A0A077ZK81_TRITR Loading...

Tape meas lam C domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZK81, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 572 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	53.9	Low	57.2	Low	217 Å²	217	114.8 Å²	114.8	100%	1.069	63%	0.626	S	S	*	*				0	-41	0	-71.4	-84	-119.3	0	0	112.5	A3 L4	M1-A3 PolarHBondContact O-N 3.02Å; M1-L4 PolarHBondContact O-N 3.04Å
2	S	63.1	Low	57.1	Low	94 Å²	94	111.9 Å²	111.9	66%	0.657	62%	0.615	S	S	*	*	H	α-helix	trans	-63.3	-40.5	-178.3	-147.5	0	0	0	0	115	L4 A5 E6	S2-L4 VanDerWaalsContact C-N 3.3Å; S2-L4 PolarHBondContact O-N 3.31Å; S2-A5 PolarHBondContact O-N 2.83Å; S2-E6 PolarHBondContact O-N 3.28Å
3	A	55.9	Low	56.9	Low	76 Å²	76	107.5 Å²	107.5	63%	0.628	60%	0.597	S	S	*	*	H	α-helix	trans	-64.8	-31.3	-178.4	0	0	0	0	0	113.6	M1 E7	M1-A3 PolarHBondContact O-N 3.02Å; A3-E7 WeakPolarHBondContact O-CB 3.46Å; A3-E7 PolarHBondContact O-N 3.27Å
4	L	53.8	Low	56.7	Low	130 Å²	130	106.4 Å²	106.4	68%	0.681	59%	0.589	S	S	*	*	H	α-helix	trans	-71.2	-36.9	179.1	-164.2	75.5	0	0	0	111.3	M1 S2 T8	M1-L4 PolarHBondContact O-N 3.04Å; S2-L4 VanDerWaalsContact C-N 3.3Å; S2-L4 PolarHBondContact O-N 3.31Å; L4-T8 WeakPolarHBondContact O-CG2 3.44Å; L4-T8 PolarHBondContact O-N 3.01Å; L4-T8 PolarHBondContact O-OG1 2.91Å; L4-T8 VanDerWaalsContact O-OG1 3.08Å
5	A	54.9	Low	56.6	Low	63 Å²	63	105.9 Å²	105.9	52%	0.521	58%	0.584	S	S	.	*	H	α-helix	trans	-68.5	-41.7	-179.6	0	0	0	0	0	112.1	S2 T8 G9	S2-A5 PolarHBondContact O-N 2.83Å; A5-T8 WeakPolarHBondContact CA-OG1 3.5Å; A5-T8 PolarHBondContact O-N 3.41Å; A5-T8 PolarHBondContact O-OG1 3.25Å; A5-G9 PolarHBondContact O-N 3.21Å
6	E	58.7	Low	56.5	Low	141 Å²	141	105.1 Å²	105.1	66%	0.659	58%	0.578	S	S	*	*	H	α-helix	trans	-65.6	-41	175.4	-86.3	-179.3	150.2	0	0	112.6	S2 T8 G9 K10	S2-E6 PolarHBondContact O-N 3.28Å; E6-T8 VanDerWaalsContact C-N 3.33Å; E6-T8 PolarHBondContact O-N 3.2Å; E6-G9 PolarHBondContact O-N 3.02Å; E6-K10 PolarHBondContact O-N 3.11Å; E6-K10 VanDerWaalsContact O-N 3.1Å
7	E	59.8	Low	56.4	Low	114 Å²	114	105.1 Å²	105.1	53%	0.533	58%	0.577	S	S	.	*	H	α-helix	trans	-64.6	-39	177.5	-156.9	76.4	-155.7	0	0	111.2	A3 R11	A3-E7 WeakPolarHBondContact O-CB 3.46Å; A3-E7 PolarHBondContact O-N 3.27Å; E7-R11 WeakPolarHBondContact O-CG 3.43Å; E7-R11 PolarHBondContact O-N 3.44Å; E7-R11 VanDerWaalsContact O-N 3.12Å
8	T	57.4	Low	56.4	Low	76 Å²	76	104.9 Å²	104.9	47%	0.466	58%	0.576	S	S	.	*	H	α-helix	trans	-65.3	-40	174.4	48.2	0	0	0	0	112.5	L4 A5 E6 R11 T12	L4-T8 WeakPolarHBondContact O-CG2 3.44Å; L4-T8 PolarHBondContact O-N 3.01Å; L4-T8 PolarHBondContact O-OG1 2.91Å; L4-T8 VanDerWaalsContact O-OG1 3.08Å; A5-T8 WeakPolarHBondContact CA-OG1 3.5Å; A5-T8 PolarHBondContact O-N 3.41Å; A5-T8 PolarHBondContact O-OG1 3.25Å; E6-T8 VanDerWaalsContact C-N 3.33Å; E6-T8 PolarHBondContact O-N 3.2Å; T8-R11 PolarHBondContact O-N 3.42Å; T8-T12 PolarHBondContact O-N 2.94Å; T8-T12 PolarHBondContact O-OG1 3.25Å
9	G	56.9	Low	56.2	Low	40 Å²	40	104.8 Å²	104.8	41%	0.412	57%	0.574	S	S	.	*	H	α-helix	trans	-65	-42.7	179.6	0	0	0	0	0	113.1	A5 E6 T12 S13	A5-G9 PolarHBondContact O-N 3.21Å; E6-G9 PolarHBondContact O-N 3.02Å; G9-T12 PolarHBondContact O-N 3.08Å; G9-S13 PolarHBondContact O-N 3.2Å
10	K	59.3	Low	56	Low	143 Å²	143	105.5 Å²	105.5	62%	0.622	58%	0.577	S	S	*	*	H	α-helix	trans	-63.7	-42.1	174.3	-75.7	-176	179.1	175.6	0	112.1	E6 T12 S13 D14	E6-K10 PolarHBondContact O-N 3.11Å; E6-K10 VanDerWaalsContact O-N 3.1Å; K10-T12 VanDerWaalsContact C-N 3.32Å; K10-T12 PolarHBondContact O-N 2.99Å; K10-S13 PolarHBondContact O-N 2.92Å; K10-S13 PolarHBondContact O-OG 3.01Å; K10-D14 WeakPolarHBondContact O-CB 3.45Å; K10-D14 PolarHBondContact O-N 2.86Å
11	R	55.8	Low	55.9	Low	169 Å²	169	102.5 Å²	102.5	64%	0.638	57%	0.566	S	S	*	*	H	α-helix	trans	-62.1	-39.9	175	-76.5	-177.2	174.7	-150.3	-1.5	111.9	E7 T8 D14 I15	E7-R11 WeakPolarHBondContact O-CG 3.43Å; E7-R11 PolarHBondContact O-N 3.44Å; E7-R11 VanDerWaalsContact O-N 3.12Å; T8-R11 PolarHBondContact O-N 3.42Å; R11-D14 PolarHBondContact O-N 3.42Å; R11-I15 WeakPolarHBondContact O-CB 3.49Å; R11-I15 WeakPolarHBondContact O-CD1 3.4Å; R11-I15 WeakPolarHBondContact O-CG1 3.41Å; R11-I15 PolarHBondContact O-N 2.83Å
12	T	56	Low	55.8	Low	80 Å²	80	97 Å²	97	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-42.8	176.6	-51.2	0	0	0	0	111.8	T8 G9 K10 D14 I15 D16	T8-T12 PolarHBondContact O-N 2.94Å; T8-T12 PolarHBondContact O-OG1 3.25Å; G9-T12 PolarHBondContact O-N 3.08Å; K10-T12 VanDerWaalsContact C-N 3.32Å; K10-T12 PolarHBondContact O-N 2.99Å; T12-D14 PolarHBondContact O-N 3.19Å; T12-I15 PolarHBondContact O-N 2.87Å; T12-D16 PolarHBondContact O-N 3.42Å
13	S	54.7	Low	55.4	Low	55 Å²	55	94 Å²	94	39%	0.385	53%	0.525	S	S	.	.	H	α-helix	trans	-66.2	-36.9	176.8	66.4	0	0	0	0	112.9	G9 K10 D16 N17	G9-S13 PolarHBondContact O-N 3.2Å; K10-S13 PolarHBondContact O-N 2.92Å; K10-S13 PolarHBondContact O-OG 3.01Å; S13-D16 PolarHBondContact O-N 3.48Å; S13-N17 VanDerWaalsContact O-CB 3.29Å; S13-N17 WeakPolarHBondContact O-CB 3.36Å; S13-N17 VanDerWaalsContact O-CG 3.27Å; S13-N17 PolarHBondContact O-N 3.46Å; S13-N17 PolarHBondContact O-ND2 3.36Å
14	D	54.1	Low	55.4	Low	92 Å²	92	93.4 Å²	93.4	49%	0.492	52%	0.516	S	S	.	.	H	α-helix	trans	-70	-34.2	175.8	-74.1	-13.7	0	0	0	111.7	K10 R11 T12 N18	K10-D14 WeakPolarHBondContact O-CB 3.45Å; K10-D14 PolarHBondContact O-N 2.86Å; R11-D14 PolarHBondContact O-N 3.42Å; T12-D14 PolarHBondContact O-N 3.19Å; D14-N18 WeakPolarHBondContact O-CB 3.42Å; D14-N18 VanDerWaalsContact O-CG 3.29Å; D14-N18 PolarHBondContact O-N 3.21Å; D14-N18 PolarHBondContact O-ND2 2.79Å
15	I	55	Low	55.4	Low	98 Å²	98	90.2 Å²	90.2	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-46.4	172.4	-71	164.9	0	0	0	110.3	R11 T12 N18 L19	R11-I15 WeakPolarHBondContact O-CB 3.49Å; R11-I15 WeakPolarHBondContact O-CD1 3.4Å; R11-I15 WeakPolarHBondContact O-CG1 3.41Å; R11-I15 PolarHBondContact O-N 2.83Å; T12-I15 PolarHBondContact O-N 2.87Å; I15-N18 PolarHBondContact O-N 3.3Å; I15-L19 HydrophobicContact CG2-CD1 3.62Å; I15-L19 HydrophobicContact CG2-CG 4.21Å; I15-L19 VanDerWaalsContact O-CB 3.27Å; I15-L19 WeakPolarHBondContact O-CB 3.47Å; I15-L19 VanDerWaalsContact O-CG 3.25Å; I15-L19 WeakPolarHBondContact O-CG 3.33Å; I15-L19 PolarHBondContact O-N 2.82Å
16	D	54.9	Low	55.3	Low	93 Å²	93	92.6 Å²	92.6	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-66.1	-41.3	178.8	-91.7	-9.8	0	0	0	112.4	T12 S13 L19 N20	T12-D16 PolarHBondContact O-N 3.42Å; S13-D16 PolarHBondContact O-N 3.48Å; D16-L19 PolarHBondContact O-N 3.42Å; D16-N20 WeakPolarHBondContact O-CB 3.34Å; D16-N20 PolarHBondContact O-N 3.19Å
17	N	55.3	Low	55.4	Low	105 Å²	105	92.3 Å²	92.3	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-65.3	-40.7	175.3	-75.7	-26	0	0	0	111.5	S13 A21	S13-N17 VanDerWaalsContact O-CB 3.29Å; S13-N17 WeakPolarHBondContact O-CB 3.36Å; S13-N17 VanDerWaalsContact O-CG 3.27Å; S13-N17 PolarHBondContact O-N 3.46Å; S13-N17 PolarHBondContact O-ND2 3.36Å; N17-A21 VanDerWaalsContact O-CB 3.25Å; N17-A21 WeakPolarHBondContact O-CB 3.33Å; N17-A21 PolarHBondContact O-N 3.44Å
18	N	54.9	Low	55.6	Low	103 Å²	103	91 Å²	91	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-70.4	-35	174.9	-79.8	-41.2	0	0	0	112.5	D14 I15 A21 L22	D14-N18 WeakPolarHBondContact O-CB 3.42Å; D14-N18 VanDerWaalsContact O-CG 3.29Å; D14-N18 PolarHBondContact O-N 3.21Å; D14-N18 PolarHBondContact O-ND2 2.79Å; I15-N18 PolarHBondContact O-N 3.3Å; N18-A21 PolarHBondContact O-N 2.9Å; N18-L22 VanDerWaalsContact O-CB 3.31Å; N18-L22 WeakPolarHBondContact O-CB 3.25Å; N18-L22 VanDerWaalsContact O-CG 3.24Å; N18-L22 WeakPolarHBondContact O-CG 3.48Å; N18-L22 PolarHBondContact O-N 2.6Å
19	L	52.6	Low	55.6	Low	102 Å²	102	92 Å²	92	53%	0.534	51%	0.505	S	S	.	.	H	α-helix	trans	-69.2	-39	175.2	-78.4	170.4	0	0	0	111.5	I15 D16 L22 G23	I15-L19 HydrophobicContact CG2-CD1 3.62Å; I15-L19 HydrophobicContact CG2-CG 4.21Å; I15-L19 VanDerWaalsContact O-CB 3.27Å; I15-L19 WeakPolarHBondContact O-CB 3.47Å; I15-L19 VanDerWaalsContact O-CG 3.25Å; I15-L19 WeakPolarHBondContact O-CG 3.33Å; I15-L19 PolarHBondContact O-N 2.82Å; D16-L19 PolarHBondContact O-N 3.42Å; L19-L22 PolarHBondContact O-N 2.85Å; L19-G23 PolarHBondContact O-N 3.46Å
20	N	54	Low	56	Low	119 Å²	119	92.7 Å²	92.7	64%	0.636	50%	0.504	S	S	*	.	H	α-helix	trans	-69.7	-36.5	171.9	-88.5	-27	0	0	0	112	D16 L22 G23 S24	D16-N20 WeakPolarHBondContact O-CB 3.34Å; D16-N20 PolarHBondContact O-N 3.19Å; N20-L22 VanDerWaalsContact C-N 3.35Å; N20-G23 PolarHBondContact O-N 3.11Å; N20-S24 VanDerWaalsContact O-CB 3.27Å; N20-S24 WeakPolarHBondContact O-CB 3.3Å; N20-S24 PolarHBondContact O-N 2.93Å; N20-S24 PolarHBondContact O-OG 2.89Å
21	A	53.7	Low	56.5	Low	43 Å²	43	89.8 Å²	89.8	36%	0.355	50%	0.496	S	S	.	.	H	α-helix	trans	-63.4	-41.9	171.3	0	0	0	0	0	111	N17 N18 S24 T25	N17-A21 VanDerWaalsContact O-CB 3.25Å; N17-A21 WeakPolarHBondContact O-CB 3.33Å; N17-A21 PolarHBondContact O-N 3.44Å; N18-A21 PolarHBondContact O-N 2.9Å; A21-S24 PolarHBondContact O-OG 3.17Å; A21-T25 VanDerWaalsContact O-CB 3.3Å; A21-T25 WeakPolarHBondContact O-CB 3.1Å; A21-T25 WeakPolarHBondContact O-CG2 3.48Å; A21-T25 PolarHBondContact O-N 3.36Å; A21-T25 PolarHBondContact O-OG1 3.4Å
22	L	51.1	Low	56.7	Low	101 Å²	101	90.1 Å²	90.1	53%	0.529	50%	0.497	S	S	.	.	H	α-helix	trans	-67.7	-39.5	174.6	-75.6	169.7	0	0	0	112.4	N18 L19 N20 T25 L26	N18-L22 VanDerWaalsContact O-CB 3.31Å; N18-L22 WeakPolarHBondContact O-CB 3.25Å; N18-L22 VanDerWaalsContact O-CG 3.24Å; N18-L22 WeakPolarHBondContact O-CG 3.48Å; N18-L22 PolarHBondContact O-N 2.6Å; L19-L22 PolarHBondContact O-N 2.85Å; N20-L22 VanDerWaalsContact C-N 3.35Å; L22-T25 VanDerWaalsContact CA-OG1 3.25Å; L22-T25 WeakPolarHBondContact CA-OG1 3.37Å; L22-T25 PolarHBondContact O-OG1 2.92Å; L22-L26 VanDerWaalsContact O-CB 3.23Å; L22-L26 WeakPolarHBondContact O-CB 2.96Å; L22-L26 VanDerWaalsContact O-CG 3.22Å; L22-L26 WeakPolarHBondContact O-CG 3.36Å; L22-L26 PolarHBondContact O-N 3.37Å
23	G	54.5	Low	56.7	Low	32 Å²	32	93.7 Å²	93.7	33%	0.33	50%	0.501	S	S	.	.	H	α-helix	trans	-67.3	-44.3	176.7	0	0	0	0	0	112.4	L19 N20 L26 Q27	L19-G23 PolarHBondContact O-N 3.46Å; N20-G23 PolarHBondContact O-N 3.11Å; G23-L26 PolarHBondContact O-N 2.68Å; G23-Q27 WeakPolarHBondContact O-CB 3.43Å; G23-Q27 WeakPolarHBondContact O-CG 3.28Å; G23-Q27 PolarHBondContact O-N 3.35Å
24	S	55.9	Low	57.2	Low	62 Å²	62	97.1 Å²	97.1	43%	0.434	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-40.9	175.4	65.6	0	0	0	0	111.5	N20 A21 Q27 T28	N20-S24 VanDerWaalsContact O-CB 3.27Å; N20-S24 WeakPolarHBondContact O-CB 3.3Å; N20-S24 PolarHBondContact O-N 2.93Å; N20-S24 PolarHBondContact O-OG 2.89Å; A21-S24 PolarHBondContact O-OG 3.17Å; S24-Q27 PolarHBondContact O-N 3.17Å; S24-T28 WeakPolarHBondContact O-CG2 3.4Å; S24-T28 PolarHBondContact O-N 2.89Å; S24-T28 PolarHBondContact O-OG1 2.77Å
25	T	53.1	Low	57.6	Low	64 Å²	64	99 Å²	99	39%	0.393	52%	0.515	S	S	.	.	H	α-helix	trans	-66.4	-40	175.2	51.3	0	0	0	0	112.1	A21 L22 T28 L29	A21-T25 VanDerWaalsContact O-CB 3.3Å; A21-T25 WeakPolarHBondContact O-CB 3.1Å; A21-T25 WeakPolarHBondContact O-CG2 3.48Å; A21-T25 PolarHBondContact O-N 3.36Å; A21-T25 PolarHBondContact O-OG1 3.4Å; L22-T25 VanDerWaalsContact CA-OG1 3.25Å; L22-T25 WeakPolarHBondContact CA-OG1 3.37Å; L22-T25 PolarHBondContact O-OG1 2.92Å; T25-T28 VanDerWaalsContact CA-OG1 3.23Å; T25-T28 WeakPolarHBondContact CA-OG1 3.37Å; T25-T28 PolarHBondContact O-N 2.85Å; T25-T28 PolarHBondContact O-OG1 3.01Å; T25-L29 WeakPolarHBondContact O-CB 3.32Å; T25-L29 PolarHBondContact O-N 2.84Å
26	L	54.3	Low	58.1	Low	112 Å²	112	100 Å²	100	59%	0.586	52%	0.516	S	S	*	.	H	α-helix	trans	-66.6	-38	174.7	-78.3	169.9	0	0	0	112.4	L22 G23 L29 S30	L22-L26 VanDerWaalsContact O-CB 3.23Å; L22-L26 WeakPolarHBondContact O-CB 2.96Å; L22-L26 VanDerWaalsContact O-CG 3.22Å; L22-L26 WeakPolarHBondContact O-CG 3.36Å; L22-L26 PolarHBondContact O-N 3.37Å; G23-L26 PolarHBondContact O-N 2.68Å; L26-L29 PolarHBondContact O-N 2.8Å; L26-S30 WeakPolarHBondContact O-CB 2.97Å; L26-S30 PolarHBondContact O-N 3.47Å
27	Q	60.5	Low	58.2	Low	136 Å²	136	102.6 Å²	102.6	64%	0.636	52%	0.519	S	S	*	.	H	α-helix	trans	-63.8	-46.6	171.8	-79.5	-177.5	-7.9	0	0	110.9	G23 S24 L29 S30 D31	G23-Q27 WeakPolarHBondContact O-CB 3.43Å; G23-Q27 WeakPolarHBondContact O-CG 3.28Å; G23-Q27 PolarHBondContact O-N 3.35Å; S24-Q27 PolarHBondContact O-N 3.17Å; Q27-L29 VanDerWaalsContact C-N 3.3Å; Q27-L29 PolarHBondContact O-N 2.55Å; Q27-S30 PolarHBondContact O-N 2.95Å; Q27-D31 WeakPolarHBondContact O-CB 3.06Å; Q27-D31 PolarHBondContact O-N 3.32Å
28	T	63.8	Low	58.4	Low	86 Å²	86	102 Å²	102	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-61.6	-38.3	175.9	52.7	0	0	0	0	112.1	S24 T25 D31 W32	S24-T28 WeakPolarHBondContact O-CG2 3.4Å; S24-T28 PolarHBondContact O-N 2.89Å; S24-T28 PolarHBondContact O-OG1 2.77Å; T25-T28 VanDerWaalsContact CA-OG1 3.23Å; T25-T28 WeakPolarHBondContact CA-OG1 3.37Å; T25-T28 PolarHBondContact O-N 2.85Å; T25-T28 PolarHBondContact O-OG1 3.01Å; T28-D31 PolarHBondContact O-N 3.29Å; T28-W32 WeakPolarHBondContact O-CB 3.47Å; T28-W32 PolarHBondContact O-N 3.34Å
29	L	57.1	Low	58.5	Low	96 Å²	96	99.7 Å²	99.7	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-44.2	175.1	-89.9	161.4	0	0	0	111.7	T25 L26 Q27 D31 W32 W33	T25-L29 WeakPolarHBondContact O-CB 3.32Å; T25-L29 PolarHBondContact O-N 2.84Å; L26-L29 PolarHBondContact O-N 2.8Å; Q27-L29 VanDerWaalsContact C-N 3.3Å; Q27-L29 PolarHBondContact O-N 2.55Å; L29-D31 VanDerWaalsContact C-N 3.33Å; L29-D31 PolarHBondContact O-N 3.27Å; L29-W32 PolarHBondContact O-N 3.48Å; L29-W33 WeakPolarHBondContact O-CB 3.46Å; L29-W33 PolarHBondContact O-N 2.72Å
30	S	65.9	Low	58.7	Low	55 Å²	55	96.7 Å²	96.7	39%	0.385	50%	0.501	S	S	.	.	H	α-helix	trans	-59.5	-44.7	175.1	167.4	0	0	0	0	111.3	L26 Q27 W33 K34	L26-S30 WeakPolarHBondContact O-CB 2.97Å; L26-S30 PolarHBondContact O-N 3.47Å; Q27-S30 PolarHBondContact O-N 2.95Å; S30-W33 PolarHBondContact O-N 3.29Å; S30-K34 WeakPolarHBondContact O-CG 3.2Å; S30-K34 PolarHBondContact O-N 2.72Å
31	D	69.6	Low	58.8	Low	83 Å²	83	96.2 Å²	96.2	44%	0.444	50%	0.496	S	S	.	.	H	α-helix	trans	-68.4	-38.9	179	-71.7	-16.9	0	0	0	111.1	Q27 T28 L29 W33 K34 Q35	Q27-D31 WeakPolarHBondContact O-CB 3.06Å; Q27-D31 PolarHBondContact O-N 3.32Å; T28-D31 PolarHBondContact O-N 3.29Å; L29-D31 VanDerWaalsContact C-N 3.33Å; L29-D31 PolarHBondContact O-N 3.27Å; D31-W33 VanDerWaalsContact C-N 3.31Å; D31-W33 PolarHBondContact O-N 2.87Å; D31-K34 PolarHBondContact O-N 3.01Å; D31-Q35 WeakPolarHBondContact O-CB 3Å; D31-Q35 VanDerWaalsContact O-CG 3.29Å; D31-Q35 WeakPolarHBondContact O-CG 3.38Å; D31-Q35 PolarHBondContact O-N 3.48Å
32	W	58.7	Low	58.8	Low	175 Å²	175	98.3 Å²	98.3	66%	0.663	50%	0.502	S	S	*	.	H	α-helix	trans	-61.5	-39.9	170.6	-126.9	61	0	0	0	112	T28 L29 Q35 F36	T28-W32 WeakPolarHBondContact O-CB 3.47Å; T28-W32 PolarHBondContact O-N 3.34Å; L29-W32 PolarHBondContact O-N 3.48Å; W32-Q35 PolarHBondContact O-N 2.9Å; W32-F36 VanDerWaalsContact O-CB 3.27Å; W32-F36 WeakPolarHBondContact O-CB 3.44Å; W32-F36 PolarHBondContact O-N 2.61Å
33	W	58	Low	58.6	Low	155 Å²	155	100.4 Å²	100.4	59%	0.587	51%	0.512	S	S	*	.	H	α-helix	trans	-69.9	-39.4	179.5	-138.7	-117.8	0	0	0	112.3	L29 S30 D31 F36 W37	L29-W33 WeakPolarHBondContact O-CB 3.46Å; L29-W33 PolarHBondContact O-N 2.72Å; S30-W33 PolarHBondContact O-N 3.29Å; D31-W33 VanDerWaalsContact C-N 3.31Å; D31-W33 PolarHBondContact O-N 2.87Å; W33-F36 PolarHBondContact O-N 2.99Å; W33-W37 WeakPolarHBondContact O-CB 3.38Å; W33-W37 PolarHBondContact O-N 2.63Å
34	K	63.9	Low	58.3	Low	128 Å²	128	102.8 Å²	102.8	56%	0.557	54%	0.536	S	S	*	.	H	α-helix	trans	-63.3	-47.4	171.7	-76.6	176.5	-178.2	169	0	111	S30 D31 F36 W37 D38	S30-K34 WeakPolarHBondContact O-CG 3.2Å; S30-K34 PolarHBondContact O-N 2.72Å; D31-K34 PolarHBondContact O-N 3.01Å; K34-F36 VanDerWaalsContact C-N 3.28Å; K34-F36 PolarHBondContact O-N 3.29Å; K34-W37 PolarHBondContact O-N 3.03Å; K34-D38 WeakPolarHBondContact O-CB 3.28Å; K34-D38 PolarHBondContact O-N 2.99Å
35	Q	63.8	Low	57.8	Low	130 Å²	130	109 Å²	109	61%	0.607	55%	0.55	S	S	*	*	H	α-helix	trans	-60.2	-39.8	175.4	-75.7	179	12.9	0	0	111.7	D31 W32 A39	D31-Q35 WeakPolarHBondContact O-CB 3Å; D31-Q35 VanDerWaalsContact O-CG 3.29Å; D31-Q35 WeakPolarHBondContact O-CG 3.38Å; D31-Q35 PolarHBondContact O-N 3.48Å; W32-Q35 PolarHBondContact O-N 2.9Å; Q35-A39 WeakPolarHBondContact O-CB 3.46Å; Q35-A39 PolarHBondContact O-N 2.73Å
36	F	64.9	Low	57.8	Low	119 Å²	119	114.3 Å²	114.3	52%	0.522	57%	0.571	S	S	.	*	H	α-helix	trans	-65.8	-44.3	175.7	-178.2	-92.1	0	0	0	111.9	W32 W33 K34 A39 A40	W32-F36 VanDerWaalsContact O-CB 3.27Å; W32-F36 WeakPolarHBondContact O-CB 3.44Å; W32-F36 PolarHBondContact O-N 2.61Å; W33-F36 PolarHBondContact O-N 2.99Å; K34-F36 VanDerWaalsContact C-N 3.28Å; K34-F36 PolarHBondContact O-N 3.29Å; F36-A39 PolarHBondContact O-N 2.89Å; F36-A40 HydrophobicContact CE1-CB 4.35Å; F36-A40 WeakPolarHBondContact O-CB 3.46Å; F36-A40 PolarHBondContact O-N 3.45Å
37	W	56.6	Low	58.1	Low	148 Å²	148	114.2 Å²	114.2	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-67.1	-41.1	178.1	-110.7	98.6	0	0	0	112.4	W33 K34 A40 M41	W33-W37 WeakPolarHBondContact O-CB 3.38Å; W33-W37 PolarHBondContact O-N 2.63Å; K34-W37 PolarHBondContact O-N 3.03Å; W37-A40 PolarHBondContact O-N 3.46Å; W37-M41 HydrophobicContact CE3-CE 3.97Å; W37-M41 HydrophobicContact CE3-CG 3.57Å; W37-M41 HydrophobicContact CE3-SD 3.71Å; W37-M41 HydrophobicContact CZ3-CG 3.65Å; W37-M41 HydrophobicContact CZ3-SD 3.73Å; W37-M41 WeakPolarHBondContact O-CB 3.33Å; W37-M41 WeakPolarHBondContact O-CG 3.37Å; W37-M41 PolarHBondContact O-N 3.12Å
38	D	59.1	Low	58.4	Low	94 Å²	94	111 Å²	111	50%	0.503	56%	0.563	S	S	.	*	H	α-helix	trans	-63.6	-44	173	-79.7	-21.5	0	0	0	110.5	K34 N42	K34-D38 WeakPolarHBondContact O-CB 3.28Å; K34-D38 PolarHBondContact O-N 2.99Å; D38-N42 WeakPolarHBondContact O-CB 3.49Å; D38-N42 PolarHBondContact O-N 3.23Å; D38-N42 PolarHBondContact O-ND2 3.46Å
39	A	58.3	Low	58.6	Low	53 Å²	53	109 Å²	109	44%	0.438	55%	0.549	S	S	.	.	H	α-helix	trans	-62.1	-46.5	175.2	0	0	0	0	0	111.8	Q35 F36 N42 I43	Q35-A39 WeakPolarHBondContact O-CB 3.46Å; Q35-A39 PolarHBondContact O-N 2.73Å; F36-A39 PolarHBondContact O-N 2.89Å; A39-N42 CarbonylContact O-C 3.55Å; A39-N42 WeakPolarHBondContact O-CA 3.25Å; A39-N42 PolarHBondContact O-N 3.08Å; A39-I43 WeakPolarHBondContact O-CG1 3.42Å; A39-I43 PolarHBondContact O-N 3.03Å
40	A	55.8	Low	59.4	Low	40 Å²	40	107.7 Å²	107.7	33%	0.331	54%	0.543	S	S	.	.	H	α-helix	trans	-65.6	-39.8	-179.7	0	0	0	0	0	112.3	F36 W37 N42 I43	F36-A40 HydrophobicContact CE1-CB 4.35Å; F36-A40 WeakPolarHBondContact O-CB 3.46Å; F36-A40 PolarHBondContact O-N 3.45Å; W37-A40 PolarHBondContact O-N 3.46Å; A40-N42 PolarHBondContact O-N 2.92Å; A40-I43 PolarHBondContact O-N 3.47Å
41	M	56.4	Low	59.9	Low	108 Å²	108	106.9 Å²	106.9	53%	0.532	54%	0.54	S	S	.	.	H	α-helix	trans	-69.6	-24.2	171.2	-73.8	-167.7	-62.5	0	0	112.8	W37	W37-M41 HydrophobicContact CE3-CE 3.97Å; W37-M41 HydrophobicContact CE3-CG 3.57Å; W37-M41 HydrophobicContact CE3-SD 3.71Å; W37-M41 HydrophobicContact CZ3-CG 3.65Å; W37-M41 HydrophobicContact CZ3-SD 3.73Å; W37-M41 WeakPolarHBondContact O-CB 3.33Å; W37-M41 WeakPolarHBondContact O-CG 3.37Å; W37-M41 PolarHBondContact O-N 3.12Å
42	N	54.2	Low	60.4	Low	88 Å²	88	105.2 Å²	105.2	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-86.6	-12.5	175.5	-71.6	-25.8	0	0	0	113.6	D38 A39 A40 G44 R45	D38-N42 WeakPolarHBondContact O-CB 3.49Å; D38-N42 PolarHBondContact O-N 3.23Å; D38-N42 PolarHBondContact O-ND2 3.46Å; A39-N42 CarbonylContact O-C 3.55Å; A39-N42 WeakPolarHBondContact O-CA 3.25Å; A39-N42 PolarHBondContact O-N 3.08Å; A40-N42 PolarHBondContact O-N 2.92Å; N42-G44 PolarHBondContact O-N 3.46Å; N42-R45 PolarHBondContact O-N 3.03Å
