE1-CE2 3.77Å; F269-F273 HydrophobicContact CE1-CE2 3.77Å; F269-F273 HydrophobicContact CE1-CZ 4.08Å; A270-F273 PolarHBondContact O-N 3.12Å; A270-F273 VanDerWaalsContact O-N 3.1Å; K271-F273 PolarHBondContact O-N 3.17Å; F273-R275 PolarHBondContact O-N 2.88Å; F273-F276 HydrophobicContact CD1-CD2 4.05Å; F273-F276 PolarHBondContact O-N 3.13Å; F273-M284 HydrophobicContact CB-CE 3.84Å; F273-M284 HydrophobicContact CB-CG 4.48Å; F273-M284 HydrophobicContact CB-SD 4.42Å; F273-M284 HydrophobicContact CD1-CG 4.3Å; F273-M284 WeakPolarHBondContact O-CE 3.48Å; F273-L287 HydrophobicContact CD1-CD1 4.48Å; F273-L287 HydrophobicContact CE1-CD1 3.74Å; F273-L287 HydrophobicContact CZ-CD1 3.95Å; F273-M288 HydrophobicContact CB-CE 4.48Å; F273-M288 HydrophobicContact CD2-CE 3.85Å; F273-M288 HydrophobicContact CE2-CE 4.35Å; F273-M288 HydrophobicContact CG-CE 4.28Å
274	H	77.1	Confident	80.8	Confident	143 Å²	143	80.1 Å²	80.1	66%	0.662	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-51.6	-32.3	177.8	74.2	-82.8	0	0	0	113	K271 R272 F276 A277	K271-H274 PolarHBondContact O-N 3.07Å; K271-H274 PolarHBondContact O-ND1 3.43Å; R272-H274 PolarHBondContact O-N 2.97Å; H274-F276 PolarHBondContact O-N 3.23Å; H274-A277 WeakPolarHBondContact O-CB 3.25Å; H274-A277 PolarHBondContact O-N 3.39Å
275	R	72.4	Confident	81.1	Confident	83 Å²	83	78.2 Å²	78.2	31%	0.313	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-63.8	-23	177.6	71.1	-166.6	169.2	167.8	0.6	114.6	F225 R272 F273	F225-R275 VanDerWaalsContact CZ-NH2 3.3Å; R272-R275 WeakPolarHBondContact O-CD 3.45Å; R272-R275 VanDerWaalsContact O-CG 3.3Å; R272-R275 WeakPolarHBondContact O-CG 3.46Å; R272-R275 PolarHBondContact O-NE 3.35Å; F273-R275 PolarHBondContact O-N 2.88Å
276	F	76.4	Confident	81.5	Confident	29 Å²	29	73.3 Å²	73.3	13%	0.127	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-101.3	6.3	179.8	-53.1	-64.9	0	0	0	112.6	F245 A248 F273 H274 N278 T279 N280 M284	F245-F276 HydrophobicContact CB-CD1 3.95Å; F245-F276 HydrophobicContact CB-CD2 4.47Å; F245-F276 HydrophobicContact CB-CE1 3.95Å; F245-F276 HydrophobicContact CB-CE2 4.43Å; F245-F276 HydrophobicContact CB-CG 4.22Å; F245-F276 HydrophobicContact CB-CZ 4.18Å; F245-F276 HydrophobicContact CD2-CB 3.84Å; F245-F276 HydrophobicContact CD2-CD1 4.31Å; F245-F276 AromaticContact CD2-CD2 3.74Å; F245-F276 HydrophobicContact CD2-CD2 3.74Å; F245-F276 HydrophobicContact CD2-CE2 4.3Å; F245-F276 AromaticContact CD2-CG 3.73Å; F245-F276 HydrophobicContact CD2-CG 3.73Å; F245-F276 HydrophobicContact CE2-CB 4.46Å; F245-F276 HydrophobicContact CG-CG 4.43Å; A248-F276 HydrophobicContact CB-CE2 3.99Å; F273-F276 HydrophobicContact CD1-CD2 4.05Å; F273-F276 PolarHBondContact O-N 3.13Å; H274-F276 PolarHBondContact O-N 3.23Å; F276-N278 PolarHBondContact O-N 2.96Å; F276-N278 VanDerWaalsContact O-N 3.14Å; F276-T279 PolarHBondContact O-N 3.39Å; F276-T279 VanDerWaalsContact O-N 3.13Å; F276-T279 PolarHBondContact O-OG1 3.07Å; F276-N280 PolarHBondContact O-N 3.42Å; F276-N280 VanDerWaalsContact O-N 3.07Å; F276-M284 HydrophobicContact CB-SD 3.86Å
277	A	74	Confident	81.7	Confident	39 Å²	39	73.3 Å²	73.3	32%	0.322	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.8	-172.1	0	0	0	0	0	113.3	H274 T281 M284	H274-A277 WeakPolarHBondContact O-CB 3.25Å; H274-A277 PolarHBondContact O-N 3.39Å; A277-T281 PolarHBondContact O-OG1 3.47Å; A277-M284 HydrophobicContact CB-CE 4.23Å
278	N	77	Confident	82	Confident	164 Å²	164	71.8 Å²	71.8	88%	0.877	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-20.9	-177.5	-65.5	-17.6	0	0	0	113.8	F276	F276-N278 PolarHBondContact O-N 2.96Å; F276-N278 VanDerWaalsContact O-N 3.14Å
279	T	77	Confident	82.3	Confident	87 Å²	87	67.8 Å²	67.8	53%	0.534	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-40.1	-173.2	55.9	0	0	0	0	113.2	F276	F276-T279 PolarHBondContact O-N 3.39Å; F276-T279 VanDerWaalsContact O-N 3.13Å; F276-T279 PolarHBondContact O-OG1 3.07Å
280	N	81.9	Confident	82.6	Confident	17 Å²	17	67.3 Å²	67.3	9%	0.091	34%	0.337	C	S	.	.			trans	-125.4	37.1	-169.1	-64.1	80.8	0	0	0	113.1	F245 F276 K282 E283 M284	F245-N280 HydrophobicContact CD1-CB 4.16Å; F245-N280 HydrophobicContact CD2-CB 3.91Å; F245-N280 HydrophobicContact CE1-CB 3.97Å; F245-N280 HydrophobicContact CE2-CB 3.69Å; F245-N280 HydrophobicContact CG-CB 4.15Å; F245-N280 HydrophobicContact CZ-CB 3.74Å; F276-N280 PolarHBondContact O-N 3.42Å; F276-N280 VanDerWaalsContact O-N 3.07Å; N280-K282 VanDerWaalsContact C-N 3.35Å; N280-K282 PolarHBondContact O-N 2.87Å; N280-E283 PolarHBondContact O-N 3.29Å; N280-M284 WeakPolarHBondContact O-CG 3.46Å; N280-M284 PolarHBondContact O-N 3.1Å
281	T	83.3	Confident	82.7	Confident	71 Å²	71	68.7 Å²	68.7	44%	0.436	34%	0.342	S	S	.	.	H	α-helix	trans	-54.1	-43.7	-171	-36.4	0	0	0	0	114	A277 M284 Q285	A277-T281 PolarHBondContact O-OG1 3.47Å; T281-M284 PolarHBondContact O-N 2.96Å; T281-Q285 WeakPolarHBondContact O-CG 3.32Å; T281-Q285 PolarHBondContact O-N 3.04Å
282	K	86.4	Confident	82.9	Confident	172 Å²	172	66.8 Å²	66.8	75%	0.748	34%	0.343	S	S	*	.	H	α-helix	trans	-65.5	-44.1	-178.9	-68.6	-175.8	179.9	179.9	0	112.3	N280 M284 Q285 V286	N280-K282 VanDerWaalsContact C-N 3.35Å; N280-K282 PolarHBondContact O-N 2.87Å; K282-M284 VanDerWaalsContact C-N 3.31Å; K282-Q285 PolarHBondContact O-N 2.88Å; K282-V286 WeakPolarHBondContact O-CG2 3.4Å; K282-V286 PolarHBondContact O-N 3.27Å; K282-V286 VanDerWaalsContact O-N 3.15Å
283	E	87	Confident	83.2	Confident	68 Å²	68	66 Å²	66	32%	0.318	34%	0.342	S	S	.	.	H	α-helix	trans	-67.6	-36.2	177.8	-69.9	-168.6	-130.1	0	0	111.2	F245 R249 N280 Q285 V286 L287	F245-E283 HydrophobicContact CE1-CB 4.03Å; F245-E283 VanDerWaalsContact CE1-OE2 3.27Å; F245-E283 WeakPolarHBondContact CE1-OE2 3.45Å; F245-E283 HydrophobicContact CZ-CB 3.59Å; R249-E283 IonicContact CZ-OE2 3.82Å; R249-E283 IonicContact NH1-OE2 2.62Å; R249-E283 PolarHBondContact NH1-OE2 3.37Å; N280-E283 PolarHBondContact O-N 3.29Å; E283-Q285 PolarHBondContact O-N 2.87Å; E283-V286 WeakPolarHBondContact O-CB 3.41Å; E283-V286 PolarHBondContact O-N 2.66Å; E283-L287 VanDerWaalsContact O-CG 3.3Å; E283-L287 WeakPolarHBondContact O-CG 3.11Å; E283-L287 PolarHBondContact O-N 3.16Å
284	M	86.3	Confident	83.3	Confident	27 Å²	27	67.3 Å²	67.3	13%	0.133	35%	0.348	C	S	.	.	H	α-helix	trans	-61.1	-43.4	172.9	-71.9	174.7	51.8	0	0	112.2	F245 F273 F276 A277 N280 T281 K282 V286 L287 M288	F245-M284 HydrophobicContact CE2-CG 3.95Å; F273-M284 HydrophobicContact CB-CE 3.84Å; F273-M284 HydrophobicContact CB-CG 4.48Å; F273-M284 HydrophobicContact CB-SD 4.42Å; F273-M284 HydrophobicContact CD1-CG 4.3Å; F273-M284 WeakPolarHBondContact O-CE 3.48Å; F276-M284 HydrophobicContact CB-SD 3.86Å; A277-M284 HydrophobicContact CB-CE 4.23Å; N280-M284 WeakPolarHBondContact O-CG 3.46Å; N280-M284 PolarHBondContact O-N 3.1Å; T281-M284 PolarHBondContact O-N 2.96Å; K282-M284 VanDerWaalsContact C-N 3.31Å; M284-V286 VanDerWaalsContact C-N 3.31Å; M284-V286 PolarHBondContact O-N 3.47Å; M284-L287 PolarHBondContact O-N 2.91Å; M284-M288 VanDerWaalsContact O-CG 3.31Å; M284-M288 WeakPolarHBondContact O-CG 3.48Å; M284-M288 PolarHBondContact O-N 3.11Å
285	Q	88.4	Confident	83.4	Confident	127 Å²	127	64.8 Å²	64.8	59%	0.593	35%	0.352	S	S	*	.	H	α-helix	trans	-59.9	-42.4	176.5	-73	172.6	-8.5	0	0	111.8	T281 K282 E283 M288 A289	T281-Q285 WeakPolarHBondContact O-CG 3.32Å; T281-Q285 PolarHBondContact O-N 3.04Å; K282-Q285 PolarHBondContact O-N 2.88Å; E283-Q285 PolarHBondContact O-N 2.87Å; Q285-M288 PolarHBondContact O-N 3.07Å; Q285-A289 VanDerWaalsContact O-CB 3.3Å; Q285-A289 WeakPolarHBondContact O-CB 3.33Å; Q285-A289 PolarHBondContact O-N 2.97Å
286	V	90.7	Very high	83.9	Confident	37 Å²	37	64.2 Å²	64.2	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-59.4	-46.6	174.3	165.4	0	0	0	0	111.3	K282 E283 M284 M288 A289 S290 Y303 Y305 L306	K282-V286 WeakPolarHBondContact O-CG2 3.4Å; K282-V286 PolarHBondContact O-N 3.27Å; K282-V286 VanDerWaalsContact O-N 3.15Å; E283-V286 WeakPolarHBondContact O-CB 3.41Å; E283-V286 PolarHBondContact O-N 2.66Å; M284-V286 VanDerWaalsContact C-N 3.31Å; M284-V286 PolarHBondContact O-N 3.47Å; V286-M288 VanDerWaalsContact C-N 3.35Å; V286-M288 PolarHBondContact O-N 2.91Å; V286-A289 PolarHBondContact O-N 2.85Å; V286-S290 PolarHBondContact O-N 2.84Å; V286-Y303 HydrophobicContact CB-CE1 4.48Å; V286-Y303 HydrophobicContact CG1-CD1 3.71Å; V286-Y303 HydrophobicContact CG1-CE1 3.87Å; V286-Y305 WeakPolarHBondContact CG1-OH 3.47Å; V286-L306 HydrophobicContact CG1-CD1 4.26Å; V286-L306 HydrophobicContact CG1-CD2 4.43Å
287	L	88.7	Confident	84.1	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-64.4	-39.7	177.9	-65.9	170.1	0	0	0	111.7	F245 R249 F252 V253 F273 E283 M284 S290 L306	F245-L287 HydrophobicContact CZ-CD1 4.28Å; R249-L287 HydrophobicContact CB-CD1 4.22Å; R249-L287 HydrophobicContact CG-CD1 3.98Å; R249-L287 HydrophobicContact CG-CD2 3.89Å; F252-L287 HydrophobicContact CD1-CB 4.03Å; F252-L287 HydrophobicContact CD1-CD2 4.15Å; F252-L287 HydrophobicContact CD1-CG 4.5Å; F252-L287 HydrophobicContact CE1-CB 3.91Å; F252-L287 WeakPolarHBondContact CE1-O 3.27Å; V253-L287 HydrophobicContact CG2-CD2 4.19Å; F273-L287 HydrophobicContact CD1-CD1 4.48Å; F273-L287 HydrophobicContact CE1-CD1 3.74Å; F273-L287 HydrophobicContact CZ-CD1 3.95Å; E283-L287 VanDerWaalsContact O-CG 3.3Å; E283-L287 WeakPolarHBondContact O-CG 3.11Å; E283-L287 PolarHBondContact O-N 3.16Å; M284-L287 PolarHBondContact O-N 2.91Å; L287-S290 PolarHBondContact O-N 3.01Å; L287-S290 PolarHBondContact O-OG 3.28Å; L287-L306 HydrophobicContact CD2-CD1 4.06Å; L287-L306 HydrophobicContact CD2-CD2 4.37Å
288	M	89.6	Confident	84.6	Confident	60 Å²	60	62.9 Å²	62.9	30%	0.296	36%	0.357	S	S	.	.	H	α-helix	trans	-68.4	-37	176.8	-64.4	-56.7	119.8	0	0	111.8	F252 A270 F273 M284 Q285 V286 M291	F252-M288 HydrophobicContact CE1-CE 4.27Å; F252-M288 HydrophobicContact CZ-CE 4.06Å; A270-M288 HydrophobicContact CB-CE 4.04Å; A270-M288 HydrophobicContact CB-SD 4.03Å; F273-M288 HydrophobicContact CB-CE 4.48Å; F273-M288 HydrophobicContact CD2-CE 3.85Å; F273-M288 HydrophobicContact CE2-CE 4.35Å; F273-M288 HydrophobicContact CG-CE 4.28Å; M284-M288 VanDerWaalsContact O-CG 3.31Å; M284-M288 WeakPolarHBondContact O-CG 3.48Å; M284-M288 PolarHBondContact O-N 3.11Å; Q285-M288 PolarHBondContact O-N 3.07Å; V286-M288 VanDerWaalsContact C-N 3.35Å; V286-M288 PolarHBondContact O-N 2.91Å; M288-M291 HydrophobicContact CB-CE 4.26Å; M288-M291 WeakPolarHBondContact O-CB 3.45Å; M288-M291 WeakPolarHBondContact O-CE 3.44Å; M288-M291 PolarHBondContact O-N 2.71Å; M288-M291 HydrophobicContact SD-CE 3.74Å
289	A	88	Confident	85	Confident	33 Å²	33	62.4 Å²	62.4	27%	0.273	35%	0.35	S	S	.	.	H	α-helix	trans	-70.9	-32.3	177.4	0	0	0	0	0	112.7	Q285 V286 M291 V292 Y303	Q285-A289 VanDerWaalsContact O-CB 3.3Å; Q285-A289 WeakPolarHBondContact O-CB 3.33Å; Q285-A289 PolarHBondContact O-N 2.97Å; V286-A289 PolarHBondContact O-N 2.85Å; A289-M291 PolarHBondContact O-N 3.22Å; A289-V292 WeakPolarHBondContact O-CB 3.24Å; A289-V292 WeakPolarHBondContact O-CG2 3.45Å; A289-V292 PolarHBondContact O-N 2.76Å; A289-V292 VanDerWaalsContact O-N 3.13Å; A289-Y303 HydrophobicContact CB-CE2 4.19Å; A289-Y303 VanDerWaalsContact CB-OH 3.25Å; A289-Y303 WeakPolarHBondContact CB-OH 3.28Å
290	S	87.6	Confident	85.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-64.7	-21.8	178	75.2	0	0	0	0	113	V286 L287 V292 F293	V286-S290 PolarHBondContact O-N 2.84Å; L287-S290 PolarHBondContact O-N 3.01Å; L287-S290 PolarHBondContact O-OG 3.28Å; S290-V292 PolarHBondContact O-N 3.18Å; S290-F293 PolarHBondContact O-N 3.38Å
291	M	85.3	Confident	85.5	Confident	46 Å²	46	61.7 Å²	61.7	23%	0.227	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-59.2	-26.5	173.2	-66.8	-165.8	-67	0	0	113.5	F252 I256 I266 M288 A289 F293 M294	F252-M291 HydrophobicContact CE1-CG 4.33Å; F252-M291 HydrophobicContact CZ-CG 3.86Å; F252-M291 HydrophobicContact CZ-SD 3.82Å; I256-M291 HydrophobicContact CD1-CG 4.2Å; I266-M291 HydrophobicContact CG2-CG 4.46Å; I266-M291 HydrophobicContact CG2-SD 3.96Å; M288-M291 HydrophobicContact CB-CE 4.26Å; M288-M291 WeakPolarHBondContact O-CB 3.45Å; M288-M291 WeakPolarHBondContact O-CE 3.44Å; M288-M291 PolarHBondContact O-N 2.71Å; M288-M291 HydrophobicContact SD-CE 3.74Å; A289-M291 PolarHBondContact O-N 3.22Å; M291-F293 PolarHBondContact O-N 3.07Å; M291-M294 HydrophobicContact CB-CE 4.07Å; M291-M294 HydrophobicContact CB-SD 4.42Å; M291-M294 WeakPolarHBondContact O-CB 3.46Å; M291-M294 WeakPolarHBondContact O-CE 3.49Å; M291-M294 WeakPolarHBondContact O-CG 3.44Å; M291-M294 PolarHBondContact O-N 2.86Å
292	V	86.7	Confident	85.7	Confident	119 Å²	119	62.4 Å²	62.4	72%	0.721	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-62.3	-29.1	177.7	179.7	0	0	0	0	111.2	A289 S290	A289-V292 WeakPolarHBondContact O-CB 3.24Å; A289-V292 WeakPolarHBondContact O-CG2 3.45Å; A289-V292 PolarHBondContact O-N 2.76Å; A289-V292 VanDerWaalsContact O-N 3.13Å; S290-V292 PolarHBondContact O-N 3.18Å