43	I	46.6	Very low	61.4	Low	145 Å²	145	97.4 Å²	97.4	74%	0.744	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	102.8	172	-70.1	170.2	0	0	0	108.1	A39 A40	A39-I43 WeakPolarHBondContact O-CG1 3.42Å; A39-I43 PolarHBondContact O-N 3.03Å; A40-I43 PolarHBondContact O-N 3.47Å
44	G	48.3	Very low	62.5	Low	82 Å²	82	94.4 Å²	94.4	85%	0.845	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.6	-6.8	179.7	0	0	0	0	0	115.9	N42	N42-G44 PolarHBondContact O-N 3.46Å
45	R	44.8	Very low	63.3	Low	191 Å²	191	90.9 Å²	90.9	72%	0.721	49%	0.491	S	S	*	.	S	Bend	trans	-84.4	126.2	166.1	-86.3	-176.5	161.6	-169.2	-3	108.7	N42 D47	N42-R45 PolarHBondContact O-N 3.03Å; R45-D47 PolarHBondContact O-N 3.2Å
46	E	52.3	Low	64.1	Low	177 Å²	177	85.6 Å²	85.6	83%	0.827	47%	0.466	S	S	*	.			trans	-50.6	132.5	163.6	-70.4	-177	159.9	0	0	108.4	S48	E46-S48 PolarHBondContact O-N 2.96Å
47	D	60.9	Low	64.9	Low	109 Å²	109	83.6 Å²	83.6	58%	0.583	46%	0.459	S	S	*	.			trans	-45.3	139.8	174.2	-74.8	-33.8	0	0	0	109.6	R45 A51 Q52	R45-D47 PolarHBondContact O-N 3.2Å; D47-A51 HydrophobicContact CB-CB 4.1Å; D47-Q52 HydrophobicContact CB-CG 3.62Å; D47-Q52 PolarHBondContact O-NE2 3.08Å
48	S	66.9	Low	66.1	Low	69 Å²	69	81.8 Å²	81.8	48%	0.483	46%	0.456	S	S	.	.			trans	-54	149.1	175.4	70.6	0	0	0	0	109.6	E46 D50 A51 Q52	E46-S48 PolarHBondContact O-N 2.96Å; S48-D50 PolarHBondContact O-N 3.49Å; S48-A51 PolarHBondContact O-N 3.26Å; S48-A51 WeakPolarHBondContact OG-CB 3.4Å; S48-A51 PolarHBondContact OG-N 3.38Å; S48-A51 VanDerWaalsContact OG-N 3.09Å; S48-Q52 PolarHBondContact O-N 3.05Å
49	L	68.1	Low	67	Low	44 Å²	44	81.6 Å²	81.6	23%	0.23	45%	0.451	C	S	.	.	H	α-helix	trans	-50	-34.4	175.9	-87.8	157.1	0	0	0	111.3	I53 L85 K88 K92	L49-I53 WeakPolarHBondContact O-CB 3.29Å; L49-I53 VanDerWaalsContact O-CD1 3.32Å; L49-I53 WeakPolarHBondContact O-CD1 3.19Å; L49-I53 WeakPolarHBondContact O-CG1 3.43Å; L49-I53 PolarHBondContact O-N 3.39Å; L49-L85 HydrophobicContact CD2-CD2 3.87Å; L49-K88 HydrophobicContact CD2-CB 4Å; L49-K92 HydrophobicContact CD1-CD 4.17Å
50	D	75.3	Confident	68	Low	69 Å²	69	79.3 Å²	79.3	37%	0.369	43%	0.431	S	S	.	.	H	α-helix	trans	-63.7	-53	173.4	-65.9	-42.2	0	0	0	112.8	S48 Q52 I53 D54 K89	S48-D50 PolarHBondContact O-N 3.49Å; D50-Q52 VanDerWaalsContact C-N 3.28Å; D50-Q52 PolarHBondContact O-N 3.26Å; D50-I53 WeakPolarHBondContact O-CB 2.95Å; D50-I53 PolarHBondContact O-N 3.39Å; D50-I53 VanDerWaalsContact O-N 3.11Å; D50-D54 PolarHBondContact O-N 3.2Å; D50-K89 WeakPolarHBondContact OD1-CD 3.34Å; D50-K89 WeakPolarHBondContact OD1-CE 3.45Å; D50-K89 IonicContact OD1-NZ 3.77Å; D50-K89 PolarHBondContact OD1-NZ 2.94Å
51	A	76.2	Confident	69	Low	38 Å²	38	83.2 Å²	83.2	31%	0.314	44%	0.443	S	S	.	.	H	α-helix	trans	-60.8	-37.4	178.4	0	0	0	0	0	112.2	D47 S48 A55	D47-A51 HydrophobicContact CB-CB 4.1Å; S48-A51 PolarHBondContact O-N 3.26Å; S48-A51 WeakPolarHBondContact OG-CB 3.4Å; S48-A51 PolarHBondContact OG-N 3.38Å; S48-A51 VanDerWaalsContact OG-N 3.09Å; A51-A55 VanDerWaalsContact O-CB 3.23Å; A51-A55 WeakPolarHBondContact O-CB 3.35Å; A51-A55 PolarHBondContact O-N 3.47Å
52	Q	78.7	Confident	69.9	Low	48 Å²	48	85.3 Å²	85.3	22%	0.224	45%	0.445	C	S	.	.	H	α-helix	trans	-65.7	-41.1	174.7	-64.2	-176.2	30	0	0	112.2	D47 S48 D50 L56 L85	D47-Q52 HydrophobicContact CB-CG 3.62Å; D47-Q52 PolarHBondContact O-NE2 3.08Å; S48-Q52 PolarHBondContact O-N 3.05Å; D50-Q52 VanDerWaalsContact C-N 3.28Å; D50-Q52 PolarHBondContact O-N 3.26Å; Q52-L56 WeakPolarHBondContact O-CB 3.39Å; Q52-L56 PolarHBondContact O-N 2.97Å; Q52-L56 VanDerWaalsContact O-N 3.09Å; Q52-L85 HydrophobicContact CB-CD1 3.91Å
53	I	80.4	Confident	70.7	Confident	10 Å²	10	81.3 Å²	81.3	5%	0.051	42%	0.424	C	S	.	.	H	α-helix	trans	-64.2	-47.9	176.4	-74.7	165.2	0	0	0	110.1	L49 D50 L56 Q57 L82 L85 Q86 K89	L49-I53 WeakPolarHBondContact O-CB 3.29Å; L49-I53 VanDerWaalsContact O-CD1 3.32Å; L49-I53 WeakPolarHBondContact O-CD1 3.19Å; L49-I53 WeakPolarHBondContact O-CG1 3.43Å; L49-I53 PolarHBondContact O-N 3.39Å; D50-I53 WeakPolarHBondContact O-CB 2.95Å; D50-I53 PolarHBondContact O-N 3.39Å; D50-I53 VanDerWaalsContact O-N 3.11Å; I53-L56 PolarHBondContact O-N 2.96Å; I53-Q57 HydrophobicContact CG2-CG 4.49Å; I53-Q57 WeakPolarHBondContact O-CB 3.17Å; I53-Q57 WeakPolarHBondContact O-CG 3.44Å; I53-Q57 PolarHBondContact O-N 3.37Å; I53-L82 HydrophobicContact CB-CD1 4.33Å; I53-L82 HydrophobicContact CG1-CD1 4.45Å; I53-L82 HydrophobicContact CG2-CD1 3.81Å; I53-L85 HydrophobicContact CD1-CB 4.35Å; I53-L85 HydrophobicContact CG1-CB 3.74Å; I53-Q86 HydrophobicContact CD1-CG 4.01Å; I53-Q86 HydrophobicContact CG1-CG 4.22Å; I53-Q86 HydrophobicContact CG2-CG 4.22Å; I53-K89 HydrophobicContact CD1-CB 3.94Å; I53-K89 HydrophobicContact CD1-CD 3.82Å; I53-K89 HydrophobicContact CD1-CG 4.49Å
54	D	80.7	Confident	71.8	Confident	92 Å²	92	80.1 Å²	80.1	49%	0.492	41%	0.413	S	S	.	.	H	α-helix	trans	-65.1	-44.6	-178	-69.5	-14.4	0	0	0	111.2	D50 L56 Q57 E58	D50-D54 PolarHBondContact O-N 3.2Å; D54-L56 PolarHBondContact O-N 3.39Å; D54-Q57 PolarHBondContact O-N 2.89Å; D54-E58 PolarHBondContact O-N 3.47Å
55	A	81.9	Confident	73	Confident	55 Å²	55	83.2 Å²	83.2	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-40.9	176.3	0	0	0	0	0	112.5	A51 K59	A51-A55 VanDerWaalsContact O-CB 3.23Å; A51-A55 WeakPolarHBondContact O-CB 3.35Å; A51-A55 PolarHBondContact O-N 3.47Å; A55-K59 WeakPolarHBondContact O-CB 3.46Å; A55-K59 PolarHBondContact O-N 2.74Å
56	L	80.2	Confident	74.3	Confident	19 Å²	19	79.1 Å²	79.1	10%	0.099	39%	0.389	C	S	.	.	H	α-helix	trans	-68.7	-40.4	175.2	-92.5	158.2	0	0	0	112.2	Q52 I53 D54 K59 I60 D78 R81 L82 L85	Q52-L56 WeakPolarHBondContact O-CB 3.39Å; Q52-L56 PolarHBondContact O-N 2.97Å; Q52-L56 VanDerWaalsContact O-N 3.09Å; I53-L56 PolarHBondContact O-N 2.96Å; D54-L56 PolarHBondContact O-N 3.39Å; L56-K59 PolarHBondContact O-N 3.45Å; L56-I60 WeakPolarHBondContact O-CD1 3.26Å; L56-I60 VanDerWaalsContact O-CG1 3.29Å; L56-I60 WeakPolarHBondContact O-CG1 3.43Å; L56-I60 PolarHBondContact O-N 3.21Å; L56-D78 HydrophobicContact CD2-CB 3.91Å; L56-R81 HydrophobicContact CD1-CB 4.33Å; L56-R81 HydrophobicContact CD1-CG 3.89Å; L56-L82 HydrophobicContact CB-CD1 4.42Å; L56-L85 HydrophobicContact CD1-CD1 3.36Å
57	Q	81.7	Confident	74.7	Confident	77 Å²	77	74.9 Å²	74.9	36%	0.36	38%	0.377	S	S	.	.	H	α-helix	trans	-60.2	-47.1	174.3	-80	-175	-7.5	0	0	111.2	I53 D54 K59 I60 Q61 L82	I53-Q57 HydrophobicContact CG2-CG 4.49Å; I53-Q57 WeakPolarHBondContact O-CB 3.17Å; I53-Q57 WeakPolarHBondContact O-CG 3.44Å; I53-Q57 PolarHBondContact O-N 3.37Å; D54-Q57 PolarHBondContact O-N 2.89Å; Q57-K59 VanDerWaalsContact C-N 3.3Å; Q57-K59 PolarHBondContact O-N 3.28Å; Q57-I60 PolarHBondContact O-N 3.11Å; Q57-Q61 WeakPolarHBondContact O-CB 3.15Å; Q57-Q61 VanDerWaalsContact O-CG 3.23Å; Q57-Q61 WeakPolarHBondContact O-CG 3.3Å; Q57-Q61 PolarHBondContact O-N 3.48Å; Q57-L82 HydrophobicContact CG-CD1 3.67Å; Q57-L82 HydrophobicContact CG-CD2 3.6Å; Q57-L82 HydrophobicContact CG-CG 4.32Å
58	E	81.2	Confident	74.9	Confident	109 Å²	109	79.5 Å²	79.5	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-59.8	-40.5	175.7	-80.7	-163	169.5	0	0	112.4	D54 Q61 R62	D54-E58 PolarHBondContact O-N 3.47Å; E58-Q61 PolarHBondContact O-N 3.39Å; E58-R62 WeakPolarHBondContact O-CB 3.05Å; E58-R62 WeakPolarHBondContact O-CG 3.49Å; E58-R62 PolarHBondContact O-N 2.69Å; E58-R62 IonicContact OE2-CZ 2.95Å; E58-R62 IonicContact OE2-NH2 3.01Å; E58-R62 PolarHBondContact OE2-NH2 2.79Å
59	K	78.7	Confident	74.7	Confident	90 Å²	90	80 Å²	80	39%	0.391	39%	0.386	S	S	.	.	H	α-helix	trans	-64.1	-43.3	178.5	-165.9	-178.4	175.8	-144.8	0	111.6	A55 L56 Q57 R62 A63 D78	A55-K59 WeakPolarHBondContact O-CB 3.46Å; A55-K59 PolarHBondContact O-N 2.74Å; L56-K59 PolarHBondContact O-N 3.45Å; Q57-K59 VanDerWaalsContact C-N 3.3Å; Q57-K59 PolarHBondContact O-N 3.28Å; K59-R62 PolarHBondContact O-N 3.37Å; K59-A63 WeakPolarHBondContact O-CB 3.35Å; K59-A63 PolarHBondContact O-N 2.93Å; K59-D78 WeakPolarHBondContact CD-OD2 3.27Å; K59-D78 WeakPolarHBondContact CE-OD2 3.29Å; K59-D78 VanDerWaalsContact NZ-CG 3.32Å; K59-D78 IonicContact NZ-OD1 2.6Å; K59-D78 PolarHBondContact NZ-OD1 2.94Å; K59-D78 IonicContact NZ-OD2 2.97Å; K59-D78 PolarHBondContact NZ-OD2 3.06Å
60	I	77.9	Confident	74.2	Confident	5 Å²	5	80.5 Å²	80.5	3%	0.026	39%	0.389	C	S	.	.	H	α-helix	trans	-65	-41.1	175	-66.6	161.5	0	0	0	110.9	L56 Q57 A63 K64 V75 D78 Q79 L82	L56-I60 WeakPolarHBondContact O-CD1 3.26Å; L56-I60 VanDerWaalsContact O-CG1 3.29Å; L56-I60 WeakPolarHBondContact O-CG1 3.43Å; L56-I60 PolarHBondContact O-N 3.21Å; Q57-I60 PolarHBondContact O-N 3.11Å; I60-A63 WeakPolarHBondContact O-CB 3.39Å; I60-A63 PolarHBondContact O-N 2.75Å; I60-K64 HydrophobicContact CG2-CD 4.25Å; I60-K64 WeakPolarHBondContact O-CG 3.47Å; I60-K64 PolarHBondContact O-N 2.99Å; I60-V75 HydrophobicContact CG2-CG1 4.48Å; I60-D78 HydrophobicContact CD1-CB 4.29Å; I60-D78 HydrophobicContact CG1-CB 3.84Å; I60-Q79 HydrophobicContact CD1-CB 4.29Å; I60-L82 HydrophobicContact CD1-CB 3.99Å; I60-L82 HydrophobicContact CD1-CD2 3.64Å; I60-L82 HydrophobicContact CD1-CG 4.44Å
61	Q	78	Confident	73.4	Confident	122 Å²	122	80 Å²	80	57%	0.57	39%	0.394	S	S	*	.	H	α-helix	trans	-66.4	-42.3	177.7	-70.6	-67.1	-7	0	0	111.9	Q57 E58 A63 K64 K65	Q57-Q61 WeakPolarHBondContact O-CB 3.15Å; Q57-Q61 VanDerWaalsContact O-CG 3.23Å; Q57-Q61 WeakPolarHBondContact O-CG 3.3Å; Q57-Q61 PolarHBondContact O-N 3.48Å; E58-Q61 PolarHBondContact O-N 3.39Å; Q61-A63 VanDerWaalsContact C-N 3.32Å; Q61-A63 PolarHBondContact O-N 2.89Å; Q61-K64 PolarHBondContact O-N 3.25Å; Q61-K65 WeakPolarHBondContact O-CB 3.23Å; Q61-K65 PolarHBondContact O-N 3.37Å
62	R	75.2	Confident	72.7	Confident	153 Å²	153	82.6 Å²	82.6	58%	0.577	41%	0.41	S	S	*	.	H	α-helix	trans	-60.6	-42	173.2	-76.5	-174.7	-114.9	-161.7	-3	111.5	E58 K59 K65 Y66	E58-R62 WeakPolarHBondContact O-CB 3.05Å; E58-R62 WeakPolarHBondContact O-CG 3.49Å; E58-R62 PolarHBondContact O-N 2.69Å; E58-R62 IonicContact OE2-CZ 2.95Å; E58-R62 IonicContact OE2-NH2 3.01Å; E58-R62 PolarHBondContact OE2-NH2 2.79Å; K59-R62 PolarHBondContact O-N 3.37Å; R62-K65 PolarHBondContact O-N 2.96Å; R62-Y66 PolarHBondContact O-N 3.38Å
63	A	71.5	Confident	72	Confident	4 Å²	4	84.9 Å²	84.9	3%	0.033	43%	0.428	C	S	.	.	H	α-helix	trans	-63.5	-40.9	175.7	0	0	0	0	0	112.9	K59 I60 Q61 Y66 P67 N70 V75	K59-A63 WeakPolarHBondContact O-CB 3.35Å; K59-A63 PolarHBondContact O-N 2.93Å; I60-A63 WeakPolarHBondContact O-CB 3.39Å; I60-A63 PolarHBondContact O-N 2.75Å; Q61-A63 VanDerWaalsContact C-N 3.32Å; Q61-A63 PolarHBondContact O-N 2.89Å; A63-Y66 CarbonylContact O-C 3.57Å; A63-P67 WeakPolarHBondContact O-CA 3.25Å; A63-N70 WeakPolarHBondContact CA-ND2 3.43Å; A63-N70 HydrophobicContact CB-CB 4.28Å; A63-N70 WeakPolarHBondContact CB-ND2 3.43Å; A63-V75 HydrophobicContact CB-CG2 3.6Å
64	K	69	Low	71.5	Confident	120 Å²	120	89.3 Å²	89.3	52%	0.522	45%	0.448	S	S	.	.	H	α-helix	trans	-68.2	-34.1	175.6	-75.4	178.8	-179.6	176.3	0	112.6	I60 Q61	I60-K64 HydrophobicContact CG2-CD 4.25Å; I60-K64 WeakPolarHBondContact O-CG 3.47Å; I60-K64 PolarHBondContact O-N 2.99Å; Q61-K64 PolarHBondContact O-N 3.25Å
65	K	74.1	Confident	71.1	Confident	147 Å²	147	86.4 Å²	86.4	64%	0.639	43%	0.434	S	S	*	.	H	α-helix	trans	-71.6	-34.3	178.3	-171.7	175	179.9	-179	0	112.5	Q61 R62 P67	Q61-K65 WeakPolarHBondContact O-CB 3.23Å; Q61-K65 PolarHBondContact O-N 3.37Å; R62-K65 PolarHBondContact O-N 2.96Å; K65-P67 VanDerWaalsContact C-CD 3.48Å; K65-P67 WeakPolarHBondContact O-CD 3.28Å
66	Y	70.5	Confident	70.7	Confident	104 Å²	104	90.1 Å²	90.1	41%	0.408	44%	0.442	S	S	.	.	S	Bend	trans	-122.3	70.1	178.7	-58.2	-72.7	0	0	0	110.9	R62 A63 W68 T69	R62-Y66 PolarHBondContact O-N 3.38Å; A63-Y66 CarbonylContact O-C 3.57Å; Y66-W68 AromaticContact CD1-CH2 3.67Å; Y66-W68 HydrophobicContact CD1-CH2 3.67Å; Y66-W68 AromaticContact CD1-CZ2 3.76Å; Y66-W68 HydrophobicContact CD1-CZ2 3.76Å; Y66-W68 HydrophobicContact CD1-CZ3 4.37Å; Y66-W68 HydrophobicContact CE1-CH2 4.3Å; Y66-W68 HydrophobicContact CE1-CZ2 4.49Å; Y66-W68 PolarHBondContact O-N 3.02Å; Y66-W68 VanDerWaalsContact O-N 3.08Å; Y66-T69 PolarHBondContact O-N 3.18Å; Y66-T69 PolarHBondContact O-OG1 3.28Å
67	P	62.4	Low	70.6	Confident	89 Å²	89	95.9 Å²	95.9	58%	0.578	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.5	-171.5	23.6	-32.3	0	0	0	113.8	A63 K65 T69	A63-P67 WeakPolarHBondContact O-CA 3.25Å; K65-P67 VanDerWaalsContact C-CD 3.48Å; K65-P67 WeakPolarHBondContact O-CD 3.28Å; P67-T69 VanDerWaalsContact C-N 3.33Å
68	W	64.4	Low	70.5	Confident	206 Å²	206	92.6 Å²	92.6	78%	0.78	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.1	176.7	70.4	79.2	0	0	0	113.9	Y66	Y66-W68 AromaticContact CD1-CH2 3.67Å; Y66-W68 HydrophobicContact CD1-CH2 3.67Å; Y66-W68 AromaticContact CD1-CZ2 3.76Å; Y66-W68 HydrophobicContact CD1-CZ2 3.76Å; Y66-W68 HydrophobicContact CD1-CZ3 4.37Å; Y66-W68 HydrophobicContact CE1-CH2 4.3Å; Y66-W68 HydrophobicContact CE1-CZ2 4.49Å; Y66-W68 PolarHBondContact O-N 3.02Å; Y66-W68 VanDerWaalsContact O-N 3.08Å
69	T	63.2	Low	70.4	Confident	79 Å²	79	90.4 Å²	90.4	49%	0.485	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-22.9	-176.2	64.7	0	0	0	0	113	Y66 P67	Y66-T69 PolarHBondContact O-N 3.18Å; Y66-T69 PolarHBondContact O-OG1 3.28Å; P67-T69 VanDerWaalsContact C-N 3.33Å
70	N	56.9	Low	70.4	Confident	55 Å²	55	92.2 Å²	92.2	29%	0.294	45%	0.448	S	S	.	.	S	Bend	trans	-121.9	135.1	-169.2	-66.6	2	0	0	0	111	A63 V75	A63-N70 WeakPolarHBondContact CA-ND2 3.43Å; A63-N70 HydrophobicContact CB-CB 4.28Å; A63-N70 WeakPolarHBondContact CB-ND2 3.43Å; N70-V75 HydrophobicContact CB-CG2 4.38Å
71	A	58.6	Low	70.6	Confident	57 Å²	57	98 Å²	98	47%	0.471	47%	0.469	S	S	.	.			trans	-63.9	135	171.9	0	0	0	0	0	110	T73 Q74	A71-T73 PolarHBondContact O-N 3.3Å; A71-T73 VanDerWaalsContact O-N 3.13Å; A71-Q74 WeakPolarHBondContact O-CB 3.24Å; A71-Q74 PolarHBondContact O-N 3.39Å
72	S	61	Low	70.9	Confident	93 Å²	93	92.6 Å²	92.6	65%	0.65	44%	0.444	S	S	*	.	H	α-helix	trans	-52.3	-36.9	-178.6	52.1	0	0	0	0	113.2	Q74 V75 E76	S72-Q74 VanDerWaalsContact C-N 3.3Å; S72-Q74 PolarHBondContact O-N 2.98Å; S72-V75 PolarHBondContact O-N 3.11Å; S72-E76 PolarHBondContact O-N 2.86Å
73	T	64.6	Low	71.2	Confident	97 Å²	97	89.2 Å²	89.2	60%	0.595	44%	0.438	S	S	*	.	H	α-helix	trans	-61.6	-33.2	176.9	37.1	0	0	0	0	113.6	A71 Y77	A71-T73 PolarHBondContact O-N 3.3Å; A71-T73 VanDerWaalsContact O-N 3.13Å; T73-Y77 PolarHBondContact O-N 3Å
74	Q	69.3	Low	71.9	Confident	103 Å²	103	94.2 Å²	94.2	48%	0.481	46%	0.464	S	S	.	.	H	α-helix	trans	-73.2	-34.1	-178.5	-149.5	170.5	18.2	0	0	111.4	A71 S72 D78	A71-Q74 WeakPolarHBondContact O-CB 3.24Å; A71-Q74 PolarHBondContact O-N 3.39Å; S72-Q74 VanDerWaalsContact C-N 3.3Å; S72-Q74 PolarHBondContact O-N 2.98Å; Q74-D78 PolarHBondContact O-N 3.42Å
75	V	72.3	Confident	72.7	Confident	30 Å²	30	89 Å²	89	18%	0.182	44%	0.442	C	S	.	.	H	α-helix	trans	-69.5	-41	177	-175.8	0	0	0	0	111.4	I60 A63 N70 S72 D78 Q79	I60-V75 HydrophobicContact CG2-CG1 4.48Å; A63-V75 HydrophobicContact CB-CG2 3.6Å; N70-V75 HydrophobicContact CB-CG2 4.38Å; S72-V75 PolarHBondContact O-N 3.11Å; V75-D78 PolarHBondContact O-N 3.2Å; V75-Q79 WeakPolarHBondContact O-CB 3.36Å; V75-Q79 PolarHBondContact O-N 3.07Å
76	E	74.2	Confident	73.2	Confident	134 Å²	134	85.7 Å²	85.7	63%	0.626	43%	0.428	S	S	*	.	H	α-helix	trans	-63.4	-42.7	175.9	-74.6	-178.1	168.2	0	0	112.1	S72 Q79 Q80	S72-E76 PolarHBondContact O-N 2.86Å; E76-Q79 PolarHBondContact O-N 3.15Å; E76-Q80 PolarHBondContact O-N 3.35Å
77	Y	77.8	Confident	73.6	Confident	139 Å²	139	84.7 Å²	84.7	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-46.3	175.9	-179.2	-98.1	0	0	0	112.2	T73 Q79 Q80 R81	T73-Y77 PolarHBondContact O-N 3Å; Y77-Q79 VanDerWaalsContact C-N 3.3Å; Y77-Q79 PolarHBondContact O-N 2.9Å; Y77-Q80 PolarHBondContact O-N 3.02Å; Y77-R81 PolarHBondContact O-N 3.46Å
78	D	79.5	Confident	74.7	Confident	9 Å²	9	86.9 Å²	86.9	5%	0.048	43%	0.428	C	S	.	.	H	α-helix	trans	-63.1	-37.4	176.9	-74.3	-24.8	0	0	0	111.2	L56 K59 I60 Q74 V75 R81 L82	L56-D78 HydrophobicContact CD2-CB 3.91Å; K59-D78 WeakPolarHBondContact CD-OD2 3.27Å; K59-D78 WeakPolarHBondContact CE-OD2 3.29Å; K59-D78 VanDerWaalsContact NZ-CG 3.32Å; K59-D78 IonicContact NZ-OD1 2.6Å; K59-D78 PolarHBondContact NZ-OD1 2.94Å; K59-D78 IonicContact NZ-OD2 2.97Å; K59-D78 PolarHBondContact NZ-OD2 3.06Å; I60-D78 HydrophobicContact CD1-CB 4.29Å; I60-D78 HydrophobicContact CG1-CB 3.84Å; Q74-D78 PolarHBondContact O-N 3.42Å; V75-D78 PolarHBondContact O-N 3.2Å; D78-R81 PolarHBondContact O-N 2.75Å; D78-L82 WeakPolarHBondContact O-CB 3.07Å; D78-L82 PolarHBondContact O-N 2.81Å
79	Q	78.9	Confident	75.6	Confident	63 Å²	63	80.3 Å²	80.3	29%	0.294	41%	0.405	S	S	.	.	H	α-helix	trans	-67.3	-39.5	176.6	-172.6	67.6	60.6	0	0	112.8	I60 V75 E76 Y77 L82 N83	I60-Q79 HydrophobicContact CD1-CB 4.29Å; V75-Q79 WeakPolarHBondContact O-CB 3.36Å; V75-Q79 PolarHBondContact O-N 3.07Å; E76-Q79 PolarHBondContact O-N 3.15Å; Y77-Q79 VanDerWaalsContact C-N 3.3Å; Y77-Q79 PolarHBondContact O-N 2.9Å; Q79-L82 PolarHBondContact O-N 2.91Å; Q79-N83 PolarHBondContact NE2-OD1 2.79Å; Q79-N83 VanDerWaalsContact O-CG 3.29Å; Q79-N83 PolarHBondContact O-N 3.35Å; Q79-N83 VanDerWaalsContact O-N 3.12Å; Q79-N83 PolarHBondContact O-OD1 3.15Å
80	Q	79.8	Confident	76.2	Confident	128 Å²	128	82.5 Å²	82.5	60%	0.598	40%	0.404	S	S	*	.	H	α-helix	trans	-62.8	-46.3	173.2	-77.2	-176.6	-5.7	0	0	111.1	E76 Y77 L82 N83 D84	E76-Q80 PolarHBondContact O-N 3.35Å; Y77-Q80 PolarHBondContact O-N 3.02Å; Q80-L82 VanDerWaalsContact C-N 3.28Å; Q80-L82 PolarHBondContact O-N 2.8Å; Q80-N83 PolarHBondContact O-N 2.79Å; Q80-N83 VanDerWaalsContact O-N 3.13Å; Q80-D84 PolarHBondContact O-N 3.34Å
81	R	81.2	Confident	77.2	Confident	126 Å²	126	87.6 Å²	87.6	48%	0.475	42%	0.419	S	S	.	.	H	α-helix	trans	-62.2	-36.5	178.6	-168.2	170.7	177.3	171.9	-0.6	112.4	L56 Y77 D78 D84 L85	L56-R81 HydrophobicContact CD1-CB 4.33Å; L56-R81 HydrophobicContact CD1-CG 3.89Å; Y77-R81 PolarHBondContact O-N 3.46Å; D78-R81 PolarHBondContact O-N 2.75Å; R81-D84 PolarHBondContact O-N 2.81Å; R81-L85 HydrophobicContact CG-CD1 4.49Å; R81-L85 WeakPolarHBondContact O-CG 3.39Å; R81-L85 PolarHBondContact O-N 2.85Å; R81-L85 VanDerWaalsContact O-N 3.09Å
82	L	83.8	Confident	78.3	Confident	8 Å²	8	90.2 Å²	90.2	4%	0.042	42%	0.42	C	S	.	.	H	α-helix	trans	-61.2	-47.7	172.7	174.3	61.8	0	0	0	111.7	I53 L56 Q57 I60 D78 Q79 Q80 D84 L85 Q86	I53-L82 HydrophobicContact CB-CD1 4.33Å; I53-L82 HydrophobicContact CG1-CD1 4.45Å; I53-L82 HydrophobicContact CG2-CD1 3.81Å; L56-L82 HydrophobicContact CB-CD1 4.42Å; Q57-L82 HydrophobicContact CG-CD1 3.67Å; Q57-L82 HydrophobicContact CG-CD2 3.6Å; Q57-L82 HydrophobicContact CG-CG 4.32Å; I60-L82 HydrophobicContact CD1-CB 3.99Å; I60-L82 HydrophobicContact CD1-CD2 3.64Å; I60-L82 HydrophobicContact CD1-CG 4.44Å; D78-L82 WeakPolarHBondContact O-CB 3.07Å; D78-L82 PolarHBondContact O-N 2.81Å; Q79-L82 PolarHBondContact O-N 2.91Å; Q80-L82 VanDerWaalsContact C-N 3.28Å; Q80-L82 PolarHBondContact O-N 2.8Å; L82-D84 VanDerWaalsContact C-N 3.32Å; L82-D84 PolarHBondContact O-N 3.49Å; L82-L85 PolarHBondContact O-N 3.2Å; L82-Q86 HydrophobicContact CD1-CG 4.17Å; L82-Q86 WeakPolarHBondContact O-CG 3.35Å; L82-Q86 PolarHBondContact O-N 3.32Å
83	N	83.4	Confident	79.3	Confident	83 Å²	83	89.6 Å²	89.6	44%	0.444	41%	0.409	S	S	.	.	H	α-helix	trans	-61.2	-42.1	179.2	-67	-11.1	0	0	0	111.3	Q79 Q80 L85 Q86 E87	Q79-N83 PolarHBondContact NE2-OD1 2.79Å; Q79-N83 VanDerWaalsContact O-CG 3.29Å; Q79-N83 PolarHBondContact O-N 3.35Å; Q79-N83 VanDerWaalsContact O-N 3.12Å; Q79-N83 PolarHBondContact O-OD1 3.15Å; Q80-N83 PolarHBondContact O-N 2.79Å; Q80-N83 VanDerWaalsContact O-N 3.13Å; N83-L85 PolarHBondContact O-N 3.43Å; N83-Q86 PolarHBondContact O-N 3.17Å; N83-E87 WeakPolarHBondContact O-CB 3.2Å; N83-E87 PolarHBondContact O-N 3.44Å
84	D	84.8	Confident	79.8	Confident	108 Å²	108	88.5 Å²	88.5	58%	0.578	40%	0.399	S	S	*	.	H	α-helix	trans	-63.3	-40.6	177.8	-75.2	-16.3	0	0	0	112.7	Q80 R81 L82 E87 K88	Q80-D84 PolarHBondContact O-N 3.34Å; R81-D84 PolarHBondContact O-N 2.81Å; L82-D84 VanDerWaalsContact C-N 3.32Å; L82-D84 PolarHBondContact O-N 3.49Å; D84-E87 PolarHBondContact O-N 2.98Å; D84-K88 PolarHBondContact O-N 2.92Å
85	L	85.4	Confident	80.4	Confident	12 Å²	12	90.1 Å²	90.1	6%	0.063	41%	0.407	C	S	.	.	H	α-helix	trans	-69.3	-40.3	177	-71.5	171.3	0	0	0	112	L49 Q52 I53 L56 R81 L82 N83 E87 K88 K89	L49-L85 HydrophobicContact CD2-CD2 3.87Å; Q52-L85 HydrophobicContact CB-CD1 3.91Å; I53-L85 HydrophobicContact CD1-CB 4.35Å; I53-L85 HydrophobicContact CG1-CB 3.74Å; L56-L85 HydrophobicContact CD1-CD1 3.36Å; R81-L85 HydrophobicContact CG-CD1 4.49Å; R81-L85 WeakPolarHBondContact O-CG 3.39Å; R81-L85 PolarHBondContact O-N 2.85Å; R81-L85 VanDerWaalsContact O-N 3.09Å; L82-L85 PolarHBondContact O-N 3.2Å; N83-L85 PolarHBondContact O-N 3.43Å; L85-E87 VanDerWaalsContact C-N 3.32Å; L85-E87 PolarHBondContact O-N 2.88Å; L85-K88 WeakPolarHBondContact O-CB 3.49Å; L85-K88 PolarHBondContact O-N 2.82Å; L85-K89 PolarHBondContact O-N 3.46Å
86	Q	84.8	Confident	80.9	Confident	77 Å²	77	93 Å²	93	36%	0.36	42%	0.422	S	S	.	.	H	α-helix	trans	-61.8	-40.5	174.2	-74.4	-178	-20.1	0	0	111.7	I53 L82 N83 K89 R90	I53-Q86 HydrophobicContact CD1-CG 4.01Å; I53-Q86 HydrophobicContact CG1-CG 4.22Å; I53-Q86 HydrophobicContact CG2-CG 4.22Å; L82-Q86 HydrophobicContact CD1-CG 4.17Å; L82-Q86 WeakPolarHBondContact O-CG 3.35Å; L82-Q86 PolarHBondContact O-N 3.32Å; N83-Q86 PolarHBondContact O-N 3.17Å; Q86-K89 PolarHBondContact O-N 2.9Å; Q86-R90 WeakPolarHBondContact O-CB 3.28Å; Q86-R90 PolarHBondContact O-N 2.86Å
87	E	80	Confident	81.1	Confident	83 Å²	83	89.5 Å²	89.5	39%	0.388	42%	0.416	S	S	.	.	H	α-helix	trans	-63.7	-41.7	175.1	-168.1	73.2	-139	0	0	111.3	N83 D84 L85 R90 R91	N83-E87 WeakPolarHBondContact O-CB 3.2Å; N83-E87 PolarHBondContact O-N 3.44Å; D84-E87 PolarHBondContact O-N 2.98Å; L85-E87 VanDerWaalsContact C-N 3.32Å; L85-E87 PolarHBondContact O-N 2.88Å; E87-R90 PolarHBondContact O-N 3.29Å; E87-R90 IonicContact OE1-CZ 2.64Å; E87-R90 IonicContact OE1-NE 3.09Å; E87-R90 PolarHBondContact OE1-NE 2.96Å; E87-R90 IonicContact OE1-NH2 2.7Å; E87-R90 PolarHBondContact OE1-NH2 3.44Å; E87-R91 WeakPolarHBondContact O-CG 3.33Å; E87-R91 PolarHBondContact O-N 2.84Å
88	K	84	Confident	80.9	Confident	134 Å²	134	89 Å²	89	58%	0.583	42%	0.416	S	S	*	.	H	α-helix	trans	-61.9	-46.3	174.1	-79.5	-178.5	-178.7	177.9	0	112.2	L49 D84 L85 R91 K92	L49-K88 HydrophobicContact CD2-CB 4Å; D84-K88 PolarHBondContact O-N 2.92Å; L85-K88 WeakPolarHBondContact O-CB 3.49Å; L85-K88 PolarHBondContact O-N 2.82Å; K88-R91 PolarHBondContact O-N 3.2Å; K88-K92 PolarHBondContact O-N 3.05Å; K88-K92 VanDerWaalsContact O-N 3.1Å
89	K	83.4	Confident	81	Confident	69 Å²	69	90.4 Å²	90.4	30%	0.3	43%	0.429	S	S	.	.	H	α-helix	trans	-58.7	-50.9	175.9	179	-178.3	174.2	178.4	0	110.8	D50 I53 L85 Q86 R91 K92 D93	D50-K89 WeakPolarHBondContact OD1-CD 3.34Å; D50-K89 WeakPolarHBondContact OD1-CE 3.45Å; D50-K89 IonicContact OD1-NZ 3.77Å; D50-K89 PolarHBondContact OD1-NZ 2.94Å; I53-K89 HydrophobicContact CD1-CB 3.94Å; I53-K89 HydrophobicContact CD1-CD 3.82Å; I53-K89 HydrophobicContact CD1-CG 4.49Å; L85-K89 PolarHBondContact O-N 3.46Å; Q86-K89 PolarHBondContact O-N 2.9Å; K89-R91 VanDerWaalsContact C-N 3.25Å; K89-R91 PolarHBondContact O-N 2.82Å; K89-K92 WeakPolarHBondContact O-CB 3.22Å; K89-K92 PolarHBondContact O-N 2.89Å; K89-D93 WeakPolarHBondContact CE-OD2 3.15Å; K89-D93 PolarHBondContact O-N 3.21Å
90	R	76	Confident	80.9	Confident	125 Å²	125	91.4 Å²	91.4	47%	0.472	43%	0.434	S	S	.	.	H	α-helix	trans	-55.6	-40.3	178.5	-168.5	-165.4	67.9	83.1	-1.2	112	Q86 E87 L94	Q86-R90 WeakPolarHBondContact O-CB 3.28Å; Q86-R90 PolarHBondContact O-N 2.86Å; E87-R90 PolarHBondContact O-N 3.29Å; E87-R90 IonicContact OE1-CZ 2.64Å; E87-R90 IonicContact OE1-NE 3.09Å; E87-R90 PolarHBondContact OE1-NE 2.96Å; E87-R90 IonicContact OE1-NH2 2.7Å; E87-R90 PolarHBondContact OE1-NH2 3.44Å; R90-L94 VanDerWaalsContact O-CB 3.27Å; R90-L94 WeakPolarHBondContact O-CB 3.31Å; R90-L94 PolarHBondContact O-N 3.31Å
91	R	79.4	Confident	80.5	Confident	161 Å²	161	88 Å²	88	61%	0.608	43%	0.428	S	S	*	.	H	α-helix	trans	-65.4	-40.8	176.2	-73.9	177.7	-176.7	-158.4	2.3	112.5	E87 K88 K89 Q95	E87-R91 WeakPolarHBondContact O-CG 3.33Å; E87-R91 PolarHBondContact O-N 2.84Å; K88-R91 PolarHBondContact O-N 3.2Å; K89-R91 VanDerWaalsContact C-N 3.25Å; K89-R91 PolarHBondContact O-N 2.82Å; R91-Q95 PolarHBondContact O-N 3.38Å; R91-Q95 VanDerWaalsContact O-N 3.1Å
92	K	81.5	Confident	80.1	Confident	112 Å²	112	88.2 Å²	88.2	49%	0.487	43%	0.434	S	S	.	.	H	α-helix	trans	-67.6	-49	179	-171.1	177.7	179.4	176.9	0	111.7	L49 K88 K89 L94 Q95 D96	L49-K92 HydrophobicContact CD1-CD 4.17Å; K88-K92 PolarHBondContact O-N 3.05Å; K88-K92 VanDerWaalsContact O-N 3.1Å; K89-K92 WeakPolarHBondContact O-CB 3.22Å; K89-K92 PolarHBondContact O-N 2.89Å; K92-L94 PolarHBondContact O-N 3.27Å; K92-Q95 WeakPolarHBondContact O-CA 3.43Å; K92-Q95 WeakPolarHBondContact O-CB 3.42Å; K92-Q95 PolarHBondContact O-N 2.91Å; K92-D96 PolarHBondContact O-N 2.98Å
93	D	81.4	Confident	79.8	Confident	80 Å²	80	95 Å²	95	43%	0.428	46%	0.459	S	S	.	.	H	α-helix	trans	-57.9	-37.4	177.2	-65.9	-16.8	0	0	0	111.4	K89 D96 A97	K89-D93 WeakPolarHBondContact CE-OD2 3.15Å; K89-D93 PolarHBondContact O-N 3.21Å; D93-D96 PolarHBondContact O-N 2.88Å; D93-A97 VanDerWaalsContact O-CB 3.22Å; D93-A97 WeakPolarHBondContact O-CB 3.47Å; D93-A97 PolarHBondContact O-N 2.78Å
94	L	74.1	Confident	79.4	Confident	74 Å²	74	94.9 Å²	94.9	39%	0.387	46%	0.459	S	S	.	.	H	α-helix	trans	-71.5	-32.4	177.7	-145.6	158.1	0	0	0	112	R90 K92 K98	R90-L94 VanDerWaalsContact O-CB 3.27Å; R90-L94 WeakPolarHBondContact O-CB 3.31Å; R90-L94 PolarHBondContact O-N 3.31Å; K92-L94 PolarHBondContact O-N 3.27Å; L94-K98 HydrophobicContact CD2-CD 4.1Å; L94-K98 HydrophobicContact CD2-CG 4.43Å; L94-K98 WeakPolarHBondContact O-CB 3.4Å; L94-K98 VanDerWaalsContact O-CG 3.26Å; L94-K98 WeakPolarHBondContact O-CG 3.41Å; L94-K98 PolarHBondContact O-N 3Å; L94-K98 VanDerWaalsContact O-N 3.15Å
95	Q	82.9	Confident	78.6	Confident	137 Å²	137	95.8 Å²	95.8	64%	0.64	46%	0.455	S	S	*	.	H	α-helix	trans	-69.9	-44.8	170.9	-79.4	-177	-15.5	0	0	111.9	R91 K92 A97 K98 A99	R91-Q95 PolarHBondContact O-N 3.38Å; R91-Q95 VanDerWaalsContact O-N 3.1Å; K92-Q95 WeakPolarHBondContact O-CA 3.43Å; K92-Q95 WeakPolarHBondContact O-CB 3.42Å; K92-Q95 PolarHBondContact O-N 2.91Å; Q95-A97 PolarHBondContact O-N 3.2Å; Q95-K98 WeakPolarHBondContact O-CB 3.21Å; Q95-K98 PolarHBondContact O-N 2.76Å; Q95-A99 PolarHBondContact O-N 2.79Å
96	D	81.9	Confident	77.9	Confident	91 Å²	91	100.6 Å²	100.6	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-65	-40.7	179.1	-71	-26.6	0	0	0	111.3	K92 D93 K98 A99 Q100	K92-D96 PolarHBondContact O-N 2.98Å; D93-D96 PolarHBondContact O-N 2.88Å; D96-K98 PolarHBondContact O-N 3Å; D96-A99 PolarHBondContact O-N 2.8Å; D96-Q100 WeakPolarHBondContact O-CB 3.35Å; D96-Q100 PolarHBondContact O-N 2.88Å
97	A	78.5	Confident	77.4	Confident	61 Å²	61	102.8 Å²	102.8	50%	0.504	49%	0.487	S	S	.	.	H	α-helix	trans	-62.3	-40	173.2	0	0	0	0	0	112.4	D93 Q95 A101	D93-A97 VanDerWaalsContact O-CB 3.22Å; D93-A97 WeakPolarHBondContact O-CB 3.47Å; D93-A97 PolarHBondContact O-N 2.78Å; Q95-A97 PolarHBondContact O-N 3.2Å; A97-A101 WeakPolarHBondContact O-CB 3.42Å; A97-A101 PolarHBondContact O-N 2.89Å
98	K	74.1	Confident	77	Confident	128 Å²	128	103.7 Å²	103.7	56%	0.557	49%	0.492	S	S	*	.	H	α-helix	trans	-64.9	-49	174.5	-80.5	175.8	175.7	-178.7	0	111.6	L94 Q95 D96 Q100 A101 E102	L94-K98 HydrophobicContact CD2-CD 4.1Å; L94-K98 HydrophobicContact CD2-CG 4.43Å; L94-K98 WeakPolarHBondContact O-CB 3.4Å; L94-K98 VanDerWaalsContact O-CG 3.26Å; L94-K98 WeakPolarHBondContact O-CG 3.41Å; L94-K98 PolarHBondContact O-N 3Å; L94-K98 VanDerWaalsContact O-N 3.15Å; Q95-K98 WeakPolarHBondContact O-CB 3.21Å; Q95-K98 PolarHBondContact O-N 2.76Å; D96-K98 PolarHBondContact O-N 3Å; K98-Q100 VanDerWaalsContact C-N 3.27Å; K98-Q100 PolarHBondContact O-N 2.98Å; K98-A101 PolarHBondContact O-N 2.97Å; K98-E102 WeakPolarHBondContact O-CB 3.4Å; K98-E102 PolarHBondContact O-N 3.11Å
99	A	81.4	Confident	76.1	Confident	38 Å²	38	101 Å²	101	31%	0.314	48%	0.481	S	S	.	.	H	α-helix	trans	-60.4	-38.3	178.3	0	0	0	0	0	111.8	Q95 D96 R103	Q95-A99 PolarHBondContact O-N 2.79Å; D96-A99 PolarHBondContact O-N 2.8Å; A99-R103 WeakPolarHBondContact O-CG 3.28Å; A99-R103 PolarHBondContact O-N 2.96Å
100	Q	76.4	Confident	75.6	Confident	84 Å²	84	104.9 Å²	104.9	39%	0.393	50%	0.498	S	S	.	.	H	α-helix	trans	-68.5	-43.7	175.1	-169.3	59.8	28.4	0	0	112.5	D96 K98 E102 R103 N104	D96-Q100 WeakPolarHBondContact O-CB 3.35Å; D96-Q100 PolarHBondContact O-N 2.88Å; K98-Q100 VanDerWaalsContact C-N 3.27Å; K98-Q100 PolarHBondContact O-N 2.98Å; Q100-E102 VanDerWaalsContact C-N 3.27Å; Q100-E102 PolarHBondContact O-N 3.35Å; Q100-R103 PolarHBondContact O-N 3.17Å; Q100-R103 VanDerWaalsContact OE1-NH2 3.14Å; Q100-N104 PolarHBondContact NE2-OD1 3.46Å; Q100-N104 VanDerWaalsContact NE2-OD1 3.09Å; Q100-N104 WeakPolarHBondContact O-CB 3.39Å; Q100-N104 PolarHBondContact O-N 3.34Å; Q100-N104 PolarHBondContact O-OD1 2.92Å
101	A	72.4	Confident	75.4	Confident	58 Å²	58	107.6 Å²	107.6	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-39	175.7	0	0	0	0	0	111.7	A97 K98 N104 Y105	A97-A101 WeakPolarHBondContact O-CB 3.42Å; A97-A101 PolarHBondContact O-N 2.89Å; K98-A101 PolarHBondContact O-N 2.97Å; A101-N104 PolarHBondContact O-N 3.41Å; A101-Y105 VanDerWaalsContact O-CB 3.31Å; A101-Y105 WeakPolarHBondContact O-CB 3.44Å; A101-Y105 PolarHBondContact O-N 3.29Å
102	E	72.9	Confident	74.6	Confident	129 Å²	129	104.8 Å²	104.8	60%	0.603	50%	0.497	S	S	*	.	H	α-helix	trans	-69.8	-41.5	179.8	-152.7	154.8	-154.9	0	0	111.8	K98 Q100 Y105 Q106	K98-E102 WeakPolarHBondContact O-CB 3.4Å; K98-E102 PolarHBondContact O-N 3.11Å; Q100-E102 VanDerWaalsContact C-N 3.27Å; Q100-E102 PolarHBondContact O-N 3.35Å; E102-Y105 PolarHBondContact O-N 3.39Å; E102-Q106 WeakPolarHBondContact O-CG 3.42Å; E102-Q106 PolarHBondContact O-N 2.94Å
103	R	76.3	Confident	74	Confident	150 Å²	150	104.6 Å²	104.6	57%	0.566	50%	0.502	S	S	*	.	H	α-helix	trans	-60.4	-48.6	170.6	-75.8	-171.1	-74.8	-148.2	0.8	112.1	A99 Q100 Y105 Q106 E107	A99-R103 WeakPolarHBondContact O-CG 3.28Å; A99-R103 PolarHBondContact O-N 2.96Å; Q100-R103 PolarHBondContact O-N 3.17Å; Q100-R103 VanDerWaalsContact OE1-NH2 3.14Å; R103-Y105 VanDerWaalsContact C-N 3.29Å; R103-Y105 PolarHBondContact O-N 2.9Å; R103-Q106 PolarHBondContact O-N 3.27Å; R103-E107 PolarHBondContact O-N 2.92Å
104	N	76.3	Confident	73.7	Confident	82 Å²	82	103.3 Å²	103.3	44%	0.439	50%	0.502	S	S	.	.	H	α-helix	trans	-60.3	-40.2	177.8	-70.8	-5.3	0	0	0	111.6	Q100 A101 Q108	Q100-N104 PolarHBondContact NE2-OD1 3.46Å; Q100-N104 VanDerWaalsContact NE2-OD1 3.09Å; Q100-N104 WeakPolarHBondContact O-CB 3.39Å; Q100-N104 PolarHBondContact O-N 3.34Å; Q100-N104 PolarHBondContact O-OD1 2.92Å; A101-N104 PolarHBondContact O-N 3.41Å; N104-Q108 VanDerWaalsContact O-CB 3.3Å; N104-Q108 WeakPolarHBondContact O-CB 3.16Å; N104-Q108 PolarHBondContact O-N 3.29Å
105	Y	68	Low	73.4	Confident	127 Å²	127	106 Å²	106	50%	0.498	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-43.5	177.8	-176.3	-103.4	0	0	0	112.1	A101 E102 R103 Q108 Q109	A101-Y105 VanDerWaalsContact O-CB 3.31Å; A101-Y105 WeakPolarHBondContact O-CB 3.44Å; A101-Y105 PolarHBondContact O-N 3.29Å; E102-Y105 PolarHBondContact O-N 3.39Å; R103-Y105 VanDerWaalsContact C-N 3.29Å; R103-Y105 PolarHBondContact O-N 2.9Å; Y105-Q108 PolarHBondContact O-N 2.88Å; Y105-Q109 HydrophobicContact CE1-CG 4.19Å; Y105-Q109 VanDerWaalsContact CE1-NE2 3.27Å; Y105-Q109 VanDerWaalsContact CZ-NE2 3.26Å; Y105-Q109 PolarHBondContact O-N 2.73Å; Y105-Q109 PolarHBondContact OH-NE2 3.44Å
106	Q	70	Confident	72.5	Confident	113 Å²	113	104.3 Å²	104.3	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-42.4	176	-72.8	-160.6	17.1	0	0	112.4	E102 R103 Q109 K110	E102-Q106 WeakPolarHBondContact O-CG 3.42Å; E102-Q106 PolarHBondContact O-N 2.94Å; R103-Q106 PolarHBondContact O-N 3.27Å; Q106-Q109 PolarHBondContact O-N 3.17Å; Q106-K110 WeakPolarHBondContact O-CG 3.27Å; Q106-K110 PolarHBondContact O-N 2.87Å
107	E	74.6	Confident	71.8	Confident	122 Å²	122	101.9 Å²	101.9	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-41.6	175.7	-74.9	-173	175.2	0	0	112.1	R103 Q109 K110 R111	R103-E107 PolarHBondContact O-N 2.92Å; E107-Q109 VanDerWaalsContact C-N 3.34Å; E107-Q109 PolarHBondContact O-N 2.95Å; E107-K110 PolarHBondContact O-N 2.84Å; E107-R111 PolarHBondContact O-N 2.81Å
108	Q	71.6	Confident	71.4	Confident	103 Å²	103	101 Å²	101	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-39.9	176.6	-167.8	-177.9	58.8	0	0	111.5	N104 Y105 R111 R112	N104-Q108 VanDerWaalsContact O-CB 3.3Å; N104-Q108 WeakPolarHBondContact O-CB 3.16Å; N104-Q108 PolarHBondContact O-N 3.29Å; Y105-Q108 PolarHBondContact O-N 2.88Å; Q108-R111 PolarHBondContact O-N 3.37Å; Q108-R112 WeakPolarHBondContact O-CG 3.41Å; Q108-R112 PolarHBondContact O-N 2.91Å; Q108-R112 VanDerWaalsContact OE1-NH1 3.1Å
109	Q	65.1	Low	70.5	Confident	77 Å²	77	99.5 Å²	99.5	36%	0.36	49%	0.491	S	S	.	.	H	α-helix	trans	-63.6	-44.5	173.4	-80	-157.2	-1.2	0	0	112.5	Y105 Q106 E107 R111 R112 N113	Y105-Q109 HydrophobicContact CE1-CG 4.19Å; Y105-Q109 VanDerWaalsContact CE1-NE2 3.27Å; Y105-Q109 VanDerWaalsContact CZ-NE2 3.26Å; Y105-Q109 PolarHBondContact O-N 2.73Å; Y105-Q109 PolarHBondContact OH-NE2 3.44Å; Q106-Q109 PolarHBondContact O-N 3.17Å; E107-Q109 VanDerWaalsContact C-N 3.34Å; E107-Q109 PolarHBondContact O-N 2.95Å; Q109-R111 VanDerWaalsContact C-N 3.32Å; Q109-R111 PolarHBondContact O-N 2.86Å; Q109-R112 PolarHBondContact O-N 2.9Å; Q109-N113 WeakPolarHBondContact O-CB 3.44Å; Q109-N113 PolarHBondContact O-N 3.37Å
110	K	72.9	Confident	69.6	Low	151 Å²	151	102.6 Å²	102.6	66%	0.657	50%	0.502	S	S	*	.	H	α-helix	trans	-59.9	-42.3	175.9	-74.4	179.6	-177.1	177.4	0	111.6	Q106 E107 N113 A114	Q106-K110 WeakPolarHBondContact O-CG 3.27Å; Q106-K110 PolarHBondContact O-N 2.87Å; E107-K110 PolarHBondContact O-N 2.84Å; K110-N113 PolarHBondContact O-N 2.85Å; K110-A114 VanDerWaalsContact O-CB 3.31Å; K110-A114 WeakPolarHBondContact O-CB 3.32Å; K110-A114 PolarHBondContact O-N 3.42Å
111	R	71.2	Confident	68.8	Low	181 Å²	181	104.8 Å²	104.8	68%	0.683	51%	0.507	S	S	*	.	H	α-helix	trans	-62.4	-49.2	175.1	-79.8	-179.4	161.5	-176.8	-4.2	112.3	E107 Q108 Q109 N113 A114 E115	E107-R111 PolarHBondContact O-N 2.81Å; Q108-R111 PolarHBondContact O-N 3.37Å; Q109-R111 VanDerWaalsContact C-N 3.32Å; Q109-R111 PolarHBondContact O-N 2.86Å; R111-N113 VanDerWaalsContact C-N 3.33Å; R111-N113 PolarHBondContact O-N 2.98Å; R111-A114 PolarHBondContact O-N 3.36Å; R111-A114 VanDerWaalsContact O-N 3.17Å; R111-E115 WeakPolarHBondContact O-CB 3.5Å; R111-E115 WeakPolarHBondContact O-CG 3.1Å; R111-E115 PolarHBondContact O-N 3.13Å
112	R	62.5	Low	68.3	Low	102 Å²	102	108.3 Å²	108.3	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-59.1	-42.9	176.9	-74.5	-167.4	-63.2	-121.4	0.2	112.3	Q108 Q109 E115 N116	Q108-R112 WeakPolarHBondContact O-CG 3.41Å; Q108-R112 PolarHBondContact O-N 2.91Å; Q108-R112 VanDerWaalsContact OE1-NH1 3.1Å; Q109-R112 PolarHBondContact O-N 2.9Å; R112-E115 PolarHBondContact O-N 3.43Å; R112-N116 WeakPolarHBondContact O-CB 3.33Å; R112-N116 PolarHBondContact O-N 3.07Å
113	N	70	Confident	67.5	Low	108 Å²	108	108.5 Å²	108.5	58%	0.578	52%	0.52	S	S	*	.	H	α-helix	trans	-66.8	-38.5	177.4	-72.7	-6	0	0	0	111.8	Q109 K110 R111 A117	Q109-N113 WeakPolarHBondContact O-CB 3.44Å; Q109-N113 PolarHBondContact O-N 3.37Å; K110-N113 PolarHBondContact O-N 2.85Å; R111-N113 VanDerWaalsContact C-N 3.33Å; R111-N113 PolarHBondContact O-N 2.98Å; N113-A117 VanDerWaalsContact O-CB 3.27Å; N113-A117 WeakPolarHBondContact O-CB 3.4Å; N113-A117 PolarHBondContact O-N 2.83Å
114	A	74.2	Confident	66.7	Low	53 Å²	53	102.9 Å²	102.9	44%	0.438	50%	0.501	S	S	.	.	H	α-helix	trans	-66.7	-41.8	175.6	0	0	0	0	0	112.5	K110 R111 A117 A118	K110-A114 VanDerWaalsContact O-CB 3.31Å; K110-A114 WeakPolarHBondContact O-CB 3.32Å; K110-A114 PolarHBondContact O-N 3.42Å; R111-A114 PolarHBondContact O-N 3.36Å; R111-A114 VanDerWaalsContact O-N 3.17Å; A114-A117 PolarHBondContact O-N 3.23Å; A114-A118 WeakPolarHBondContact O-CB 3.4Å; A114-A118 PolarHBondContact O-N 2.86Å
115	E	68.3	Low	66.3	Low	130 Å²	130	103.4 Å²	103.4	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-65.1	-46.1	175.5	-76.7	176.3	178.2	0	0	111.6	R111 R112 A117 A118 L119	R111-E115 WeakPolarHBondContact O-CB 3.5Å; R111-E115 WeakPolarHBondContact O-CG 3.1Å; R111-E115 PolarHBondContact O-N 3.13Å; R112-E115 PolarHBondContact O-N 3.43Å; E115-A117 VanDerWaalsContact C-N 3.32Å; E115-A117 PolarHBondContact O-N 3.5Å; E115-A118 CarbonylContact O-C 3.59Å; E115-A118 WeakPolarHBondContact O-CA 3.33Å; E115-A118 WeakPolarHBondContact O-CB 3.42Å; E115-A118 PolarHBondContact O-N 2.83Å; E115-L119 PolarHBondContact O-N 2.73Å
116	N	63.4	Low	66.4	Low	102 Å²	102	100.5 Å²	100.5	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-61.5	-41	174.5	-81.4	-11.2	0	0	0	111.9	R112 A118 L119 N120	R112-N116 WeakPolarHBondContact O-CB 3.33Å; R112-N116 PolarHBondContact O-N 3.07Å; N116-A118 VanDerWaalsContact C-N 3.27Å; N116-A118 PolarHBondContact O-N 3.41Å; N116-L119 PolarHBondContact O-N 2.9Å; N116-N120 WeakPolarHBondContact O-CB 3.29Å; N116-N120 PolarHBondContact O-N 2.98Å
117	A	67.6	Low	66.4	Low	41 Å²	41	97.1 Å²	97.1	34%	0.339	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-29.9	173.8	0	0	0	0	0	112.4	N113 A114 E115 R121	N113-A117 VanDerWaalsContact O-CB 3.27Å; N113-A117 WeakPolarHBondContact O-CB 3.4Å; N113-A117 PolarHBondContact O-N 2.83Å; A114-A117 PolarHBondContact O-N 3.23Å; E115-A117 VanDerWaalsContact C-N 3.32Å; E115-A117 PolarHBondContact O-N 3.5Å; A117-R121 VanDerWaalsContact O-CG 3.24Å; A117-R121 WeakPolarHBondContact O-CG 3.43Å; A117-R121 PolarHBondContact O-N 2.66Å; A117-R121 PolarHBondContact O-NE 2.95Å
118	A	71.6	Confident	66.3	Low	42 Å²	42	92.8 Å²	92.8	35%	0.347	47%	0.474	S	S	.	.	H	α-helix	trans	-75.4	-36.4	173.8	0	0	0	0	0	112.2	A114 E115 N116 R121 M122	A114-A118 WeakPolarHBondContact O-CB 3.4Å; A114-A118 PolarHBondContact O-N 2.86Å; E115-A118 CarbonylContact O-C 3.59Å; E115-A118 WeakPolarHBondContact O-CA 3.33Å; E115-A118 WeakPolarHBondContact O-CB 3.42Å; E115-A118 PolarHBondContact O-N 2.83Å; N116-A118 VanDerWaalsContact C-N 3.27Å; N116-A118 PolarHBondContact O-N 3.41Å; A118-R121 VanDerWaalsContact O-CB 3.31Å; A118-R121 WeakPolarHBondContact O-CB 3.34Å; A118-R121 PolarHBondContact O-N 3.41Å; A118-M122 PolarHBondContact O-N 3.23Å
119	L	54.7	Low	66.4	Low	96 Å²	96	92.9 Å²	92.9	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-66.4	-44.3	175.3	-142.9	87.2	0	0	0	111.1	E115 N116 R121 M122 N123	E115-L119 PolarHBondContact O-N 2.73Å; N116-L119 PolarHBondContact O-N 2.9Å; L119-R121 PolarHBondContact O-N 3.17Å; L119-M122 HydrophobicContact CD1-CE 3.56Å; L119-M122 HydrophobicContact CG-CE 4.07Å; L119-M122 PolarHBondContact O-N 2.96Å; L119-N123 PolarHBondContact O-N 3.1Å