293	F	84.4	Confident	85.8	Confident	61 Å²	61	56.5 Å²	56.5	27%	0.268	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-92.7	12.2	-178.3	-61.2	-85.3	0	0	0	113.5	S290 M291 A295 S296 G297 S301 P302 Y303	S290-F293 PolarHBondContact O-N 3.38Å; M291-F293 PolarHBondContact O-N 3.07Å; F293-A295 PolarHBondContact O-N 3.05Å; F293-S296 PolarHBondContact O-N 3.47Å; F293-S296 PolarHBondContact O-OG 2.79Å; F293-G297 CarbonylContact O-C 2.95Å; F293-G297 WeakPolarHBondContact O-CA 3.34Å; F293-G297 PolarHBondContact O-N 2.8Å; F293-S301 VanDerWaalsContact CG-CB 3.49Å; F293-P302 HydrophobicContact CE2-CG 4.29Å; F293-P302 HydrophobicContact CZ-CG 4.23Å; F293-Y303 AromaticContact CD2-CD2 3.95Å; F293-Y303 HydrophobicContact CD2-CD2 3.95Å; F293-Y303 AromaticContact CD2-CE2 3.95Å; F293-Y303 HydrophobicContact CD2-CE2 3.95Å; F293-Y303 HydrophobicContact CE2-CD2 4.11Å; F293-Y303 AromaticContact CE2-CE2 3.74Å; F293-Y303 HydrophobicContact CE2-CE2 3.74Å
294	M	81.3	Confident	85.9	Confident	30 Å²	30	57.6 Å²	57.6	15%	0.148	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-57.5	-31.1	177.7	-79.2	-176	-59.3	0	0	113.7	I256 I266 M291	I256-M294 HydrophobicContact CG2-CG 4.07Å; I266-M294 HydrophobicContact CD1-SD 3.64Å; I266-M294 HydrophobicContact CG2-SD 4.22Å; M291-M294 HydrophobicContact CB-CE 4.07Å; M291-M294 HydrophobicContact CB-SD 4.42Å; M291-M294 WeakPolarHBondContact O-CB 3.46Å; M291-M294 WeakPolarHBondContact O-CE 3.49Å; M291-M294 WeakPolarHBondContact O-CG 3.44Å; M291-M294 PolarHBondContact O-N 2.86Å
295	A	79	Confident	86	Confident	90 Å²	90	60.9 Å²	60.9	74%	0.744	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-34.2	-179.9	0	0	0	0	0	112.8	F293	F293-A295 PolarHBondContact O-N 3.05Å
296	S	82	Confident	86.1	Confident	71 Å²	71	55.3 Å²	55.3	50%	0.497	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.7	-178.7	57.2	0	0	0	0	113.6	F293 S300	F293-S296 PolarHBondContact O-N 3.47Å; F293-S296 PolarHBondContact O-OG 2.79Å; S296-S300 PolarHBondContact O-OG 3.49Å
297	G	81.8	Confident	85.9	Confident	31 Å²	31	55.5 Å²	55.5	32%	0.32	32%	0.322	S	S	.	.			trans	86.9	153.1	-171.3	0	0	0	0	0	112.6	F293 S300	F293-G297 CarbonylContact O-C 2.95Å; F293-G297 WeakPolarHBondContact O-CA 3.34Å; F293-G297 PolarHBondContact O-N 2.8Å; G297-S300 PolarHBondContact O-OG 2.97Å
298	L	84.1	Confident	85.9	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.047	34%	0.335	C	S	.	.	S	Bend	trans	-75.6	-26.1	178.3	-120.4	61.9	0	0	0	112.9	V253 I256 S300 S301 N304 L306 L307	V253-L298 HydrophobicContact CG1-CD2 4.25Å; I256-L298 HydrophobicContact CG2-CD1 3.46Å; I256-L298 VanDerWaalsContact CG2-CD1 3.46Å; I256-L298 HydrophobicContact CG2-CD2 4.24Å; I256-L298 HydrophobicContact CG2-CG 4.41Å; L298-S300 VanDerWaalsContact C-N 3.32Å; L298-S300 PolarHBondContact O-N 2.63Å; L298-S301 WeakPolarHBondContact O-CB 3.42Å; L298-S301 PolarHBondContact O-N 2.76Å; L298-S301 VanDerWaalsContact O-N 3.13Å; L298-S301 PolarHBondContact O-OG 3.43Å; L298-N304 WeakPolarHBondContact O-CA 3.34Å; L298-L306 HydrophobicContact CD2-CB 4.34Å; L298-L306 HydrophobicContact CD2-CD1 4.4Å; L298-L307 HydrophobicContact CB-CD1 3.94Å; L298-L307 HydrophobicContact CB-CG 4.3Å; L298-L307 HydrophobicContact CD2-CD2 4.31Å; L298-L307 HydrophobicContact CD2-CG 4.43Å
299	E	85	Confident	85.9	Confident	154 Å²	154	59.1 Å²	59.1	72%	0.72	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-38.2	-179.6	-61.7	-177.1	170.6	0	0	112.6	S301 L307	E299-S301 VanDerWaalsContact C-N 3.27Å; E299-S301 PolarHBondContact O-N 3.19Å; E299-L307 HydrophobicContact CG-CD1 3.64Å
300	S	83.6	Confident	86.1	Confident	84 Å²	84	61.9 Å²	61.9	59%	0.587	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-3.4	178.2	61.7	0	0	0	0	113.2	S296 G297 L298	S296-S300 PolarHBondContact O-OG 3.49Å; G297-S300 PolarHBondContact O-OG 2.97Å; L298-S300 VanDerWaalsContact C-N 3.32Å; L298-S300 PolarHBondContact O-N 2.63Å
301	S	86.2	Confident	86.1	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.028	36%	0.359	C	S	.	.	S	Bend	trans	-94	160.2	-175.5	85.1	0	0	0	0	111.8	F293 L298 E299 Y303 N304	F293-S301 VanDerWaalsContact CG-CB 3.49Å; L298-S301 WeakPolarHBondContact O-CB 3.42Å; L298-S301 PolarHBondContact O-N 2.76Å; L298-S301 VanDerWaalsContact O-N 3.13Å; L298-S301 PolarHBondContact O-OG 3.43Å; E299-S301 VanDerWaalsContact C-N 3.27Å; E299-S301 PolarHBondContact O-N 3.19Å; S301-Y303 PolarHBondContact O-N 3.04Å; S301-Y303 WeakPolarHBondContact OG-CB 3.31Å; S301-Y303 PolarHBondContact OG-N 3.39Å; S301-Y303 VanDerWaalsContact OG-N 3.07Å; S301-N304 PolarHBondContact O-N 2.86Å
302	P	87.6	Confident	86.4	Confident	87 Å²	87	61.4 Å²	61.4	57%	0.565	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-7.9	169.6	27.6	-36	0	0	0	113.4	F293 Y305	F293-P302 HydrophobicContact CE2-CG 4.29Å; F293-P302 HydrophobicContact CZ-CG 4.23Å; P302-Y305 WeakPolarHBondContact O-CD1 3.46Å; P302-Y305 WeakPolarHBondContact O-CE1 3.26Å
303	Y	88.5	Confident	86.6	Confident	48 Å²	48	60.2 Å²	60.2	19%	0.188	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	15.9	179.9	-51.9	-65.9	0	0	0	113.7	V286 A289 F293 S301 Y305 L306	V286-Y303 HydrophobicContact CB-CE1 4.48Å; V286-Y303 HydrophobicContact CG1-CD1 3.71Å; V286-Y303 HydrophobicContact CG1-CE1 3.87Å; A289-Y303 HydrophobicContact CB-CE2 4.19Å; A289-Y303 VanDerWaalsContact CB-OH 3.25Å; A289-Y303 WeakPolarHBondContact CB-OH 3.28Å; F293-Y303 AromaticContact CD2-CD2 3.95Å; F293-Y303 HydrophobicContact CD2-CD2 3.95Å; F293-Y303 AromaticContact CD2-CE2 3.95Å; F293-Y303 HydrophobicContact CD2-CE2 3.95Å; F293-Y303 HydrophobicContact CE2-CD2 4.11Å; F293-Y303 AromaticContact CE2-CE2 3.74Å; F293-Y303 HydrophobicContact CE2-CE2 3.74Å; S301-Y303 PolarHBondContact O-N 3.04Å; S301-Y303 WeakPolarHBondContact OG-CB 3.31Å; S301-Y303 PolarHBondContact OG-N 3.39Å; S301-Y303 VanDerWaalsContact OG-N 3.07Å; Y303-Y305 HydrophobicContact CD1-CE1 4.11Å; Y303-Y305 PolarHBondContact O-N 2.94Å; Y303-L306 VanDerWaalsContact O-CB 3.3Å; Y303-L306 WeakPolarHBondContact O-CB 3.32Å; Y303-L306 WeakPolarHBondContact O-CG 3.48Å; Y303-L306 PolarHBondContact O-N 3.38Å
304	N	88.2	Confident	86.8	Confident	90 Å²	90	60 Å²	60	48%	0.481	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-52.4	-30.2	178.7	65.8	16.1	0	0	0	113.6	L298 S301 L306 L307	L298-N304 WeakPolarHBondContact O-CA 3.34Å; S301-N304 PolarHBondContact O-N 2.86Å; N304-L306 PolarHBondContact O-N 3.22Å; N304-L306 VanDerWaalsContact O-N 3.15Å; N304-L307 WeakPolarHBondContact O-CB 3.36Å; N304-L307 PolarHBondContact O-N 2.93Å
305	Y	90.3	Very high	87.1	Confident	97 Å²	97	58.6 Å²	58.6	38%	0.38	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-63.5	-19.6	178.5	68.1	-91.9	0	0	0	113.1	V286 P302 Y303 L307 S308 M311	V286-Y305 WeakPolarHBondContact CG1-OH 3.47Å; P302-Y305 WeakPolarHBondContact O-CD1 3.46Å; P302-Y305 WeakPolarHBondContact O-CE1 3.26Å; Y303-Y305 HydrophobicContact CD1-CE1 4.11Å; Y303-Y305 PolarHBondContact O-N 2.94Å; Y305-L307 PolarHBondContact O-N 3.13Å; Y305-S308 VanDerWaalsContact O-CB 3.28Å; Y305-S308 WeakPolarHBondContact O-CB 3.41Å; Y305-S308 PolarHBondContact O-N 3.32Å; Y305-S308 VanDerWaalsContact O-N 3.13Å; Y305-S308 PolarHBondContact O-OG 3.43Å; Y305-M311 HydrophobicContact CD2-CE 3.63Å; Y305-M311 HydrophobicContact CE2-CE 4.14Å; Y305-M311 WeakPolarHBondContact O-CE 3.42Å
306	L	89.1	Confident	87.5	Confident	9 Å²	9	55.4 Å²	55.4	5%	0.047	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-65.7	-21.7	172.2	-65.5	178.6	0	0	0	112.7	V253 V286 L287 L298 Y303 N304 M311	V253-L306 HydrophobicContact CG2-CB 4.12Å; V253-L306 HydrophobicContact CG2-CD1 4.48Å; V286-L306 HydrophobicContact CG1-CD1 4.26Å; V286-L306 HydrophobicContact CG1-CD2 4.43Å; L287-L306 HydrophobicContact CD2-CD1 4.06Å; L287-L306 HydrophobicContact CD2-CD2 4.37Å; L298-L306 HydrophobicContact CD2-CB 4.34Å; L298-L306 HydrophobicContact CD2-CD1 4.4Å; Y303-L306 VanDerWaalsContact O-CB 3.3Å; Y303-L306 WeakPolarHBondContact O-CB 3.32Å; Y303-L306 WeakPolarHBondContact O-CG 3.48Å; Y303-L306 PolarHBondContact O-N 3.38Å; N304-L306 PolarHBondContact O-N 3.22Å; N304-L306 VanDerWaalsContact O-N 3.15Å; L306-M311 HydrophobicContact CD2-CE 4.38Å; L306-M311 WeakPolarHBondContact O-CG 3.25Å
307	L	87.4	Confident	87.7	Confident	42 Å²	42	55 Å²	55	22%	0.22	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-87	-7.5	175.1	-59.5	173.9	0	0	0	112.8	V253 L298 E299 N304 Y305	V253-L307 HydrophobicContact CG1-CD2 3.66Å; L298-L307 HydrophobicContact CB-CD1 3.94Å; L298-L307 HydrophobicContact CB-CG 4.3Å; L298-L307 HydrophobicContact CD2-CD2 4.31Å; L298-L307 HydrophobicContact CD2-CG 4.43Å; E299-L307 HydrophobicContact CG-CD1 3.64Å; N304-L307 WeakPolarHBondContact O-CB 3.36Å; N304-L307 PolarHBondContact O-N 2.93Å; Y305-L307 PolarHBondContact O-N 3.13Å
308	S	89.2	Confident	87.9	Confident	41 Å²	41	54.2 Å²	54.2	29%	0.287	30%	0.296	S	S	.	.	S	Bend	trans	-67.6	148.9	-176.9	69.3	0	0	0	0	112.5	Y305 N310 M311	Y305-S308 VanDerWaalsContact O-CB 3.28Å; Y305-S308 WeakPolarHBondContact O-CB 3.41Å; Y305-S308 PolarHBondContact O-N 3.32Å; Y305-S308 VanDerWaalsContact O-N 3.13Å; Y305-S308 PolarHBondContact O-OG 3.43Å; S308-N310 PolarHBondContact O-N 3.32Å; S308-N310 VanDerWaalsContact O-N 3.14Å; S308-M311 WeakPolarHBondContact O-CB 3.14Å; S308-M311 PolarHBondContact O-N 2.93Å
309	D	89.6	Confident	87.9	Confident	96 Å²	96	53.8 Å²	53.8	51%	0.513	29%	0.294	S	S	.	.	H	α-helix	trans	-62.1	-22	177.4	-61.7	-32.3	0	0	0	112.3	K208 M311 W312 D313	K208-D309 WeakPolarHBondContact CE-OD1 3.48Å; K208-D309 IonicContact NZ-OD1 3.91Å; K208-D309 PolarHBondContact NZ-OD1 2.93Å; D309-M311 PolarHBondContact O-N 3.45Å; D309-M311 VanDerWaalsContact O-N 3.15Å; D309-W312 WeakPolarHBondContact O-CA 3.35Å; D309-W312 VanDerWaalsContact O-CB 3.3Å; D309-W312 WeakPolarHBondContact O-CB 3.3Å; D309-W312 PolarHBondContact O-N 3.39Å; D309-D313 PolarHBondContact O-N 3.45Å
310	N	90.3	Very high	87.8	Confident	90 Å²	90	48.8 Å²	48.8	48%	0.481	27%	0.274	S	S	.	.	H	α-helix	trans	-57.4	-30	172.4	-174.8	30.2	0	0	0	113	S308 W312 D313 Q314	S308-N310 PolarHBondContact O-N 3.32Å; S308-N310 VanDerWaalsContact O-N 3.14Å; N310-W312 VanDerWaalsContact C-N 3.29Å; N310-W312 PolarHBondContact O-N 2.85Å; N310-D313 PolarHBondContact O-N 2.82Å; N310-Q314 WeakPolarHBondContact O-CG 3.34Å; N310-Q314 PolarHBondContact O-N 3.25Å; N310-Q314 VanDerWaalsContact O-N 3.08Å
311	M	89.1	Confident	87.7	Confident	16 Å²	16	46.6 Å²	46.6	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-67.6	-33.3	175.7	-64.5	-60.8	157.3	0	0	112	R249 L250 Y305 L306 S308 D309 A315	R249-M311 VanDerWaalsContact CZ-SD 3.53Å; R249-M311 PolarHBondContact NH2-O 2.98Å; L250-M311 HydrophobicContact CD2-CB 3.88Å; Y305-M311 HydrophobicContact CD2-CE 3.63Å; Y305-M311 HydrophobicContact CE2-CE 4.14Å; Y305-M311 WeakPolarHBondContact O-CE 3.42Å; L306-M311 HydrophobicContact CD2-CE 4.38Å; L306-M311 WeakPolarHBondContact O-CG 3.25Å; S308-M311 WeakPolarHBondContact O-CB 3.14Å; S308-M311 PolarHBondContact O-N 2.93Å; D309-M311 PolarHBondContact O-N 3.45Å; D309-M311 VanDerWaalsContact O-N 3.15Å; M311-A315 PolarHBondContact O-N 3.17Å
312	W	90.9	Very high	87.4	Confident	20 Å²	20	47.1 Å²	47.1	8%	0.076	26%	0.262	C	S	.	.	H	α-helix	trans	-74.5	-43.2	175	-65.8	88.5	0	0	0	110.8	L205 K208 I210 L250 D309 N310 Q314 A315 I316	L205-W312 HydrophobicContact CD2-CE3 4.41Å; L205-W312 HydrophobicContact CD2-CZ3 4.18Å; L205-W312 WeakPolarHBondContact O-CZ3 3.29Å; K208-W312 VanDerWaalsContact CA-CZ3 3.5Å; K208-W312 HydrophobicContact CB-CH2 3.76Å; K208-W312 HydrophobicContact CB-CZ2 3.64Å; K208-W312 HydrophobicContact CB-CZ3 4.33Å; K208-W312 HydrophobicContact CD-CZ2 4.42Å; K208-W312 HydrophobicContact CG-CD2 4.29Å; K208-W312 HydrophobicContact CG-CH2 4.34Å; K208-W312 HydrophobicContact CG-CZ2 3.87Å; K208-W312 VanDerWaalsContact O-CH2 3.27Å; K208-W312 WeakPolarHBondContact O-CH2 3.43Å; I210-W312 HydrophobicContact CD1-CH2 3.91Å; I210-W312 HydrophobicContact CD1-CZ3 4.44Å; I210-W312 HydrophobicContact CG1-CH2 3.49Å; I210-W312 VanDerWaalsContact CG1-CH2 3.49Å; I210-W312 HydrophobicContact CG1-CZ3 3.73Å; L250-W312 HydrophobicContact CD1-CD2 4.09Å; L250-W312 HydrophobicContact CD1-CE3 3.8Å; L250-W312 HydrophobicContact CD1-CZ3 4.03Å; L250-W312 HydrophobicContact CD2-CD2 3.98Å; L250-W312 HydrophobicContact CD2-CE3 4.48Å; L250-W312 HydrophobicContact CD2-CG 4.21Å; L250-W312 HydrophobicContact CD2-CZ2 4.25Å; D309-W312 WeakPolarHBondContact O-CA 3.35Å; D309-W312 VanDerWaalsContact O-CB 3.3Å; D309-W312 WeakPolarHBondContact O-CB 3.3Å; D309-W312 PolarHBondContact O-N 3.39Å; N310-W312 VanDerWaalsContact C-N 3.29Å; N310-W312 PolarHBondContact O-N 2.85Å; W312-Q314 VanDerWaalsContact C-N 3.27Å; W312-Q314 PolarHBondContact O-N 3.12Å; W312-A315 WeakPolarHBondContact O-CB 3.19Å; W312-A315 PolarHBondContact O-N 3.03Å; W312-I316 WeakPolarHBondContact O-CG1 3.37Å; W312-I316 PolarHBondContact O-N 3.48Å