120	N	61.2	Low	67	Low	103 Å²	103	90.3 Å²	90.3	55%	0.551	46%	0.458	S	S	*	.	H	α-helix	trans	-59.7	-35.8	173.5	-75.7	-14.2	0	0	0	111.5	N116 M122 N123 E124	N116-N120 WeakPolarHBondContact O-CB 3.29Å; N116-N120 PolarHBondContact O-N 2.98Å; N120-M122 VanDerWaalsContact C-N 3.3Å; N120-M122 PolarHBondContact O-N 3.29Å; N120-N123 PolarHBondContact O-N 3.39Å; N120-N123 VanDerWaalsContact O-N 3.12Å; N120-E124 VanDerWaalsContact C-OE1 3.31Å; N120-E124 VanDerWaalsContact O-CG 3.25Å; N120-E124 WeakPolarHBondContact O-CG 3.45Å; N120-E124 PolarHBondContact O-N 2.93Å; N120-E124 VanDerWaalsContact O-N 3.08Å
121	R	61.1	Low	67.3	Low	131 Å²	131	90.2 Å²	90.2	49%	0.494	46%	0.46	S	S	.	.	H	α-helix	trans	-60.1	-34.5	173.6	-80.5	174.7	-103.9	177.2	-6	113.9	A117 A118 L119 N123 E124	A117-R121 VanDerWaalsContact O-CG 3.24Å; A117-R121 WeakPolarHBondContact O-CG 3.43Å; A117-R121 PolarHBondContact O-N 2.66Å; A117-R121 PolarHBondContact O-NE 2.95Å; A118-R121 VanDerWaalsContact O-CB 3.31Å; A118-R121 WeakPolarHBondContact O-CB 3.34Å; A118-R121 PolarHBondContact O-N 3.41Å; L119-R121 PolarHBondContact O-N 3.17Å; R121-N123 VanDerWaalsContact C-N 3.33Å; R121-E124 VanDerWaalsContact CA-OE1 3.28Å; R121-E124 WeakPolarHBondContact CA-OE1 3.39Å; R121-E124 PolarHBondContact N-OE1 3.04Å
122	M	61.7	Low	67.6	Low	131 Å²	131	86.9 Å²	86.9	65%	0.645	45%	0.448	S	S	*	.	H	α-helix	trans	-70.8	-30.4	176.7	-68	-169.3	-72.1	0	0	112.3	A118 L119 N120	A118-M122 PolarHBondContact O-N 3.23Å; L119-M122 HydrophobicContact CD1-CE 3.56Å; L119-M122 HydrophobicContact CG-CE 4.07Å; L119-M122 PolarHBondContact O-N 2.96Å; N120-M122 VanDerWaalsContact C-N 3.3Å; N120-M122 PolarHBondContact O-N 3.29Å
123	N	55.4	Low	68.5	Low	133 Å²	133	85.4 Å²	85.4	71%	0.711	45%	0.445	S	S	*	.	H	α-helix	trans	-98.4	1.2	-176.5	-71.2	-18.2	0	0	0	114.6	L119 N120 R121	L119-N123 PolarHBondContact O-N 3.1Å; N120-N123 PolarHBondContact O-N 3.39Å; N120-N123 VanDerWaalsContact O-N 3.12Å; R121-N123 VanDerWaalsContact C-N 3.33Å
124	E	59.2	Low	69.2	Low	33 Å²	33	82.1 Å²	82.1	15%	0.154	43%	0.427	C	S	.	.			trans	-69.4	138.6	-177.9	-87.8	153.2	-148.2	0	0	113.5	N120 R121 A128 R129 R132	N120-E124 VanDerWaalsContact C-OE1 3.31Å; N120-E124 VanDerWaalsContact O-CG 3.25Å; N120-E124 WeakPolarHBondContact O-CG 3.45Å; N120-E124 PolarHBondContact O-N 2.93Å; N120-E124 VanDerWaalsContact O-N 3.08Å; R121-E124 VanDerWaalsContact CA-OE1 3.28Å; R121-E124 WeakPolarHBondContact CA-OE1 3.39Å; R121-E124 PolarHBondContact N-OE1 3.04Å; E124-A128 HydrophobicContact CB-CB 4.29Å; E124-A128 HydrophobicContact CG-CB 4.16Å; E124-R129 HydrophobicContact CB-CG 4.3Å; E124-R132 IonicContact OE1-CZ 3.75Å; E124-R132 IonicContact OE1-NH1 3.78Å; E124-R132 PolarHBondContact OE1-NH1 2.96Å; E124-R132 IonicContact OE1-NH2 2.83Å; E124-R132 PolarHBondContact OE1-NH2 2.88Å; E124-R132 IonicContact OE2-CZ 2.81Å; E124-R132 IonicContact OE2-NE 2.61Å; E124-R132 IonicContact OE2-NH1 2.77Å; E124-R132 PolarHBondContact OE2-NH1 2.9Å; E124-R132 IonicContact OE2-NH2 3.05Å; E124-R132 PolarHBondContact OE2-NH2 3.22Å
125	T	68.4	Low	69.7	Low	93 Å²	93	82.3 Å²	82.3	57%	0.571	43%	0.429	S	S	*	.			trans	-68	154.2	170.3	59.6	0	0	0	0	110.9	A127 A128 R129	T125-A127 PolarHBondContact O-N 2.71Å; T125-A128 PolarHBondContact O-N 3.47Å; T125-A128 PolarHBondContact OG1-N 2.87Å; T125-R129 PolarHBondContact O-N 2.93Å; T125-R129 VanDerWaalsContact O-N 3.1Å
126	E	69.3	Low	70.4	Confident	66 Å²	66	83.6 Å²	83.6	31%	0.308	43%	0.428	S	S	.	.	H	α-helix	trans	-55.5	-33.6	175.3	-73.6	-65.7	136.1	0	0	112.2	R129 H130 A162	E126-R129 PolarHBondContact O-N 2.67Å; E126-R129 IonicContact OE1-CZ 2.78Å; E126-R129 IonicContact OE1-NH1 3.7Å; E126-R129 PolarHBondContact OE1-NH1 3.24Å; E126-H130 WeakPolarHBondContact O-CB 3.39Å; E126-H130 PolarHBondContact O-N 2.77Å; E126-A162 HydrophobicContact CG-CB 4.47Å
127	A	71.1	Confident	71.4	Confident	42 Å²	42	79.4 Å²	79.4	35%	0.347	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-40.7	174.5	0	0	0	0	0	112.8	T125 H130 Q131 Y159	T125-A127 PolarHBondContact O-N 2.71Å; A127-H130 PolarHBondContact O-N 3.17Å; A127-Q131 PolarHBondContact O-N 3.1Å; A127-Y159 HydrophobicContact CB-CE2 4.15Å
128	A	72.7	Confident	72	Confident	31 Å²	31	81.5 Å²	81.5	26%	0.256	41%	0.411	S	S	.	.	H	α-helix	trans	-69.5	-36.9	178.2	0	0	0	0	0	112.2	E124 T125 R132	E124-A128 HydrophobicContact CB-CB 4.29Å; E124-A128 HydrophobicContact CG-CB 4.16Å; T125-A128 PolarHBondContact O-N 3.47Å; T125-A128 PolarHBondContact OG1-N 2.87Å; A128-R132 WeakPolarHBondContact O-CB 3.14Å; A128-R132 PolarHBondContact O-N 3.41Å
129	R	72.2	Confident	72.6	Confident	105 Å²	105	82.9 Å²	82.9	40%	0.396	42%	0.422	S	S	.	.	H	α-helix	trans	-62.4	-49.3	172.6	-68.4	-178.5	-172.7	167.9	-2	111	E124 T125 E126 Q131 R132 E133	E124-R129 HydrophobicContact CB-CG 4.3Å; T125-R129 PolarHBondContact O-N 2.93Å; T125-R129 VanDerWaalsContact O-N 3.1Å; E126-R129 PolarHBondContact O-N 2.67Å; E126-R129 IonicContact OE1-CZ 2.78Å; E126-R129 IonicContact OE1-NH1 3.7Å; E126-R129 PolarHBondContact OE1-NH1 3.24Å; R129-Q131 PolarHBondContact O-N 3.36Å; R129-R132 WeakPolarHBondContact O-CB 3.4Å; R129-R132 PolarHBondContact O-N 3.29Å; R129-R132 VanDerWaalsContact O-N 3.16Å; R129-E133 PolarHBondContact O-N 3.12Å
130	H	78.4	Confident	73.8	Confident	23 Å²	23	82.9 Å²	82.9	11%	0.106	42%	0.421	C	S	.	.	H	α-helix	trans	-56.4	-51.3	179.9	179.2	59.2	0	0	0	112.5	E126 A127 R132 E133 I134 E155 N156 Y159	E126-H130 WeakPolarHBondContact O-CB 3.39Å; E126-H130 PolarHBondContact O-N 2.77Å; A127-H130 PolarHBondContact O-N 3.17Å; H130-R132 PolarHBondContact O-N 3.33Å; H130-E133 PolarHBondContact O-N 2.81Å; H130-I134 VanDerWaalsContact CE1-CD1 3.49Å; H130-I134 WeakPolarHBondContact CE1-CD1 3.45Å; H130-I134 VanDerWaalsContact NE2-CD1 3.34Å; H130-I134 WeakPolarHBondContact NE2-CD1 3.34Å; H130-I134 WeakPolarHBondContact O-CG1 3.36Å; H130-I134 PolarHBondContact O-N 2.7Å; H130-E155 IonicContact ND1-OE1 2.74Å; H130-N156 PolarHBondContact CE1-OD1 3.37Å; H130-N156 PolarHBondContact NE2-OD1 2.89Å; H130-Y159 HydrophobicContact CB-CD1 4.48Å; H130-Y159 HydrophobicContact CB-CD2 3.6Å; H130-Y159 HydrophobicContact CB-CE2 4.07Å; H130-Y159 HydrophobicContact CB-CG 3.85Å; H130-Y159 AromaticContact CD2-CD1 3.5Å; H130-Y159 AromaticContact CD2-CE1 3.82Å; H130-Y159 AromaticContact CD2-CG 3.7Å; H130-Y159 AromaticContact CG-CD1 3.8Å; H130-Y159 AromaticContact CG-CD2 3.78Å; H130-Y159 AromaticContact CG-CG 3.47Å; H130-Y159 VanDerWaalsContact CG-CG 3.47Å; H130-Y159 WeakPolarHBondContact ND1-CB 3.42Å; H130-Y159 AromaticContact ND1-CG 3.73Å; H130-Y159 AromaticContact NE2-CD1 3.67Å
131	Q	79.7	Confident	74.4	Confident	149 Å²	149	84.8 Å²	84.8	70%	0.696	43%	0.426	S	S	*	.	H	α-helix	trans	-60.6	-34.4	179.7	-171.3	170	9.9	0	0	112.5	A127 R129 A135	A127-Q131 PolarHBondContact O-N 3.1Å; R129-Q131 PolarHBondContact O-N 3.36Å; Q131-A135 WeakPolarHBondContact O-CB 3.45Å; Q131-A135 PolarHBondContact O-N 3.38Å
132	R	76.9	Confident	75.1	Confident	111 Å²	111	89.7 Å²	89.7	42%	0.419	45%	0.446	S	S	.	.	H	α-helix	trans	-74	-40	179.9	-160	-174.7	-60.3	-170.6	-12.2	112.4	E124 A128 R129 H130 I134 A135 R136	E124-R132 IonicContact OE1-CZ 3.75Å; E124-R132 IonicContact OE1-NH1 3.78Å; E124-R132 PolarHBondContact OE1-NH1 2.96Å; E124-R132 IonicContact OE1-NH2 2.83Å; E124-R132 PolarHBondContact OE1-NH2 2.88Å; E124-R132 IonicContact OE2-CZ 2.81Å; E124-R132 IonicContact OE2-NE 2.61Å; E124-R132 IonicContact OE2-NH1 2.77Å; E124-R132 PolarHBondContact OE2-NH1 2.9Å; E124-R132 IonicContact OE2-NH2 3.05Å; E124-R132 PolarHBondContact OE2-NH2 3.22Å; A128-R132 WeakPolarHBondContact O-CB 3.14Å; A128-R132 PolarHBondContact O-N 3.41Å; R129-R132 WeakPolarHBondContact O-CB 3.4Å; R129-R132 PolarHBondContact O-N 3.29Å; R129-R132 VanDerWaalsContact O-N 3.16Å; H130-R132 PolarHBondContact O-N 3.33Å; R132-I134 VanDerWaalsContact C-N 3.34Å; R132-A135 PolarHBondContact O-N 2.96Å; R132-R136 WeakPolarHBondContact O-CB 3.49Å; R132-R136 PolarHBondContact O-N 3.02Å
133	E	81.9	Confident	75.8	Confident	71 Å²	71	85 Å²	85	33%	0.332	43%	0.429	S	S	.	.	H	α-helix	trans	-68.1	-38.4	177.9	-151.2	65.2	-164.4	0	0	110.4	R129 H130 A135 R136 I137 E155	R129-E133 PolarHBondContact O-N 3.12Å; H130-E133 PolarHBondContact O-N 2.81Å; E133-A135 PolarHBondContact O-N 2.74Å; E133-R136 WeakPolarHBondContact O-CB 3.23Å; E133-R136 PolarHBondContact O-N 3.47Å; E133-R136 IonicContact OE1-NH1 3.03Å; E133-I137 WeakPolarHBondContact O-CD1 3.46Å; E133-I137 WeakPolarHBondContact O-CG1 3.29Å; E133-I137 PolarHBondContact O-N 2.64Å; E133-E155 HydrophobicContact CB-CG 3.96Å; E133-E155 HydrophobicContact CG-CG 4.26Å
134	I	84.7	Confident	77	Confident	39 Å²	39	84.6 Å²	84.6	20%	0.2	43%	0.426	C	S	.	.	H	α-helix	trans	-58.3	-48.5	168.7	-68.9	178.9	0	0	0	111.2	H130 R132 R136 I137 N138	H130-I134 VanDerWaalsContact CE1-CD1 3.49Å; H130-I134 WeakPolarHBondContact CE1-CD1 3.45Å; H130-I134 VanDerWaalsContact NE2-CD1 3.34Å; H130-I134 WeakPolarHBondContact NE2-CD1 3.34Å; H130-I134 WeakPolarHBondContact O-CG1 3.36Å; H130-I134 PolarHBondContact O-N 2.7Å; R132-I134 VanDerWaalsContact C-N 3.34Å; I134-R136 VanDerWaalsContact C-N 3.26Å; I134-R136 PolarHBondContact O-N 3.21Å; I134-I137 PolarHBondContact O-N 2.87Å; I134-N138 WeakPolarHBondContact O-CB 3.39Å; I134-N138 PolarHBondContact O-N 3.48Å; I134-N138 PolarHBondContact O-ND2 2.92Å
135	A	83.9	Confident	78	Confident	57 Å²	57	89.6 Å²	89.6	47%	0.471	45%	0.45	S	S	.	.	H	α-helix	trans	-60.6	-37.8	178.4	0	0	0	0	0	112	Q131 R132 E133 N138 A139	Q131-A135 WeakPolarHBondContact O-CB 3.45Å; Q131-A135 PolarHBondContact O-N 3.38Å; R132-A135 PolarHBondContact O-N 2.96Å; E133-A135 PolarHBondContact O-N 2.74Å; A135-N138 PolarHBondContact O-N 3.11Å; A135-A139 WeakPolarHBondContact O-CB 3.41Å; A135-A139 PolarHBondContact O-N 2.9Å
136	R	83.3	Confident	78.8	Confident	157 Å²	157	88.8 Å²	88.8	59%	0.592	45%	0.453	S	S	*	.	H	α-helix	trans	-66.9	-42.9	176.9	-164.1	-176.7	-171.3	-171.2	1.8	111.9	R132 E133 I134 A139 M140	R132-R136 WeakPolarHBondContact O-CB 3.49Å; R132-R136 PolarHBondContact O-N 3.02Å; E133-R136 WeakPolarHBondContact O-CB 3.23Å; E133-R136 PolarHBondContact O-N 3.47Å; E133-R136 IonicContact OE1-NH1 3.03Å; I134-R136 VanDerWaalsContact C-N 3.26Å; I134-R136 PolarHBondContact O-N 3.21Å; R136-A139 PolarHBondContact O-N 3.13Å; R136-M140 HydrophobicContact CG-CE 4.24Å; R136-M140 WeakPolarHBondContact O-CG 3.44Å; R136-M140 PolarHBondContact O-N 2.86Å
137	I	83.9	Confident	79.6	Confident	13 Å²	13	89.7 Å²	89.7	7%	0.067	46%	0.463	C	S	.	.	H	α-helix	trans	-63.7	-43.5	175.5	-64.8	160.3	0	0	0	110.6	E133 I134 A139 M140 R148 A151 I152 E155	E133-I137 WeakPolarHBondContact O-CD1 3.46Å; E133-I137 WeakPolarHBondContact O-CG1 3.29Å; E133-I137 PolarHBondContact O-N 2.64Å; I134-I137 PolarHBondContact O-N 2.87Å; I137-A139 VanDerWaalsContact C-N 3.32Å; I137-A139 PolarHBondContact O-N 2.86Å; I137-M140 PolarHBondContact O-N 3.12Å; I137-R148 HydrophobicContact CG2-CB 4.21Å; I137-R148 HydrophobicContact CG2-CG 4.36Å; I137-A151 HydrophobicContact CD1-CB 4Å; I137-A151 HydrophobicContact CG1-CB 4.24Å; I137-A151 HydrophobicContact CG2-CB 3.97Å; I137-I152 HydrophobicContact CB-CG1 4.23Å; I137-I152 HydrophobicContact CD1-CG1 4.4Å; I137-I152 HydrophobicContact CG2-CD1 4.26Å; I137-I152 HydrophobicContact CG2-CG1 3.65Å; I137-E155 HydrophobicContact CD1-CB 4.37Å
138	N	80.5	Confident	80	Confident	86 Å²	86	90.5 Å²	90.5	46%	0.46	46%	0.457	S	S	.	.	H	α-helix	trans	-65.7	-33.2	177.1	-73.8	-19.5	0	0	0	112.9	I134 A135 M140 I152	I134-N138 WeakPolarHBondContact O-CB 3.39Å; I134-N138 PolarHBondContact O-N 3.48Å; I134-N138 PolarHBondContact O-ND2 2.92Å; A135-N138 PolarHBondContact O-N 3.11Å; N138-M140 VanDerWaalsContact C-N 3.27Å; N138-M140 PolarHBondContact O-N 3.43Å; N138-I152 WeakPolarHBondContact OD1-CD1 3.49Å
139	A	83.4	Confident	80.5	Confident	71 Å²	71	93.2 Å²	93.2	59%	0.587	47%	0.467	S	S	*	.	H	α-helix	trans	-72	-16.6	177.6	0	0	0	0	0	113.8	A135 R136 I137 Q141	A135-A139 WeakPolarHBondContact O-CB 3.41Å; A135-A139 PolarHBondContact O-N 2.9Å; R136-A139 PolarHBondContact O-N 3.13Å; I137-A139 VanDerWaalsContact C-N 3.32Å; I137-A139 PolarHBondContact O-N 2.86Å; A139-Q141 PolarHBondContact O-N 3.3Å
140	M	80.2	Confident	81.3	Confident	95 Å²	95	90 Å²	90	47%	0.468	46%	0.463	S	S	.	.			trans	-75.5	67.8	174.9	-67	-176.1	-130.5	0	0	111.2	R136 I137 N138 Y142 A143 R148	R136-M140 HydrophobicContact CG-CE 4.24Å; R136-M140 WeakPolarHBondContact O-CG 3.44Å; R136-M140 PolarHBondContact O-N 2.86Å; I137-M140 PolarHBondContact O-N 3.12Å; N138-M140 VanDerWaalsContact C-N 3.27Å; N138-M140 PolarHBondContact O-N 3.43Å; M140-Y142 PolarHBondContact O-N 2.92Å; M140-Y142 VanDerWaalsContact O-N 3.17Å; M140-A143 HydrophobicContact CB-CB 4.38Å; M140-A143 PolarHBondContact O-N 3.33Å; M140-R148 WeakPolarHBondContact O-CD 3.15Å; M140-R148 PolarHBondContact O-NE 3.45Å
141	Q	73.9	Confident	81.7	Confident	144 Å²	144	90.3 Å²	90.3	67%	0.673	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.5	-172.5	-68	-177.9	-1.9	0	0	114.5	A139 R148	A139-Q141 PolarHBondContact O-N 3.3Å; Q141-R148 PolarHBondContact O-NH2 3.01Å
142	Y	76.4	Confident	81.9	Confident	233 Å²	233	84.7 Å²	84.7	91%	0.914	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-8.8	-177.9	-63.3	-75.6	0	0	0	114.6	M140	M140-Y142 PolarHBondContact O-N 2.92Å; M140-Y142 VanDerWaalsContact O-N 3.17Å
143	A	76.1	Confident	82.4	Confident	33 Å²	33	85.2 Å²	85.2	27%	0.273	45%	0.451	S	S	.	.	S	Bend	trans	-78.3	146.3	177.5	0	0	0	0	0	110.9	M140 Q145 R148	M140-A143 HydrophobicContact CB-CB 4.38Å; M140-A143 PolarHBondContact O-N 3.33Å; A143-Q145 PolarHBondContact O-N 2.95Å; A143-R148 HydrophobicContact CB-CG 3.97Å; A143-R148 PolarHBondContact O-NE 2.87Å; A143-R148 PolarHBondContact O-NH2 2.78Å
144	D	80.4	Confident	82.7	Confident	124 Å²	124	89.9 Å²	89.9	66%	0.663	47%	0.466	S	S	*	.			trans	-56	141.6	173.1	-74.8	-37.7	0	0	0	111.3	A146 V147 R148	D144-A146 VanDerWaalsContact C-N 3.31Å; D144-A146 PolarHBondContact O-N 3.48Å; D144-V147 HydrophobicContact CB-CB 4.41Å; D144-V147 HydrophobicContact CB-CG2 3.99Å; D144-V147 WeakPolarHBondContact O-CB 3.34Å; D144-V147 PolarHBondContact O-N 3.1Å; D144-R148 PolarHBondContact O-N 3.34Å
145	Q	81.3	Confident	82.7	Confident	138 Å²	138	89.8 Å²	89.8	65%	0.645	47%	0.465	S	S	*	.	H	α-helix	trans	-61.7	-40	-174.6	-166.8	150.6	-15.5	0	0	112.1	A143 V147 R148 D149	A143-Q145 PolarHBondContact O-N 2.95Å; Q145-V147 VanDerWaalsContact C-N 3.26Å; Q145-V147 PolarHBondContact O-N 3.08Å; Q145-R148 WeakPolarHBondContact O-CB 3.4Å; Q145-R148 PolarHBondContact O-N 3.12Å; Q145-R148 VanDerWaalsContact O-N 3.15Å; Q145-D149 VanDerWaalsContact O-CG 3.32Å; Q145-D149 PolarHBondContact O-N 3.12Å
146	A	85.5	Confident	82.8	Confident	77 Å²	77	90.3 Å²	90.3	64%	0.636	46%	0.459	S	S	*	.	H	α-helix	trans	-60	-34.8	174.3	0	0	0	0	0	113.1	D144 A150	D144-A146 VanDerWaalsContact C-N 3.31Å; D144-A146 PolarHBondContact O-N 3.48Å; A146-A150 WeakPolarHBondContact O-CB 3.25Å; A146-A150 PolarHBondContact O-N 2.98Å; A146-A150 VanDerWaalsContact O-N 3.09Å
147	V	84.6	Confident	83	Confident	85 Å²	85	87.3 Å²	87.3	52%	0.515	45%	0.452	S	S	.	.	H	α-helix	trans	-72.6	-39	177.7	179.2	0	0	0	0	110.6	D144 Q145 A151	D144-V147 HydrophobicContact CB-CB 4.41Å; D144-V147 HydrophobicContact CB-CG2 3.99Å; D144-V147 WeakPolarHBondContact O-CB 3.34Å; D144-V147 PolarHBondContact O-N 3.1Å; Q145-V147 VanDerWaalsContact C-N 3.26Å; Q145-V147 PolarHBondContact O-N 3.08Å; V147-A151 WeakPolarHBondContact O-CB 3.2Å; V147-A151 PolarHBondContact O-N 2.91Å; V147-A151 VanDerWaalsContact O-N 3.08Å
148	R	80.4	Confident	83.1	Confident	58 Å²	58	94.8 Å²	94.8	22%	0.219	48%	0.479	C	S	.	.	H	α-helix	trans	-63.1	-48.6	174	-75.1	-175.8	-97.8	-178.9	-8.1	111.5	I137 M140 Q141 A143 D144 Q145 A150 A151 I152	I137-R148 HydrophobicContact CG2-CB 4.21Å; I137-R148 HydrophobicContact CG2-CG 4.36Å; M140-R148 WeakPolarHBondContact O-CD 3.15Å; M140-R148 PolarHBondContact O-NE 3.45Å; Q141-R148 PolarHBondContact O-NH2 3.01Å; A143-R148 HydrophobicContact CB-CG 3.97Å; A143-R148 PolarHBondContact O-NE 2.87Å; A143-R148 PolarHBondContact O-NH2 2.78Å; D144-R148 PolarHBondContact O-N 3.34Å; Q145-R148 WeakPolarHBondContact O-CB 3.4Å; Q145-R148 PolarHBondContact O-N 3.12Å; Q145-R148 VanDerWaalsContact O-N 3.15Å; R148-A150 VanDerWaalsContact C-N 3.34Å; R148-A150 PolarHBondContact O-N 3.3Å; R148-A151 WeakPolarHBondContact O-CB 3.2Å; R148-A151 PolarHBondContact O-N 3.27Å; R148-I152 WeakPolarHBondContact O-CG1 3.22Å; R148-I152 PolarHBondContact O-N 2.91Å
149	D	83.9	Confident	83.1	Confident	88 Å²	88	93.5 Å²	93.5	47%	0.471	47%	0.468	S	S	.	.	H	α-helix	trans	-60.9	-43.4	179.8	-66.9	-22.7	0	0	0	111.4	Q145 A151 I152 Q153	Q145-D149 VanDerWaalsContact O-CG 3.32Å; Q145-D149 PolarHBondContact O-N 3.12Å; D149-A151 VanDerWaalsContact C-N 3.27Å; D149-A151 PolarHBondContact O-N 2.88Å; D149-I152 PolarHBondContact O-N 3.27Å; D149-Q153 WeakPolarHBondContact O-CB 3.38Å; D149-Q153 PolarHBondContact O-N 3.43Å
150	A	87.9	Confident	83	Confident	39 Å²	39	94.3 Å²	94.3	32%	0.322	46%	0.46	S	S	.	.	H	α-helix	trans	-65.2	-26.7	175.2	0	0	0	0	0	113.6	A146 R148 R154	A146-A150 WeakPolarHBondContact O-CB 3.25Å; A146-A150 PolarHBondContact O-N 2.98Å; A146-A150 VanDerWaalsContact O-N 3.09Å; R148-A150 VanDerWaalsContact C-N 3.34Å; R148-A150 PolarHBondContact O-N 3.3Å; A150-R154 WeakPolarHBondContact O-CG 3.26Å; A150-R154 PolarHBondContact O-N 2.78Å; A150-R154 PolarHBondContact O-NE 3.39Å; A150-R154 VanDerWaalsContact O-NE 3.11Å
151	A	86.2	Confident	83.1	Confident	29 Å²	29	96.3 Å²	96.3	24%	0.24	47%	0.466	C	S	.	.	H	α-helix	trans	-77.6	-43	174.2	0	0	0	0	0	111.5	I137 V147 R148 D149 Q153 R154 E155	I137-A151 HydrophobicContact CD1-CB 4Å; I137-A151 HydrophobicContact CG1-CB 4.24Å; I137-A151 HydrophobicContact CG2-CB 3.97Å; V147-A151 WeakPolarHBondContact O-CB 3.2Å; V147-A151 PolarHBondContact O-N 2.91Å; V147-A151 VanDerWaalsContact O-N 3.08Å; R148-A151 WeakPolarHBondContact O-CB 3.2Å; R148-A151 PolarHBondContact O-N 3.27Å; D149-A151 VanDerWaalsContact C-N 3.27Å; D149-A151 PolarHBondContact O-N 2.88Å; A151-Q153 VanDerWaalsContact C-N 3.3Å; A151-Q153 PolarHBondContact O-N 2.7Å; A151-R154 PolarHBondContact O-N 2.97Å; A151-E155 PolarHBondContact O-N 3.26Å
152	I	85.6	Confident	83.2	Confident	31 Å²	31	90.6 Å²	90.6	16%	0.159	44%	0.443	C	S	.	.	H	α-helix	trans	-60.1	-43.3	174.9	-64.4	169.8	0	0	0	110.1	I137 N138 R148 D149 R154 E155 N156	I137-I152 HydrophobicContact CB-CG1 4.23Å; I137-I152 HydrophobicContact CD1-CG1 4.4Å; I137-I152 HydrophobicContact CG2-CD1 4.26Å; I137-I152 HydrophobicContact CG2-CG1 3.65Å; N138-I152 WeakPolarHBondContact OD1-CD1 3.49Å; R148-I152 WeakPolarHBondContact O-CG1 3.22Å; R148-I152 PolarHBondContact O-N 2.91Å; D149-I152 PolarHBondContact O-N 3.27Å; I152-R154 PolarHBondContact O-N 3.43Å; I152-E155 PolarHBondContact O-N 2.94Å; I152-N156 VanDerWaalsContact O-CG 3.25Å; I152-N156 PolarHBondContact O-N 2.87Å; I152-N156 PolarHBondContact O-OD1 3.5Å
153	Q	87.2	Confident	82.9	Confident	122 Å²	122	82.1 Å²	82.1	57%	0.57	41%	0.413	S	S	*	.	H	α-helix	trans	-62.9	-43.5	179.2	-168.7	172.1	3.9	0	0	112.3	D149 A151 E155 N156 E157	D149-Q153 WeakPolarHBondContact O-CB 3.38Å; D149-Q153 PolarHBondContact O-N 3.43Å; A151-Q153 VanDerWaalsContact C-N 3.3Å; A151-Q153 PolarHBondContact O-N 2.7Å; Q153-E155 VanDerWaalsContact C-N 3.28Å; Q153-E155 PolarHBondContact O-N 3.47Å; Q153-N156 PolarHBondContact O-N 2.87Å; Q153-E157 WeakPolarHBondContact O-CG 3.47Å; Q153-E157 PolarHBondContact O-N 3.23Å
154	R	86.8	Confident	82.5	Confident	169 Å²	169	86.7 Å²	86.7	64%	0.638	43%	0.427	S	S	*	.	H	α-helix	trans	-60.4	-38.6	174.5	-82.1	-176.9	-88.4	-173.5	-7.2	112.3	A150 A151 I152 R158	A150-R154 WeakPolarHBondContact O-CG 3.26Å; A150-R154 PolarHBondContact O-N 2.78Å; A150-R154 PolarHBondContact O-NE 3.39Å; A150-R154 VanDerWaalsContact O-NE 3.11Å; A151-R154 PolarHBondContact O-N 2.97Å; I152-R154 PolarHBondContact O-N 3.43Å; R154-R158 WeakPolarHBondContact O-CB 3.46Å; R154-R158 PolarHBondContact O-N 3.4Å
155	E	85	Confident	81.6	Confident	37 Å²	37	89 Å²	89	17%	0.173	43%	0.431	C	S	.	.	H	α-helix	trans	-72	-40.6	178.5	-173.8	56.1	-159.6	0	0	112.3	H130 E133 I137 A151 I152 Q153 E157 R158 Y159	H130-E155 IonicContact ND1-OE1 2.74Å; E133-E155 HydrophobicContact CB-CG 3.96Å; E133-E155 HydrophobicContact CG-CG 4.26Å; I137-E155 HydrophobicContact CD1-CB 4.37Å; A151-E155 PolarHBondContact O-N 3.26Å; I152-E155 PolarHBondContact O-N 2.94Å; Q153-E155 VanDerWaalsContact C-N 3.28Å; Q153-E155 PolarHBondContact O-N 3.47Å; E155-E157 VanDerWaalsContact C-N 3.34Å; E155-E157 PolarHBondContact O-N 2.99Å; E155-R158 WeakPolarHBondContact O-CB 3.46Å; E155-R158 PolarHBondContact O-N 3.07Å; E155-Y159 WeakPolarHBondContact O-CB 3.47Å; E155-Y159 PolarHBondContact O-N 3.32Å
156	N	87.1	Confident	80.2	Confident	67 Å²	67	87.9 Å²	87.9	36%	0.358	43%	0.43	S	S	.	.	H	α-helix	trans	-58.1	-44.3	171.7	-70.1	-11.9	0	0	0	111.5	H130 I152 Q153 R158 Y159 E160	H130-N156 PolarHBondContact CE1-OD1 3.37Å; H130-N156 PolarHBondContact NE2-OD1 2.89Å; I152-N156 VanDerWaalsContact O-CG 3.25Å; I152-N156 PolarHBondContact O-N 2.87Å; I152-N156 PolarHBondContact O-OD1 3.5Å; Q153-N156 PolarHBondContact O-N 2.87Å; N156-R158 VanDerWaalsContact C-N 3.35Å; N156-R158 PolarHBondContact O-N 3.3Å; N156-Y159 PolarHBondContact O-N 3.34Å; N156-E160 WeakPolarHBondContact O-CB 3.37Å; N156-E160 WeakPolarHBondContact O-CG 3.42Å; N156-E160 PolarHBondContact O-N 3.45Å
157	E	87.8	Confident	78.4	Confident	94 Å²	94	88.9 Å²	88.9	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-64.8	-37.3	176.2	-74.8	-179.6	-164	0	0	113	Q153 E155 K161	Q153-E157 WeakPolarHBondContact O-CG 3.47Å; Q153-E157 PolarHBondContact O-N 3.23Å; E155-E157 VanDerWaalsContact C-N 3.34Å; E155-E157 PolarHBondContact O-N 2.99Å; E157-K161 WeakPolarHBondContact O-CB 3.45Å; E157-K161 VanDerWaalsContact O-CG 3.28Å; E157-K161 WeakPolarHBondContact O-CG 3.42Å; E157-K161 PolarHBondContact O-N 3.43Å
158	R	84.7	Confident	76.4	Confident	170 Å²	170	95.5 Å²	95.5	64%	0.642	44%	0.444	S	S	*	.	H	α-helix	trans	-65.9	-45.3	177.6	-159.9	-174.1	-148.4	-80.3	0.6	110.8	R154 E155 N156 K161 A162	R154-R158 WeakPolarHBondContact O-CB 3.46Å; R154-R158 PolarHBondContact O-N 3.4Å; E155-R158 WeakPolarHBondContact O-CB 3.46Å; E155-R158 PolarHBondContact O-N 3.07Å; N156-R158 VanDerWaalsContact C-N 3.35Å; N156-R158 PolarHBondContact O-N 3.3Å; R158-K161 PolarHBondContact O-N 2.91Å; R158-A162 WeakPolarHBondContact O-CB 3.37Å; R158-A162 PolarHBondContact O-N 3.46Å
159	Y	81.2	Confident	74.5	Confident	59 Å²	59	97.1 Å²	97.1	23%	0.231	47%	0.469	C	S	.	.	H	α-helix	trans	-62	-46.9	175.8	178.2	-119.5	0	0	0	111.6	A127 H130 E155 N156 K161 A162 I163	A127-Y159 HydrophobicContact CB-CE2 4.15Å; H130-Y159 HydrophobicContact CB-CD1 4.48Å; H130-Y159 HydrophobicContact CB-CD2 3.6Å; H130-Y159 HydrophobicContact CB-CE2 4.07Å; H130-Y159 HydrophobicContact CB-CG 3.85Å; H130-Y159 AromaticContact CD2-CD1 3.5Å; H130-Y159 AromaticContact CD2-CE1 3.82Å; H130-Y159 AromaticContact CD2-CG 3.7Å; H130-Y159 AromaticContact CG-CD1 3.8Å; H130-Y159 AromaticContact CG-CD2 3.78Å; H130-Y159 AromaticContact CG-CG 3.47Å; H130-Y159 VanDerWaalsContact CG-CG 3.47Å; H130-Y159 WeakPolarHBondContact ND1-CB 3.42Å; H130-Y159 AromaticContact ND1-CG 3.73Å; H130-Y159 AromaticContact NE2-CD1 3.67Å; E155-Y159 WeakPolarHBondContact O-CB 3.47Å; E155-Y159 PolarHBondContact O-N 3.32Å; N156-Y159 PolarHBondContact O-N 3.34Å; Y159-K161 VanDerWaalsContact C-N 3.34Å; Y159-K161 PolarHBondContact O-N 2.86Å; Y159-A162 WeakPolarHBondContact O-CB 3.41Å; Y159-A162 PolarHBondContact O-N 2.94Å; Y159-A162 VanDerWaalsContact O-N 3.12Å; Y159-I163 HydrophobicContact CD1-CD1 3.63Å; Y159-I163 HydrophobicContact CD2-CD1 3.94Å; Y159-I163 HydrophobicContact CD2-CG1 4.1Å; Y159-I163 HydrophobicContact CE1-CD1 3.21Å; Y159-I163 HydrophobicContact CE1-CG1 4.33Å; Y159-I163 HydrophobicContact CE2-CD1 3.54Å; Y159-I163 HydrophobicContact CE2-CG1 3.78Å; Y159-I163 HydrophobicContact CG-CD1 3.98Å; Y159-I163 HydrophobicContact CG-CG1 4.49Å; Y159-I163 VanDerWaalsContact O-CG1 3.31Å; Y159-I163 WeakPolarHBondContact O-CG1 3.48Å; Y159-I163 PolarHBondContact O-N 2.91Å
160	E	81.7	Confident	72.5	Confident	88 Å²	88	96.8 Å²	96.8	41%	0.411	47%	0.471	S	S	.	.	H	α-helix	trans	-55.8	-45.6	173.4	-88.4	-70.8	129.8	0	0	112.5	N156 K164	N156-E160 WeakPolarHBondContact O-CB 3.37Å; N156-E160 WeakPolarHBondContact O-CG 3.42Å; N156-E160 PolarHBondContact O-N 3.45Å; E160-K164 VanDerWaalsContact O-CB 3.24Å; E160-K164 WeakPolarHBondContact O-CB 3.36Å; E160-K164 VanDerWaalsContact O-CG 3.27Å; E160-K164 WeakPolarHBondContact O-CG 3.23Å; E160-K164 PolarHBondContact O-N 3.08Å; E160-K164 WeakPolarHBondContact OE2-CE 3.25Å; E160-K164 IonicContact OE2-NZ 3.19Å; E160-K164 PolarHBondContact OE2-NZ 3.4Å
161	K	82.1	Confident	70.2	Confident	138 Å²	138	105.3 Å²	105.3	60%	0.6	50%	0.495	S	S	*	.	H	α-helix	trans	-64.3	-39.2	176.1	-74.3	169.2	-174.8	165.8	0	112	E157 R158 Y159 K165	E157-K161 WeakPolarHBondContact O-CB 3.45Å; E157-K161 VanDerWaalsContact O-CG 3.28Å; E157-K161 WeakPolarHBondContact O-CG 3.42Å; E157-K161 PolarHBondContact O-N 3.43Å; R158-K161 PolarHBondContact O-N 2.91Å; Y159-K161 VanDerWaalsContact C-N 3.34Å; Y159-K161 PolarHBondContact O-N 2.86Å; K161-K165 WeakPolarHBondContact O-CB 3.32Å; K161-K165 PolarHBondContact O-N 3.05Å
162	A	74.9	Confident	68.4	Low	23 Å²	23	109 Å²	109	19%	0.19	51%	0.51	C	S	.	.	H	α-helix	trans	-66.4	-45.3	178.1	0	0	0	0	0	111.8	E126 R158 Y159 K165 N166	E126-A162 HydrophobicContact CG-CB 4.47Å; R158-A162 WeakPolarHBondContact O-CB 3.37Å; R158-A162 PolarHBondContact O-N 3.46Å; Y159-A162 WeakPolarHBondContact O-CB 3.41Å; Y159-A162 PolarHBondContact O-N 2.94Å; Y159-A162 VanDerWaalsContact O-N 3.12Å; A162-K165 PolarHBondContact O-N 3.4Å; A162-N166 PolarHBondContact O-N 3.12Å; A162-N166 VanDerWaalsContact O-N 3.11Å
163	I	70.2	Confident	66.7	Low	56 Å²	56	109.9 Å²	109.9	29%	0.287	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-44.8	175.6	-59.6	164.2	0	0	0	110.6	Y159 K165 N166 T167	Y159-I163 HydrophobicContact CD1-CD1 3.63Å; Y159-I163 HydrophobicContact CD2-CD1 3.94Å; Y159-I163 HydrophobicContact CD2-CG1 4.1Å; Y159-I163 HydrophobicContact CE1-CD1 3.21Å; Y159-I163 HydrophobicContact CE1-CG1 4.33Å; Y159-I163 HydrophobicContact CE2-CD1 3.54Å; Y159-I163 HydrophobicContact CE2-CG1 3.78Å; Y159-I163 HydrophobicContact CG-CD1 3.98Å; Y159-I163 HydrophobicContact CG-CG1 4.49Å; Y159-I163 VanDerWaalsContact O-CG1 3.31Å; Y159-I163 WeakPolarHBondContact O-CG1 3.48Å; Y159-I163 PolarHBondContact O-N 2.91Å; I163-K165 VanDerWaalsContact C-N 3.33Å; I163-K165 PolarHBondContact O-N 2.88Å; I163-N166 CarbonylContact O-C 3.53Å; I163-N166 PolarHBondContact O-N 2.87Å; I163-N166 VanDerWaalsContact O-N 3.13Å; I163-T167 PolarHBondContact O-N 3.33Å; I163-T167 PolarHBondContact O-OG1 2.9Å
164	K	67.6	Low	65	Low	129 Å²	129	106.8 Å²	106.8	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-61.6	-37.1	177.2	-78.5	174	178.5	152.1	0	113	E160 N166 T167	E160-K164 VanDerWaalsContact O-CB 3.24Å; E160-K164 WeakPolarHBondContact O-CB 3.36Å; E160-K164 VanDerWaalsContact O-CG 3.27Å; E160-K164 WeakPolarHBondContact O-CG 3.23Å; E160-K164 PolarHBondContact O-N 3.08Å; E160-K164 WeakPolarHBondContact OE2-CE 3.25Å; E160-K164 IonicContact OE2-NZ 3.19Å; E160-K164 PolarHBondContact OE2-NZ 3.4Å; K164-N166 VanDerWaalsContact C-N 3.35Å; K164-T167 VanDerWaalsContact CA-OG1 3.25Å; K164-T167 WeakPolarHBondContact CA-OG1 3.43Å; K164-T167 PolarHBondContact O-N 3.26Å; K164-T167 PolarHBondContact O-OG1 3.49Å
165	K	61.3	Low	63.4	Low	173 Å²	173	98.7 Å²	98.7	75%	0.752	47%	0.47	S	S	*	.	H	α-helix	trans	-65.5	-38.6	173.7	-168.2	177.8	179.1	-176.3	0	111.6	K161 A162 I163	K161-K165 WeakPolarHBondContact O-CB 3.32Å; K161-K165 PolarHBondContact O-N 3.05Å; A162-K165 PolarHBondContact O-N 3.4Å; I163-K165 VanDerWaalsContact C-N 3.33Å; I163-K165 PolarHBondContact O-N 2.88Å
166	N	53	Low	62.3	Low	114 Å²	114	98.9 Å²	98.9	61%	0.61	47%	0.474	S	S	*	.	H	α-helix	trans	-79	-18.7	177.2	-83.4	-7.3	0	0	0	114.4	A162 I163 K164	A162-N166 PolarHBondContact O-N 3.12Å; A162-N166 VanDerWaalsContact O-N 3.11Å; I163-N166 CarbonylContact O-C 3.53Å; I163-N166 PolarHBondContact O-N 2.87Å; I163-N166 VanDerWaalsContact O-N 3.13Å; K164-N166 VanDerWaalsContact C-N 3.35Å
167	T	47.5	Very low	61.4	Low	98 Å²	98	103.1 Å²	103.1	60%	0.601	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-3.6	-178.9	23.8	0	0	0	0	114.4	I163 K164 A169	I163-T167 PolarHBondContact O-N 3.33Å; I163-T167 PolarHBondContact O-OG1 2.9Å; K164-T167 VanDerWaalsContact CA-OG1 3.25Å; K164-T167 WeakPolarHBondContact CA-OG1 3.43Å; K164-T167 PolarHBondContact O-N 3.26Å; K164-T167 PolarHBondContact O-OG1 3.49Å; T167-A169 VanDerWaalsContact C-N 3.3Å; T167-A169 PolarHBondContact O-N 3.45Å
168	R	43	Very low	60.4	Low	223 Å²	223	99.9 Å²	99.9	84%	0.842	47%	0.471	S	S	*	.	S	Bend	trans	-66.5	93.4	167.7	-77.7	-173.3	177.9	-179.2	-0.4	109.3	T170	R168-T170 PolarHBondContact O-N 2.93Å
169	A	39.6	Very low	59.6	Low	92 Å²	92	93.6 Å²	93.6	76%	0.76	45%	0.449	S	S	*	.	S	Bend	trans	62.2	23	163.7	0	0	0	0	0	118.7	T167 R171	T167-A169 VanDerWaalsContact C-N 3.3Å; T167-A169 PolarHBondContact O-N 3.45Å; A169-R171 PolarHBondContact O-N 3.41Å; A169-R171 VanDerWaalsContact O-N 3.08Å
170	T	41.2	Very low	59.1	Low	82 Å²	82	95.7 Å²	95.7	50%	0.503	46%	0.464	S	S	.	.			trans	-83.9	69.8	153.6	-49	0	0	0	0	107.8	R168 T176	R168-T170 PolarHBondContact O-N 2.93Å; T170-T176 HydrophobicContact CG2-CG2 4.43Å
171	R	40.5	Very low	58.8	Low	218 Å²	218	96.4 Å²	96.4	82%	0.823	47%	0.468	S	S	*	.			trans	-54.8	142.5	156.3	-140.5	171.1	-173.9	166.7	-0.2	104.9	A169 D173	A169-R171 PolarHBondContact O-N 3.41Å; A169-R171 VanDerWaalsContact O-N 3.08Å; R171-D173 PolarHBondContact O-N 2.94Å; R171-D173 VanDerWaalsContact O-OD1 3.08Å
172	N	47.7	Very low	58	Low	106 Å²	106	90.7 Å²	90.7	57%	0.567	44%	0.442	S	S	*	.			trans	-64.2	68.4	-174.1	-78.9	-48	0	0	0	111.8	E174 R177	N172-E174 PolarHBondContact O-N 3.14Å; N172-R177 PolarHBondContact ND2-NH2 2.94Å
173	D	51.1	Low	57.6	Low	49 Å²	49	92 Å²	92	26%	0.262	45%	0.45	S	S	.	.			trans	-59.7	130.5	178.7	-57.1	-19.9	0	0	0	106.8	R171 A175 T176 R177	R171-D173 PolarHBondContact O-N 2.94Å; R171-D173 VanDerWaalsContact O-OD1 3.08Å; D173-A175 PolarHBondContact O-N 3.06Å; D173-T176 WeakPolarHBondContact O-CB 3.41Å; D173-T176 PolarHBondContact O-N 3.09Å; D173-R177 PolarHBondContact O-N 3.44Å
174	E	51.9	Low	57.5	Low	57 Å²	57	95.4 Å²	95.4	27%	0.266	47%	0.465	S	S	.	.	H	α-helix	trans	-46.8	-37.9	-179.6	-156.3	-168.6	166.3	0	0	111.1	N172 T176 R177 L178 R220 D232	N172-E174 PolarHBondContact O-N 3.14Å; E174-T176 PolarHBondContact O-N 2.99Å; E174-R177 PolarHBondContact O-N 3.24Å; E174-L178 HydrophobicContact CG-CD1 4.33Å; E174-L178 WeakPolarHBondContact O-CB 3.38Å; E174-L178 WeakPolarHBondContact O-CG 3.26Å; E174-L178 PolarHBondContact O-N 3.39Å; E174-R220 IonicContact OE1-CZ 2.72Å; E174-R220 IonicContact OE1-NH1 3.54Å; E174-R220 PolarHBondContact OE1-NH1 3.44Å; E174-R220 IonicContact OE1-NH2 2.68Å; E174-R220 PolarHBondContact OE1-NH2 2.91Å; E174-R220 IonicContact OE2-CZ 3.21Å; E174-R220 IonicContact OE2-NH1 2.86Å; E174-R220 IonicContact OE2-NH2 3.08Å; E174-R220 PolarHBondContact OE2-NH2 2.81Å; E174-D232 HydrophobicContact CB-CB 4.34Å
175	A	52.8	Low	57.4	Low	0 Å²	0	91.8 Å²	91.8	0%	0	45%	0.45	C	S	.	.	H	α-helix	trans	-61.3	-39.3	175.5	0	0	0	0	0	114.3	D173 L178 L179 R239 L243	D173-A175 PolarHBondContact O-N 3.06Å; A175-L178 PolarHBondContact O-N 2.86Å; A175-L179 WeakPolarHBondContact O-CB 3.41Å; A175-L179 WeakPolarHBondContact O-CG 3.33Å; A175-L179 PolarHBondContact O-N 3.1Å; A175-R239 HydrophobicContact CB-CB 4.01Å; A175-R239 HydrophobicContact CB-CG 4.23Å; A175-L243 HydrophobicContact CB-CD1 4.31Å
176	T	61.6	Low	57.2	Low	41 Å²	41	85.4 Å²	85.4	25%	0.252	42%	0.423	S	S	.	.	H	α-helix	trans	-69.1	-38.8	177.4	-53.4	0	0	0	0	110.8	T170 D173 E174 L180 R239	T170-T176 HydrophobicContact CG2-CG2 4.43Å; D173-T176 WeakPolarHBondContact O-CB 3.41Å; D173-T176 PolarHBondContact O-N 3.09Å; E174-T176 PolarHBondContact O-N 2.99Å; T176-L180 WeakPolarHBondContact O-CB 3.42Å; T176-L180 PolarHBondContact O-N 2.77Å; T176-R239 PolarHBondContact OG1-NH1 3.25Å; T176-R239 PolarHBondContact OG1-NH2 2.95Å
177	R	67.4	Low	57.5	Low	156 Å²	156	82.7 Å²	82.7	59%	0.589	42%	0.416	S	S	*	.	H	α-helix	trans	-65.2	-44.4	173.9	-74	-179	173.7	171.9	-0.9	111.6	N172 D173 E174 L180 Q181	N172-R177 PolarHBondContact ND2-NH2 2.94Å; D173-R177 PolarHBondContact O-N 3.44Å; E174-R177 PolarHBondContact O-N 3.24Å; R177-L180 PolarHBondContact O-N 3.4Å; R177-Q181 WeakPolarHBondContact O-CB 3.49Å; R177-Q181 PolarHBondContact O-N 2.68Å
178	L	68.4	Low	58.2	Low	26 Å²	26	84.4 Å²	84.4	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-61.7	-45.5	175.9	-80.9	161.8	0	0	0	111.8	E174 A175 L180 Q181 Y182 L243	E174-L178 HydrophobicContact CG-CD1 4.33Å; E174-L178 WeakPolarHBondContact O-CB 3.38Å; E174-L178 WeakPolarHBondContact O-CG 3.26Å; E174-L178 PolarHBondContact O-N 3.39Å; A175-L178 PolarHBondContact O-N 2.86Å; L178-L180 PolarHBondContact O-N 2.89Å; L178-Q181 PolarHBondContact O-N 3.39Å; L178-Y182 HydrophobicContact CB-CE2 4.16Å; L178-Y182 HydrophobicContact CD2-CE2 4.26Å; L178-Y182 WeakPolarHBondContact O-CB 3.45Å; L178-Y182 WeakPolarHBondContact O-CD2 3.28Å; L178-Y182 VanDerWaalsContact O-CG 3.24Å; L178-Y182 PolarHBondContact O-N 2.96Å; L178-L243 HydrophobicContact CB-CD2 3.65Å
179	L	67.3	Low	59.1	Low	37 Å²	37	74.4 Å²	74.4	19%	0.194	38%	0.381	C	S	.	.	H	α-helix	trans	-61.2	-42	176.7	-80.9	165.2	0	0	0	112.5	A175 Y182 S183 E242 L243 A246	A175-L179 WeakPolarHBondContact O-CB 3.41Å; A175-L179 WeakPolarHBondContact O-CG 3.33Å; A175-L179 PolarHBondContact O-N 3.1Å; L179-Y182 PolarHBondContact O-N 3.1Å; L179-S183 WeakPolarHBondContact O-CB 3.28Å; L179-S183 PolarHBondContact O-N 2.83Å; L179-S183 PolarHBondContact O-OG 2.79Å; L179-E242 HydrophobicContact CD1-CB 4.37Å; L179-E242 WeakPolarHBondContact CD1-OE2 3.48Å; L179-E242 HydrophobicContact CD2-CB 4.22Å; L179-L243 HydrophobicContact CD2-CD2 4.26Å; L179-L243 HydrophobicContact CG-CD2 3.92Å; L179-A246 HydrophobicContact CD2-CB 3.98Å
180	L	70.9	Confident	59.8	Low	103 Å²	103	74.5 Å²	74.5	54%	0.539	37%	0.366	S	S	.	.	H	α-helix	trans	-67.2	-39.2	176.6	-174.7	66.6	0	0	0	111.8	T176 R177 L178 S183 Q184	T176-L180 WeakPolarHBondContact O-CB 3.42Å; T176-L180 PolarHBondContact O-N 2.77Å; R177-L180 PolarHBondContact O-N 3.4Å; L178-L180 PolarHBondContact O-N 2.89Å; L180-S183 PolarHBondContact O-N 3.33Å; L180-S183 PolarHBondContact O-OG 3.45Å; L180-Q184 WeakPolarHBondContact O-CB 3.44Å; L180-Q184 PolarHBondContact O-N 3.41Å
181	Q	73.9	Confident	60.5	Low	104 Å²	104	72.8 Å²	72.8	49%	0.486	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-45	174.8	-174.4	179.9	11.8	0	0	111	R177 L178 Q184 Q185	R177-Q181 WeakPolarHBondContact O-CB 3.49Å; R177-Q181 PolarHBondContact O-N 2.68Å; L178-Q181 PolarHBondContact O-N 3.39Å; Q181-Q184 PolarHBondContact O-N 3.15Å; Q181-Q185 PolarHBondContact O-N 3.31Å
182	Y	65.4	Low	61.3	Low	17 Å²	17	67.5 Å²	67.5	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-65.6	-41.7	176.9	-65.6	-35.7	0	0	0	112	L178 L179 Q184 Q185 Q186 L243 A246 L247	L178-Y182 HydrophobicContact CB-CE2 4.16Å; L178-Y182 HydrophobicContact CD2-CE2 4.26Å; L178-Y182 WeakPolarHBondContact O-CB 3.45Å; L178-Y182 WeakPolarHBondContact O-CD2 3.28Å; L178-Y182 VanDerWaalsContact O-CG 3.24Å; L178-Y182 PolarHBondContact O-N 2.96Å; L179-Y182 PolarHBondContact O-N 3.1Å; Y182-Q184 PolarHBondContact O-N 2.94Å; Y182-Q185 PolarHBondContact O-N 3.11Å; Y182-Q186 WeakPolarHBondContact O-CB 3.49Å; Y182-Q186 PolarHBondContact O-N 3.2Å; Y182-L243 HydrophobicContact CD2-CD2 4.1Å; Y182-L243 HydrophobicContact CE2-CD2 3.81Å; Y182-A246 HydrophobicContact CD2-CB 4.32Å; Y182-L247 HydrophobicContact CD1-CD2 3.94Å; Y182-L247 HydrophobicContact CD1-CG 4.44Å; Y182-L247 HydrophobicContact CD2-CG 4.15Å; Y182-L247 HydrophobicContact CE1-CD2 3.5Å; Y182-L247 HydrophobicContact CE1-CG 4.09Å; Y182-L247 HydrophobicContact CE2-CD1 3.93Å; Y182-L247 HydrophobicContact CE2-CD2 4.12Å; Y182-L247 HydrophobicContact CE2-CG 3.75Å; Y182-L247 HydrophobicContact CG-CD2 4.45Å; Y182-L247 HydrophobicContact CG-CG 4.5Å
183	S	67.5	Low	61.6	Low	51 Å²	51	62.8 Å²	62.8	36%	0.357	32%	0.324	S	S	.	.	H	α-helix	trans	-65.8	-37.4	177.4	73.9	0	0	0	0	112.4	L179 L180 Q186 A187	L179-S183 WeakPolarHBondContact O-CB 3.28Å; L179-S183 PolarHBondContact O-N 2.83Å; L179-S183 PolarHBondContact O-OG 2.79Å; L180-S183 PolarHBondContact O-N 3.33Å; L180-S183 PolarHBondContact O-OG 3.45Å; S183-Q186 WeakPolarHBondContact O-CB 3.29Å; S183-Q186 PolarHBondContact O-N 3.07Å; S183-A187 WeakPolarHBondContact O-CB 3.29Å; S183-A187 PolarHBondContact O-N 3.46Å
184	Q	68.1	Low	61.6	Low	128 Å²	128	63.5 Å²	63.5	60%	0.598	34%	0.336	S	S	*	.	H	α-helix	trans	-65.5	-44.9	172.5	-81.2	-174.3	1.1	0	0	112.3	L180 Q181 Y182 Q186 A187 Q188	L180-Q184 WeakPolarHBondContact O-CB 3.44Å; L180-Q184 PolarHBondContact O-N 3.41Å; Q181-Q184 PolarHBondContact O-N 3.15Å; Y182-Q184 PolarHBondContact O-N 2.94Å; Q184-Q186 VanDerWaalsContact C-N 3.25Å; Q184-Q186 PolarHBondContact O-N 2.85Å; Q184-A187 PolarHBondContact O-N 2.91Å; Q184-Q188 PolarHBondContact O-N 3.44Å
185	Q	65.3	Low	61.6	Low	52 Å²	52	64.4 Å²	64.4	24%	0.243	35%	0.353	C	S	.	.	H	α-helix	trans	-59.7	-41	173.2	-82	-173.8	-22.7	0	0	111.2	Q181 Y182 A187 Q188 V189 L250	Q181-Q185 PolarHBondContact O-N 3.31Å; Y182-Q185 PolarHBondContact O-N 3.11Å; Q185-A187 VanDerWaalsContact C-N 3.35Å; Q185-A187 PolarHBondContact O-N 3.18Å; Q185-Q188 PolarHBondContact O-N 2.89Å; Q185-V189 WeakPolarHBondContact O-CB 3.4Å; Q185-V189 VanDerWaalsContact O-CG2 3.26Å; Q185-V189 WeakPolarHBondContact O-CG2 3.33Å; Q185-V189 PolarHBondContact O-N 3.39Å; Q185-L250 HydrophobicContact CB-CD1 3.92Å; Q185-L250 HydrophobicContact CB-CD2 4.39Å
186	Q	57.1	Low	61.3	Low	39 Å²	39	64.8 Å²	64.8	18%	0.182	36%	0.356	C	S	.	.	H	α-helix	trans	-63.5	-40.6	179	-165.3	-166.8	-5.5	0	0	111.7	Y182 S183 Q184 E190 L250 K253	Y182-Q186 WeakPolarHBondContact O-CB 3.49Å; Y182-Q186 PolarHBondContact O-N 3.2Å; S183-Q186 WeakPolarHBondContact O-CB 3.29Å; S183-Q186 PolarHBondContact O-N 3.07Å; Q184-Q186 VanDerWaalsContact C-N 3.25Å; Q184-Q186 PolarHBondContact O-N 2.85Å; Q186-E190 WeakPolarHBondContact O-CB 3.16Å; Q186-E190 PolarHBondContact O-N 2.96Å; Q186-L250 HydrophobicContact CB-CD1 4.04Å; Q186-K253 HydrophobicContact CG-CD 3.53Å; Q186-K253 VanDerWaalsContact CG-NZ 3.27Å
187	A	59	Low	60.5	Low	57 Å²	57	70.4 Å²	70.4	47%	0.471	37%	0.373	S	S	.	.	H	α-helix	trans	-68.1	-38	174.7	0	0	0	0	0	112.5	S183 Q184 Q185 E190 G191	S183-A187 WeakPolarHBondContact O-CB 3.29Å; S183-A187 PolarHBondContact O-N 3.46Å; Q184-A187 PolarHBondContact O-N 2.91Å; Q185-A187 VanDerWaalsContact C-N 3.35Å; Q185-A187 PolarHBondContact O-N 3.18Å; A187-E190 PolarHBondContact O-N 3.06Å; A187-G191 PolarHBondContact O-N 3.35Å