313	D	90.2	Very high	87	Confident	94 Å²	94	43.2 Å²	43.2	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-57.4	-39.8	176.2	-66.8	-36.6	0	0	0	112.1	D309 N310 I316 A317	D309-D313 PolarHBondContact O-N 3.45Å; N310-D313 PolarHBondContact O-N 2.82Å; D313-I316 PolarHBondContact O-N 3.38Å; D313-A317 VanDerWaalsContact O-CB 3.26Å; D313-A317 WeakPolarHBondContact O-CB 3.46Å; D313-A317 PolarHBondContact O-N 3.17Å
314	Q	89.7	Confident	86.6	Confident	58 Å²	58	41.4 Å²	41.4	27%	0.271	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-42.6	174.5	-73.9	174.7	18.1	0	0	112.6	R249 N310 W312 A318	R249-Q314 VanDerWaalsContact NH1-OE1 3.13Å; N310-Q314 WeakPolarHBondContact O-CG 3.34Å; N310-Q314 PolarHBondContact O-N 3.25Å; N310-Q314 VanDerWaalsContact O-N 3.08Å; W312-Q314 VanDerWaalsContact C-N 3.27Å; W312-Q314 PolarHBondContact O-N 3.12Å; Q314-A318 WeakPolarHBondContact O-CB 3.39Å; Q314-A318 PolarHBondContact O-N 3.06Å
315	A	86.6	Confident	86	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-42.1	178.1	0	0	0	0	0	111.3	L247 L250 M311 W312 A318 F319	L247-A315 HydrophobicContact CD2-CB 4.44Å; L250-A315 HydrophobicContact CD1-CB 3.54Å; M311-A315 PolarHBondContact O-N 3.17Å; W312-A315 WeakPolarHBondContact O-CB 3.19Å; W312-A315 PolarHBondContact O-N 3.03Å; A315-A318 PolarHBondContact O-N 3.05Å; A315-F319 VanDerWaalsContact O-CB 3.25Å; A315-F319 WeakPolarHBondContact O-CB 3.41Å; A315-F319 PolarHBondContact O-N 3.48Å
316	I	87.2	Confident	85.2	Confident	22 Å²	22	41 Å²	41	11%	0.113	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-49.3	175.9	-67.9	165.4	0	0	0	110.2	V202 L205 K206 W312 D313 A318 F319 T320	V202-I316 HydrophobicContact CG1-CG2 4.01Å; L205-I316 HydrophobicContact CB-CD1 4.15Å; L205-I316 HydrophobicContact CB-CG1 3.73Å; L205-I316 HydrophobicContact CD1-CG1 4.01Å; K206-I316 HydrophobicContact CG-CD1 3.82Å; W312-I316 WeakPolarHBondContact O-CG1 3.37Å; W312-I316 PolarHBondContact O-N 3.48Å; D313-I316 PolarHBondContact O-N 3.38Å; I316-A318 VanDerWaalsContact C-N 3.35Å; I316-A318 PolarHBondContact O-N 2.78Å; I316-F319 WeakPolarHBondContact O-CB 3.43Å; I316-F319 PolarHBondContact O-N 2.69Å; I316-T320 PolarHBondContact O-N 2.62Å; I316-T320 PolarHBondContact O-OG1 3.39Å; I316-T320 VanDerWaalsContact O-OG1 3.05Å
317	A	87.5	Confident	84.4	Confident	62 Å²	62	43.8 Å²	43.8	51%	0.512	24%	0.243	S	C	.	.	H	α-helix	trans	-61.3	-42.5	179.7	0	0	0	0	0	112.3	D313 S321	D313-A317 VanDerWaalsContact O-CB 3.26Å; D313-A317 WeakPolarHBondContact O-CB 3.46Å; D313-A317 PolarHBondContact O-N 3.17Å; A317-S321 VanDerWaalsContact O-CB 3.3Å; A317-S321 WeakPolarHBondContact O-CB 3.25Å; A317-S321 PolarHBondContact O-N 2.96Å
318	A	85.2	Confident	83.6	Confident	15 Å²	15	52.9 Å²	52.9	12%	0.124	27%	0.274	C	S	.	.	H	α-helix	trans	-64.1	-44.7	175.2	0	0	0	0	0	111.7	L243 Y246 Q314 A315 I316 S321 D322	L243-A318 HydrophobicContact CB-CB 4.3Å; L243-A318 HydrophobicContact CD1-CB 4.22Å; Y246-A318 HydrophobicContact CD2-CB 3.63Å; Y246-A318 HydrophobicContact CE2-CB 3.76Å; Q314-A318 WeakPolarHBondContact O-CB 3.39Å; Q314-A318 PolarHBondContact O-N 3.06Å; A315-A318 PolarHBondContact O-N 3.05Å; I316-A318 VanDerWaalsContact C-N 3.35Å; I316-A318 PolarHBondContact O-N 2.78Å; A318-S321 PolarHBondContact O-N 3.02Å; A318-D322 WeakPolarHBondContact O-CB 3.18Å; A318-D322 VanDerWaalsContact O-CG 3.3Å; A318-D322 PolarHBondContact O-N 3.39Å
319	F	85	Confident	83	Confident	1 Å²	1	52.4 Å²	52.4	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-58.5	-52.1	177.2	174.3	-100.6	0	0	0	111.4	M198 I201 V202 Y216 L243 A315 I316 S321 D322 W323	M198-F319 HydrophobicContact CG-CE1 3.83Å; M198-F319 HydrophobicContact CG-CZ 4.47Å; I201-F319 HydrophobicContact CB-CE1 3.99Å; I201-F319 HydrophobicContact CB-CE2 4.5Å; I201-F319 HydrophobicContact CB-CZ 3.76Å; I201-F319 HydrophobicContact CD1-CE2 4.24Å; I201-F319 HydrophobicContact CD1-CZ 3.65Å; I201-F319 HydrophobicContact CG1-CZ 4.33Å; I201-F319 HydrophobicContact CG2-CD1 4.34Å; I201-F319 HydrophobicContact CG2-CD2 4.34Å; I201-F319 HydrophobicContact CG2-CE1 3.79Å; I201-F319 HydrophobicContact CG2-CE2 3.78Å; I201-F319 HydrophobicContact CG2-CZ 3.5Å; I201-F319 VanDerWaalsContact CG2-CZ 3.5Å; V202-F319 HydrophobicContact CG2-CD1 3.86Å; V202-F319 HydrophobicContact CG2-CE1 3.93Å; Y216-F319 HydrophobicContact CD1-CD2 4.5Å; Y216-F319 AromaticContact CD1-CE2 3.51Å; Y216-F319 HydrophobicContact CD1-CE2 3.51Å; Y216-F319 HydrophobicContact CD1-CZ 4.23Å; Y216-F319 AromaticContact CE1-CE2 3.66Å; Y216-F319 HydrophobicContact CE1-CE2 3.66Å; Y216-F319 HydrophobicContact CE1-CZ 4.27Å; Y216-F319 HydrophobicContact CG-CE2 4.11Å; L243-F319 HydrophobicContact CD1-CB 3.83Å; L243-F319 HydrophobicContact CD2-CB 4.35Å; L243-F319 HydrophobicContact CD2-CD2 4.05Å; A315-F319 VanDerWaalsContact O-CB 3.25Å; A315-F319 WeakPolarHBondContact O-CB 3.41Å; A315-F319 PolarHBondContact O-N 3.48Å; I316-F319 WeakPolarHBondContact O-CB 3.43Å; I316-F319 PolarHBondContact O-N 2.69Å; F319-S321 VanDerWaalsContact C-N 3.34Å; F319-S321 PolarHBondContact O-N 3.41Å; F319-D322 PolarHBondContact O-N 2.84Å; F319-W323 WeakPolarHBondContact O-CB 3.48Å; F319-W323 PolarHBondContact O-N 3.33Å
320	T	82.9	Confident	82.1	Confident	49 Å²	49	51.2 Å²	51.2	30%	0.301	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-44.2	178.6	-57.3	0	0	0	0	111.3	I316 C324	I316-T320 PolarHBondContact O-N 2.62Å; I316-T320 PolarHBondContact O-OG1 3.39Å; I316-T320 VanDerWaalsContact O-OG1 3.05Å; T320-C324 WeakPolarHBondContact O-CB 3.48Å; T320-C324 PolarHBondContact O-N 2.86Å; T320-C324 PolarHBondContact O-SG 3.42Å
321	S	82.1	Confident	81.1	Confident	38 Å²	38	52 Å²	52	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-58.7	-50	176.4	156.9	0	0	0	0	112.1	A317 A318 F319 C324 K325	A317-S321 VanDerWaalsContact O-CB 3.3Å; A317-S321 WeakPolarHBondContact O-CB 3.25Å; A317-S321 PolarHBondContact O-N 2.96Å; A318-S321 PolarHBondContact O-N 3.02Å; F319-S321 VanDerWaalsContact C-N 3.34Å; F319-S321 PolarHBondContact O-N 3.41Å; S321-C324 WeakPolarHBondContact O-CB 3.22Å; S321-C324 PolarHBondContact O-N 2.96Å; S321-K325 WeakPolarHBondContact O-CG 3.36Å; S321-K325 PolarHBondContact O-N 3.44Å; S321-K325 VanDerWaalsContact O-N 3.07Å; S321-K325 WeakPolarHBondContact OG-CE 3.38Å; S321-K325 PolarHBondContact OG-NZ 3.41Å
322	D	78.8	Confident	80.3	Confident	15 Å²	15	54 Å²	54	8%	0.08	29%	0.289	C	S	.	.	H	α-helix	trans	-72.5	-35.4	-175.6	-65.9	-23.2	0	0	0	111.9	S241 A318 F319 C324 K325 V326	S241-D322 WeakPolarHBondContact CB-OD2 3.48Å; S241-D322 PolarHBondContact OG-OD2 3.39Å; A318-D322 WeakPolarHBondContact O-CB 3.18Å; A318-D322 VanDerWaalsContact O-CG 3.3Å; A318-D322 PolarHBondContact O-N 3.39Å; F319-D322 PolarHBondContact O-N 2.84Å; D322-C324 VanDerWaalsContact C-N 3.35Å; D322-C324 PolarHBondContact O-N 3Å; D322-K325 PolarHBondContact O-N 2.95Å; D322-K325 IonicContact OD1-NZ 2.96Å; D322-K325 PolarHBondContact OD1-NZ 3.48Å; D322-V326 VanDerWaalsContact O-CG2 3.27Å; D322-V326 WeakPolarHBondContact O-CG2 3.41Å; D322-V326 PolarHBondContact O-N 3.13Å
323	W	79.6	Confident	79.9	Confident	5 Å²	5	54 Å²	54	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-57.8	-47.1	170.5	-174.6	99.5	0	0	0	111.4	R194 F195 M198 Y216 F319 K325 V326 Y327 I329	R194-W323 HydrophobicContact CB-CH2 4.43Å; R194-W323 HydrophobicContact CB-CZ2 3.8Å; R194-W323 WeakPolarHBondContact O-CZ2 3.32Å; F195-W323 AromaticContact CD1-CH2 3.68Å; F195-W323 HydrophobicContact CD1-CH2 3.68Å; F195-W323 HydrophobicContact CD1-CZ3 4.19Å; F195-W323 AromaticContact CE1-CH2 3.65Å; F195-W323 HydrophobicContact CE1-CH2 3.65Å; F195-W323 AromaticContact CE1-CZ3 3.79Å; F195-W323 HydrophobicContact CE1-CZ3 3.79Å; F195-W323 HydrophobicContact CE2-CH2 4.47Å; F195-W323 HydrophobicContact CG-CH2 4.12Å; F195-W323 HydrophobicContact CZ-CH2 4.06Å; F195-W323 HydrophobicContact CZ-CZ3 4.28Å; M198-W323 HydrophobicContact CB-CD2 4.17Å; M198-W323 HydrophobicContact CB-CH2 4.44Å; M198-W323 HydrophobicContact CB-CZ2 3.75Å; M198-W323 HydrophobicContact CG-CD2 3.72Å; M198-W323 HydrophobicContact CG-CE3 4.23Å; M198-W323 HydrophobicContact CG-CG 3.89Å; M198-W323 HydrophobicContact CG-CZ2 4.18Å; M198-W323 HydrophobicContact SD-CD2 3.59Å; M198-W323 VanDerWaalsContact SD-CD2 3.59Å; M198-W323 HydrophobicContact SD-CE3 3.44Å; M198-W323 HydrophobicContact SD-CG 4.19Å; M198-W323 HydrophobicContact SD-CH2 3.98Å; M198-W323 HydrophobicContact SD-CZ2 4.11Å; M198-W323 HydrophobicContact SD-CZ3 3.64Å; Y216-W323 AromaticContact CZ-CD1 3.76Å; F319-W323 WeakPolarHBondContact O-CB 3.48Å; F319-W323 PolarHBondContact O-N 3.33Å; W323-K325 VanDerWaalsContact C-N 3.34Å; W323-K325 PolarHBondContact O-N 2.99Å; W323-V326 PolarHBondContact O-N 2.92Å; W323-Y327 AromaticContact CD1-CD2 3.89Å; W323-Y327 AromaticContact CD1-CE2 3.62Å; W323-Y327 AromaticContact CD2-CD2 3.74Å; W323-Y327 HydrophobicContact CD2-CD2 3.74Å; W323-Y327 HydrophobicContact CD2-CE2 4.21Å; W323-Y327 AromaticContact CE2-CD2 3.46Å; W323-Y327 VanDerWaalsContact CE2-CD2 3.46Å; W323-Y327 AromaticContact CE2-CE2 3.66Å; W323-Y327 HydrophobicContact CE3-CD2 4.41Å; W323-Y327 AromaticContact CG-CD2 3.99Å; W323-Y327 HydrophobicContact CG-CD2 3.99Å; W323-Y327 HydrophobicContact CG-CE2 4.16Å; W323-Y327 AromaticContact CZ2-CD2 3.96Å; W323-Y327 HydrophobicContact CZ2-CD2 3.96Å; W323-Y327 HydrophobicContact CZ2-CE2 4.29Å; W323-Y327 AromaticContact NE1-CD2 3.56Å; W323-Y327 AromaticContact NE1-CE2 3.25Å; W323-Y327 WeakPolarHBondContact O-CD2 3.38Å; W323-Y327 PolarHBondContact O-N 3.43Å; W323-Y327 VanDerWaalsContact O-N 3.07Å; W323-I329 HydrophobicContact CE3-CD1 4.28Å; W323-I329 HydrophobicContact CH2-CD1 3.25Å; W323-I329 HydrophobicContact CZ2-CD1 4.24Å; W323-I329 HydrophobicContact CZ3-CB 4.29Å; W323-I329 HydrophobicContact CZ3-CD1 3.28Å; W323-I329 HydrophobicContact CZ3-CG1 4.35Å; W323-I329 HydrophobicContact CZ3-CG2 4.33Å
324	C	79.2	Confident	79.5	Confident	10 Å²	10	52.2 Å²	52.2	7%	0.068	29%	0.286	C	S	.	.	H	α-helix	trans	-58.3	-44.5	175.3	-76.2	0	0	0	0	111.9	T320 S321 D322 R328 I329 T331	T320-C324 WeakPolarHBondContact O-CB 3.48Å; T320-C324 PolarHBondContact O-N 2.86Å; T320-C324 PolarHBondContact O-SG 3.42Å; S321-C324 WeakPolarHBondContact O-CB 3.22Å; S321-C324 PolarHBondContact O-N 2.96Å; D322-C324 VanDerWaalsContact C-N 3.35Å; D322-C324 PolarHBondContact O-N 3Å; C324-R328 WeakPolarHBondContact O-CA 3.42Å; C324-R328 PolarHBondContact O-N 2.94Å; C324-I329 WeakPolarHBondContact CB-O 3.23Å; C324-I329 PolarHBondContact O-N 3.13Å; C324-T331 HydrophobicContact CB-CG2 3.8Å
325	K	76.2	Confident	79.4	Confident	96 Å²	96	50.6 Å²	50.6	42%	0.417	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-45.3	177.9	-68.4	171.5	-167.1	164	0	112.3	L239 S321 D322 W323 R328	L239-K325 HydrophobicContact CD2-CB 4.39Å; L239-K325 HydrophobicContact CD2-CD 4.26Å; S321-K325 WeakPolarHBondContact O-CG 3.36Å; S321-K325 PolarHBondContact O-N 3.44Å; S321-K325 VanDerWaalsContact O-N 3.07Å; S321-K325 WeakPolarHBondContact OG-CE 3.38Å; S321-K325 PolarHBondContact OG-NZ 3.41Å; D322-K325 PolarHBondContact O-N 2.95Å; D322-K325 IonicContact OD1-NZ 2.96Å; D322-K325 PolarHBondContact OD1-NZ 3.48Å; W323-K325 VanDerWaalsContact C-N 3.34Å; W323-K325 PolarHBondContact O-N 2.99Å; K325-R328 PolarHBondContact O-N 2.7Å
326	V	73.1	Confident	79.3	Confident	81 Å²	81	52.6 Å²	52.6	49%	0.491	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-44.6	-178	168.9	0	0	0	0	111.1	L239 D322 W323 R328	L239-V326 HydrophobicContact CD1-CG2 4.39Å; D322-V326 VanDerWaalsContact O-CG2 3.27Å; D322-V326 WeakPolarHBondContact O-CG2 3.41Å; D322-V326 PolarHBondContact O-N 3.13Å; W323-V326 PolarHBondContact O-N 2.92Å; V326-R328 VanDerWaalsContact C-N 3.34Å
327	Y	73.2	Confident	79.1	Confident	69 Å²	69	52.2 Å²	52.2	27%	0.271	29%	0.292	S	S	.	.	H	α-helix	trans	-89	4.4	-179.3	-67.5	-68.6	0	0	0	114.4	R194 Y216 W323 I329	R194-Y327 HydrophobicContact CG-CD1 4.31Å; R194-Y327 HydrophobicContact CG-CE1 4.07Å; Y216-Y327 VanDerWaalsContact OH-CE2 3.27Å; Y216-Y327 WeakPolarHBondContact OH-CE2 3.43Å; W323-Y327 AromaticContact CD1-CD2 3.89Å; W323-Y327 AromaticContact CD1-CE2 3.62Å; W323-Y327 AromaticContact CD2-CD2 3.74Å; W323-Y327 HydrophobicContact CD2-CD2 3.74Å; W323-Y327 HydrophobicContact CD2-CE2 4.21Å; W323-Y327 AromaticContact CE2-CD2 3.46Å; W323-Y327 VanDerWaalsContact CE2-CD2 3.46Å; W323-Y327 AromaticContact CE2-CE2 3.66Å; W323-Y327 HydrophobicContact CE3-CD2 4.41Å; W323-Y327 AromaticContact CG-CD2 3.99Å; W323-Y327 HydrophobicContact CG-CD2 3.99Å; W323-Y327 HydrophobicContact CG-CE2 4.16Å; W323-Y327 AromaticContact CZ2-CD2 3.96Å; W323-Y327 HydrophobicContact CZ2-CD2 3.96Å; W323-Y327 HydrophobicContact CZ2-CE2 4.29Å; W323-Y327 AromaticContact NE1-CD2 3.56Å; W323-Y327 AromaticContact NE1-CE2 3.25Å; W323-Y327 WeakPolarHBondContact O-CD2 3.38Å; W323-Y327 PolarHBondContact O-N 3.43Å; W323-Y327 VanDerWaalsContact O-N 3.07Å; Y327-I329 PolarHBondContact O-N 3.29Å