188	Q	63.2	Low	59.8	Low	135 Å²	135	71.5 Å²	71.5	63%	0.631	39%	0.385	S	S	*	.	H	α-helix	trans	-63.4	-47.2	173.1	-83.9	-173.5	-30.8	0	0	111.7	Q184 Q185 E190 G191 Q192	Q184-Q188 PolarHBondContact O-N 3.44Å; Q185-Q188 PolarHBondContact O-N 2.89Å; Q188-E190 VanDerWaalsContact C-N 3.31Å; Q188-E190 PolarHBondContact O-N 3.01Å; Q188-G191 PolarHBondContact O-N 3.36Å; Q188-Q192 WeakPolarHBondContact O-CG 3.49Å; Q188-Q192 PolarHBondContact O-N 3.2Å; Q188-Q192 VanDerWaalsContact O-N 3.07Å
189	V	60.3	Low	58.6	Low	12 Å²	12	70.8 Å²	70.8	7%	0.073	38%	0.382	C	S	.	.	H	α-helix	trans	-64.2	-39	176.7	177.4	0	0	0	0	109.8	Q185 Q192 I193 L250 K253 Q254 L257	Q185-V189 WeakPolarHBondContact O-CB 3.4Å; Q185-V189 VanDerWaalsContact O-CG2 3.26Å; Q185-V189 WeakPolarHBondContact O-CG2 3.33Å; Q185-V189 PolarHBondContact O-N 3.39Å; V189-Q192 CarbonylContact O-C 3.53Å; V189-Q192 PolarHBondContact O-N 3Å; V189-I193 HydrophobicContact CG1-CD1 3.84Å; V189-I193 HydrophobicContact CG1-CG1 4.14Å; V189-I193 WeakPolarHBondContact O-CB 3.38Å; V189-I193 WeakPolarHBondContact O-CG1 3.4Å; V189-I193 PolarHBondContact O-N 3.44Å; V189-L250 HydrophobicContact CG2-CD1 4.23Å; V189-K253 HydrophobicContact CG1-CB 3.8Å; V189-Q254 HydrophobicContact CG1-CG 4.2Å; V189-Q254 HydrophobicContact CG2-CG 4.01Å; V189-L257 HydrophobicContact CG1-CB 4.33Å; V189-L257 HydrophobicContact CG1-CD2 4.27Å
190	E	54.2	Low	57	Low	95 Å²	95	70.8 Å²	70.8	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-42.3	173.2	-106.3	174.9	167	0	0	113.7	Q186 A187 Q188 Q192 I193 A194 K253	Q186-E190 WeakPolarHBondContact O-CB 3.16Å; Q186-E190 PolarHBondContact O-N 2.96Å; A187-E190 PolarHBondContact O-N 3.06Å; Q188-E190 VanDerWaalsContact C-N 3.31Å; Q188-E190 PolarHBondContact O-N 3.01Å; E190-Q192 VanDerWaalsContact C-N 3.28Å; E190-Q192 PolarHBondContact O-N 3.4Å; E190-I193 PolarHBondContact O-N 3.35Å; E190-A194 VanDerWaalsContact O-CB 3.27Å; E190-A194 WeakPolarHBondContact O-CB 3.42Å; E190-A194 PolarHBondContact O-N 3.48Å; E190-K253 HydrophobicContact CG-CD 4.05Å; E190-K253 WeakPolarHBondContact OE1-CE 3.41Å; E190-K253 IonicContact OE1-NZ 3.38Å; E190-K253 PolarHBondContact OE1-NZ 3.42Å; E190-K253 IonicContact OE2-NZ 2.81Å; E190-K253 PolarHBondContact OE2-NZ 3.12Å
191	G	56.2	Low	55.2	Low	46 Å²	46	68.2 Å²	68.2	47%	0.474	39%	0.386	S	S	.	.	H	α-helix	trans	-60.3	-40.9	174.6	0	0	0	0	0	111.7	A187 Q188 A194 A195	A187-G191 PolarHBondContact O-N 3.35Å; Q188-G191 PolarHBondContact O-N 3.36Å; G191-A194 PolarHBondContact O-N 2.85Å; G191-A195 PolarHBondContact O-N 3.3Å; G191-A195 VanDerWaalsContact O-N 3.07Å
192	Q	58.2	Low	53.3	Low	106 Å²	106	69.9 Å²	69.9	50%	0.495	40%	0.396	S	S	.	.	H	α-helix	trans	-70.6	-40.6	176.2	-66.1	177	9.1	0	0	112.2	Q188 V189 E190 A195 A196 L257	Q188-Q192 WeakPolarHBondContact O-CG 3.49Å; Q188-Q192 PolarHBondContact O-N 3.2Å; Q188-Q192 VanDerWaalsContact O-N 3.07Å; V189-Q192 CarbonylContact O-C 3.53Å; V189-Q192 PolarHBondContact O-N 3Å; E190-Q192 VanDerWaalsContact C-N 3.28Å; E190-Q192 PolarHBondContact O-N 3.4Å; Q192-A195 PolarHBondContact O-N 3.41Å; Q192-A196 VanDerWaalsContact O-CB 3.27Å; Q192-A196 WeakPolarHBondContact O-CB 3.36Å; Q192-A196 PolarHBondContact O-N 2.94Å; Q192-L257 HydrophobicContact CB-CD1 3.6Å; Q192-L257 HydrophobicContact CB-CD2 3.97Å; Q192-L257 HydrophobicContact CB-CG 4.45Å
193	I	52.9	Low	51.7	Low	8 Å²	8	71.6 Å²	71.6	4%	0.041	42%	0.415	C	S	.	.	H	α-helix	trans	-63.6	-43.5	173.9	-67.9	167.3	0	0	0	109.5	V189 E190 A195 A196 R197 K253 E256 L257	V189-I193 HydrophobicContact CG1-CD1 3.84Å; V189-I193 HydrophobicContact CG1-CG1 4.14Å; V189-I193 WeakPolarHBondContact O-CB 3.38Å; V189-I193 WeakPolarHBondContact O-CG1 3.4Å; V189-I193 PolarHBondContact O-N 3.44Å; E190-I193 PolarHBondContact O-N 3.35Å; I193-A195 VanDerWaalsContact C-N 3.28Å; I193-A195 PolarHBondContact O-N 2.96Å; I193-A196 CarbonylContact O-C 3.6Å; I193-A196 PolarHBondContact O-N 3.34Å; I193-R197 HydrophobicContact CG2-CB 4.39Å; I193-R197 HydrophobicContact CG2-CG 3.56Å; I193-R197 WeakPolarHBondContact O-CA 3.4Å; I193-R197 WeakPolarHBondContact O-CB 3.36Å; I193-R197 PolarHBondContact O-N 3.32Å; I193-K253 HydrophobicContact CD1-CB 3.68Å; I193-K253 HydrophobicContact CD1-CG 3.86Å; I193-K253 WeakPolarHBondContact CD1-O 3.43Å; I193-E256 HydrophobicContact CD1-CB 4.26Å; I193-E256 HydrophobicContact CD1-CG 4.38Å; I193-E256 HydrophobicContact CG2-CG 3.97Å; I193-L257 HydrophobicContact CG1-CB 3.76Å; I193-L257 HydrophobicContact CG1-CD1 4.25Å
194	A	53.1	Low	49.9	Very low	63 Å²	63	73.4 Å²	73.4	52%	0.521	42%	0.423	S	S	.	.	H	α-helix	trans	-63.4	-37.4	179.5	0	0	0	0	0	111.4	E190 G191 A196	E190-A194 VanDerWaalsContact O-CB 3.27Å; E190-A194 WeakPolarHBondContact O-CB 3.42Å; E190-A194 PolarHBondContact O-N 3.48Å; G191-A194 PolarHBondContact O-N 2.85Å; A194-A196 VanDerWaalsContact C-N 3.32Å
195	A	50.8	Low	48.2	Very low	76 Å²	76	76.7 Å²	76.7	63%	0.628	44%	0.439	S	S	*	.	H	α-helix	trans	-66.2	-33.7	170.9	0	0	0	0	0	112.5	G191 Q192 I193	G191-A195 PolarHBondContact O-N 3.3Å; G191-A195 VanDerWaalsContact O-N 3.07Å; Q192-A195 PolarHBondContact O-N 3.41Å; I193-A195 VanDerWaalsContact C-N 3.28Å; I193-A195 PolarHBondContact O-N 2.96Å
196	A	47.5	Very low	46.9	Very low	8 Å²	8	82.9 Å²	82.9	7%	0.066	46%	0.46	C	S	.	.	H	α-helix	trans	-89.9	-30.9	-176.5	0	0	0	0	0	114.1	Q192 I193 A194 Q198 S199 L257 Q260	Q192-A196 VanDerWaalsContact O-CB 3.27Å; Q192-A196 WeakPolarHBondContact O-CB 3.36Å; Q192-A196 PolarHBondContact O-N 2.94Å; I193-A196 CarbonylContact O-C 3.6Å; I193-A196 PolarHBondContact O-N 3.34Å; A194-A196 VanDerWaalsContact C-N 3.32Å; A196-Q198 PolarHBondContact O-N 3.47Å; A196-Q198 VanDerWaalsContact O-N 3.13Å; A196-S199 PolarHBondContact O-N 2.99Å; A196-S199 VanDerWaalsContact O-N 3.15Å; A196-S199 PolarHBondContact O-OG 2.82Å; A196-L257 HydrophobicContact CB-CD1 4.29Å; A196-Q260 HydrophobicContact CB-CB 3.48Å; A196-Q260 VanDerWaalsContact CB-CB 3.48Å; A196-Q260 HydrophobicContact CB-CG 4.27Å; A196-Q260 PolarHBondContact O-OE1 3.02Å
197	R	44.8	Very low	46.1	Very low	160 Å²	160	86.9 Å²	86.9	60%	0.604	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.4	-175.9	-100.6	-173.7	179.2	-176.7	0.4	114.4	I193 S199 E256 Q260	I193-R197 HydrophobicContact CG2-CB 4.39Å; I193-R197 HydrophobicContact CG2-CG 3.56Å; I193-R197 WeakPolarHBondContact O-CA 3.4Å; I193-R197 WeakPolarHBondContact O-CB 3.36Å; I193-R197 PolarHBondContact O-N 3.32Å; R197-S199 PolarHBondContact O-N 3.33Å; R197-E256 IonicContact NE-OE1 3.79Å; R197-Q260 HydrophobicContact CG-CG 4.42Å
198	Q	50.8	Low	45.7	Very low	178 Å²	178	84.2 Å²	84.2	83%	0.832	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	2.6	169.8	-66.9	-172.9	-1.8	0	0	112.6	A196	A196-Q198 PolarHBondContact O-N 3.47Å; A196-Q198 VanDerWaalsContact O-N 3.13Å
199	S	43.8	Very low	45.5	Very low	12 Å²	12	84.1 Å²	84.1	8%	0.084	46%	0.457	C	S	.	.	S	Bend	trans	-152	77.7	-166.7	37.6	0	0	0	0	117.3	A196 R197 Q260 N264	A196-S199 PolarHBondContact O-N 2.99Å; A196-S199 VanDerWaalsContact O-N 3.15Å; A196-S199 PolarHBondContact O-OG 2.82Å; R197-S199 PolarHBondContact O-N 3.33Å; S199-Q260 PolarHBondContact O-OE1 3.13Å; S199-N264 WeakPolarHBondContact CB-OD1 3.33Å; S199-N264 PolarHBondContact OG-ND2 3.19Å; S199-N264 PolarHBondContact OG-OD1 2.95Å
200	A	34.9	Very low	45.4	Very low	36 Å²	36	83.5 Å²	83.5	30%	0.298	45%	0.454	S	S	.	.			trans	62.1	159.3	167.4	0	0	0	0	0	115.3	Q260 L263 R267	A200-Q260 PolarHBondContact O-NE2 2.96Å; A200-Q260 PolarHBondContact O-OE1 2.96Å; A200-L263 HydrophobicContact CB-CD1 4.48Å; A200-L263 WeakPolarHBondContact O-CD1 3.35Å; A200-R267 VanDerWaalsContact CB-CZ 3.47Å
201	G	32.2	Very low	45.3	Very low	49 Å²	49	81.8 Å²	81.8	51%	0.505	45%	0.446	S	S	.	.			cis	96.5	77.3	32.3	0	0	0	0	0	116.9	L263	G201-L263 WeakPolarHBondContact O-CD1 3.36Å; G201-L263 WeakPolarHBondContact O-CD2 3.35Å
202	I	33.9	Very low	45.4	Very low	139 Å²	139	86.2 Å²	86.2	71%	0.713	45%	0.452	S	S	*	.			trans	111.2	123.7	164	-55.3	171.1	0	0	0	121.5	L263	I202-L263 HydrophobicContact CB-CD2 4.21Å; I202-L263 WeakPolarHBondContact O-CD1 3.44Å; I202-L263 WeakPolarHBondContact O-CD2 3.48Å; I202-L263 VanDerWaalsContact O-CG 3.22Å; I202-L263 WeakPolarHBondContact O-CG 3.34Å
203	A	31.3	Very low	45.6	Very low	54 Å²	54	84 Å²	84	45%	0.446	44%	0.441	S	S	.	.			trans	49.7	129.1	151	0	0	0	0	0	124.2
204	T	30.6	Very low	45.9	Very low	88 Å²	88	84.5 Å²	84.5	54%	0.54	44%	0.444	S	S	.	.				-177.7	131.5	107.8	-52.5	0	0	0	0	109.2	R206	T204-R206 PolarHBondContact O-N 2.85Å
205	E	32.9	Very low	46.1	Very low	198 Å²	198	85.7 Å²	85.7	93%	0.925	44%	0.441	S	S	*	.			trans	-75.1	95.6	176.7	-69.3	171.7	167.7	0	0	110.8
206	R	37.8	Very low	46.9	Very low	182 Å²	182	84.7 Å²	84.7	69%	0.687	43%	0.433	S	S	*	.			trans	-110.8	125.7	154.5	-73.6	-178.3	175.5	170.5	-0.3	107.3	T204 T208 Q258	T204-R206 PolarHBondContact O-N 2.85Å; R206-T208 PolarHBondContact O-N 3.4Å; R206-Q258 PolarHBondContact O-OE1 3.5Å
207	M	39.2	Very low	47.7	Very low	122 Å²	122	84.8 Å²	84.8	60%	0.601	43%	0.432	S	S	*	.			trans	-52.6	108.5	168	-71.6	-104.1	-71.6	0	0	108.3	H211	M207-H211 HydrophobicContact SD-CB 4.48Å; M207-H211 PolarHBondContact SD-CD2 2.85Å
208	T	51.5	Low	48.7	Very low	1 Å²	1	82.6 Å²	82.6	1%	0.006	43%	0.429	C	S	.	.			trans	-68.5	156.9	-175.1	16	0	0	0	0	110.9	R206 A210 H211 K212 D251 Q254 Q255	R206-T208 PolarHBondContact O-N 3.4Å; T208-A210 PolarHBondContact O-N 3.27Å; T208-H211 WeakPolarHBondContact O-CA 3.22Å; T208-H211 VanDerWaalsContact O-CB 3.27Å; T208-H211 WeakPolarHBondContact O-CB 3.36Å; T208-H211 PolarHBondContact O-N 3.47Å; T208-K212 PolarHBondContact O-N 3.39Å; T208-D251 WeakPolarHBondContact CB-OD1 3.36Å; T208-D251 PolarHBondContact OG1-OD1 3.45Å; T208-Q254 VanDerWaalsContact CB-OE1 3.27Å; T208-Q254 HydrophobicContact CG2-CB 3.32Å; T208-Q254 HydrophobicContact CG2-CG 4.46Å; T208-Q255 HydrophobicContact CG2-CG 4.19Å
209	E	58.6	Low	49.1	Very low	133 Å²	133	79.9 Å²	79.9	62%	0.621	42%	0.416	S	S	*	.	H	α-helix	trans	-58.5	-35.1	179.3	-69.9	-176.8	161	0	0	111	H211 K212 Q213 Q254	E209-H211 VanDerWaalsContact C-N 3.34Å; E209-H211 PolarHBondContact O-N 3.23Å; E209-K212 WeakPolarHBondContact O-CB 3.4Å; E209-K212 PolarHBondContact O-N 3.43Å; E209-Q213 WeakPolarHBondContact O-CG 3.34Å; E209-Q213 PolarHBondContact O-N 3.43Å; E209-Q254 VanDerWaalsContact N-OE1 3.17Å
210	A	57.3	Low	50.1	Low	0 Å²	0	83.6 Å²	83.6	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-58.8	-40.3	171.1	0	0	0	0	0	112.6	T208 K212 Q213 L214 L250 D251	T208-A210 PolarHBondContact O-N 3.27Å; A210-K212 VanDerWaalsContact C-N 3.33Å; A210-K212 PolarHBondContact O-N 3.33Å; A210-Q213 PolarHBondContact O-N 3.13Å; A210-L214 WeakPolarHBondContact O-CB 3.31Å; A210-L214 PolarHBondContact O-N 2.91Å; A210-L250 HydrophobicContact CB-CB 4.11Å; A210-L250 HydrophobicContact CB-CD2 3.77Å; A210-L250 HydrophobicContact CB-CG 3.82Å; A210-D251 HydrophobicContact CB-CB 3.81Å
211	H	53.6	Low	51.5	Low	59 Å²	59	82.9 Å²	82.9	27%	0.273	42%	0.419	S	S	.	.	H	α-helix	trans	-61.3	-41.4	174.9	-140.1	80	0	0	0	111.8	M207 T208 E209 L214 L215 D251	M207-H211 HydrophobicContact SD-CB 4.48Å; M207-H211 PolarHBondContact SD-CD2 2.85Å; T208-H211 WeakPolarHBondContact O-CA 3.22Å; T208-H211 VanDerWaalsContact O-CB 3.27Å; T208-H211 WeakPolarHBondContact O-CB 3.36Å; T208-H211 PolarHBondContact O-N 3.47Å; E209-H211 VanDerWaalsContact C-N 3.34Å; E209-H211 PolarHBondContact O-N 3.23Å; H211-L214 WeakPolarHBondContact O-CB 3.47Å; H211-L214 PolarHBondContact O-N 2.89Å; H211-L215 PolarHBondContact O-N 3.38Å; H211-D251 WeakPolarHBondContact CA-OD1 3.45Å; H211-D251 WeakPolarHBondContact CB-OD1 3.32Å; H211-D251 IonicContact CE1-OD2 3.86Å; H211-D251 IonicContact CG-OD1 3.85Å; H211-D251 IonicContact CG-OD2 2.79Å; H211-D251 PolarHBondContact N-OD1 2.92Å; H211-D251 VanDerWaalsContact ND1-CG 3.28Å; H211-D251 IonicContact ND1-OD1 2.83Å; H211-D251 PolarHBondContact ND1-OD1 3.29Å; H211-D251 IonicContact ND1-OD2 3.05Å; H211-D251 PolarHBondContact ND1-OD2 2.95Å
212	K	57.2	Low	52.8	Low	138 Å²	138	84.2 Å²	84.2	60%	0.6	42%	0.421	S	S	*	.	H	α-helix	trans	-64.2	-42	175.2	-64.2	-178.2	-179.1	177.6	0	111.5	T208 E209 A210 L214 L215 A216	T208-K212 PolarHBondContact O-N 3.39Å; E209-K212 WeakPolarHBondContact O-CB 3.4Å; E209-K212 PolarHBondContact O-N 3.43Å; A210-K212 VanDerWaalsContact C-N 3.33Å; A210-K212 PolarHBondContact O-N 3.33Å; K212-L214 VanDerWaalsContact C-N 3.34Å; K212-L215 PolarHBondContact O-N 3.24Å; K212-A216 PolarHBondContact O-N 2.87Å
213	Q	63.4	Low	54.1	Low	60 Å²	60	82.5 Å²	82.5	28%	0.28	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-37	176.3	-71.6	177.3	-8	0	0	112.2	E209 A210 A216 L217 L247	E209-Q213 WeakPolarHBondContact O-CG 3.34Å; E209-Q213 PolarHBondContact O-N 3.43Å; A210-Q213 PolarHBondContact O-N 3.13Å; Q213-A216 PolarHBondContact O-N 3.48Å; Q213-L217 WeakPolarHBondContact O-CB 3.42Å; Q213-L217 PolarHBondContact O-N 2.97Å; Q213-L247 HydrophobicContact CB-CD2 3.69Å
214	L	58.7	Low	55.5	Low	19 Å²	19	80.3 Å²	80.3	10%	0.099	39%	0.394	C	S	.	.	H	α-helix	trans	-60	-46.9	172.9	-121.2	163.4	0	0	0	111.6	A210 H211 K212 L217 Q218 I244 L247 T248	A210-L214 WeakPolarHBondContact O-CB 3.31Å; A210-L214 PolarHBondContact O-N 2.91Å; H211-L214 WeakPolarHBondContact O-CB 3.47Å; H211-L214 PolarHBondContact O-N 2.89Å; K212-L214 VanDerWaalsContact C-N 3.34Å; L214-L217 PolarHBondContact O-N 3.5Å; L214-Q218 WeakPolarHBondContact O-CB 3.45Å; L214-Q218 PolarHBondContact O-N 2.92Å; L214-I244 HydrophobicContact CD2-CG2 4.25Å; L214-L247 HydrophobicContact CD1-CB 4.06Å; L214-L247 HydrophobicContact CD2-CB 4.5Å; L214-L247 HydrophobicContact CG-CB 3.68Å; L214-L247 HydrophobicContact CG-CD1 4.38Å; L214-T248 HydrophobicContact CD1-CG2 3.56Å; L214-T248 HydrophobicContact CD2-CG2 4.33Å
215	L	56.5	Low	57	Low	87 Å²	87	82.5 Å²	82.5	46%	0.455	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-44.9	177.6	-132.3	77.3	0	0	0	111.4	H211 K212 Q218 Q219	H211-L215 PolarHBondContact O-N 3.38Å; K212-L215 PolarHBondContact O-N 3.24Å; L215-Q218 PolarHBondContact O-N 3.32Å; L215-Q219 WeakPolarHBondContact O-CG 3.48Å; L215-Q219 PolarHBondContact O-N 3.45Å
216	A	68.1	Low	58.2	Low	55 Å²	55	76.9 Å²	76.9	46%	0.455	40%	0.397	S	S	.	.	H	α-helix	trans	-64.7	-39	177.3	0	0	0	0	0	112.2	K212 Q213 Q219 R220	K212-A216 PolarHBondContact O-N 2.87Å; Q213-A216 PolarHBondContact O-N 3.48Å; A216-Q219 PolarHBondContact O-N 2.87Å; A216-R220 WeakPolarHBondContact O-CB 3.21Å; A216-R220 PolarHBondContact O-N 3.21Å
217	L	65.6	Low	59.1	Low	11 Å²	11	74.6 Å²	74.6	6%	0.058	39%	0.392	C	S	.	.	H	α-helix	trans	-66.8	-42.6	175.5	-173.7	76.9	0	0	0	111.1	Q213 L214 Q219 R220 I221 V236 L243 I244 L247	Q213-L217 WeakPolarHBondContact O-CB 3.42Å; Q213-L217 PolarHBondContact O-N 2.97Å; L214-L217 PolarHBondContact O-N 3.5Å; L217-Q219 VanDerWaalsContact C-N 3.32Å; L217-Q219 PolarHBondContact O-N 3.3Å; L217-R220 PolarHBondContact O-N 3.37Å; L217-I221 HydrophobicContact CD2-CD1 4.21Å; L217-I221 HydrophobicContact CG-CD1 3.92Å; L217-I221 HydrophobicContact CG-CG1 4.48Å; L217-I221 VanDerWaalsContact O-CG1 3.27Å; L217-I221 WeakPolarHBondContact O-CG1 3.38Å; L217-I221 PolarHBondContact O-N 3.33Å; L217-V236 HydrophobicContact CD1-CG1 4.49Å; L217-L243 HydrophobicContact CD1-CD1 4.41Å; L217-L243 HydrophobicContact CD2-CB 3.6Å; L217-I244 HydrophobicContact CD2-CG1 4.1Å; L217-L247 HydrophobicContact CB-CD1 4.04Å; L217-L247 HydrophobicContact CD2-CD1 3.59Å; L217-L247 HydrophobicContact CG-CD1 4.36Å
218	Q	65.5	Low	59.6	Low	113 Å²	113	79.1 Å²	79.1	53%	0.528	41%	0.409	S	S	.	.	H	α-helix	trans	-64.8	-37.9	178.2	-172.3	173.1	-11.9	0	0	111.7	L214 L215 S222	L214-Q218 WeakPolarHBondContact O-CB 3.45Å; L214-Q218 PolarHBondContact O-N 2.92Å; L215-Q218 PolarHBondContact O-N 3.32Å; Q218-S222 WeakPolarHBondContact O-CB 3.41Å; Q218-S222 PolarHBondContact O-N 2.9Å; Q218-S222 PolarHBondContact O-OG 3.29Å
219	Q	58.6	Low	59.6	Low	121 Å²	121	81.2 Å²	81.2	57%	0.565	42%	0.42	S	S	*	.	H	α-helix	trans	-63	-49.1	169.7	-76.9	178.9	-18.7	0	0	111.3	L215 A216 L217 I221 S222 D223	L215-Q219 WeakPolarHBondContact O-CG 3.48Å; L215-Q219 PolarHBondContact O-N 3.45Å; A216-Q219 PolarHBondContact O-N 2.87Å; L217-Q219 VanDerWaalsContact C-N 3.32Å; L217-Q219 PolarHBondContact O-N 3.3Å; Q219-I221 VanDerWaalsContact C-N 3.31Å; Q219-I221 PolarHBondContact O-N 2.89Å; Q219-S222 CarbonylContact O-C 3.53Å; Q219-S222 WeakPolarHBondContact O-CA 3.31Å; Q219-S222 WeakPolarHBondContact O-CB 3.3Å; Q219-S222 PolarHBondContact O-N 2.79Å; Q219-D223 PolarHBondContact O-N 2.87Å
220	R	64.2	Low	59.7	Low	90 Å²	90	78.5 Å²	78.5	34%	0.34	41%	0.413	S	S	.	.	H	α-helix	trans	-57.7	-43.1	177.2	-167.6	174.3	178.8	-166.1	-5.5	111.4	E174 A216 L217 S222 D223 L224	E174-R220 IonicContact OE1-CZ 2.72Å; E174-R220 IonicContact OE1-NH1 3.54Å; E174-R220 PolarHBondContact OE1-NH1 3.44Å; E174-R220 IonicContact OE1-NH2 2.68Å; E174-R220 PolarHBondContact OE1-NH2 2.91Å; E174-R220 IonicContact OE2-CZ 3.21Å; E174-R220 IonicContact OE2-NH1 2.86Å; E174-R220 IonicContact OE2-NH2 3.08Å; E174-R220 PolarHBondContact OE2-NH2 2.81Å; A216-R220 WeakPolarHBondContact O-CB 3.21Å; A216-R220 PolarHBondContact O-N 3.21Å; L217-R220 PolarHBondContact O-N 3.37Å; R220-S222 VanDerWaalsContact C-N 3.33Å; R220-S222 PolarHBondContact O-N 3.28Å; R220-D223 PolarHBondContact O-N 2.84Å; R220-L224 HydrophobicContact CG-CD1 4.04Å; R220-L224 HydrophobicContact CG-CG 4.47Å; R220-L224 WeakPolarHBondContact O-CB 3.43Å; R220-L224 WeakPolarHBondContact O-CD1 3.44Å; R220-L224 WeakPolarHBondContact O-CG 3.39Å; R220-L224 PolarHBondContact O-N 3.3Å; R220-L224 VanDerWaalsContact O-N 3.09Å
221	I	64.5	Low	59.8	Low	21 Å²	21	82.3 Å²	82.3	11%	0.108	44%	0.444	C	S	.	.	H	α-helix	trans	-62.5	-40.7	176.2	-68.8	161.4	0	0	0	111.2	L217 Q219 L224 D225 L237 K240 I244	L217-I221 HydrophobicContact CD2-CD1 4.21Å; L217-I221 HydrophobicContact CG-CD1 3.92Å; L217-I221 HydrophobicContact CG-CG1 4.48Å; L217-I221 VanDerWaalsContact O-CG1 3.27Å; L217-I221 WeakPolarHBondContact O-CG1 3.38Å; L217-I221 PolarHBondContact O-N 3.33Å; Q219-I221 VanDerWaalsContact C-N 3.31Å; Q219-I221 PolarHBondContact O-N 2.89Å; I221-L224 PolarHBondContact O-N 3.47Å; I221-D225 PolarHBondContact O-N 3.42Å; I221-L237 HydrophobicContact CG2-CD2 4.22Å; I221-K240 HydrophobicContact CD1-CB 3.85Å; I221-K240 HydrophobicContact CG1-CB 4.33Å; I221-K240 HydrophobicContact CG2-CD 4.39Å; I221-I244 HydrophobicContact CD1-CD1 3.89Å; I221-I244 HydrophobicContact CD1-CG1 4.18Å
222	S	59.1	Low	59.9	Low	78 Å²	78	83.5 Å²	83.5	55%	0.545	45%	0.452	S	S	.	.	H	α-helix	trans	-68.3	-39.4	178.2	-55.1	0	0	0	0	112.1	Q218 Q219 R220 L224 D225	Q218-S222 WeakPolarHBondContact O-CB 3.41Å; Q218-S222 PolarHBondContact O-N 2.9Å; Q218-S222 PolarHBondContact O-OG 3.29Å; Q219-S222 CarbonylContact O-C 3.53Å; Q219-S222 WeakPolarHBondContact O-CA 3.31Å; Q219-S222 WeakPolarHBondContact O-CB 3.3Å; Q219-S222 PolarHBondContact O-N 2.79Å; R220-S222 VanDerWaalsContact C-N 3.33Å; R220-S222 PolarHBondContact O-N 3.28Å; S222-L224 VanDerWaalsContact C-N 3.27Å; S222-L224 PolarHBondContact O-N 3.08Å; S222-D225 PolarHBondContact O-N 2.91Å
223	D	61.8	Low	60	Low	102 Å²	102	79.2 Å²	79.2	55%	0.545	43%	0.434	S	S	.	.	H	α-helix	trans	-71.6	-21.9	179	-71.8	-26.1	0	0	0	113.6	Q219 R220 K227	Q219-D223 PolarHBondContact O-N 2.87Å; R220-D223 PolarHBondContact O-N 2.84Å; D223-K227 WeakPolarHBondContact O-CD 3.37Å; D223-K227 WeakPolarHBondContact O-CE 3.44Å; D223-K227 PolarHBondContact O-NZ 3.29Å
224	L	61	Low	59.9	Low	8 Å²	8	82.4 Å²	82.4	4%	0.042	45%	0.447	C	S	.	.	H	α-helix	trans	-85.4	-23.1	177.7	-72.4	175.7	0	0	0	112.5	R220 I221 S222 G226 K227 L229 E233 V236 L237	R220-L224 HydrophobicContact CG-CD1 4.04Å; R220-L224 HydrophobicContact CG-CG 4.47Å; R220-L224 WeakPolarHBondContact O-CB 3.43Å; R220-L224 WeakPolarHBondContact O-CD1 3.44Å; R220-L224 WeakPolarHBondContact O-CG 3.39Å; R220-L224 PolarHBondContact O-N 3.3Å; R220-L224 VanDerWaalsContact O-N 3.09Å; I221-L224 PolarHBondContact O-N 3.47Å; S222-L224 VanDerWaalsContact C-N 3.27Å; S222-L224 PolarHBondContact O-N 3.08Å; L224-G226 PolarHBondContact O-N 3.34Å; L224-G226 VanDerWaalsContact O-N 3.17Å; L224-K227 PolarHBondContact O-N 2.72Å; L224-L229 HydrophobicContact CB-CD2 3.9Å; L224-L229 HydrophobicContact CD2-CD2 3.8Å; L224-L229 HydrophobicContact CG-CD2 4.31Å; L224-E233 HydrophobicContact CD1-CB 4.12Å; L224-E233 HydrophobicContact CD1-CG 4.23Å; L224-E233 HydrophobicContact CD2-CB 3.75Å; L224-E233 HydrophobicContact CD2-CG 3.44Å; L224-E233 VanDerWaalsContact CD2-CG 3.44Å; L224-E233 WeakPolarHBondContact CD2-OE1 3.45Å; L224-E233 HydrophobicContact CG-CG 4.48Å; L224-V236 HydrophobicContact CD1-CG1 4.47Å; L224-L237 HydrophobicContact CB-CD1 4.19Å; L224-L237 HydrophobicContact CB-CG 4.46Å
225	D	61.1	Low	60.1	Low	135 Å²	135	82.1 Å²	82.1	72%	0.722	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	113.3	178.7	-152.7	14.3	0	0	0	109.8	I221 S222	I221-D225 PolarHBondContact O-N 3.42Å; S222-D225 PolarHBondContact O-N 2.91Å
226	G	58.3	Low	60.3	Low	79 Å²	79	78 Å²	78	81%	0.814	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	100	-1.2	179.4	0	0	0	0	0	117.6	L224	L224-G226 PolarHBondContact O-N 3.34Å; L224-G226 VanDerWaalsContact O-N 3.17Å
227	K	57.5	Low	60	Low	134 Å²	134	77 Å²	77	58%	0.583	41%	0.412	S	S	*	.	S	Bend	trans	-97.5	162.1	177.2	-69.6	177.8	-174.4	148.1	0	113.2	D223 L224 L229	D223-K227 WeakPolarHBondContact O-CD 3.37Å; D223-K227 WeakPolarHBondContact O-CE 3.44Å; D223-K227 PolarHBondContact O-NZ 3.29Å; L224-K227 PolarHBondContact O-N 2.72Å; K227-L229 WeakPolarHBondContact O-CG 3.27Å; K227-L229 PolarHBondContact O-N 2.86Å
228	K	49.5	Very low	60.3	Low	217 Å²	217	80.6 Å²	80.6	94%	0.943	44%	0.443	S	S	*	.			trans	-71.7	96.8	167.9	-80.2	-170.5	179.6	179.9	0	109
229	L	52.2	Low	60.4	Low	45 Å²	45	78.6 Å²	78.6	24%	0.236	43%	0.431	C	S	.	.			trans	-74.2	132.7	-171.5	-64.9	149.4	0	0	0	112.7	L224 K227 E233 K234 L237	L224-L229 HydrophobicContact CB-CD2 3.9Å; L224-L229 HydrophobicContact CD2-CD2 3.8Å; L224-L229 HydrophobicContact CG-CD2 4.31Å; K227-L229 WeakPolarHBondContact O-CG 3.27Å; K227-L229 PolarHBondContact O-N 2.86Å; L229-E233 WeakPolarHBondContact CA-OE2 3.43Å; L229-E233 HydrophobicContact CB-CB 4.14Å; L229-E233 HydrophobicContact CD2-CB 3.44Å; L229-E233 VanDerWaalsContact CD2-CB 3.44Å; L229-E233 HydrophobicContact CD2-CG 4.41Å; L229-E233 HydrophobicContact CG-CB 4.43Å; L229-K234 HydrophobicContact CB-CD 4.49Å; L229-K234 HydrophobicContact CB-CG 3.58Å; L229-K234 HydrophobicContact CD1-CG 4.2Å; L229-K234 HydrophobicContact CG-CG 4.49Å; L229-L237 HydrophobicContact CD1-CD1 3.35Å; L229-L237 HydrophobicContact CD2-CD1 3.55Å; L229-L237 HydrophobicContact CG-CD1 4.08Å
230	T	59.6	Low	61.1	Low	77 Å²	77	76.7 Å²	76.7	47%	0.472	42%	0.421	S	S	.	.			trans	-62.5	160	161.9	52.8	0	0	0	0	110.8	D232 E233 K234	T230-D232 PolarHBondContact O-N 3.45Å; T230-E233 PolarHBondContact N-OE2 2.95Å; T230-E233 PolarHBondContact O-N 2.93Å; T230-E233 WeakPolarHBondContact OG1-CG 3.43Å; T230-E233 PolarHBondContact OG1-OE2 2.64Å; T230-K234 PolarHBondContact O-N 2.96Å
231	A	58.8	Low	61.6	Low	80 Å²	80	77.2 Å²	77.2	66%	0.661	43%	0.43	S	S	*	.	H	α-helix	trans	-56.5	-35.2	-179.7	0	0	0	0	0	112.1	S235	A231-S235 PolarHBondContact O-N 3.33Å; A231-S235 VanDerWaalsContact O-N 3.15Å
232	D	55.8	Low	62.1	Low	83 Å²	83	80.9 Å²	80.9	44%	0.444	45%	0.447	S	S	.	.	H	α-helix	trans	-67.5	-46.6	177.7	-62.1	-30.5	0	0	0	111.5	E174 T230 K234 S235 V236	E174-D232 HydrophobicContact CB-CB 4.34Å; T230-D232 PolarHBondContact O-N 3.45Å; D232-K234 VanDerWaalsContact C-N 3.32Å; D232-K234 PolarHBondContact O-N 2.94Å; D232-S235 WeakPolarHBondContact O-CA 3.29Å; D232-S235 WeakPolarHBondContact O-CB 3.31Å; D232-S235 PolarHBondContact O-N 3.32Å; D232-S235 PolarHBondContact O-OG 3.36Å; D232-V236 PolarHBondContact O-N 3.31Å
233	E	59.4	Low	62.8	Low	48 Å²	48	77.2 Å²	77.2	22%	0.224	42%	0.421	C	S	.	.	H	α-helix	trans	-65.7	-34	178.2	-65.3	166.8	145.3	0	0	112.6	L224 L229 T230 S235 V236 L237	L224-E233 HydrophobicContact CD1-CB 4.12Å; L224-E233 HydrophobicContact CD1-CG 4.23Å; L224-E233 HydrophobicContact CD2-CB 3.75Å; L224-E233 HydrophobicContact CD2-CG 3.44Å; L224-E233 VanDerWaalsContact CD2-CG 3.44Å; L224-E233 WeakPolarHBondContact CD2-OE1 3.45Å; L224-E233 HydrophobicContact CG-CG 4.48Å; L229-E233 WeakPolarHBondContact CA-OE2 3.43Å; L229-E233 HydrophobicContact CB-CB 4.14Å; L229-E233 HydrophobicContact CD2-CB 3.44Å; L229-E233 VanDerWaalsContact CD2-CB 3.44Å; L229-E233 HydrophobicContact CD2-CG 4.41Å; L229-E233 HydrophobicContact CG-CB 4.43Å; T230-E233 PolarHBondContact N-OE2 2.95Å; T230-E233 PolarHBondContact O-N 2.93Å; T230-E233 WeakPolarHBondContact OG1-CG 3.43Å; T230-E233 PolarHBondContact OG1-OE2 2.64Å; E233-S235 VanDerWaalsContact C-N 3.29Å; E233-S235 PolarHBondContact O-N 2.67Å; E233-V236 PolarHBondContact O-N 3.2Å; E233-L237 PolarHBondContact O-N 3.19Å
234	K	62.7	Low	63.5	Low	127 Å²	127	75 Å²	75	55%	0.552	41%	0.409	S	S	*	.	H	α-helix	trans	-62.4	-37.1	170.3	-71	-173.7	-177.6	179.6	0	111.7	L229 T230 D232 L237 A238	L229-K234 HydrophobicContact CB-CD 4.49Å; L229-K234 HydrophobicContact CB-CG 3.58Å; L229-K234 HydrophobicContact CD1-CG 4.2Å; L229-K234 HydrophobicContact CG-CG 4.49Å; T230-K234 PolarHBondContact O-N 2.96Å; D232-K234 VanDerWaalsContact C-N 3.32Å; D232-K234 PolarHBondContact O-N 2.94Å; K234-L237 PolarHBondContact O-N 3.26Å; K234-A238 VanDerWaalsContact O-CB 3.25Å; K234-A238 WeakPolarHBondContact O-CB 3.48Å; K234-A238 PolarHBondContact O-N 3.47Å
235	S	61.9	Low	64.2	Low	13 Å²	13	80.9 Å²	80.9	9%	0.091	44%	0.436	C	S	.	.	H	α-helix	trans	-67.5	-40.4	177.1	83.5	0	0	0	0	112	A231 D232 E233 A238 R239	A231-S235 PolarHBondContact O-N 3.33Å; A231-S235 VanDerWaalsContact O-N 3.15Å; D232-S235 WeakPolarHBondContact O-CA 3.29Å; D232-S235 WeakPolarHBondContact O-CB 3.31Å; D232-S235 PolarHBondContact O-N 3.32Å; D232-S235 PolarHBondContact O-OG 3.36Å; E233-S235 VanDerWaalsContact C-N 3.29Å; E233-S235 PolarHBondContact O-N 2.67Å; S235-A238 PolarHBondContact O-N 3.34Å; S235-R239 PolarHBondContact O-N 3.29Å
236	V	60.3	Low	64.8	Low	0 Å²	0	75.2 Å²	75.2	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-64	-42.9	175.5	176	0	0	0	0	110.3	L217 L224 D232 E233 R239 K240 L243	L217-V236 HydrophobicContact CD1-CG1 4.49Å; L224-V236 HydrophobicContact CD1-CG1 4.47Å; D232-V236 PolarHBondContact O-N 3.31Å; E233-V236 PolarHBondContact O-N 3.2Å; V236-R239 CarbonylContact O-C 3.55Å; V236-K240 VanDerWaalsContact O-CA 3.22Å; V236-K240 WeakPolarHBondContact O-CA 3.39Å; V236-K240 WeakPolarHBondContact O-CB 3.36Å; V236-K240 PolarHBondContact O-N 3.06Å; V236-L243 HydrophobicContact CG1-CD1 4.16Å
237	L	62.7	Low	65.6	Low	36 Å²	36	71.4 Å²	71.4	19%	0.188	37%	0.369	C	S	.	.	H	α-helix	trans	-66.1	-40.6	174.6	-85.2	166	0	0	0	112.8	I221 L224 L229 E233 K234 K240	I221-L237 HydrophobicContact CG2-CD2 4.22Å; L224-L237 HydrophobicContact CB-CD1 4.19Å; L224-L237 HydrophobicContact CB-CG 4.46Å; L229-L237 HydrophobicContact CD1-CD1 3.35Å; L229-L237 HydrophobicContact CD2-CD1 3.55Å; L229-L237 HydrophobicContact CG-CD1 4.08Å; E233-L237 PolarHBondContact O-N 3.19Å; K234-L237 PolarHBondContact O-N 3.26Å; L237-K240 WeakPolarHBondContact O-CB 3.44Å; L237-K240 WeakPolarHBondContact O-CD 3.24Å; L237-K240 VanDerWaalsContact O-CG 3.29Å; L237-K240 WeakPolarHBondContact O-CG 3.31Å; L237-K240 PolarHBondContact O-N 2.92Å
238	A	71.8	Confident	66.4	Low	85 Å²	85	67.8 Å²	67.8	70%	0.702	36%	0.358	S	S	*	.	H	α-helix	trans	-65.2	-39.5	178.6	0	0	0	0	0	112	K234 S235	K234-A238 VanDerWaalsContact O-CB 3.25Å; K234-A238 WeakPolarHBondContact O-CB 3.48Å; K234-A238 PolarHBondContact O-N 3.47Å; S235-A238 PolarHBondContact O-N 3.34Å
239	R	67	Low	67.7	Low	71 Å²	71	61.7 Å²	61.7	27%	0.268	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	16	179.3	-59.3	-162.4	-170.7	-171.2	10.8	113.9	A175 T176 S235 V236 N241 E242 L243	A175-R239 HydrophobicContact CB-CB 4.01Å; A175-R239 HydrophobicContact CB-CG 4.23Å; T176-R239 PolarHBondContact OG1-NH1 3.25Å; T176-R239 PolarHBondContact OG1-NH2 2.95Å; S235-R239 PolarHBondContact O-N 3.29Å; V236-R239 CarbonylContact O-C 3.55Å; R239-N241 PolarHBondContact O-N 2.89Å; R239-N241 VanDerWaalsContact O-N 3.15Å; R239-E242 WeakPolarHBondContact CD-OE2 3.49Å; R239-E242 WeakPolarHBondContact O-CB 3.47Å; R239-E242 PolarHBondContact O-N 3.49Å; R239-L243 PolarHBondContact O-N 3.39Å
240	K	73.7	Confident	68.7	Low	81 Å²	81	59.5 Å²	59.5	35%	0.352	32%	0.324	S	S	.	.	H	α-helix	trans	-52.3	-42.5	-175.8	71.3	-176.3	-176.7	176.9	0	112.5	I221 V236 L237 E242 L243 I244	I221-K240 HydrophobicContact CD1-CB 3.85Å; I221-K240 HydrophobicContact CG1-CB 4.33Å; I221-K240 HydrophobicContact CG2-CD 4.39Å; V236-K240 VanDerWaalsContact O-CA 3.22Å; V236-K240 WeakPolarHBondContact O-CA 3.39Å; V236-K240 WeakPolarHBondContact O-CB 3.36Å; V236-K240 PolarHBondContact O-N 3.06Å; L237-K240 WeakPolarHBondContact O-CB 3.44Å; L237-K240 WeakPolarHBondContact O-CD 3.24Å; L237-K240 VanDerWaalsContact O-CG 3.29Å; L237-K240 WeakPolarHBondContact O-CG 3.31Å; L237-K240 PolarHBondContact O-N 2.92Å; K240-E242 PolarHBondContact O-N 2.74Å; K240-L243 PolarHBondContact O-N 3.27Å; K240-I244 WeakPolarHBondContact O-CB 3.39Å; K240-I244 WeakPolarHBondContact O-CD1 3.3Å; K240-I244 WeakPolarHBondContact O-CG1 3.33Å; K240-I244 PolarHBondContact O-N 3.22Å
241	N	74.2	Confident	69.2	Low	102 Å²	102	56.3 Å²	56.3	55%	0.545	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-38.3	-177.7	-66.5	-15.6	0	0	0	111.1	R239 Q245	R239-N241 PolarHBondContact O-N 2.89Å; R239-N241 VanDerWaalsContact O-N 3.15Å; N241-Q245 WeakPolarHBondContact O-CB 3.32Å; N241-Q245 VanDerWaalsContact O-CG 3.29Å; N241-Q245 WeakPolarHBondContact O-CG 3.48Å; N241-Q245 PolarHBondContact O-N 3.43Å
242	E	76.1	Confident	69.9	Low	98 Å²	98	57 Å²	57	46%	0.458	30%	0.3	S	S	.	.	H	α-helix	trans	-69	-42.2	177.6	-62.1	178.7	178.1	0	0	111.3	L179 R239 K240 Q245 A246	L179-E242 HydrophobicContact CD1-CB 4.37Å; L179-E242 WeakPolarHBondContact CD1-OE2 3.48Å; L179-E242 HydrophobicContact CD2-CB 4.22Å; R239-E242 WeakPolarHBondContact CD-OE2 3.49Å; R239-E242 WeakPolarHBondContact O-CB 3.47Å; R239-E242 PolarHBondContact O-N 3.49Å; K240-E242 PolarHBondContact O-N 2.74Å; E242-Q245 PolarHBondContact O-N 3.41Å; E242-A246 WeakPolarHBondContact O-CB 3.29Å; E242-A246 PolarHBondContact O-N 2.9Å
243	L	73.8	Confident	70.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-43.3	177.1	-70.6	167.2	0	0	0	111.8	A175 L178 L179 Y182 L217 V236 R239 K240 A246 L247	A175-L243 HydrophobicContact CB-CD1 4.31Å; L178-L243 HydrophobicContact CB-CD2 3.65Å; L179-L243 HydrophobicContact CD2-CD2 4.26Å; L179-L243 HydrophobicContact CG-CD2 3.92Å; Y182-L243 HydrophobicContact CD2-CD2 4.1Å; Y182-L243 HydrophobicContact CE2-CD2 3.81Å; L217-L243 HydrophobicContact CD1-CD1 4.41Å; L217-L243 HydrophobicContact CD2-CB 3.6Å; V236-L243 HydrophobicContact CG1-CD1 4.16Å; R239-L243 PolarHBondContact O-N 3.39Å; K240-L243 PolarHBondContact O-N 3.27Å; L243-A246 PolarHBondContact O-N 3.43Å; L243-L247 WeakPolarHBondContact O-CB 3.41Å; L243-L247 PolarHBondContact O-N 2.8Å
244	I	76	Confident	71.2	Confident	56 Å²	56	53.3 Å²	53.3	29%	0.287	28%	0.28	S	S	.	.	H	α-helix	trans	-60.3	-46.6	174.3	-71	166.7	0	0	0	109.8	L214 L217 I221 K240 L247 T248	L214-I244 HydrophobicContact CD2-CG2 4.25Å; L217-I244 HydrophobicContact CD2-CG1 4.1Å; I221-I244 HydrophobicContact CD1-CD1 3.89Å; I221-I244 HydrophobicContact CD1-CG1 4.18Å; K240-I244 WeakPolarHBondContact O-CB 3.39Å; K240-I244 WeakPolarHBondContact O-CD1 3.3Å; K240-I244 WeakPolarHBondContact O-CG1 3.33Å; K240-I244 PolarHBondContact O-N 3.22Å; I244-L247 PolarHBondContact O-N 3.39Å; I244-T248 HydrophobicContact CG2-CG2 4.35Å; I244-T248 WeakPolarHBondContact O-CG2 3.43Å; I244-T248 PolarHBondContact O-N 2.83Å; I244-T248 PolarHBondContact O-OG1 3.34Å; I244-T248 VanDerWaalsContact O-OG1 3.11Å
245	Q	75.6	Confident	71.5	Confident	131 Å²	131	50.4 Å²	50.4	61%	0.612	27%	0.268	S	S	*	.	H	α-helix	trans	-64	-41.1	178	-78.3	-179.6	13.8	0	0	113.1	N241 E242 T248 L249	N241-Q245 WeakPolarHBondContact O-CB 3.32Å; N241-Q245 VanDerWaalsContact O-CG 3.29Å; N241-Q245 WeakPolarHBondContact O-CG 3.48Å; N241-Q245 PolarHBondContact O-N 3.43Å; E242-Q245 PolarHBondContact O-N 3.41Å; Q245-T248 WeakPolarHBondContact CA-OG1 3.27Å; Q245-T248 PolarHBondContact O-OG1 3.06Å; Q245-L249 WeakPolarHBondContact O-CB 3.14Å; Q245-L249 PolarHBondContact O-N 3.31Å; Q245-L249 VanDerWaalsContact O-N 3.1Å
246	A	74.9	Confident	71.8	Confident	16 Å²	16	52.2 Å²	52.2	13%	0.132	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-43.4	178	0	0	0	0	0	111.6	L179 Y182 E242 L243 L249 L250	L179-A246 HydrophobicContact CD2-CB 3.98Å; Y182-A246 HydrophobicContact CD2-CB 4.32Å; E242-A246 WeakPolarHBondContact O-CB 3.29Å; E242-A246 PolarHBondContact O-N 2.9Å; L243-A246 PolarHBondContact O-N 3.43Å; A246-L249 PolarHBondContact O-N 2.9Å; A246-L250 WeakPolarHBondContact O-CB 3.36Å; A246-L250 PolarHBondContact O-N 3.46Å
247	L	73.3	Confident	72.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-70.8	-39.2	178	-79.1	163.9	0	0	0	113.1	Y182 Q213 L214 L217 L243 I244 L249 L250 D251	Y182-L247 HydrophobicContact CD1-CD2 3.94Å; Y182-L247 HydrophobicContact CD1-CG 4.44Å; Y182-L247 HydrophobicContact CD2-CG 4.15Å; Y182-L247 HydrophobicContact CE1-CD2 3.5Å; Y182-L247 HydrophobicContact CE1-CG 4.09Å; Y182-L247 HydrophobicContact CE2-CD1 3.93Å; Y182-L247 HydrophobicContact CE2-CD2 4.12Å; Y182-L247 HydrophobicContact CE2-CG 3.75Å; Y182-L247 HydrophobicContact CG-CD2 4.45Å; Y182-L247 HydrophobicContact CG-CG 4.5Å; Q213-L247 HydrophobicContact CB-CD2 3.69Å; L214-L247 HydrophobicContact CD1-CB 4.06Å; L214-L247 HydrophobicContact CD2-CB 4.5Å; L214-L247 HydrophobicContact CG-CB 3.68Å; L214-L247 HydrophobicContact CG-CD1 4.38Å; L217-L247 HydrophobicContact CB-CD1 4.04Å; L217-L247 HydrophobicContact CD2-CD1 3.59Å; L217-L247 HydrophobicContact CG-CD1 4.36Å; L243-L247 WeakPolarHBondContact O-CB 3.41Å; L243-L247 PolarHBondContact O-N 2.8Å; I244-L247 PolarHBondContact O-N 3.39Å; L247-L249 PolarHBondContact O-N 2.85Å; L247-L250 HydrophobicContact CD2-CD2 4.4Å; L247-L250 WeakPolarHBondContact O-CB 3.31Å; L247-L250 PolarHBondContact O-N 2.98Å; L247-D251 WeakPolarHBondContact O-CB 3.43Å; L247-D251 PolarHBondContact O-N 3.04Å
248	T	75.7	Confident	72.5	Confident	58 Å²	58	54.5 Å²	54.5	36%	0.356	29%	0.285	S	S	.	.	H	α-helix	trans	-61.2	-39	174.9	50.7	0	0	0	0	110.6	L214 I244 Q245 D251 V252	L214-T248 HydrophobicContact CD1-CG2 3.56Å; L214-T248 HydrophobicContact CD2-CG2 4.33Å; I244-T248 HydrophobicContact CG2-CG2 4.35Å; I244-T248 WeakPolarHBondContact O-CG2 3.43Å; I244-T248 PolarHBondContact O-N 2.83Å; I244-T248 PolarHBondContact O-OG1 3.34Å; I244-T248 VanDerWaalsContact O-OG1 3.11Å; Q245-T248 WeakPolarHBondContact CA-OG1 3.27Å; Q245-T248 PolarHBondContact O-OG1 3.06Å; T248-D251 WeakPolarHBondContact O-CB 3.39Å; T248-D251 PolarHBondContact O-N 2.91Å; T248-V252 WeakPolarHBondContact O-CG2 3.35Å; T248-V252 PolarHBondContact O-N 3.27Å
249	L	76.3	Confident	72.4	Confident	88 Å²	88	54.2 Å²	54.2	46%	0.461	27%	0.268	S	S	.	.	H	α-helix	trans	-72.2	-34.6	178.5	-138.6	137.8	0	0	0	112.4	Q245 A246 L247 D251 K253	Q245-L249 WeakPolarHBondContact O-CB 3.14Å; Q245-L249 PolarHBondContact O-N 3.31Å; Q245-L249 VanDerWaalsContact O-N 3.1Å; A246-L249 PolarHBondContact O-N 2.9Å; L247-L249 PolarHBondContact O-N 2.85Å; L249-D251 VanDerWaalsContact C-N 3.34Å; L249-K253 HydrophobicContact CD2-CD 4.23Å; L249-K253 WeakPolarHBondContact O-CB 3.36Å; L249-K253 WeakPolarHBondContact O-CG 3.48Å; L249-K253 PolarHBondContact O-N 3.43Å; L249-K253 VanDerWaalsContact O-N 3.13Å
250	L	73.7	Confident	72.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-41.3	170	-174	71.7	0	0	0	111.2	Q185 Q186 V189 A210 A246 L247 K253 Q254	Q185-L250 HydrophobicContact CB-CD1 3.92Å; Q185-L250 HydrophobicContact CB-CD2 4.39Å; Q186-L250 HydrophobicContact CB-CD1 4.04Å; V189-L250 HydrophobicContact CG2-CD1 4.23Å; A210-L250 HydrophobicContact CB-CB 4.11Å; A210-L250 HydrophobicContact CB-CD2 3.77Å; A210-L250 HydrophobicContact CB-CG 3.82Å; A246-L250 WeakPolarHBondContact O-CB 3.36Å; A246-L250 PolarHBondContact O-N 3.46Å; L247-L250 HydrophobicContact CD2-CD2 4.4Å; L247-L250 WeakPolarHBondContact O-CB 3.31Å; L247-L250 PolarHBondContact O-N 2.98Å; L250-K253 PolarHBondContact O-N 2.95Å; L250-Q254 WeakPolarHBondContact O-CG 2.99Å; L250-Q254 PolarHBondContact O-N 3.45Å
251	D	68.5	Low	71.7	Confident	9 Å²	9	50.6 Å²	50.6	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-50.5	179.6	-168.8	61.5	0	0	0	112.4	T208 A210 H211 L247 T248 L249 K253 Q254 Q255	T208-D251 WeakPolarHBondContact CB-OD1 3.36Å; T208-D251 PolarHBondContact OG1-OD1 3.45Å; A210-D251 HydrophobicContact CB-CB 3.81Å; H211-D251 WeakPolarHBondContact CA-OD1 3.45Å; H211-D251 WeakPolarHBondContact CB-OD1 3.32Å; H211-D251 IonicContact CE1-OD2 3.86Å; H211-D251 IonicContact CG-OD1 3.85Å; H211-D251 IonicContact CG-OD2 2.79Å; H211-D251 PolarHBondContact N-OD1 2.92Å; H211-D251 VanDerWaalsContact ND1-CG 3.28Å; H211-D251 IonicContact ND1-OD1 2.83Å; H211-D251 PolarHBondContact ND1-OD1 3.29Å; H211-D251 IonicContact ND1-OD2 3.05Å; H211-D251 PolarHBondContact ND1-OD2 2.95Å; L247-D251 WeakPolarHBondContact O-CB 3.43Å; L247-D251 PolarHBondContact O-N 3.04Å; T248-D251 WeakPolarHBondContact O-CB 3.39Å; T248-D251 PolarHBondContact O-N 2.91Å; L249-D251 VanDerWaalsContact C-N 3.34Å; D251-K253 PolarHBondContact O-N 3Å; D251-Q254 PolarHBondContact O-N 3.41Å; D251-Q254 VanDerWaalsContact O-N 3.17Å; D251-Q255 WeakPolarHBondContact O-CG 3.49Å; D251-Q255 PolarHBondContact O-N 3.42Å; D251-Q255 PolarHBondContact OD2-NE2 3.09Å; D251-Q255 VanDerWaalsContact OD2-NE2 3.16Å
252	V	75.4	Confident	71.5	Confident	95 Å²	95	47.2 Å²	47.2	58%	0.576	25%	0.246	S	C	*	.	H	α-helix	trans	-57.1	-41	174.3	172.2	0	0	0	0	111.1	T248 Q255 E256	T248-V252 WeakPolarHBondContact O-CG2 3.35Å; T248-V252 PolarHBondContact O-N 3.27Å; V252-Q255 PolarHBondContact O-N 2.94Å; V252-E256 WeakPolarHBondContact O-CB 3.41Å; V252-E256 PolarHBondContact O-N 3.31Å
253	K	72.5	Confident	71.3	Confident	26 Å²	26	42.9 Å²	42.9	11%	0.113	23%	0.226	C	C	.	.	H	α-helix	trans	-65.8	-45.9	176.3	-82.1	177.7	175.5	-179.1	0	112	Q186 V189 E190 I193 L249 L250 D251 Q255 E256 L257	Q186-K253 HydrophobicContact CG-CD 3.53Å; Q186-K253 VanDerWaalsContact CG-NZ 3.27Å; V189-K253 HydrophobicContact CG1-CB 3.8Å; E190-K253 HydrophobicContact CG-CD 4.05Å; E190-K253 WeakPolarHBondContact OE1-CE 3.41Å; E190-K253 IonicContact OE1-NZ 3.38Å; E190-K253 PolarHBondContact OE1-NZ 3.42Å; E190-K253 IonicContact OE2-NZ 2.81Å; E190-K253 PolarHBondContact OE2-NZ 3.12Å; I193-K253 HydrophobicContact CD1-CB 3.68Å; I193-K253 HydrophobicContact CD1-CG 3.86Å; I193-K253 WeakPolarHBondContact CD1-O 3.43Å; L249-K253 HydrophobicContact CD2-CD 4.23Å; L249-K253 WeakPolarHBondContact O-CB 3.36Å; L249-K253 WeakPolarHBondContact O-CG 3.48Å; L249-K253 PolarHBondContact O-N 3.43Å; L249-K253 VanDerWaalsContact O-N 3.13Å; L250-K253 PolarHBondContact O-N 2.95Å; D251-K253 PolarHBondContact O-N 3Å; K253-Q255 VanDerWaalsContact C-N 3.31Å; K253-Q255 PolarHBondContact O-N 2.87Å; K253-E256 WeakPolarHBondContact O-CB 3.31Å; K253-E256 PolarHBondContact O-N 3.49Å; K253-L257 PolarHBondContact O-N 3.38Å