328	R	71	Confident	79	Confident	232 Å²	232	54 Å²	54	88%	0.875	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	36.1	-175.9	-56.1	-177.6	178.6	-172.5	-1.1	112.8	C324 K325 V326	C324-R328 WeakPolarHBondContact O-CA 3.42Å; C324-R328 PolarHBondContact O-N 2.94Å; K325-R328 PolarHBondContact O-N 2.7Å; V326-R328 VanDerWaalsContact C-N 3.34Å
329	I	74.7	Confident	79	Confident	31 Å²	31	57.4 Å²	57.4	16%	0.159	31%	0.307	C	S	.	.			trans	-91	132	175.7	-67.6	168.4	0	0	0	107.5	F195 W323 C324 Y327 T331	F195-I329 HydrophobicContact CE2-CD1 4.3Å; F195-I329 HydrophobicContact CZ-CD1 4.03Å; F195-I329 HydrophobicContact CZ-CG2 4.11Å; W323-I329 HydrophobicContact CE3-CD1 4.28Å; W323-I329 HydrophobicContact CH2-CD1 3.25Å; W323-I329 HydrophobicContact CZ2-CD1 4.24Å; W323-I329 HydrophobicContact CZ3-CB 4.29Å; W323-I329 HydrophobicContact CZ3-CD1 3.28Å; W323-I329 HydrophobicContact CZ3-CG1 4.35Å; W323-I329 HydrophobicContact CZ3-CG2 4.33Å; C324-I329 WeakPolarHBondContact CB-O 3.23Å; C324-I329 PolarHBondContact O-N 3.13Å; Y327-I329 PolarHBondContact O-N 3.29Å; I329-T331 PolarHBondContact O-N 3.4Å
330	P	71.6	Confident	78.9	Confident	72 Å²	72	62.5 Å²	62.5	47%	0.468	33%	0.33	S	S	.	.			trans	-54.8	131.8	173.3	-25.5	34.7	0	0	0	110.9	S332	P330-S332 WeakPolarHBondContact CB-O 3.32Å; P330-S332 PolarHBondContact O-N 3.39Å
331	T	68.9	Low	78.8	Confident	106 Å²	106	62 Å²	62	65%	0.65	33%	0.327	S	S	*	.	S	Bend	trans	-64.3	-26.7	178.4	39.3	0	0	0	0	112.9	C324 I329	C324-T331 HydrophobicContact CB-CG2 3.8Å; I329-T331 PolarHBondContact O-N 3.4Å
332	S	73.6	Confident	78.8	Confident	58 Å²	58	61.5 Å²	61.5	41%	0.406	33%	0.328	S	S	.	.	S	Bend	trans	-106.9	137.4	173	-57.6	0	0	0	0	109.6	P330 P334	P330-S332 WeakPolarHBondContact CB-O 3.32Å; P330-S332 PolarHBondContact O-N 3.39Å; S332-P334 WeakPolarHBondContact O-CD 3.28Å
333	S	81	Confident	78.7	Confident	19 Å²	19	64.2 Å²	64.2	13%	0.133	34%	0.342	C	S	.	.			trans	-61.5	127.3	175.5	-170.6	0	0	0	0	109.6	H166 L335 S336 V337	H166-S333 WeakPolarHBondContact ND1-CB 3.27Å; H166-S333 PolarHBondContact ND1-OG 3.26Å; S333-L335 PolarHBondContact O-N 2.93Å; S333-L335 VanDerWaalsContact O-N 3.14Å; S333-S336 WeakPolarHBondContact O-CB 3.49Å; S333-S336 PolarHBondContact O-N 3.42Å; S333-V337 PolarHBondContact O-N 2.68Å; S333-V337 VanDerWaalsContact O-N 3.09Å
334	P	82.4	Confident	78.7	Confident	58 Å²	58	68.1 Å²	68.1	38%	0.377	36%	0.359	S	S	.	.	H	α-helix	trans	-54.1	-35.2	177.8	-27.9	35.3	0	0	0	112.5	L162 S332 V337 I338	L162-P334 HydrophobicContact CD1-CB 4Å; S332-P334 WeakPolarHBondContact O-CD 3.28Å; P334-V337 PolarHBondContact O-N 3.24Å; P334-I338 WeakPolarHBondContact O-CB 3.22Å; P334-I338 WeakPolarHBondContact O-CD1 3.46Å; P334-I338 WeakPolarHBondContact O-CG1 3.42Å; P334-I338 PolarHBondContact O-N 3.3Å
335	L	87.3	Confident	78.6	Confident	24 Å²	24	68.4 Å²	68.4	13%	0.126	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-45.6	176	-177.1	64.6	0	0	0	111.9	L162 L163 H166 S333 V337 I338 I339	L162-L335 HydrophobicContact CD1-CB 4.2Å; L162-L335 HydrophobicContact CD2-CD1 3.86Å; L162-L335 HydrophobicContact CG-CB 4.19Å; L162-L335 HydrophobicContact CG-CD1 4.21Å; L163-L335 HydrophobicContact CD2-CD2 3.81Å; H166-L335 HydrophobicContact CB-CB 4.11Å; H166-L335 HydrophobicContact CB-CD2 3.7Å; S333-L335 PolarHBondContact O-N 2.93Å; S333-L335 VanDerWaalsContact O-N 3.14Å; L335-V337 VanDerWaalsContact C-N 3.31Å; L335-V337 PolarHBondContact O-N 3.48Å; L335-I338 PolarHBondContact O-N 3.46Å; L335-I339 HydrophobicContact CD1-CD1 4.03Å; L335-I339 HydrophobicContact CD1-CG1 4.3Å; L335-I339 HydrophobicContact CD2-CD1 4.45Å; L335-I339 HydrophobicContact CG-CD1 3.83Å; L335-I339 HydrophobicContact CG-CG1 4.45Å; L335-I339 WeakPolarHBondContact O-CB 3.49Å; L335-I339 VanDerWaalsContact O-CG1 3.28Å; L335-I339 WeakPolarHBondContact O-CG1 3.36Å; L335-I339 PolarHBondContact O-N 3.41Å
336	S	84.3	Confident	78.8	Confident	42 Å²	42	65.4 Å²	65.4	29%	0.294	35%	0.352	S	S	.	.	H	α-helix	trans	-60.1	-43.4	177	-59.5	0	0	0	0	111.2	H166 S333 I339 E340	H166-S336 PolarHBondContact CE1-OG 3.12Å; S333-S336 WeakPolarHBondContact O-CB 3.49Å; S333-S336 PolarHBondContact O-N 3.42Å; S336-I339 PolarHBondContact O-N 3.23Å; S336-E340 WeakPolarHBondContact O-CB 3.43Å; S336-E340 WeakPolarHBondContact O-CG 3.37Å; S336-E340 PolarHBondContact O-N 3.24Å
337	V	84.3	Confident	78.9	Confident	14 Å²	14	61.9 Å²	61.9	9%	0.085	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-44.8	177.4	-180	0	0	0	0	111.2	S333 P334 L335 I339 E340 V341 F380 Y383	S333-V337 PolarHBondContact O-N 2.68Å; S333-V337 VanDerWaalsContact O-N 3.09Å; P334-V337 PolarHBondContact O-N 3.24Å; L335-V337 VanDerWaalsContact C-N 3.31Å; L335-V337 PolarHBondContact O-N 3.48Å; V337-I339 VanDerWaalsContact C-N 3.33Å; V337-I339 PolarHBondContact O-N 3.09Å; V337-E340 PolarHBondContact O-N 3.07Å; V337-V341 HydrophobicContact CG1-CG2 4.23Å; V337-V341 WeakPolarHBondContact O-CB 3.01Å; V337-V341 VanDerWaalsContact O-CG2 3.24Å; V337-V341 WeakPolarHBondContact O-CG2 3.37Å; V337-V341 PolarHBondContact O-N 2.77Å; V337-F380 HydrophobicContact CG1-CD1 4.32Å; V337-Y383 HydrophobicContact CG1-CE2 4.02Å
338	I	85.3	Confident	79	Confident	98 Å²	98	59.8 Å²	59.8	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-59.4	-44.2	175.9	-70.6	162.4	0	0	0	110.8	L162 P334 L335 G342	L162-I338 HydrophobicContact CD2-CD1 3.99Å; P334-I338 WeakPolarHBondContact O-CB 3.22Å; P334-I338 WeakPolarHBondContact O-CD1 3.46Å; P334-I338 WeakPolarHBondContact O-CG1 3.42Å; P334-I338 PolarHBondContact O-N 3.3Å; L335-I338 PolarHBondContact O-N 3.46Å; I338-G342 WeakPolarHBondContact O-CA 3.47Å; I338-G342 PolarHBondContact O-N 3.09Å
339	I	84.7	Confident	79.3	Confident	88 Å²	88	49.6 Å²	49.6	45%	0.451	29%	0.29	S	S	.	.	H	α-helix	trans	-65.9	-45.8	179	-70.6	170.9	0	0	0	110.7	L335 S336 V337 G342 I343	L335-I339 HydrophobicContact CD1-CD1 4.03Å; L335-I339 HydrophobicContact CD1-CG1 4.3Å; L335-I339 HydrophobicContact CD2-CD1 4.45Å; L335-I339 HydrophobicContact CG-CD1 3.83Å; L335-I339 HydrophobicContact CG-CG1 4.45Å; L335-I339 WeakPolarHBondContact O-CB 3.49Å; L335-I339 VanDerWaalsContact O-CG1 3.28Å; L335-I339 WeakPolarHBondContact O-CG1 3.36Å; L335-I339 PolarHBondContact O-N 3.41Å; S336-I339 PolarHBondContact O-N 3.23Å; V337-I339 VanDerWaalsContact C-N 3.33Å; V337-I339 PolarHBondContact O-N 3.09Å; I339-G342 PolarHBondContact O-N 3.28Å; I339-I343 HydrophobicContact CG2-CD1 3.68Å; I339-I343 HydrophobicContact CG2-CG1 4.31Å; I339-I343 WeakPolarHBondContact O-CB 3.36Å; I339-I343 WeakPolarHBondContact O-CD1 3.39Å; I339-I343 WeakPolarHBondContact O-CG1 3.47Å; I339-I343 PolarHBondContact O-N 3.06Å
340	E	82.6	Confident	79.3	Confident	107 Å²	107	49.5 Å²	49.5	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-44.3	179.8	-75.2	-179.6	-163.2	0	0	112.5	S336 V337 I343 K344 F380	S336-E340 WeakPolarHBondContact O-CB 3.43Å; S336-E340 WeakPolarHBondContact O-CG 3.37Å; S336-E340 PolarHBondContact O-N 3.24Å; V337-E340 PolarHBondContact O-N 3.07Å; E340-I343 PolarHBondContact O-N 3.43Å; E340-K344 PolarHBondContact O-N 3.37Å; E340-F380 HydrophobicContact CB-CE1 3.73Å; E340-F380 HydrophobicContact CB-CZ 3.81Å; E340-F380 WeakPolarHBondContact OE2-CE1 3.42Å
341	V	82	Confident	79.4	Confident	38 Å²	38	48.2 Å²	48.2	23%	0.23	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-44.3	174	173.4	0	0	0	0	110.1	V337 I343 K344 A345 F380	V337-V341 HydrophobicContact CG1-CG2 4.23Å; V337-V341 WeakPolarHBondContact O-CB 3.01Å; V337-V341 VanDerWaalsContact O-CG2 3.24Å; V337-V341 WeakPolarHBondContact O-CG2 3.37Å; V337-V341 PolarHBondContact O-N 2.77Å; V341-I343 PolarHBondContact O-N 2.87Å; V341-K344 PolarHBondContact O-N 3.46Å; V341-A345 WeakPolarHBondContact O-CB 3.29Å; V341-A345 PolarHBondContact O-N 2.94Å; V341-F380 HydrophobicContact CG2-CD1 3.92Å; V341-F380 HydrophobicContact CG2-CD2 3.85Å; V341-F380 HydrophobicContact CG2-CE1 3.93Å; V341-F380 HydrophobicContact CG2-CE2 3.8Å; V341-F380 HydrophobicContact CG2-CG 3.89Å; V341-F380 HydrophobicContact CG2-CZ 3.88Å
342	G	80.6	Confident	79.6	Confident	28 Å²	28	45.1 Å²	45.1	29%	0.289	26%	0.258	S	S	.	.	H	α-helix	trans	-58.9	-42.9	176.9	0	0	0	0	0	112.5	I338 I339 K344 A345 V346	I338-G342 WeakPolarHBondContact O-CA 3.47Å; I338-G342 PolarHBondContact O-N 3.09Å; I339-G342 PolarHBondContact O-N 3.28Å; G342-K344 PolarHBondContact O-N 3Å; G342-A345 PolarHBondContact O-N 2.98Å; G342-V346 VanDerWaalsContact O-CB 3.3Å; G342-V346 WeakPolarHBondContact O-CB 3.41Å; G342-V346 WeakPolarHBondContact O-CG2 3.49Å; G342-V346 PolarHBondContact O-N 3.48Å
343	I	78.1	Confident	79.5	Confident	73 Å²	73	45.5 Å²	45.5	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-44.1	176	-73.5	164.1	0	0	0	111	F132 I339 E340 V341 T347	F132-I343 HydrophobicContact CE2-CG1 4.5Å; F132-I343 HydrophobicContact CE2-CG2 3.68Å; F132-I343 HydrophobicContact CZ-CG1 4.32Å; F132-I343 HydrophobicContact CZ-CG2 3.95Å; I339-I343 HydrophobicContact CG2-CD1 3.68Å; I339-I343 HydrophobicContact CG2-CG1 4.31Å; I339-I343 WeakPolarHBondContact O-CB 3.36Å; I339-I343 WeakPolarHBondContact O-CD1 3.39Å; I339-I343 WeakPolarHBondContact O-CG1 3.47Å; I339-I343 PolarHBondContact O-N 3.06Å; E340-I343 PolarHBondContact O-N 3.43Å; V341-I343 PolarHBondContact O-N 2.87Å; I343-T347 PolarHBondContact O-N 3.33Å; I343-T347 PolarHBondContact O-OG1 2.97Å
344	K	78.1	Confident	78.9	Confident	87 Å²	87	50.1 Å²	50.1	38%	0.378	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-46.2	175.5	-69.4	-163.3	-169.6	172.6	0	111.3	E340 V341 G342 T347 A348 V375 F380	E340-K344 PolarHBondContact O-N 3.37Å; V341-K344 PolarHBondContact O-N 3.46Å; G342-K344 PolarHBondContact O-N 3Å; K344-T347 PolarHBondContact O-N 3.3Å; K344-A348 PolarHBondContact O-N 3.49Å; K344-V375 HydrophobicContact CB-CG1 4Å; K344-F380 HydrophobicContact CD-CE2 3.75Å; K344-F380 HydrophobicContact CD-CZ 4.33Å
345	A	78.8	Confident	78.2	Confident	15 Å²	15	52.2 Å²	52.2	12%	0.124	28%	0.28	C	S	.	.	H	α-helix	trans	-64.7	-47.7	-179	0	0	0	0	0	112.4	V341 G342 T347 A348 M349 V375	V341-A345 WeakPolarHBondContact O-CB 3.29Å; V341-A345 PolarHBondContact O-N 2.94Å; G342-A345 PolarHBondContact O-N 2.98Å; A345-T347 PolarHBondContact O-N 2.69Å; A345-A348 WeakPolarHBondContact O-CB 3.46Å; A345-A348 PolarHBondContact O-N 3.45Å; A345-A348 VanDerWaalsContact O-N 3.09Å; A345-M349 VanDerWaalsContact O-CG 3.25Å; A345-M349 WeakPolarHBondContact O-CG 3.43Å; A345-M349 PolarHBondContact O-N 3.09Å; A345-V375 HydrophobicContact CB-CG2 4.1Å
346	V	78.9	Confident	77.1	Confident	34 Å²	34	52.5 Å²	52.5	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-55.8	-40.5	177	165.2	0	0	0	0	110.9	F132 L139 G342 M349 L350	F132-V346 HydrophobicContact CE1-CG1 4.31Å; L139-V346 HydrophobicContact CD2-CG1 3.53Å; G342-V346 VanDerWaalsContact O-CB 3.3Å; G342-V346 WeakPolarHBondContact O-CB 3.41Å; G342-V346 WeakPolarHBondContact O-CG2 3.49Å; G342-V346 PolarHBondContact O-N 3.48Å; V346-M349 PolarHBondContact O-N 3.18Å; V346-L350 HydrophobicContact CG1-CD1 3.99Å; V346-L350 HydrophobicContact CG1-CG 4.37Å; V346-L350 WeakPolarHBondContact O-CB 3.32Å; V346-L350 WeakPolarHBondContact O-CG 3.14Å; V346-L350 PolarHBondContact O-N 3.15Å
347	T	75.4	Confident	76	Confident	6 Å²	6	59.3 Å²	59.3	4%	0.037	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-42	178.8	-54.3	0	0	0	0	112	F130 I343 K344 A345 N351	F130-T347 HydrophobicContact CB-CG2 3.9Å; F130-T347 HydrophobicContact CD1-CG2 4.24Å; I343-T347 PolarHBondContact O-N 3.33Å; I343-T347 PolarHBondContact O-OG1 2.97Å; K344-T347 PolarHBondContact O-N 3.3Å; A345-T347 PolarHBondContact O-N 2.69Å; T347-N351 PolarHBondContact O-N 3.31Å; T347-N351 PolarHBondContact O-ND2 3.21Å
348	A	76.6	Confident	74.8	Confident	25 Å²	25	67.1 Å²	67.1	21%	0.207	34%	0.336	C	S	.	.	H	α-helix	trans	-62.3	-42.9	173.3	0	0	0	0	0	111.7	K344 A345 N351 L352 V373 V375	K344-A348 PolarHBondContact O-N 3.49Å; A345-A348 WeakPolarHBondContact O-CB 3.46Å; A345-A348 PolarHBondContact O-N 3.45Å; A345-A348 VanDerWaalsContact O-N 3.09Å; A348-N351 PolarHBondContact O-N 3.28Å; A348-L352 PolarHBondContact O-N 3.45Å; A348-V373 HydrophobicContact CB-CG1 4.47Å; A348-V375 HydrophobicContact CB-CG2 4.31Å
349	M	76.4	Confident	73.3	Confident	18 Å²	18	64.4 Å²	64.4	9%	0.089	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-38.3	179.9	-67.8	-64.8	-70.5	0	0	113.1	V142 M144 A345 V346 N351 L352 R353 L371 P372	V142-M349 HydrophobicContact CG1-CB 3.44Å; V142-M349 VanDerWaalsContact CG1-CB 3.44Å; V142-M349 HydrophobicContact CG1-CG 4.37Å; M144-M349 HydrophobicContact CE-CE 3.8Å; M144-M349 HydrophobicContact CG-CE 4.3Å; A345-M349 VanDerWaalsContact O-CG 3.25Å; A345-M349 WeakPolarHBondContact O-CG 3.43Å; A345-M349 PolarHBondContact O-N 3.09Å; V346-M349 PolarHBondContact O-N 3.18Å; M349-N351 VanDerWaalsContact C-N 3.33Å; M349-N351 PolarHBondContact O-N 2.73Å; M349-L352 PolarHBondContact O-N 3.18Å; M349-L352 HydrophobicContact SD-CD2 4.41Å; M349-R353 WeakPolarHBondContact O-CB 3.43Å; M349-R353 PolarHBondContact O-N 3.17Å; M349-L371 HydrophobicContact SD-CD2 4.15Å; M349-P372 HydrophobicContact CE-CG 4.08Å; M349-P372 HydrophobicContact SD-CG 4.06Å
350	L	75.4	Confident	71.9	Confident	30 Å²	30	69.9 Å²	69.9	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-62.4	-40.4	173.8	-77.1	170.5	0	0	0	111.9	V136 V142 V346 R353 K354	V136-L350 HydrophobicContact CB-CD1 4.47Å; V136-L350 HydrophobicContact CG1-CD2 4.4Å; V136-L350 HydrophobicContact CG2-CD1 3.76Å; V136-L350 HydrophobicContact CG2-CD2 3.96Å; V142-L350 HydrophobicContact CG2-CD2 3.47Å; V142-L350 VanDerWaalsContact CG2-CD2 3.47Å; V142-L350 HydrophobicContact CG2-CG 4.11Å; V346-L350 HydrophobicContact CG1-CD1 3.99Å; V346-L350 HydrophobicContact CG1-CG 4.37Å; V346-L350 WeakPolarHBondContact O-CB 3.32Å; V346-L350 WeakPolarHBondContact O-CG 3.14Å; V346-L350 PolarHBondContact O-N 3.15Å; L350-R353 PolarHBondContact O-N 2.93Å; L350-K354 PolarHBondContact O-N 3.02Å
351	N	73.2	Confident	70.6	Confident	45 Å²	45	68.4 Å²	68.4	24%	0.241	35%	0.35	C	S	.	.	H	α-helix	trans	-67.2	-46.4	175.4	-71.5	-26.2	0	0	0	111.5	T347 A348 M349 R353 K354 V355	T347-N351 PolarHBondContact O-N 3.31Å; T347-N351 PolarHBondContact O-ND2 3.21Å; A348-N351 PolarHBondContact O-N 3.28Å; M349-N351 VanDerWaalsContact C-N 3.33Å; M349-N351 PolarHBondContact O-N 2.73Å; N351-R353 VanDerWaalsContact C-N 3.25Å; N351-R353 PolarHBondContact O-N 3.44Å; N351-K354 WeakPolarHBondContact O-CB 3.21Å; N351-K354 PolarHBondContact O-N 3.47Å; N351-K354 VanDerWaalsContact O-N 3.15Å; N351-V355 PolarHBondContact O-N 3Å
352	L	73.6	Confident	69.5	Low	40 Å²	40	69.6 Å²	69.6	21%	0.209	36%	0.364	C	S	.	.	H	α-helix	trans	-54	-44.8	174.8	-175.9	92.6	0	0	0	110.5	A348 M349 K354 V355 M356 L365 P372 V373	A348-L352 PolarHBondContact O-N 3.45Å; M349-L352 PolarHBondContact O-N 3.18Å; M349-L352 HydrophobicContact SD-CD2 4.41Å; L352-K354 PolarHBondContact O-N 2.94Å; L352-V355 CarbonylContact O-C 3.56Å; L352-V355 WeakPolarHBondContact O-CB 3.31Å; L352-V355 PolarHBondContact O-N 3.21Å; L352-V355 VanDerWaalsContact O-N 3.1Å; L352-M356 HydrophobicContact CD1-SD 4.28Å; L352-M356 HydrophobicContact CD2-CG 4.41Å; L352-M356 HydrophobicContact CD2-SD 3.25Å; L352-M356 WeakPolarHBondContact CD2-SD 3.11Å; L352-M356 HydrophobicContact CG-CG 4.02Å; L352-M356 HydrophobicContact CG-SD 3.5Å; L352-M356 VanDerWaalsContact CG-SD 3.5Å; L352-M356 WeakPolarHBondContact O-CB 3.35Å; L352-M356 WeakPolarHBondContact O-CG 3.45Å; L352-M356 PolarHBondContact O-N 3.16Å; L352-L365 HydrophobicContact CD2-CD1 4.32Å; L352-P372 HydrophobicContact CD2-CB 3.84Å; L352-P372 HydrophobicContact CD2-CG 4.02Å; L352-V373 HydrophobicContact CB-CG2 4.17Å; L352-V373 HydrophobicContact CD1-CG2 3.39Å; L352-V373 HydrophobicContact CD2-CG2 4.23Å; L352-V373 HydrophobicContact CG-CG2 4.1Å
353	R	70.8	Confident	68.4	Low	67 Å²	67	76 Å²	76	25%	0.253	39%	0.387	S	S	.	.	H	α-helix	trans	-62.3	-39.3	179	-172	177	179.5	-150	-0.1	113.5	E141 M349 L350 N351 V355 M356 R357	E141-R353 VanDerWaalsContact CB-NH1 3.25Å; E141-R353 IonicContact OE2-CZ 2.68Å; E141-R353 IonicContact OE2-NH1 2.73Å; E141-R353 PolarHBondContact OE2-NH1 3.09Å; E141-R353 IonicContact OE2-NH2 3.77Å; E141-R353 PolarHBondContact OE2-NH2 3.4Å; M349-R353 WeakPolarHBondContact O-CB 3.43Å; M349-R353 PolarHBondContact O-N 3.17Å; L350-R353 PolarHBondContact O-N 2.93Å; N351-R353 VanDerWaalsContact C-N 3.25Å; N351-R353 PolarHBondContact O-N 3.44Å; R353-V355 PolarHBondContact O-N 3.07Å; R353-M356 PolarHBondContact O-N 3.26Å; R353-R357 PolarHBondContact O-N 3.23Å
354	K	68.6	Low	67.3	Low	116 Å²	116	77.7 Å²	77.7	50%	0.504	40%	0.4	S	S	.	.	H	α-helix	trans	-58	-39	174.4	-74.4	-179	-179.3	179.7	0	111.2	L350 N351 L352	L350-K354 PolarHBondContact O-N 3.02Å; N351-K354 WeakPolarHBondContact O-CB 3.21Å; N351-K354 PolarHBondContact O-N 3.47Å; N351-K354 VanDerWaalsContact O-N 3.15Å; L352-K354 PolarHBondContact O-N 2.94Å
355	V	68.4	Low	66.2	Low	102 Å²	102	75.7 Å²	75.7	62%	0.618	39%	0.393	S	S	*	.	H	α-helix	trans	-74.4	-39.8	176.7	-176.8	0	0	0	0	111.1	N351 L352 R353 Q358	N351-V355 PolarHBondContact O-N 3Å; L352-V355 CarbonylContact O-C 3.56Å; L352-V355 WeakPolarHBondContact O-CB 3.31Å; L352-V355 PolarHBondContact O-N 3.21Å; L352-V355 VanDerWaalsContact O-N 3.1Å; R353-V355 PolarHBondContact O-N 3.07Å; V355-Q358 WeakPolarHBondContact O-CB 3.44Å; V355-Q358 PolarHBondContact O-N 2.95Å
356	M	64.2	Low	65.2	Low	30 Å²	30	75.7 Å²	75.7	15%	0.148	40%	0.395	C	S	.	.	H	α-helix	trans	-77.9	-21.3	-175	-75.8	179.4	66.6	0	0	116	L352 R353 Q358 G359 V361 A362 L365	L352-M356 HydrophobicContact CD1-SD 4.28Å; L352-M356 HydrophobicContact CD2-CG 4.41Å; L352-M356 HydrophobicContact CD2-SD 3.25Å; L352-M356 WeakPolarHBondContact CD2-SD 3.11Å; L352-M356 HydrophobicContact CG-CG 4.02Å; L352-M356 HydrophobicContact CG-SD 3.5Å; L352-M356 VanDerWaalsContact CG-SD 3.5Å; L352-M356 WeakPolarHBondContact O-CB 3.35Å; L352-M356 WeakPolarHBondContact O-CG 3.45Å; L352-M356 PolarHBondContact O-N 3.16Å; R353-M356 PolarHBondContact O-N 3.26Å; M356-Q358 PolarHBondContact O-N 3.01Å; M356-G359 PolarHBondContact O-N 3Å; M356-V361 HydrophobicContact CE-CB 3.95Å; M356-V361 HydrophobicContact CE-CG1 4.24Å; M356-V361 WeakPolarHBondContact CE-O 3.13Å; M356-A362 VanDerWaalsContact CE-CA 3.47Å; M356-A362 HydrophobicContact CE-CB 4.15Å; M356-L365 HydrophobicContact CE-CD1 3.36Å; M356-L365 HydrophobicContact SD-CD1 3.55Å; M356-L365 VanDerWaalsContact SD-CD1 3.55Å
357	R	60.4	Low	64	Low	185 Å²	185	81.6 Å²	81.6	70%	0.698	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-11.7	172.2	-82.3	-172.3	-179.5	-171.5	0.4	112.6	R353 G359	R353-R357 PolarHBondContact O-N 3.23Å; R357-G359 VanDerWaalsContact C-N 3.35Å
358	Q	59.4	Low	63.2	Low	178 Å²	178	83.9 Å²	83.9	83%	0.832	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-2.9	171.7	-59.5	-180	-12.6	0	0	114.2	V355 M356	V355-Q358 WeakPolarHBondContact O-CB 3.44Å; V355-Q358 PolarHBondContact O-N 2.95Å; M356-Q358 PolarHBondContact O-N 3.01Å
359	G	53.4	Low	62.6	Low	40 Å²	40	89.6 Å²	89.6	41%	0.412	47%	0.469	S	S	.	.	S	Bend	trans	-158.9	161.2	-178.5	0	0	0	0	0	116.8	M356 R357 V361	M356-G359 PolarHBondContact O-N 3Å; R357-G359 VanDerWaalsContact C-N 3.35Å; G359-V361 PolarHBondContact O-N 3.04Å
360	K	55.7	Low	62.1	Low	203 Å²	203	95.5 Å²	95.5	88%	0.883	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	30.7	-179.8	-70.5	-176.1	175.2	-178.2	0	114.8
361	V	55.2	Low	61.8	Low	76 Å²	76	98.9 Å²	98.9	46%	0.461	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-5.5	-173	-170.6	0	0	0	0	112.6	M356 G359 E363 V364 L365	M356-V361 HydrophobicContact CE-CB 3.95Å; M356-V361 HydrophobicContact CE-CG1 4.24Å; M356-V361 WeakPolarHBondContact CE-O 3.13Å; G359-V361 PolarHBondContact O-N 3.04Å; V361-E363 PolarHBondContact O-N 3.12Å; V361-V364 PolarHBondContact O-N 3.03Å; V361-L365 HydrophobicContact CG1-CD1 3.92Å; V361-L365 HydrophobicContact CG1-CG 4.26Å; V361-L365 PolarHBondContact O-N 2.93Å
362	A	58.5	Low	61.6	Low	63 Å²	63	98.8 Å²	98.8	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-36.5	-177.9	0	0	0	0	0	114.1	M356	M356-A362 VanDerWaalsContact CE-CA 3.47Å; M356-A362 HydrophobicContact CE-CB 4.15Å
363	E	57	Low	61.5	Low	164 Å²	164	99.1 Å²	99.1	77%	0.766	52%	0.519	S	S	*	.	H	α-helix	trans	-75.3	-36.5	-179	-74	179.1	158.2	0	0	112.9	V361 L365 G366	V361-E363 PolarHBondContact O-N 3.12Å; E363-L365 VanDerWaalsContact C-N 3.31Å; E363-L365 PolarHBondContact O-N 3.44Å; E363-G366 PolarHBondContact O-N 3.24Å
364	V	55.6	Low	61.5	Low	108 Å²	108	105 Å²	105	66%	0.655	55%	0.549	S	S	*	.	H	α-helix	trans	-67.5	-33.9	-178.3	-179.3	0	0	0	0	111.5	V361	V361-V364 PolarHBondContact O-N 3.03Å
365	L	54.9	Low	61.7	Low	44 Å²	44	100.9 Å²	100.9	23%	0.23	53%	0.534	C	S	.	.	H	α-helix	trans	-77.9	-20.8	-178.5	-77.5	168.3	0	0	0	114	M144 L352 M356 V361 E363 M367 P372	M144-L365 HydrophobicContact CE-CB 3.78Å; M144-L365 VanDerWaalsContact SD-C 3.54Å; M144-L365 HydrophobicContact SD-CB 3.95Å; L352-L365 HydrophobicContact CD2-CD1 4.32Å; M356-L365 HydrophobicContact CE-CD1 3.36Å; M356-L365 HydrophobicContact SD-CD1 3.55Å; M356-L365 VanDerWaalsContact SD-CD1 3.55Å; V361-L365 HydrophobicContact CG1-CD1 3.92Å; V361-L365 HydrophobicContact CG1-CG 4.26Å; V361-L365 PolarHBondContact O-N 2.93Å; E363-L365 VanDerWaalsContact C-N 3.31Å; E363-L365 PolarHBondContact O-N 3.44Å; L365-M367 VanDerWaalsContact C-N 3.27Å; L365-M367 PolarHBondContact O-N 3.05Å; L365-P372 HydrophobicContact CB-CG 4.16Å; L365-P372 HydrophobicContact CD1-CB 4.01Å; L365-P372 HydrophobicContact CD1-CG 4.22Å; L365-P372 HydrophobicContact CD2-CB 3.48Å; L365-P372 VanDerWaalsContact CD2-CB 3.48Å; L365-P372 HydrophobicContact CD2-CG 3.82Å; L365-P372 HydrophobicContact CG-CB 4.23Å; L365-P372 HydrophobicContact CG-CG 4.28Å
366	G	57.8	Low	62	Low	16 Å²	16	101.7 Å²	101.7	17%	0.165	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-11.1	179.3	0	0	0	0	0	114.7	E363	E363-G366 PolarHBondContact O-N 3.24Å
367	M	54.7	Low	62.2	Low	158 Å²	158	105.9 Å²	105.9	78%	0.778	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-11.2	-172.2	-59.2	-59.2	112	0	0	114	L365	L365-M367 VanDerWaalsContact C-N 3.27Å; L365-M367 PolarHBondContact O-N 3.05Å
368	A	56.8	Low	62.6	Low	54 Å²	54	100.2 Å²	100.2	45%	0.446	55%	0.548	S	S	.	.	S	Bend	trans	-89.7	146.8	179	0	0	0	0	0	111.5	E370	A368-E370 HydrophobicContact CB-CB 4.44Å; A368-E370 PolarHBondContact O-N 3.43Å
369	D	64.2	Low	63.1	Low	145 Å²	145	95.8 Å²	95.8	78%	0.775	55%	0.55	S	S	*	.	S	Bend	trans	-71.6	4.4	164.8	-86.4	-26.5	0	0	0	112.3	R145	R145-D369 IonicContact CZ-OD1 3.85Å; R145-D369 IonicContact NH1-OD1 2.68Å; R145-D369 IonicContact NH2-OD1 3.33Å; R145-D369 PolarHBondContact NH2-OD1 3.29Å
370	E	66	Low	64	Low	141 Å²	141	95.7 Å²	95.7	66%	0.659	54%	0.538	S	S	*	.	S	Bend	trans	-119.1	154.9	-173	-62.9	-179.2	176.2	0	0	111.7	A368	A368-E370 HydrophobicContact CB-CB 4.44Å; A368-E370 PolarHBondContact O-N 3.43Å
371	L	70.3	Confident	64.4	Low	101 Å²	101	89.1 Å²	89.1	53%	0.529	52%	0.516	S	S	.	.			trans	-74.1	141.3	175.9	-76.9	164.1	0	0	0	110.9	M349 V373 V375	M349-L371 HydrophobicContact SD-CD2 4.15Å; L371-V373 PolarHBondContact O-N 3.45Å; L371-V373 VanDerWaalsContact O-N 3.17Å; L371-V375 HydrophobicContact CD1-CG2 4.14Å
372	P	67.9	Low	64.8	Low	43 Å²	43	94.4 Å²	94.4	28%	0.279	54%	0.536	S	S	.	.	S	Bend	trans	-62	-22.4	176.3	-20.1	29	0	0	0	114.7	M144 M349 L352 L365	M144-P372 HydrophobicContact CE-CG 4.18Å; M349-P372 HydrophobicContact CE-CG 4.08Å; M349-P372 HydrophobicContact SD-CG 4.06Å; L352-P372 HydrophobicContact CD2-CB 3.84Å; L352-P372 HydrophobicContact CD2-CG 4.02Å; L365-P372 HydrophobicContact CB-CG 4.16Å; L365-P372 HydrophobicContact CD1-CB 4.01Å; L365-P372 HydrophobicContact CD1-CG 4.22Å; L365-P372 HydrophobicContact CD2-CB 3.48Å; L365-P372 VanDerWaalsContact CD2-CB 3.48Å; L365-P372 HydrophobicContact CD2-CG 3.82Å; L365-P372 HydrophobicContact CG-CB 4.23Å; L365-P372 HydrophobicContact CG-CG 4.28Å
373	V	71.8	Confident	65.2	Low	47 Å²	47	97.6 Å²	97.6	29%	0.285	54%	0.536	S	S	.	.	S	Bend	trans	-128.3	135.1	-170.4	-177.2	0	0	0	0	108	A348 L352 L371 V375	A348-V373 HydrophobicContact CB-CG1 4.47Å; L352-V373 HydrophobicContact CB-CG2 4.17Å; L352-V373 HydrophobicContact CD1-CG2 3.39Å; L352-V373 HydrophobicContact CD2-CG2 4.23Å; L352-V373 HydrophobicContact CG-CG2 4.1Å; L371-V373 PolarHBondContact O-N 3.45Å; L371-V373 VanDerWaalsContact O-N 3.17Å; V373-V375 PolarHBondContact O-N 3.47Å; V373-V375 VanDerWaalsContact O-N 3.15Å
374	E	70.8	Confident	65.5	Low	191 Å²	191	97.2 Å²	97.2	89%	0.893	53%	0.533	S	S	*	.			trans	-64.6	113	166.9	-67	-176.1	175.1	0	0	109.5
375	V	73.3	Confident	65.8	Low	29 Å²	29	95.9 Å²	95.9	18%	0.176	53%	0.529	C	S	.	.			trans	-90.3	117.5	171.8	-177.3	0	0	0	0	107	K344 A345 A348 L371 V373 M377	K344-V375 HydrophobicContact CB-CG1 4Å; A345-V375 HydrophobicContact CB-CG2 4.1Å; A348-V375 HydrophobicContact CB-CG2 4.31Å; L371-V375 HydrophobicContact CD1-CG2 4.14Å; V373-V375 PolarHBondContact O-N 3.47Å; V373-V375 VanDerWaalsContact O-N 3.15Å; V375-M377 WeakPolarHBondContact O-CG 3.43Å; V375-M377 PolarHBondContact O-N 2.93Å
376	D	73.5	Confident	66.5	Low	119 Å²	119	98.9 Å²	98.9	64%	0.636	55%	0.549	S	S	*	.			trans	-62.5	104.2	174.3	-177.8	11.1	0	0	0	110.2	A378	D376-A378 VanDerWaalsContact C-N 3.29Å; D376-A378 WeakPolarHBondContact OD1-CB 3.37Å; D376-A378 PolarHBondContact OD1-N 2.9Å
377	M	69.5	Low	67.6	Low	118 Å²	118	100.1 Å²	100.1	58%	0.581	55%	0.55	S	S	*	.			trans	-89.9	13.3	177.7	-67.7	-172.2	-72.7	0	0	112.6	V375 G379 F380	V375-M377 WeakPolarHBondContact O-CG 3.43Å; V375-M377 PolarHBondContact O-N 2.93Å; M377-G379 PolarHBondContact O-N 3.32Å; M377-G379 VanDerWaalsContact O-N 3.16Å; M377-F380 HydrophobicContact CB-CD2 4.25Å; M377-F380 WeakPolarHBondContact O-CD2 3.4Å; M377-F380 PolarHBondContact O-N 3.22Å
378	A	69.1	Low	69	Low	67 Å²	67	95.6 Å²	95.6	55%	0.554	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	125.1	178.6	0	0	0	0	0	111.7	D376	D376-A378 VanDerWaalsContact C-N 3.29Å; D376-A378 WeakPolarHBondContact OD1-CB 3.37Å; D376-A378 PolarHBondContact OD1-N 2.9Å
379	G	69.6	Low	70.4	Confident	84 Å²	84	93.1 Å²	93.1	87%	0.866	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	-11.5	-179.3	0	0	0	0	0	115.8	M377	M377-G379 PolarHBondContact O-N 3.32Å; M377-G379 VanDerWaalsContact O-N 3.16Å
380	F	71.1	Confident	71.4	Confident	38 Å²	38	88.3 Å²	88.3	17%	0.167	49%	0.494	C	S	.	.	S	Bend	trans	-84.2	145.9	172	-68.5	-69.9	0	0	0	111.7	V337 E340 V341 K344 M377 Q382	V337-F380 HydrophobicContact CG1-CD1 4.32Å; E340-F380 HydrophobicContact CB-CE1 3.73Å; E340-F380 HydrophobicContact CB-CZ 3.81Å; E340-F380 WeakPolarHBondContact OE2-CE1 3.42Å; V341-F380 HydrophobicContact CG2-CD1 3.92Å; V341-F380 HydrophobicContact CG2-CD2 3.85Å; V341-F380 HydrophobicContact CG2-CE1 3.93Å; V341-F380 HydrophobicContact CG2-CE2 3.8Å; V341-F380 HydrophobicContact CG2-CG 3.89Å; V341-F380 HydrophobicContact CG2-CZ 3.88Å; K344-F380 HydrophobicContact CD-CE2 3.75Å; K344-F380 HydrophobicContact CD-CZ 4.33Å; M377-F380 HydrophobicContact CB-CD2 4.25Å; M377-F380 WeakPolarHBondContact O-CD2 3.4Å; M377-F380 PolarHBondContact O-N 3.22Å; F380-Q382 PolarHBondContact O-N 3.45Å
381	P	65.3	Low	72.2	Confident	65 Å²	65	84.6 Å²	84.6	42%	0.422	48%	0.478	S	S	.	.			trans	-62.3	127.8	172.8	25.3	-33.4	0	0	0	110.6	Y383	P381-Y383 HydrophobicContact CB-CE1 4.25Å; P381-Y383 HydrophobicContact CB-CE2 4.35Å; P381-Y383 HydrophobicContact CG-CE1 4.15Å; P381-Y383 HydrophobicContact CG-CE2 3.78Å; P381-Y383 VanDerWaalsContact CG-CZ 3.45Å; P381-Y383 WeakPolarHBondContact CG-OH 3.33Å; P381-Y383 WeakPolarHBondContact O-CD2 3.42Å; P381-Y383 WeakPolarHBondContact O-CE2 3.49Å; P381-Y383 PolarHBondContact O-N 2.94Å
382	Q	63.8	Low	72.9	Confident	187 Å²	187	80.7 Å²	80.7	87%	0.874	46%	0.457	S	S	*	.			trans	-79.4	113.9	170.1	-69.5	179.7	-0.5	0	0	108.7	F380	F380-Q382 PolarHBondContact O-N 3.45Å
383	Y	66.3	Low	73.6	Confident	131 Å²	131	89.3 Å²	89.3	51%	0.514	48%	0.484	S	S	.	.			trans	-89.2	-21	-178.8	-62.2	-75.1	0	0	0	113.6	V337 P381	V337-Y383 HydrophobicContact CG1-CE2 4.02Å; P381-Y383 HydrophobicContact CB-CE1 4.25Å; P381-Y383 HydrophobicContact CB-CE2 4.35Å; P381-Y383 HydrophobicContact CG-CE1 4.15Å; P381-Y383 HydrophobicContact CG-CE2 3.78Å; P381-Y383 VanDerWaalsContact CG-CZ 3.45Å; P381-Y383 WeakPolarHBondContact CG-OH 3.33Å; P381-Y383 WeakPolarHBondContact O-CD2 3.42Å; P381-Y383 WeakPolarHBondContact O-CE2 3.49Å; P381-Y383 PolarHBondContact O-N 2.94Å
384	H	62.3	Low	74.1	Confident	155 Å²	155	92 Å²	92	72%	0.718	49%	0.494	S	S	*	.	S	Bend	trans	-121.6	123.7	179.9	-61.2	-61.1	0	0	0	109.9	V386	H384-V386 HydrophobicContact CB-CG2 4.41Å; H384-V386 PolarHBondContact O-N 2.82Å; H384-V386 VanDerWaalsContact O-N 3.14Å
385	S	62.6	Low	74.6	Confident	81 Å²	81	85.7 Å²	85.7	57%	0.566	47%	0.469	S	S	*	.			trans	-74.7	97.2	165.2	-61.6	0	0	0	0	107.9
386	V	70	Confident	75	Confident	106 Å²	106	85.5 Å²	85.5	64%	0.642	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-84.6	116.7	173.7	-177.9	0	0	0	0	108.2	H384 P395	H384-V386 HydrophobicContact CB-CG2 4.41Å; H384-V386 PolarHBondContact O-N 2.82Å; H384-V386 VanDerWaalsContact O-N 3.14Å; V386-P395 HydrophobicContact CG1-CB 3.66Å
387	F	80.6	Confident	75.5	Confident	42 Å²	42	83.6 Å²	83.6	18%	0.184	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-92.7	117.2	170.8	175	-93.3	0	0	0	109.9	C389 T396 P402 V410 F451	F387-C389 HydrophobicContact CE1-CB 4.44Å; F387-T396 HydrophobicContact CD1-CG2 3.59Å; F387-T396 HydrophobicContact CE1-CG2 4.2Å; F387-T396 PolarHBondContact O-N 3.24Å; F387-T396 PolarHBondContact O-OG1 2.83Å; F387-P402 HydrophobicContact CB-CB 4.37Å; F387-P402 HydrophobicContact CD1-CB 3.67Å; F387-P402 HydrophobicContact CE1-CB 4.2Å; F387-P402 HydrophobicContact CG-CB 4.08Å; F387-V410 HydrophobicContact CD1-CG1 4.36Å; F387-V410 HydrophobicContact CD2-CG1 4.32Å; F387-V410 HydrophobicContact CE1-CG1 3.88Å; F387-V410 HydrophobicContact CE2-CB 3.86Å; F387-V410 HydrophobicContact CE2-CG1 3.85Å; F387-V410 HydrophobicContact CZ-CB 3.8Å; F387-V410 HydrophobicContact CZ-CG1 3.63Å; F387-V410 VanDerWaalsContact CZ-O 3.27Å; F387-V410 WeakPolarHBondContact CZ-O 3.46Å; F387-F451 HydrophobicContact CB-CE2 3.53Å; F387-F451 HydrophobicContact CB-CZ 3.98Å; F387-F451 HydrophobicContact CD2-CZ 4.45Å; F387-F451 HydrophobicContact CG-CE2 4.32Å; F387-F451 HydrophobicContact CG-CZ 4.47Å
388	A	83.2	Confident	75.9	Confident	64 Å²	64	87.4 Å²	87.4	53%	0.529	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	121.9	171.5	0	0	0	0	0	109.9	P390	A388-P390 WeakPolarHBondContact O-CD 3.35Å
389	C	86.9	Confident	76.6	Confident	1 Å²	1	88.3 Å²	88.3	1%	0.007	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	124.7	174.4	-177.9	0	0	0	0	109.8	F387 I391 L392 R393 Q394 S412 A415	F387-C389 HydrophobicContact CE1-CB 4.44Å; C389-I391 VanDerWaalsContact C-N 3.31Å; C389-I391 PolarHBondContact O-N 2.9Å; C389-L392 HydrophobicContact CB-CB 4.2Å; C389-R393 WeakPolarHBondContact O-CA 3.19Å; C389-R393 PolarHBondContact O-N 3.28Å; C389-Q394 WeakPolarHBondContact CB-O 3.39Å; C389-Q394 PolarHBondContact N-O 3.39Å; C389-S412 PolarHBondContact SG-N 3.39Å; C389-S412 VanDerWaalsContact SG-N 3.38Å; C389-A415 VanDerWaalsContact SG-CB 3.5Å
390	P	85.2	Confident	77.5	Confident	44 Å²	44	84.8 Å²	84.8	29%	0.286	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.6	-177.2	26.4	-34.9	0	0	0	114	A388 I411 Y436	A388-P390 WeakPolarHBondContact O-CD 3.35Å; P390-I411 HydrophobicContact CG-CG2 4.22Å; P390-Y436 HydrophobicContact CB-CE2 4.32Å; P390-Y436 WeakPolarHBondContact CB-OH 3.32Å; P390-Y436 HydrophobicContact CG-CE2 3.65Å; P390-Y436 WeakPolarHBondContact CG-OH 3.37Å
391	I	83.5	Confident	78.3	Confident	63 Å²	63	83.8 Å²	83.8	32%	0.323	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-51	179.9	-51.5	-172.5	0	0	0	110.4	C389 R393 I411 A415 L419 P435	C389-I391 VanDerWaalsContact C-N 3.31Å; C389-I391 PolarHBondContact O-N 2.9Å; I391-R393 VanDerWaalsContact C-N 3.28Å; I391-I411 HydrophobicContact CD1-CD1 4.23Å; I391-I411 HydrophobicContact CD1-CG2 4.08Å; I391-I411 HydrophobicContact CG1-CG2 4.29Å; I391-A415 HydrophobicContact CB-CB 4.07Å; I391-A415 HydrophobicContact CD1-CB 4.05Å; I391-A415 HydrophobicContact CG1-CB 4.39Å; I391-L419 HydrophobicContact CD1-CD1 3.47Å; I391-L419 VanDerWaalsContact CD1-CD1 3.47Å; I391-L419 HydrophobicContact CD1-CD2 4.21Å; I391-L419 HydrophobicContact CD1-CG 3.92Å; I391-P435 HydrophobicContact CD1-CG 3.38Å; I391-P435 HydrophobicContact CG1-CG 3.93Å
392	L	84	Confident	79.5	Confident	20 Å²	20	81.2 Å²	81.2	11%	0.105	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.3	179.7	-60.4	-177.3	0	0	0	112.5	C389 Q394 S412 D414 A415	C389-L392 HydrophobicContact CB-CB 4.2Å; L392-Q394 HydrophobicContact CB-CB 4.17Å; L392-Q394 WeakPolarHBondContact O-CG 3.45Å; L392-Q394 PolarHBondContact O-N 3.42Å; L392-S412 VanDerWaalsContact CD1-OG 3.23Å; L392-S412 WeakPolarHBondContact CD1-OG 3.43Å; L392-D414 HydrophobicContact CD1-CB 3.69Å; L392-A415 HydrophobicContact CD1-CB 4.31Å; L392-A415 HydrophobicContact CG-CB 4.06Å
393	R	84	Confident	80.7	Confident	224 Å²	224	72.5 Å²	72.5	85%	0.845	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	36.3	-171.2	-58	180	175.6	-177.1	-2.3	112	C389 I391	C389-R393 WeakPolarHBondContact O-CA 3.19Å; C389-R393 PolarHBondContact O-N 3.28Å; I391-R393 VanDerWaalsContact C-N 3.28Å
394	Q	81.8	Confident	82	Confident	104 Å²	104	71.7 Å²	71.7	49%	0.486	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.3	-177.7	-74.2	175.3	-17	0	0	109.6	C389 L392	C389-Q394 WeakPolarHBondContact CB-O 3.39Å; C389-Q394 PolarHBondContact N-O 3.39Å; L392-Q394 HydrophobicContact CB-CB 4.17Å; L392-Q394 WeakPolarHBondContact O-CG 3.45Å; L392-Q394 PolarHBondContact O-N 3.42Å
395	P	81.6	Confident	83.3	Confident	58 Å²	58	64.3 Å²	64.3	38%	0.377	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	143.4	172.5	28.1	-34	0	0	0	110.7	V386	V386-P395 HydrophobicContact CG1-CB 3.66Å
396	T	82	Confident	84.6	Confident	24 Å²	24	63.2 Å²	63.2	15%	0.147	34%	0.338	C	S	.	.			trans	-72.4	141	171.8	49	0	0	0	0	110.8	F387 N400 P402	F387-T396 HydrophobicContact CD1-CG2 3.59Å; F387-T396 HydrophobicContact CE1-CG2 4.2Å; F387-T396 PolarHBondContact O-N 3.24Å; F387-T396 PolarHBondContact O-OG1 2.83Å; T396-N400 WeakPolarHBondContact CA-O 3.49Å; T396-N400 WeakPolarHBondContact CB-O 3.29Å; T396-N400 WeakPolarHBondContact CG2-O 3.3Å; T396-P402 HydrophobicContact CG2-CB 4.17Å
397	T	82.7	Confident	85.6	Confident	80 Å²	80	59.7 Å²	59.7	49%	0.491	32%	0.318	S	S	.	.			trans	-114.5	173	176.6	61.8	0	0	0	0	109.9	A399 N400 P401	T397-A399 PolarHBondContact O-N 2.68Å; T397-N400 PolarHBondContact N-O 2.89Å; T397-N400 CarbonylContact O-C 3.46Å; T397-N400 PolarHBondContact O-N 3.33Å; T397-N400 VanDerWaalsContact O-N 3.09Å; T397-N400 PolarHBondContact OG1-N 3.12Å; T397-P401 WeakPolarHBondContact O-CA 3.42Å; T397-P401 VanDerWaalsContact O-N 3.16Å
398	E	79.3	Confident	85.9	Confident	198 Å²	198	59.4 Å²	59.4	93%	0.925	33%	0.326	S	S	*	.	S	Bend	trans	-58.8	-34.4	174	-65.7	-174.1	171.9	0	0	112.5
399	A	83.4	Confident	86.2	Confident	85 Å²	85	59.7 Å²	59.7	70%	0.702	32%	0.316	S	S	*	.	S	Bend	trans	-72.5	-32.3	175.5	0	0	0	0	0	112.8	T397 P401	T397-A399 PolarHBondContact O-N 2.68Å; A399-P401 VanDerWaalsContact C-CD 3.49Å; A399-P401 WeakPolarHBondContact O-CD 3.47Å
400	N	87.5	Confident	86.3	Confident	11 Å²	11	61 Å²	61	6%	0.059	33%	0.325	C	S	.	.	S	Bend	trans	-124.2	70.5	-179	-178.1	21.2	0	0	0	110.7	T396 T397 S412 K413 D414	T396-N400 WeakPolarHBondContact CA-O 3.49Å; T396-N400 WeakPolarHBondContact CB-O 3.29Å; T396-N400 WeakPolarHBondContact CG2-O 3.3Å; T397-N400 PolarHBondContact N-O 2.89Å; T397-N400 CarbonylContact O-C 3.46Å; T397-N400 PolarHBondContact O-N 3.33Å; T397-N400 VanDerWaalsContact O-N 3.09Å; T397-N400 PolarHBondContact OG1-N 3.12Å; N400-S412 PolarHBondContact ND2-OG 2.99Å; N400-S412 VanDerWaalsContact OD1-CB 3.22Å; N400-S412 WeakPolarHBondContact OD1-CB 3.37Å; N400-S412 PolarHBondContact OD1-OG 3.46Å; N400-K413 PolarHBondContact OD1-N 2.97Å; N400-K413 VanDerWaalsContact OD1-N 3.09Å; N400-D414 PolarHBondContact ND2-OD2 3.42Å; N400-D414 VanDerWaalsContact ND2-OD2 3.07Å; N400-D414 WeakPolarHBondContact OD1-CB 3.3Å; N400-D414 PolarHBondContact OD1-N 2.73Å
401	P	87.9	Confident	86.6	Confident	17 Å²	17	59 Å²	59	11%	0.11	31%	0.311	C	S	.	.			trans	-73.6	162.8	-171.3	31.8	-38.2	0	0	0	112	T397 A399 K413 V448	T397-P401 WeakPolarHBondContact O-CA 3.42Å; T397-P401 VanDerWaalsContact O-N 3.16Å; A399-P401 VanDerWaalsContact C-CD 3.49Å; A399-P401 WeakPolarHBondContact O-CD 3.47Å; P401-K413 HydrophobicContact CG-CB 4.44Å; P401-K413 HydrophobicContact CG-CD 4.43Å; P401-K413 PolarHBondContact O-N 3.26Å; P401-V448 HydrophobicContact CB-CG1 3.68Å; P401-V448 HydrophobicContact CG-CG1 3.71Å; P401-V448 HydrophobicContact CG-CG2 4.42Å
402	P	90.2	Very high	86.9	Confident	10 Å²	10	56 Å²	56	7%	0.065	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.5	171.5	28.8	-32.4	0	0	0	110.4	F387 T396 V410 I449 F451	F387-P402 HydrophobicContact CB-CB 4.37Å; F387-P402 HydrophobicContact CD1-CB 3.67Å; F387-P402 HydrophobicContact CE1-CB 4.2Å; F387-P402 HydrophobicContact CG-CB 4.08Å; T396-P402 HydrophobicContact CG2-CB 4.17Å; P402-V410 HydrophobicContact CB-CG1 3.67Å; P402-I449 HydrophobicContact CG-CB 4.26Å; P402-I449 WeakPolarHBondContact CG-O 3.29Å; P402-I449 PolarHBondContact O-N 3.05Å; P402-F451 HydrophobicContact CB-CE2 4.28Å; P402-F451 HydrophobicContact CG-CD2 4.22Å; P402-F451 HydrophobicContact CG-CE2 3.73Å
403	V	90.8	Very high	87.1	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.024	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.6	-175.9	177.9	0	0	0	0	109.3	V410 I411 K413 V416 T446 K447 V448	V403-V410 WeakPolarHBondContact O-CA 3.28Å; V403-I411 WeakPolarHBondContact CA-O 3.46Å; V403-I411 WeakPolarHBondContact CB-O 3.46Å; V403-I411 PolarHBondContact N-O 3.24Å; V403-I411 PolarHBondContact O-N 3.07Å; V403-I411 VanDerWaalsContact O-O 3.07Å; V403-K413 HydrophobicContact CG2-CB 3.93Å; V403-V416 HydrophobicContact CB-CG2 4.22Å; V403-V416 HydrophobicContact CG1-CG2 4.12Å; V403-T446 VanDerWaalsContact CG1-CB 3.42Å; V403-T446 HydrophobicContact CG1-CG2 4.21Å; V403-K447 CarbonylContact C-O 3.26Å; V403-K447 WeakPolarHBondContact CA-O 3.33Å; V403-V448 HydrophobicContact CG2-CG2 4.37Å
404	R	91.8	Very high	87.4	Confident	114 Å²	114	52.1 Å²	52.1	43%	0.43	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.2	173.7	-154.5	-178.8	64.6	140.2	3.1	110.8	V410 T446 K447 I449	R404-V410 HydrophobicContact CG-CG2 4.35Å; R404-T446 WeakPolarHBondContact O-CA 3.36Å; R404-K447 PolarHBondContact N-O 2.97Å; R404-K447 PolarHBondContact O-N 3.41Å; R404-I449 HydrophobicContact CB-CD1 3.79Å; R404-I449 HydrophobicContact CB-CG1 3.93Å; R404-I449 HydrophobicContact CG-CD1 4.15Å
405	L	90.6	Very high	87.7	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	26%	0.264	C	S	.	.			trans	-77.9	168.5	169.2	-59.6	-175.8	0	0	0	111.2	C407 G408 H409 I411 V416 L432 C434 T446	L405-C407 PolarHBondContact O-N 3.36Å; L405-G408 PolarHBondContact O-N 3.25Å; L405-H409 WeakPolarHBondContact CB-O 3.33Å; L405-H409 PolarHBondContact N-O 3.06Å; L405-I411 HydrophobicContact CD1-CD1 4.09Å; L405-I411 HydrophobicContact CD1-CG1 4.25Å; L405-I411 HydrophobicContact CD2-CD1 4.15Å; L405-I411 HydrophobicContact CD2-CG1 4.21Å; L405-I411 HydrophobicContact CG-CD1 4.39Å; L405-I411 HydrophobicContact CG-CG1 4.21Å; L405-V416 HydrophobicContact CD2-CG2 4.41Å; L405-L432 HydrophobicContact CD1-CD1 4.02Å; L405-L432 HydrophobicContact CD2-CD1 3.8Å; L405-L432 HydrophobicContact CD2-CD2 4.37Å; L405-C434 HydrophobicContact CD1-CB 3.86Å; L405-T446 HydrophobicContact CD2-CG2 3.79Å
406	V	89.2	Confident	88	Confident	58 Å²	58	44.6 Å²	44.6	35%	0.352	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.4	179.9	-61.8	0	0	0	0	112.9	G408 Q439 S441 K445	V406-G408 PolarHBondContact O-N 2.92Å; V406-Q439 HydrophobicContact CG2-CG 4.46Å; V406-S441 WeakPolarHBondContact CG2-OG 3.46Å; V406-K445 HydrophobicContact CG1-CB 3.47Å; V406-K445 VanDerWaalsContact CG1-CB 3.47Å; V406-K445 HydrophobicContact CG1-CD 4.05Å; V406-K445 HydrophobicContact CG1-CG 4.41Å
407	C	91	Very high	88.2	Confident	32 Å²	32	47.1 Å²	47.1	22%	0.216	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-7.5	174	60.4	0	0	0	0	113.9	L405 C434 C437 Q439	L405-C407 PolarHBondContact O-N 3.36Å; C407-C434 VanDerWaalsContact SG-SG 3.6Å; C407-C437 WeakPolarHBondContact CB-SG 3.45Å; C407-Q439 HydrophobicContact CB-CB 4.03Å; C407-Q439 HydrophobicContact CB-CG 4.29Å
408	G	87.1	Confident	88.3	Confident	36 Å²	36	50.5 Å²	50.5	37%	0.371	26%	0.264	S	S	.	.	S	Bend	trans	92.2	-14.7	-177.3	0	0	0	0	0	115	L405 V406	L405-G408 PolarHBondContact O-N 3.25Å; V406-G408 PolarHBondContact O-N 2.92Å
409	H	89.6	Confident	88.5	Confident	69 Å²	69	43.1 Å²	43.1	32%	0.319	23%	0.231	S	C	.	.			trans	-66.3	149.3	172.7	-69.3	115.9	0	0	0	111.9	L405 C434 Y436	L405-H409 WeakPolarHBondContact CB-O 3.33Å; L405-H409 PolarHBondContact N-O 3.06Å; H409-C434 PolarHBondContact ND1-SG 3.5Å; H409-C434 VanDerWaalsContact ND1-SG 3.43Å; H409-Y436 HydrophobicContact CB-CD2 4.21Å
410	V	89.4	Confident	88.5	Confident	30 Å²	30	40 Å²	40	18%	0.182	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.3	-176.5	-172.3	0	0	0	0	109.4	F387 P402 V403 R404 I449	F387-V410 HydrophobicContact CD1-CG1 4.36Å; F387-V410 HydrophobicContact CD2-CG1 4.32Å; F387-V410 HydrophobicContact CE1-CG1 3.88Å; F387-V410 HydrophobicContact CE2-CB 3.86Å; F387-V410 HydrophobicContact CE2-CG1 3.85Å; F387-V410 HydrophobicContact CZ-CB 3.8Å; F387-V410 HydrophobicContact CZ-CG1 3.63Å; F387-V410 VanDerWaalsContact CZ-O 3.27Å; F387-V410 WeakPolarHBondContact CZ-O 3.46Å; P402-V410 HydrophobicContact CB-CG1 3.67Å; V403-V410 WeakPolarHBondContact O-CA 3.28Å; R404-V410 HydrophobicContact CG-CG2 4.35Å; V410-I449 HydrophobicContact CB-CD1 4.38Å; V410-I449 HydrophobicContact CG1-CD1 3.94Å; V410-I449 HydrophobicContact CG2-CD1 3.46Å; V410-I449 VanDerWaalsContact CG2-CD1 3.46Å
411	I	90.7	Very high	87.9	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	163.2	173.1	56.2	167.7	0	0	0	108.7	P390 I391 V403 L405 A415 V416 L419	P390-I411 HydrophobicContact CG-CG2 4.22Å; I391-I411 HydrophobicContact CD1-CD1 4.23Å; I391-I411 HydrophobicContact CD1-CG2 4.08Å; I391-I411 HydrophobicContact CG1-CG2 4.29Å; V403-I411 WeakPolarHBondContact CA-O 3.46Å; V403-I411 WeakPolarHBondContact CB-O 3.46Å; V403-I411 PolarHBondContact N-O 3.24Å; V403-I411 PolarHBondContact O-N 3.07Å; V403-I411 VanDerWaalsContact O-O 3.07Å; L405-I411 HydrophobicContact CD1-CD1 4.09Å; L405-I411 HydrophobicContact CD1-CG1 4.25Å; L405-I411 HydrophobicContact CD2-CD1 4.15Å; L405-I411 HydrophobicContact CD2-CG1 4.21Å; L405-I411 HydrophobicContact CG-CD1 4.39Å; L405-I411 HydrophobicContact CG-CG1 4.21Å; I411-A415 HydrophobicContact CB-CB 4.28Å; I411-A415 HydrophobicContact CD1-CB 4.46Å; I411-V416 HydrophobicContact CD1-CG2 3.58Å; I411-V416 HydrophobicContact CG1-CG2 3.76Å; I411-L419 HydrophobicContact CD1-CD1 3.78Å
412	S	90.7	Very high	87.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	160.2	179.8	76	0	0	0	0	112.5	C389 L392 N400 D414 A415 V416	C389-S412 PolarHBondContact SG-N 3.39Å; C389-S412 VanDerWaalsContact SG-N 3.38Å; L392-S412 VanDerWaalsContact CD1-OG 3.23Å; L392-S412 WeakPolarHBondContact CD1-OG 3.43Å; N400-S412 PolarHBondContact ND2-OG 2.99Å; N400-S412 VanDerWaalsContact OD1-CB 3.22Å; N400-S412 WeakPolarHBondContact OD1-CB 3.37Å; N400-S412 PolarHBondContact OD1-OG 3.46Å; S412-D414 VanDerWaalsContact C-N 3.3Å; S412-D414 PolarHBondContact O-N 3.15Å; S412-A415 WeakPolarHBondContact O-CA 3.34Å; S412-A415 VanDerWaalsContact O-CB 3.32Å; S412-A415 WeakPolarHBondContact O-CB 3.27Å; S412-A415 PolarHBondContact O-N 3.23Å; S412-A415 WeakPolarHBondContact OG-CB 3.48Å; S412-A415 PolarHBondContact OG-N 2.99Å; S412-V416 PolarHBondContact O-N 2.86Å
413	K	88.8	Confident	86.2	Confident	99 Å²	99	52.3 Å²	52.3	43%	0.43	27%	0.269	S	S	.	.	H	α-helix	trans	-56	-41.8	175.5	-173.2	-180	178	-175	0	113	N400 P401 V403 A415 V416 N417	N400-K413 PolarHBondContact OD1-N 2.97Å; N400-K413 VanDerWaalsContact OD1-N 3.09Å; P401-K413 HydrophobicContact CG-CB 4.44Å; P401-K413 HydrophobicContact CG-CD 4.43Å; P401-K413 PolarHBondContact O-N 3.26Å; V403-K413 HydrophobicContact CG2-CB 3.93Å; K413-A415 VanDerWaalsContact C-N 3.31Å; K413-A415 PolarHBondContact O-N 3.2Å; K413-V416 WeakPolarHBondContact O-CB 3.4Å; K413-V416 PolarHBondContact O-N 2.93Å; K413-N417 PolarHBondContact O-N 3.17Å; K413-N417 PolarHBondContact O-ND2 3.14Å
414	D	90	Very high	85	Confident	64 Å²	64	62.8 Å²	62.8	34%	0.342	31%	0.308	S	S	.	.	H	α-helix	trans	-67.8	-34.3	176.2	-72.1	-14.4	0	0	0	111.8	L392 N400 S412 N417 R418	L392-D414 HydrophobicContact CD1-CB 3.69Å; N400-D414 PolarHBondContact ND2-OD2 3.42Å; N400-D414 VanDerWaalsContact ND2-OD2 3.07Å; N400-D414 WeakPolarHBondContact OD1-CB 3.3Å; N400-D414 PolarHBondContact OD1-N 2.73Å; S412-D414 VanDerWaalsContact C-N 3.3Å; S412-D414 PolarHBondContact O-N 3.15Å; D414-N417 PolarHBondContact O-N 3.15Å; D414-R418 WeakPolarHBondContact O-CB 3.19Å; D414-R418 WeakPolarHBondContact O-CG 3.46Å; D414-R418 PolarHBondContact O-N 3.4Å
415	A	87.7	Confident	83.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.2	-39.4	175.1	0	0	0	0	0	111.3	C389 I391 L392 I411 S412 K413 R418 L419	C389-A415 VanDerWaalsContact SG-CB 3.5Å; I391-A415 HydrophobicContact CB-CB 4.07Å; I391-A415 HydrophobicContact CD1-CB 4.05Å; I391-A415 HydrophobicContact CG1-CB 4.39Å; L392-A415 HydrophobicContact CD1-CB 4.31Å; L392-A415 HydrophobicContact CG-CB 4.06Å; I411-A415 HydrophobicContact CB-CB 4.28Å; I411-A415 HydrophobicContact CD1-CB 4.46Å; S412-A415 WeakPolarHBondContact O-CA 3.34Å; S412-A415 VanDerWaalsContact O-CB 3.32Å; S412-A415 WeakPolarHBondContact O-CB 3.27Å; S412-A415 PolarHBondContact O-N 3.23Å; S412-A415 WeakPolarHBondContact OG-CB 3.48Å; S412-A415 PolarHBondContact OG-N 2.99Å; K413-A415 VanDerWaalsContact C-N 3.31Å; K413-A415 PolarHBondContact O-N 3.2Å; A415-R418 PolarHBondContact O-N 3.33Å; A415-L419 WeakPolarHBondContact O-CB 3.06Å; A415-L419 VanDerWaalsContact O-CG 3.28Å; A415-L419 WeakPolarHBondContact O-CG 3.41Å; A415-L419 PolarHBondContact O-N 3.5Å
416	V	87.6	Confident	82.4	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.024	32%	0.32	C	S	.	.	H	α-helix	trans	-56.2	-52.1	170	168	0	0	0	0	110	V403 L405 I411 S412 K413 R418 L419 V420 L432 I443	V403-V416 HydrophobicContact CB-CG2 4.22Å; V403-V416 HydrophobicContact CG1-CG2 4.12Å; L405-V416 HydrophobicContact CD2-CG2 4.41Å; I411-V416 HydrophobicContact CD1-CG2 3.58Å; I411-V416 HydrophobicContact CG1-CG2 3.76Å; S412-V416 PolarHBondContact O-N 2.86Å; K413-V416 WeakPolarHBondContact O-CB 3.4Å; K413-V416 PolarHBondContact O-N 2.93Å; V416-R418 PolarHBondContact O-N 2.85Å; V416-L419 PolarHBondContact O-N 3.09Å; V416-V420 WeakPolarHBondContact O-CG2 3.2Å; V416-V420 PolarHBondContact O-N 2.99Å; V416-V420 VanDerWaalsContact O-N 3.09Å; V416-L432 HydrophobicContact CB-CD2 4.47Å; V416-L432 HydrophobicContact CG1-CD2 3.73Å; V416-I443 HydrophobicContact CG1-CG1 4.31Å
417	N	86.3	Confident	81.1	Confident	77 Å²	77	63.1 Å²	63.1	41%	0.412	32%	0.322	S	S	.	.	H	α-helix	trans	-61.2	-44.1	-179.5	-69.4	-24.4	0	0	0	112.4	K413 D414 L419 V420 S421	K413-N417 PolarHBondContact O-N 3.17Å; K413-N417 PolarHBondContact O-ND2 3.14Å; D414-N417 PolarHBondContact O-N 3.15Å; N417-L419 PolarHBondContact O-N 3.33Å; N417-V420 PolarHBondContact O-N 3.41Å; N417-S421 PolarHBondContact O-N 3.02Å; N417-S421 VanDerWaalsContact O-N 3.15Å; N417-S421 PolarHBondContact O-OG 3.39Å
418	R	84.9	Confident	79.6	Confident	151 Å²	151	73.1 Å²	73.1	57%	0.57	36%	0.355	S	S	*	.	H	α-helix	trans	-63.5	-40.7	177.8	-73.4	-173.1	-165.4	-171.2	2.4	112.6	D414 A415 V416 S421 H422	D414-R418 WeakPolarHBondContact O-CB 3.19Å; D414-R418 WeakPolarHBondContact O-CG 3.46Å; D414-R418 PolarHBondContact O-N 3.4Å; A415-R418 PolarHBondContact O-N 3.33Å; V416-R418 PolarHBondContact O-N 2.85Å; R418-S421 PolarHBondContact O-N 3.42Å; R418-H422 WeakPolarHBondContact O-CB 3.35Å; R418-H422 PolarHBondContact O-N 2.96Å; R418-H422 VanDerWaalsContact O-N 3.16Å
419	L	83.4	Confident	78.6	Confident	44 Å²	44	75.5 Å²	75.5	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-65.1	-41.6	178.3	-76.6	176	0	0	0	112.1	I391 I411 A415 V416 N417 S421 H422 D423 L432 P435	I391-L419 HydrophobicContact CD1-CD1 3.47Å; I391-L419 VanDerWaalsContact CD1-CD1 3.47Å; I391-L419 HydrophobicContact CD1-CD2 4.21Å; I391-L419 HydrophobicContact CD1-CG 3.92Å; I411-L419 HydrophobicContact CD1-CD1 3.78Å; A415-L419 WeakPolarHBondContact O-CB 3.06Å; A415-L419 VanDerWaalsContact O-CG 3.28Å; A415-L419 WeakPolarHBondContact O-CG 3.41Å; A415-L419 PolarHBondContact O-N 3.5Å; V416-L419 PolarHBondContact O-N 3.09Å; N417-L419 PolarHBondContact O-N 3.33Å; L419-S421 VanDerWaalsContact C-N 3.3Å; L419-S421 PolarHBondContact O-N 2.97Å; L419-H422 PolarHBondContact O-N 3.45Å; L419-D423 PolarHBondContact O-N 3.36Å; L419-D423 VanDerWaalsContact O-N 3.09Å; L419-L432 HydrophobicContact CB-CB 4.39Å; L419-L432 HydrophobicContact CD1-CD1 4.21Å; L419-P435 HydrophobicContact CD1-CG 4.24Å
420	V	82.5	Confident	77.9	Confident	19 Å²	19	76.2 Å²	76.2	12%	0.115	37%	0.371	C	S	.	.	H	α-helix	trans	-62.3	-40.1	177.9	172.7	0	0	0	0	110.7	V416 N417 H422 I427 L432 I443	V416-V420 WeakPolarHBondContact O-CG2 3.2Å; V416-V420 PolarHBondContact O-N 2.99Å; V416-V420 VanDerWaalsContact O-N 3.09Å; N417-V420 PolarHBondContact O-N 3.41Å; V420-H422 VanDerWaalsContact C-N 3.34Å; V420-I427 VanDerWaalsContact O-CG1 3.29Å; V420-I427 WeakPolarHBondContact O-CG1 3.5Å; V420-L432 HydrophobicContact CG2-CB 4.03Å; V420-L432 HydrophobicContact CG2-CD2 4Å; V420-I443 HydrophobicContact CB-CD1 4.12Å; V420-I443 HydrophobicContact CG1-CD1 3.75Å; V420-I443 HydrophobicContact CG2-CD1 3.37Å; V420-I443 HydrophobicContact CG2-CG1 3.64Å
421	S	76.8	Confident	77.4	Confident	94 Å²	94	75.2 Å²	75.2	66%	0.657	37%	0.367	S	S	*	.	H	α-helix	trans	-69.5	-28.8	177	-56.1	0	0	0	0	113.7	N417 R418 L419	N417-S421 PolarHBondContact O-N 3.02Å; N417-S421 VanDerWaalsContact O-N 3.15Å; N417-S421 PolarHBondContact O-OG 3.39Å; R418-S421 PolarHBondContact O-N 3.42Å; L419-S421 VanDerWaalsContact C-N 3.3Å; L419-S421 PolarHBondContact O-N 2.97Å
422	H	70.8	Confident	77.1	Confident	163 Å²	163	75.2 Å²	75.2	76%	0.755	37%	0.367	S	S	*	.	H	α-helix	trans	-90.4	-31.9	-172.7	-158.3	-81.6	0	0	0	113.5	R418 L419 V420 R424	R418-H422 WeakPolarHBondContact O-CB 3.35Å; R418-H422 PolarHBondContact O-N 2.96Å; R418-H422 VanDerWaalsContact O-N 3.16Å; L419-H422 PolarHBondContact O-N 3.45Å; V420-H422 VanDerWaalsContact C-N 3.34Å; H422-R424 PolarHBondContact O-N 2.96Å
423	D	70.6	Confident	76.8	Confident	39 Å²	39	79.7 Å²	79.7	21%	0.209	39%	0.386	C	S	.	.			trans	-83.3	85.4	-179.2	-165.9	-14.8	0	0	0	111.8	L419 S425 L426 I427	L419-D423 PolarHBondContact O-N 3.36Å; L419-D423 VanDerWaalsContact O-N 3.09Å; D423-S425 PolarHBondContact O-N 3.26Å; D423-S425 WeakPolarHBondContact OD1-CB 3.33Å; D423-S425 PolarHBondContact OD1-N 2.77Å; D423-S425 PolarHBondContact OD1-OG 3.1Å; D423-L426 PolarHBondContact O-N 3.33Å; D423-I427 WeakPolarHBondContact O-CG1 3.35Å; D423-I427 PolarHBondContact O-N 2.81Å
424	R	64.9	Low	76.6	Confident	224 Å²	224	75.4 Å²	75.4	85%	0.845	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-25.3	179.4	-73.2	-167.8	-82	-147.9	-3.1	114.7	H422 I427	H422-R424 PolarHBondContact O-N 2.96Å; R424-I427 HydrophobicContact CB-CD1 4.46Å; R424-I427 HydrophobicContact CG-CD1 4.15Å
425	S	64.6	Low	76.3	Confident	82 Å²	82	75.7 Å²	75.7	57%	0.573	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-28.4	-179.5	71.4	0	0	0	0	113.4	D423	D423-S425 PolarHBondContact O-N 3.26Å; D423-S425 WeakPolarHBondContact OD1-CB 3.33Å; D423-S425 PolarHBondContact OD1-N 2.77Å; D423-S425 PolarHBondContact OD1-OG 3.1Å
426	L	63.5	Low	76.2	Confident	22 Å²	22	82 Å²	82	12%	0.115	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-2.3	-173.8	-65.1	178.4	0	0	0	114.4	D423 R428 C429 N430 G431 K433 E440	D423-L426 PolarHBondContact O-N 3.33Å; L426-R428 VanDerWaalsContact C-N 3.26Å; L426-R428 PolarHBondContact O-N 3.37Å; L426-C429 CarbonylContact O-C 3.54Å; L426-C429 PolarHBondContact O-N 2.92Å; L426-N430 PolarHBondContact O-N 3.39Å; L426-G431 VanDerWaalsContact CB-O 3.3Å; L426-G431 WeakPolarHBondContact CB-O 3.42Å; L426-G431 PolarHBondContact O-N 3.29Å; L426-K433 HydrophobicContact CD1-CG 4.01Å; L426-E440 HydrophobicContact CD1-CG 4.19Å
427	I	61.5	Low	76.1	Confident	76 Å²	76	83 Å²	83	39%	0.39	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-52	-42.8	177	-71	171	0	0	0	111.8	V420 D423 R424 C429 N430	V420-I427 VanDerWaalsContact O-CG1 3.29Å; V420-I427 WeakPolarHBondContact O-CG1 3.5Å; D423-I427 WeakPolarHBondContact O-CG1 3.35Å; D423-I427 PolarHBondContact O-N 2.81Å; R424-I427 HydrophobicContact CB-CD1 4.46Å; R424-I427 HydrophobicContact CG-CD1 4.15Å; I427-C429 PolarHBondContact O-N 3.27Å; I427-N430 PolarHBondContact O-N 3.22Å
428	R	61	Low	76.1	Confident	243 Å²	243	85.8 Å²	85.8	92%	0.917	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-64.4	-23.7	-178.1	-69.5	-169.7	-175	-143.2	2.1	113.5	L426	L426-R428 VanDerWaalsContact C-N 3.26Å; L426-R428 PolarHBondContact O-N 3.37Å
429	C	66.4	Low	76	Confident	85 Å²	85	83.3 Å²	83.3	57%	0.574	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-113.5	12.8	-173.8	-62	0	0	0	0	112.6	L426 I427 G431 H442	L426-C429 CarbonylContact O-C 3.54Å; L426-C429 PolarHBondContact O-N 2.92Å; I427-C429 PolarHBondContact O-N 3.27Å; C429-G431 PolarHBondContact O-N 3.12Å; C429-H442 PolarHBondContact O-CD2 3.4Å; C429-H442 PolarHBondContact O-NE2 3.12Å
430	N	73.6	Confident	76	Confident	85 Å²	85	86.1 Å²	86.1	46%	0.455	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	34.6	-174	-77.1	1.1	0	0	0	113.4	L426 I427 H442 I443	L426-N430 PolarHBondContact O-N 3.39Å; I427-N430 PolarHBondContact O-N 3.22Å; N430-H442 PolarHBondContact O-CD2 3.49Å; N430-I443 HydrophobicContact CB-CD1 3.89Å; N430-I443 WeakPolarHBondContact O-CG1 3.43Å; N430-I443 PolarHBondContact O-N 3.45Å; N430-I443 VanDerWaalsContact O-N 3.15Å
431	G	79.9	Confident	76	Confident	8 Å²	8	85.3 Å²	85.3	8%	0.082	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	153.1	178.6	0	0	0	0	0	111.3	L426 C429 S441	L426-G431 VanDerWaalsContact CB-O 3.3Å; L426-G431 WeakPolarHBondContact CB-O 3.42Å; L426-G431 PolarHBondContact O-N 3.29Å; C429-G431 PolarHBondContact O-N 3.12Å; G431-S441 CarbonylContact C-O 3.53Å; G431-S441 WeakPolarHBondContact CA-O 3.42Å
432	L	84	Confident	76.2	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	143.7	172.7	70.8	98.5	0	0	0	110.4	L405 V416 L419 V420 S441 I443	L405-L432 HydrophobicContact CD1-CD1 4.02Å; L405-L432 HydrophobicContact CD2-CD1 3.8Å; L405-L432 HydrophobicContact CD2-CD2 4.37Å; V416-L432 HydrophobicContact CB-CD2 4.47Å; V416-L432 HydrophobicContact CG1-CD2 3.73Å; L419-L432 HydrophobicContact CB-CB 4.39Å; L419-L432 HydrophobicContact CD1-CD1 4.21Å; V420-L432 HydrophobicContact CG2-CB 4.03Å; V420-L432 HydrophobicContact CG2-CD2 4Å; L432-S441 PolarHBondContact N-O 3.03Å; L432-S441 PolarHBondContact O-N 2.87Å; L432-I443 HydrophobicContact CD2-CG1 4.23Å
433	K	83.5	Confident	76.8	Confident	94 Å²	94	78.7 Å²	78.7	41%	0.409	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	136	171.9	-75	171.1	-176.3	173.2	0	110.3	L426 E440	L426-K433 HydrophobicContact CD1-CG 4.01Å; K433-E440 WeakPolarHBondContact CE-OE1 3.48Å; K433-E440 HydrophobicContact CG-CG 3.83Å; K433-E440 IonicContact NZ-OE1 3.12Å
434	C	85.6	Confident	77.4	Confident	9 Å²	9	81.4 Å²	81.4	6%	0.061	41%	0.412	C	S	.	.			trans	-67.2	135	172.3	-179.7	0	0	0	0	109.8	L405 C407 H409 Y436 C437 Q439	L405-C434 HydrophobicContact CD1-CB 3.86Å; C407-C434 VanDerWaalsContact SG-SG 3.6Å; H409-C434 PolarHBondContact ND1-SG 3.5Å; H409-C434 VanDerWaalsContact ND1-SG 3.43Å; C434-Y436 PolarHBondContact O-N 2.89Å; C434-Y436 PolarHBondContact SG-N 2.99Å; C434-C437 WeakPolarHBondContact CB-O 3.29Å; C434-C437 WeakPolarHBondContact CB-SG 3.49Å; C434-C437 PolarHBondContact SG-SG 2.79Å; C434-Q439 PolarHBondContact N-O 3.39Å
435	P	83.8	Confident	78.4	Confident	71 Å²	71	77.7 Å²	77.7	46%	0.461	40%	0.402	S	S	.	.	S	Bend	trans	-65.9	-24	177	-16.1	25.9	0	0	0	113.9	I391 L419	I391-P435 HydrophobicContact CD1-CG 3.38Å; I391-P435 HydrophobicContact CG1-CG 3.93Å; L419-P435 HydrophobicContact CD1-CG 4.24Å
436	Y	84.1	Confident	79.4	Confident	132 Å²	132	75.2 Å²	75.2	52%	0.518	38%	0.383	S	S	.	.	S	Bend	trans	-98.5	-21.7	-172.4	-67.4	-71	0	0	0	114.1	P390 H409 C434	P390-Y436 HydrophobicContact CB-CE2 4.32Å; P390-Y436 WeakPolarHBondContact CB-OH 3.32Å; P390-Y436 HydrophobicContact CG-CE2 3.65Å; P390-Y436 WeakPolarHBondContact CG-OH 3.37Å; H409-Y436 HydrophobicContact CB-CD2 4.21Å; C434-Y436 PolarHBondContact O-N 2.89Å; C434-Y436 PolarHBondContact SG-N 2.99Å
437	C	86.8	Confident	80.6	Confident	26 Å²	26	80.8 Å²	80.8	18%	0.176	41%	0.406	C	S	.	.	S	Bend	trans	-145.4	155.4	-174.9	71.4	0	0	0	0	109.9	C407 C434 Q439	C407-C437 WeakPolarHBondContact CB-SG 3.45Å; C434-C437 WeakPolarHBondContact CB-O 3.29Å; C434-C437 WeakPolarHBondContact CB-SG 3.49Å; C434-C437 PolarHBondContact SG-SG 2.79Å; C437-Q439 PolarHBondContact O-N 2.75Å
438	P	84.9	Confident	81.9	Confident	134 Å²	134	80 Å²	80	87%	0.87	41%	0.405	S	S	*	.	S	Bend	trans	-70.8	3.6	-176.1	29.5	-36	0	0	0	114
439	Q	84.5	Confident	83	Confident	99 Å²	99	70.6 Å²	70.6	46%	0.463	37%	0.372	S	S	.	.			trans	-81.3	130	-173.7	-165.1	167	1.1	0	0	112.2	V406 C407 C434 C437	V406-Q439 HydrophobicContact CG2-CG 4.46Å; C407-Q439 HydrophobicContact CB-CB 4.03Å; C407-Q439 HydrophobicContact CB-CG 4.29Å; C434-Q439 PolarHBondContact N-O 3.39Å; C437-Q439 PolarHBondContact O-N 2.75Å
440	E	83.7	Confident	83.5	Confident	103 Å²	103	75.8 Å²	75.8	48%	0.481	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.9	174.2	-64.8	-177.9	176.5	0	0	110.6	L426 K433	L426-E440 HydrophobicContact CD1-CG 4.19Å; K433-E440 WeakPolarHBondContact CE-OE1 3.48Å; K433-E440 HydrophobicContact CG-CG 3.83Å; K433-E440 IonicContact NZ-OE1 3.12Å
441	S	80.6	Confident	83.1	Confident	3 Å²	3	79.8 Å²	79.8	2%	0.021	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	139.8	180	-56.8	0	0	0	0	109.3	V406 G431 L432	V406-S441 WeakPolarHBondContact CG2-OG 3.46Å; G431-S441 CarbonylContact C-O 3.53Å; G431-S441 WeakPolarHBondContact CA-O 3.42Å; L432-S441 PolarHBondContact N-O 3.03Å; L432-S441 PolarHBondContact O-N 2.87Å
442	H	82.8	Confident	83.2	Confident	72 Å²	72	83.4 Å²	83.4	33%	0.333	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	138.6	171.3	-171.3	-89.8	0	0	0	109.6	C429 N430 S444 K445 T446	C429-H442 PolarHBondContact O-CD2 3.4Å; C429-H442 PolarHBondContact O-NE2 3.12Å; N430-H442 PolarHBondContact O-CD2 3.49Å; H442-S444 PolarHBondContact CE1-OG 3.04Å; H442-S444 VanDerWaalsContact CE1-OG 3.28Å; H442-S444 WeakPolarHBondContact ND1-CB 3.28Å; H442-S444 PolarHBondContact ND1-N 2.81Å; H442-S444 VanDerWaalsContact ND1-N 3.18Å; H442-S444 PolarHBondContact ND1-OG 2.73Å; H442-S444 PolarHBondContact O-N 2.93Å; H442-K445 HydrophobicContact CB-CG 4.5Å; H442-K445 PolarHBondContact O-N 2.9Å; H442-T446 PolarHBondContact O-N 3.16Å
443	I	83.3	Confident	83.2	Confident	46 Å²	46	87.7 Å²	87.7	24%	0.236	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-53.7	-41.9	-176.7	-61.8	163.5	0	0	0	111.5	V416 V420 N430 L432 K445 T446	V416-I443 HydrophobicContact CG1-CG1 4.31Å; V420-I443 HydrophobicContact CB-CD1 4.12Å; V420-I443 HydrophobicContact CG1-CD1 3.75Å; V420-I443 HydrophobicContact CG2-CD1 3.37Å; V420-I443 HydrophobicContact CG2-CG1 3.64Å; N430-I443 HydrophobicContact CB-CD1 3.89Å; N430-I443 WeakPolarHBondContact O-CG1 3.43Å; N430-I443 PolarHBondContact O-N 3.45Å; N430-I443 VanDerWaalsContact O-N 3.15Å; L432-I443 HydrophobicContact CD2-CG1 4.23Å; I443-K445 PolarHBondContact O-N 3.37Å; I443-T446 WeakPolarHBondContact O-CB 3.33Å; I443-T446 PolarHBondContact O-N 3.18Å; I443-T446 PolarHBondContact O-OG1 3.05Å
444	S	82.5	Confident	83.2	Confident	95 Å²	95	87.4 Å²	87.4	66%	0.664	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-64.7	-19.8	179.9	71.9	0	0	0	0	114.7	H442	H442-S444 PolarHBondContact CE1-OG 3.04Å; H442-S444 VanDerWaalsContact CE1-OG 3.28Å; H442-S444 WeakPolarHBondContact ND1-CB 3.28Å; H442-S444 PolarHBondContact ND1-N 2.81Å; H442-S444 VanDerWaalsContact ND1-N 3.18Å; H442-S444 PolarHBondContact ND1-OG 2.73Å; H442-S444 PolarHBondContact O-N 2.93Å
445	K	85.5	Confident	83	Confident	147 Å²	147	92 Å²	92	64%	0.639	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-93	-5.6	176.9	-65.4	-171.7	177.5	-179.6	0	112.9	V406 H442 I443	V406-K445 HydrophobicContact CG1-CB 3.47Å; V406-K445 VanDerWaalsContact CG1-CB 3.47Å; V406-K445 HydrophobicContact CG1-CD 4.05Å; V406-K445 HydrophobicContact CG1-CG 4.41Å; H442-K445 HydrophobicContact CB-CG 4.5Å; H442-K445 PolarHBondContact O-N 2.9Å; I443-K445 PolarHBondContact O-N 3.37Å
446	T	86	Confident	83	Confident	30 Å²	30	93.3 Å²	93.3	18%	0.184	46%	0.455	C	S	.	.			trans	-73.8	146.1	176.1	69.9	0	0	0	0	110.4	V403 R404 L405 H442 I443	V403-T446 VanDerWaalsContact CG1-CB 3.42Å; V403-T446 HydrophobicContact CG1-CG2 4.21Å; R404-T446 WeakPolarHBondContact O-CA 3.36Å; L405-T446 HydrophobicContact CD2-CG2 3.79Å; H442-T446 PolarHBondContact O-N 3.16Å; I443-T446 WeakPolarHBondContact O-CB 3.33Å; I443-T446 PolarHBondContact O-N 3.18Å; I443-T446 PolarHBondContact O-OG1 3.05Å
447	K	89.3	Confident	82.9	Confident	138 Å²	138	90.7 Å²	90.7	60%	0.6	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.1	131.5	178.6	-69.7	-168.4	176.5	-172.6	0	110.1	V403 R404	V403-K447 CarbonylContact C-O 3.26Å; V403-K447 WeakPolarHBondContact CA-O 3.33Å; R404-K447 PolarHBondContact N-O 2.97Å; R404-K447 PolarHBondContact O-N 3.41Å
448	V	88.7	Confident	82.6	Confident	61 Å²	61	95.4 Å²	95.4	37%	0.37	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	133.4	170.5	-177	0	0	0	0	108.7	P401 V403 Y450	P401-V448 HydrophobicContact CB-CG1 3.68Å; P401-V448 HydrophobicContact CG-CG1 3.71Å; P401-V448 HydrophobicContact CG-CG2 4.42Å; V403-V448 HydrophobicContact CG2-CG2 4.37Å; V448-Y450 HydrophobicContact CB-CE2 4.27Å; V448-Y450 HydrophobicContact CG1-CE1 4.22Å; V448-Y450 HydrophobicContact CG1-CE2 3.94Å
449	I	82.6	Confident	82.4	Confident	44 Å²	44	92.4 Å²	92.4	23%	0.226	44%	0.44	C	S	.	.			trans	-97.8	137.7	173.2	-60.3	179.4	0	0	0	107.9	P402 R404 V410 F451	P402-I449 HydrophobicContact CG-CB 4.26Å; P402-I449 WeakPolarHBondContact CG-O 3.29Å; P402-I449 PolarHBondContact O-N 3.05Å; R404-I449 HydrophobicContact CB-CD1 3.79Å; R404-I449 HydrophobicContact CB-CG1 3.93Å; R404-I449 HydrophobicContact CG-CD1 4.15Å; V410-I449 HydrophobicContact CB-CD1 4.38Å; V410-I449 HydrophobicContact CG1-CD1 3.94Å; V410-I449 HydrophobicContact CG2-CD1 3.46Å; V410-I449 VanDerWaalsContact CG2-CD1 3.46Å; I449-F451 HydrophobicContact CG2-CE1 4.41Å; I449-F451 HydrophobicContact CG2-CZ 4.37Å
450	Y	76.7	Confident	82.3	Confident	195 Å²	195	91.8 Å²	91.8	77%	0.765	44%	0.438	S	S	*	.			trans	-114.6	129.7	166.7	-58.2	-85.3	0	0	0	106.9	V448	V448-Y450 HydrophobicContact CB-CE2 4.27Å; V448-Y450 HydrophobicContact CG1-CE1 4.22Å; V448-Y450 HydrophobicContact CG1-CE2 3.94Å
451	F	65.5	Low	82.1	Confident	168 Å²	168	90.8 Å²	90.8	74%	0.737	43%	0.434	S	S	*	.			trans	-88.3	0	178.1	-71.7	-73.1	0	0	0	112	F387 P402 I449	F387-F451 HydrophobicContact CB-CE2 3.53Å; F387-F451 HydrophobicContact CB-CZ 3.98Å; F387-F451 HydrophobicContact CD2-CZ 4.45Å; F387-F451 HydrophobicContact CG-CE2 4.32Å; F387-F451 HydrophobicContact CG-CZ 4.47Å; P402-F451 HydrophobicContact CB-CE2 4.28Å; P402-F451 HydrophobicContact CG-CD2 4.22Å; P402-F451 HydrophobicContact CG-CE2 3.73Å; I449-F451 HydrophobicContact CG2-CE1 4.41Å; I449-F451 HydrophobicContact CG2-CZ 4.37Å

Retrieved 451 of 451 residues in 256.3 ms (Link to these results)

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