254	Q	68.9	Low	70.7	Confident	28 Å²	28	45 Å²	45	13%	0.131	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-37.5	177.7	-73.4	-172.4	-14.2	0	0	111.8	V189 T208 E209 L250 D251 L257 Q258	V189-Q254 HydrophobicContact CG1-CG 4.2Å; V189-Q254 HydrophobicContact CG2-CG 4.01Å; T208-Q254 VanDerWaalsContact CB-OE1 3.27Å; T208-Q254 HydrophobicContact CG2-CB 3.32Å; T208-Q254 HydrophobicContact CG2-CG 4.46Å; E209-Q254 VanDerWaalsContact N-OE1 3.17Å; L250-Q254 WeakPolarHBondContact O-CG 2.99Å; L250-Q254 PolarHBondContact O-N 3.45Å; D251-Q254 PolarHBondContact O-N 3.41Å; D251-Q254 VanDerWaalsContact O-N 3.17Å; Q254-L257 WeakPolarHBondContact O-CB 3.39Å; Q254-L257 PolarHBondContact O-N 2.96Å; Q254-Q258 WeakPolarHBondContact O-CG 3.49Å; Q254-Q258 PolarHBondContact O-N 3.47Å
255	Q	69.3	Low	70.5	Confident	65 Å²	65	47 Å²	47	30%	0.304	25%	0.249	S	C	.	.	H	α-helix	trans	-64.4	-42.6	174.5	-71.6	-177	14.3	0	0	111.8	T208 D251 V252 K253 L257 Q258 K259	T208-Q255 HydrophobicContact CG2-CG 4.19Å; D251-Q255 WeakPolarHBondContact O-CG 3.49Å; D251-Q255 PolarHBondContact O-N 3.42Å; D251-Q255 PolarHBondContact OD2-NE2 3.09Å; D251-Q255 VanDerWaalsContact OD2-NE2 3.16Å; V252-Q255 PolarHBondContact O-N 2.94Å; K253-Q255 VanDerWaalsContact C-N 3.31Å; K253-Q255 PolarHBondContact O-N 2.87Å; Q255-L257 VanDerWaalsContact C-N 3.33Å; Q255-Q258 PolarHBondContact O-N 3.39Å; Q255-K259 VanDerWaalsContact O-CG 3.32Å; Q255-K259 WeakPolarHBondContact O-CG 3.44Å; Q255-K259 PolarHBondContact O-N 2.94Å
256	E	68.3	Low	70.1	Confident	52 Å²	52	45.5 Å²	45.5	24%	0.243	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-45.1	173.9	-179.3	63.1	-162.4	0	0	110.7	I193 R197 V252 K253 Q258 K259 Q260	I193-E256 HydrophobicContact CD1-CB 4.26Å; I193-E256 HydrophobicContact CD1-CG 4.38Å; I193-E256 HydrophobicContact CG2-CG 3.97Å; R197-E256 IonicContact NE-OE1 3.79Å; V252-E256 WeakPolarHBondContact O-CB 3.41Å; V252-E256 PolarHBondContact O-N 3.31Å; K253-E256 WeakPolarHBondContact O-CB 3.31Å; K253-E256 PolarHBondContact O-N 3.49Å; E256-Q258 PolarHBondContact O-N 3.47Å; E256-K259 PolarHBondContact O-N 3.3Å; E256-Q260 HydrophobicContact CG-CG 4.41Å; E256-Q260 WeakPolarHBondContact O-CB 3.47Å; E256-Q260 WeakPolarHBondContact O-CG 3.12Å; E256-Q260 PolarHBondContact O-N 3.09Å; E256-Q260 PolarHBondContact OE1-NE2 2.81Å
257	L	68.8	Low	69.6	Low	22 Å²	22	50.3 Å²	50.3	12%	0.115	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-47.2	176.3	179.7	64	0	0	0	112	V189 Q192 I193 A196 K253 Q254 Q255 Q260 T261	V189-L257 HydrophobicContact CG1-CB 4.33Å; V189-L257 HydrophobicContact CG1-CD2 4.27Å; Q192-L257 HydrophobicContact CB-CD1 3.6Å; Q192-L257 HydrophobicContact CB-CD2 3.97Å; Q192-L257 HydrophobicContact CB-CG 4.45Å; I193-L257 HydrophobicContact CG1-CB 3.76Å; I193-L257 HydrophobicContact CG1-CD1 4.25Å; A196-L257 HydrophobicContact CB-CD1 4.29Å; K253-L257 PolarHBondContact O-N 3.38Å; Q254-L257 WeakPolarHBondContact O-CB 3.39Å; Q254-L257 PolarHBondContact O-N 2.96Å; Q255-L257 VanDerWaalsContact C-N 3.33Å; L257-Q260 WeakPolarHBondContact O-CB 3.29Å; L257-Q260 PolarHBondContact O-N 3.43Å; L257-T261 HydrophobicContact CD1-CG2 4.23Å; L257-T261 HydrophobicContact CG-CG2 4.45Å; L257-T261 WeakPolarHBondContact O-CG2 3.29Å; L257-T261 PolarHBondContact O-N 3.35Å; L257-T261 PolarHBondContact O-OG1 3.4Å
258	Q	69.7	Low	69.4	Low	61 Å²	61	56.5 Å²	56.5	29%	0.285	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-41.4	178.7	-75.6	-177.8	-3.4	0	0	112.6	R206 Q254 Q255 E256 Q260 T261 A262	R206-Q258 PolarHBondContact O-OE1 3.5Å; Q254-Q258 WeakPolarHBondContact O-CG 3.49Å; Q254-Q258 PolarHBondContact O-N 3.47Å; Q255-Q258 PolarHBondContact O-N 3.39Å; E256-Q258 PolarHBondContact O-N 3.47Å; Q258-Q260 VanDerWaalsContact C-N 3.3Å; Q258-Q260 PolarHBondContact O-N 3.37Å; Q258-T261 WeakPolarHBondContact CA-OG1 3.42Å; Q258-T261 PolarHBondContact O-N 3.48Å; Q258-T261 PolarHBondContact O-OG1 3.03Å; Q258-A262 VanDerWaalsContact O-CB 3.3Å; Q258-A262 WeakPolarHBondContact O-CB 3.39Å; Q258-A262 PolarHBondContact O-N 3.42Å
259	K	69	Low	69.2	Low	79 Å²	79	59.8 Å²	59.8	34%	0.343	30%	0.296	S	S	.	.	H	α-helix	trans	-58.7	-46.4	172.7	-72.9	172.7	-176.7	174.5	0	109.8	Q255 E256 A262 L263	Q255-K259 VanDerWaalsContact O-CG 3.32Å; Q255-K259 WeakPolarHBondContact O-CG 3.44Å; Q255-K259 PolarHBondContact O-N 2.94Å; E256-K259 PolarHBondContact O-N 3.3Å; K259-A262 PolarHBondContact O-N 2.78Å; K259-L263 WeakPolarHBondContact O-CB 3.41Å; K259-L263 WeakPolarHBondContact O-CD1 3.19Å; K259-L263 WeakPolarHBondContact O-CG 3.49Å; K259-L263 PolarHBondContact O-N 3.03Å; K259-L263 VanDerWaalsContact O-N 3.12Å
260	Q	60.8	Low	68.6	Low	12 Å²	12	58.9 Å²	58.9	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-39.1	-179	-67.7	-74.6	-13.7	0	0	113.6	A196 R197 S199 A200 E256 L257 Q258 L263 N264	A196-Q260 HydrophobicContact CB-CB 3.48Å; A196-Q260 VanDerWaalsContact CB-CB 3.48Å; A196-Q260 HydrophobicContact CB-CG 4.27Å; A196-Q260 PolarHBondContact O-OE1 3.02Å; R197-Q260 HydrophobicContact CG-CG 4.42Å; S199-Q260 PolarHBondContact O-OE1 3.13Å; A200-Q260 PolarHBondContact O-NE2 2.96Å; A200-Q260 PolarHBondContact O-OE1 2.96Å; E256-Q260 HydrophobicContact CG-CG 4.41Å; E256-Q260 WeakPolarHBondContact O-CB 3.47Å; E256-Q260 WeakPolarHBondContact O-CG 3.12Å; E256-Q260 PolarHBondContact O-N 3.09Å; E256-Q260 PolarHBondContact OE1-NE2 2.81Å; L257-Q260 WeakPolarHBondContact O-CB 3.29Å; L257-Q260 PolarHBondContact O-N 3.43Å; Q258-Q260 VanDerWaalsContact C-N 3.3Å; Q258-Q260 PolarHBondContact O-N 3.37Å; Q260-L263 PolarHBondContact O-N 2.86Å; Q260-N264 PolarHBondContact O-N 3.2Å; Q260-N264 PolarHBondContact O-ND2 3.48Å
261	T	65.8	Low	68.1	Low	65 Å²	65	63.8 Å²	63.8	40%	0.399	32%	0.324	S	S	.	.	H	α-helix	trans	-68.1	-44.4	176.1	53.6	0	0	0	0	111.3	L257 Q258 L263 N264 D265	L257-T261 HydrophobicContact CD1-CG2 4.23Å; L257-T261 HydrophobicContact CG-CG2 4.45Å; L257-T261 WeakPolarHBondContact O-CG2 3.29Å; L257-T261 PolarHBondContact O-N 3.35Å; L257-T261 PolarHBondContact O-OG1 3.4Å; Q258-T261 WeakPolarHBondContact CA-OG1 3.42Å; Q258-T261 PolarHBondContact O-N 3.48Å; Q258-T261 PolarHBondContact O-OG1 3.03Å; T261-L263 PolarHBondContact O-N 3.43Å; T261-L263 VanDerWaalsContact O-N 3.16Å; T261-N264 PolarHBondContact O-N 2.93Å; T261-D265 PolarHBondContact O-N 3.16Å
262	A	69.9	Low	68.3	Low	31 Å²	31	69.2 Å²	69.2	26%	0.256	35%	0.349	S	S	.	.	H	α-helix	trans	-56.2	-32.5	174.7	0	0	0	0	0	112.2	Q258 K259 L266	Q258-A262 VanDerWaalsContact O-CB 3.3Å; Q258-A262 WeakPolarHBondContact O-CB 3.39Å; Q258-A262 PolarHBondContact O-N 3.42Å; K259-A262 PolarHBondContact O-N 2.78Å; A262-L266 WeakPolarHBondContact O-CB 3.22Å; A262-L266 PolarHBondContact O-N 3.36Å
263	L	70.3	Confident	68.1	Low	6 Å²	6	68.7 Å²	68.7	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-82.1	-35.5	-179.6	-70.4	163	0	0	0	114.6	A200 G201 I202 K259 Q260 T261 D265 L266 R267	A200-L263 HydrophobicContact CB-CD1 4.48Å; A200-L263 WeakPolarHBondContact O-CD1 3.35Å; G201-L263 WeakPolarHBondContact O-CD1 3.36Å; G201-L263 WeakPolarHBondContact O-CD2 3.35Å; I202-L263 HydrophobicContact CB-CD2 4.21Å; I202-L263 WeakPolarHBondContact O-CD1 3.44Å; I202-L263 WeakPolarHBondContact O-CD2 3.48Å; I202-L263 VanDerWaalsContact O-CG 3.22Å; I202-L263 WeakPolarHBondContact O-CG 3.34Å; K259-L263 WeakPolarHBondContact O-CB 3.41Å; K259-L263 WeakPolarHBondContact O-CD1 3.19Å; K259-L263 WeakPolarHBondContact O-CG 3.49Å; K259-L263 PolarHBondContact O-N 3.03Å; K259-L263 VanDerWaalsContact O-N 3.12Å; Q260-L263 PolarHBondContact O-N 2.86Å; T261-L263 PolarHBondContact O-N 3.43Å; T261-L263 VanDerWaalsContact O-N 3.16Å; L263-D265 VanDerWaalsContact C-N 3.25Å; L263-L266 HydrophobicContact CD2-CD2 4.27Å; L263-L266 PolarHBondContact O-N 3.12Å; L263-R267 VanDerWaalsContact O-CB 3.32Å; L263-R267 WeakPolarHBondContact O-CB 3.47Å; L263-R267 VanDerWaalsContact O-CG 3.27Å; L263-R267 WeakPolarHBondContact O-CG 3.47Å; L263-R267 PolarHBondContact O-N 3.45Å
264	N	61.8	Low	67.9	Low	45 Å²	45	71.6 Å²	71.6	24%	0.241	36%	0.362	C	S	.	.	H	α-helix	trans	-60.7	-41.7	167.3	-86.5	-53.7	0	0	0	110.8	S199 Q260 T261 R267 K268	S199-N264 WeakPolarHBondContact CB-OD1 3.33Å; S199-N264 PolarHBondContact OG-ND2 3.19Å; S199-N264 PolarHBondContact OG-OD1 2.95Å; Q260-N264 PolarHBondContact O-N 3.2Å; Q260-N264 PolarHBondContact O-ND2 3.48Å; T261-N264 PolarHBondContact O-N 2.93Å; N264-R267 PolarHBondContact O-N 3.01Å; N264-K268 WeakPolarHBondContact O-CB 2.82Å; N264-K268 VanDerWaalsContact O-CG 3.26Å; N264-K268 WeakPolarHBondContact O-CG 3.21Å; N264-K268 PolarHBondContact O-N 3.22Å
265	D	71.5	Confident	68	Low	97 Å²	97	72 Å²	72	52%	0.519	37%	0.368	S	S	.	.	H	α-helix	trans	-67	-42.1	175.7	-70.9	-16.4	0	0	0	111.9	T261 L263 K268 K269	T261-D265 PolarHBondContact O-N 3.16Å; L263-D265 VanDerWaalsContact C-N 3.25Å; D265-K268 PolarHBondContact O-N 3.02Å; D265-K269 WeakPolarHBondContact O-CB 3.3Å; D265-K269 PolarHBondContact O-N 2.84Å
266	L	67.3	Low	68.4	Low	100 Å²	100	74 Å²	74	52%	0.524	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-45.9	174.1	-175.1	66.7	0	0	0	111.1	A262 L263 K269 T270	A262-L266 WeakPolarHBondContact O-CB 3.22Å; A262-L266 PolarHBondContact O-N 3.36Å; L263-L266 HydrophobicContact CD2-CD2 4.27Å; L263-L266 PolarHBondContact O-N 3.12Å; L266-K269 CarbonylContact O-C 3.39Å; L266-K269 PolarHBondContact O-N 3.34Å; L266-T270 WeakPolarHBondContact O-CB 3.26Å; L266-T270 PolarHBondContact O-N 3.29Å; L266-T270 PolarHBondContact O-OG1 2.85Å
267	R	64.3	Low	68.6	Low	118 Å²	118	76.5 Å²	76.5	45%	0.445	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-44.5	177.5	-77.5	174.5	169	-158.8	-1.4	112	A200 L263 N264 K269 T270 V271	A200-R267 VanDerWaalsContact CB-CZ 3.47Å; L263-R267 VanDerWaalsContact O-CB 3.32Å; L263-R267 WeakPolarHBondContact O-CB 3.47Å; L263-R267 VanDerWaalsContact O-CG 3.27Å; L263-R267 WeakPolarHBondContact O-CG 3.47Å; L263-R267 PolarHBondContact O-N 3.45Å; N264-R267 PolarHBondContact O-N 3.01Å; R267-K269 VanDerWaalsContact C-N 3.28Å; R267-K269 PolarHBondContact O-N 2.86Å; R267-T270 PolarHBondContact O-N 3.39Å; R267-V271 WeakPolarHBondContact O-CB 3.42Å; R267-V271 VanDerWaalsContact O-CG2 3.31Å; R267-V271 WeakPolarHBondContact O-CG2 3.27Å; R267-V271 PolarHBondContact O-N 3.27Å
268	K	69.5	Low	69	Low	129 Å²	129	77 Å²	77	56%	0.561	40%	0.399	S	S	*	.	H	α-helix	trans	-56.9	-45.9	173.3	-75.9	172.3	-176.1	173.3	0	110.5	N264 D265 V271 Q272	N264-K268 WeakPolarHBondContact O-CB 2.82Å; N264-K268 VanDerWaalsContact O-CG 3.26Å; N264-K268 WeakPolarHBondContact O-CG 3.21Å; N264-K268 PolarHBondContact O-N 3.22Å; D265-K268 PolarHBondContact O-N 3.02Å; K268-V271 PolarHBondContact O-N 2.93Å; K268-Q272 WeakPolarHBondContact O-CB 3.32Å; K268-Q272 VanDerWaalsContact O-CG 3.3Å; K268-Q272 WeakPolarHBondContact O-CG 3.07Å; K268-Q272 PolarHBondContact O-N 3.46Å
269	K	71.1	Confident	69.4	Low	128 Å²	128	76.4 Å²	76.4	56%	0.557	40%	0.398	S	S	*	.	H	α-helix	trans	-65.8	-40.7	177.8	-165.9	172.9	-175.8	177.7	0	112.2	D265 L266 R267 Q272 L273	D265-K269 WeakPolarHBondContact O-CB 3.3Å; D265-K269 PolarHBondContact O-N 2.84Å; L266-K269 CarbonylContact O-C 3.39Å; L266-K269 PolarHBondContact O-N 3.34Å; R267-K269 VanDerWaalsContact C-N 3.28Å; R267-K269 PolarHBondContact O-N 2.86Å; K269-Q272 PolarHBondContact O-N 3.39Å; K269-L273 HydrophobicContact CG-CD1 4.11Å; K269-L273 HydrophobicContact CG-CG 4.41Å; K269-L273 VanDerWaalsContact O-CB 3.32Å; K269-L273 WeakPolarHBondContact O-CB 3.48Å; K269-L273 VanDerWaalsContact O-CG 3.24Å; K269-L273 WeakPolarHBondContact O-CG 3.23Å; K269-L273 PolarHBondContact O-N 2.88Å
270	T	63.4	Low	69.8	Low	69 Å²	69	79.6 Å²	79.6	42%	0.423	41%	0.412	S	S	.	.	H	α-helix	trans	-65	-45	176	-58.6	0	0	0	0	111	L266 R267 Q272 L273 T274	L266-T270 WeakPolarHBondContact O-CB 3.26Å; L266-T270 PolarHBondContact O-N 3.29Å; L266-T270 PolarHBondContact O-OG1 2.85Å; R267-T270 PolarHBondContact O-N 3.39Å; T270-Q272 VanDerWaalsContact C-N 3.34Å; T270-Q272 PolarHBondContact O-N 3.26Å; T270-L273 PolarHBondContact O-N 3.04Å; T270-T274 VanDerWaalsContact O-CB 3.29Å; T270-T274 WeakPolarHBondContact O-CB 3.44Å; T270-T274 PolarHBondContact O-N 3.3Å; T270-T274 PolarHBondContact O-OG1 3.17Å
271	V	65	Low	70.6	Confident	103 Å²	103	84.3 Å²	84.3	62%	0.624	43%	0.434	S	S	*	.	H	α-helix	trans	-62	-42.9	175.1	172.2	0	0	0	0	110.7	R267 K268 S275	R267-V271 WeakPolarHBondContact O-CB 3.42Å; R267-V271 VanDerWaalsContact O-CG2 3.31Å; R267-V271 WeakPolarHBondContact O-CG2 3.27Å; R267-V271 PolarHBondContact O-N 3.27Å; K268-V271 PolarHBondContact O-N 2.93Å; V271-S275 VanDerWaalsContact O-CB 3.31Å; V271-S275 WeakPolarHBondContact O-CB 3.35Å; V271-S275 PolarHBondContact O-N 2.95Å
272	Q	72.4	Confident	71.1	Confident	123 Å²	123	87.5 Å²	87.5	58%	0.575	44%	0.439	S	S	*	.	H	α-helix	trans	-62.3	-46.3	174.8	-77.6	177.4	-10.7	0	0	112.3	K268 K269 T270 S275 Q276	K268-Q272 WeakPolarHBondContact O-CB 3.32Å; K268-Q272 VanDerWaalsContact O-CG 3.3Å; K268-Q272 WeakPolarHBondContact O-CG 3.07Å; K268-Q272 PolarHBondContact O-N 3.46Å; K269-Q272 PolarHBondContact O-N 3.39Å; T270-Q272 VanDerWaalsContact C-N 3.34Å; T270-Q272 PolarHBondContact O-N 3.26Å; Q272-S275 PolarHBondContact O-N 3.35Å; Q272-Q276 WeakPolarHBondContact O-CB 3.41Å; Q272-Q276 VanDerWaalsContact O-CG 3.27Å; Q272-Q276 WeakPolarHBondContact O-CG 3.38Å; Q272-Q276 PolarHBondContact O-N 3.48Å
273	L	70	Confident	71.6	Confident	83 Å²	83	88.3 Å²	88.3	44%	0.435	45%	0.445	S	S	.	.	H	α-helix	trans	-65.5	-44.6	178.7	-75.3	172	0	0	0	111.7	K269 T270 S275 Q276 L277	K269-L273 HydrophobicContact CG-CD1 4.11Å; K269-L273 HydrophobicContact CG-CG 4.41Å; K269-L273 VanDerWaalsContact O-CB 3.32Å; K269-L273 WeakPolarHBondContact O-CB 3.48Å; K269-L273 VanDerWaalsContact O-CG 3.24Å; K269-L273 WeakPolarHBondContact O-CG 3.23Å; K269-L273 PolarHBondContact O-N 2.88Å; T270-L273 PolarHBondContact O-N 3.04Å; L273-S275 VanDerWaalsContact C-N 3.32Å; L273-S275 PolarHBondContact O-N 3.04Å; L273-Q276 PolarHBondContact O-N 3.21Å; L273-L277 WeakPolarHBondContact O-CB 3.38Å; L273-L277 WeakPolarHBondContact O-CG 3.36Å; L273-L277 PolarHBondContact O-N 3.38Å
274	T	68.6	Low	72	Confident	87 Å²	87	92.3 Å²	92.3	53%	0.534	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-40.6	175.7	-59.1	0	0	0	0	111.1	T270 L277 A278	T270-T274 VanDerWaalsContact O-CB 3.29Å; T270-T274 WeakPolarHBondContact O-CB 3.44Å; T270-T274 PolarHBondContact O-N 3.3Å; T270-T274 PolarHBondContact O-OG1 3.17Å; T274-L277 PolarHBondContact O-N 2.89Å; T274-A278 VanDerWaalsContact O-CB 3.29Å; T274-A278 WeakPolarHBondContact O-CB 3.43Å; T274-A278 PolarHBondContact O-N 3.1Å
275	S	71.5	Confident	72.9	Confident	38 Å²	38	98 Å²	98	27%	0.266	48%	0.484	S	S	.	.	H	α-helix	trans	-61.8	-48.7	173.2	-168	0	0	0	0	111.3	V271 Q272 L273 L277 A278 D279	V271-S275 VanDerWaalsContact O-CB 3.31Å; V271-S275 WeakPolarHBondContact O-CB 3.35Å; V271-S275 PolarHBondContact O-N 2.95Å; Q272-S275 PolarHBondContact O-N 3.35Å; L273-S275 VanDerWaalsContact C-N 3.32Å; L273-S275 PolarHBondContact O-N 3.04Å; S275-L277 VanDerWaalsContact C-N 3.34Å; S275-L277 PolarHBondContact O-N 3.24Å; S275-A278 PolarHBondContact O-N 3.1Å; S275-D279 WeakPolarHBondContact O-CB 3.43Å; S275-D279 PolarHBondContact O-N 3.43Å; S275-D279 VanDerWaalsContact O-OD2 3.11Å
276	Q	77.2	Confident	73.2	Confident	107 Å²	107	95.4 Å²	95.4	50%	0.5	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-39.1	179	-75.6	177.2	2.2	0	0	112.9	Q272 L273 K280	Q272-Q276 WeakPolarHBondContact O-CB 3.41Å; Q272-Q276 VanDerWaalsContact O-CG 3.27Å; Q272-Q276 WeakPolarHBondContact O-CG 3.38Å; Q272-Q276 PolarHBondContact O-N 3.48Å; L273-Q276 PolarHBondContact O-N 3.21Å; Q276-K280 WeakPolarHBondContact O-CG 3.27Å; Q276-K280 PolarHBondContact O-N 2.9Å
277	L	73.4	Confident	73.6	Confident	104 Å²	104	95.8 Å²	95.8	55%	0.545	47%	0.468	S	S	.	.	H	α-helix	trans	-67	-45.5	174.8	-74	172.8	0	0	0	111	L273 T274 S275 D279 K280 E281	L273-L277 WeakPolarHBondContact O-CB 3.38Å; L273-L277 WeakPolarHBondContact O-CG 3.36Å; L273-L277 PolarHBondContact O-N 3.38Å; T274-L277 PolarHBondContact O-N 2.89Å; S275-L277 VanDerWaalsContact C-N 3.34Å; S275-L277 PolarHBondContact O-N 3.24Å; L277-D279 VanDerWaalsContact C-N 3.27Å; L277-D279 PolarHBondContact O-N 3.04Å; L277-K280 PolarHBondContact O-N 3.09Å; L277-E281 WeakPolarHBondContact O-CG 3.35Å; L277-E281 PolarHBondContact O-N 3.27Å
278	A	77.6	Confident	74.5	Confident	32 Å²	32	94.7 Å²	94.7	26%	0.264	47%	0.468	S	S	.	.	H	α-helix	trans	-60.4	-37.6	175.6	0	0	0	0	0	112.1	T274 S275 R282	T274-A278 VanDerWaalsContact O-CB 3.29Å; T274-A278 WeakPolarHBondContact O-CB 3.43Å; T274-A278 PolarHBondContact O-N 3.1Å; S275-A278 PolarHBondContact O-N 3.1Å; A278-R282 WeakPolarHBondContact O-CB 3.49Å; A278-R282 WeakPolarHBondContact O-CG 3.14Å; A278-R282 PolarHBondContact O-N 3.33Å
279	D	76.5	Confident	74.9	Confident	49 Å²	49	93.5 Å²	93.5	26%	0.262	47%	0.467	S	S	.	.	H	α-helix	trans	-67.4	-42.1	175.9	-68.4	-30.3	0	0	0	111.8	S275 L277 R282 A283 Q320	S275-D279 WeakPolarHBondContact O-CB 3.43Å; S275-D279 PolarHBondContact O-N 3.43Å; S275-D279 VanDerWaalsContact O-OD2 3.11Å; L277-D279 VanDerWaalsContact C-N 3.27Å; L277-D279 PolarHBondContact O-N 3.04Å; D279-R282 PolarHBondContact O-N 2.93Å; D279-A283 WeakPolarHBondContact O-CB 3.38Å; D279-A283 PolarHBondContact O-N 3.47Å; D279-Q320 PolarHBondContact OD1-OE1 3.07Å
280	K	78.7	Confident	75.1	Confident	146 Å²	146	88.3 Å²	88.3	64%	0.635	45%	0.446	S	S	*	.	H	α-helix	trans	-63.7	-45.3	173.9	-77.7	179.5	179	176	0	112.2	Q276 L277 R282 A283 L284	Q276-K280 WeakPolarHBondContact O-CG 3.27Å; Q276-K280 PolarHBondContact O-N 2.9Å; L277-K280 PolarHBondContact O-N 3.09Å; K280-R282 VanDerWaalsContact C-N 3.33Å; K280-R282 PolarHBondContact O-N 3.21Å; K280-A283 PolarHBondContact O-N 3.02Å; K280-L284 WeakPolarHBondContact O-CB 3.32Å; K280-L284 PolarHBondContact O-N 3.48Å
281	E	76.3	Confident	75.7	Confident	110 Å²	110	88.5 Å²	88.5	51%	0.514	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-41.5	177.3	-75.4	-177.6	-171.6	0	0	111.7	L277 R285	L277-E281 WeakPolarHBondContact O-CG 3.35Å; L277-E281 PolarHBondContact O-N 3.27Å; E281-R285 VanDerWaalsContact O-CG 3.31Å; E281-R285 WeakPolarHBondContact O-CG 3.37Å; E281-R285 PolarHBondContact O-N 3.21Å
282	R	76.9	Confident	76.2	Confident	133 Å²	133	89.8 Å²	89.8	50%	0.502	45%	0.446	S	S	.	.	H	α-helix	trans	-66.2	-45.6	175.5	-74.3	173.3	-173.6	-176.9	5	111.9	A278 D279 K280 L284 R285 E286	A278-R282 WeakPolarHBondContact O-CB 3.49Å; A278-R282 WeakPolarHBondContact O-CG 3.14Å; A278-R282 PolarHBondContact O-N 3.33Å; D279-R282 PolarHBondContact O-N 2.93Å; K280-R282 VanDerWaalsContact C-N 3.33Å; K280-R282 PolarHBondContact O-N 3.21Å; R282-L284 VanDerWaalsContact C-N 3.29Å; R282-L284 PolarHBondContact O-N 2.94Å; R282-R285 PolarHBondContact O-N 3.18Å; R282-E286 WeakPolarHBondContact O-CB 3.44Å; R282-E286 WeakPolarHBondContact O-CG 3.32Å; R282-E286 PolarHBondContact O-N 2.92Å
283	A	79.6	Confident	76.3	Confident	47 Å²	47	86.2 Å²	86.2	39%	0.388	44%	0.438	S	S	.	.	H	α-helix	trans	-58.6	-42.6	177.1	0	0	0	0	0	111.5	D279 K280 E286 Q287	D279-A283 WeakPolarHBondContact O-CB 3.38Å; D279-A283 PolarHBondContact O-N 3.47Å; K280-A283 PolarHBondContact O-N 3.02Å; A283-E286 PolarHBondContact O-N 2.78Å; A283-Q287 WeakPolarHBondContact O-CB 3.09Å; A283-Q287 PolarHBondContact O-N 2.86Å
284	L	79.4	Confident	76.3	Confident	90 Å²	90	82.6 Å²	82.6	47%	0.471	42%	0.419	S	S	.	.	H	α-helix	trans	-64.2	-45.9	176.3	-169.1	73.7	0	0	0	111.9	K280 R282 E286 Q287 H288	K280-L284 WeakPolarHBondContact O-CB 3.32Å; K280-L284 PolarHBondContact O-N 3.48Å; R282-L284 VanDerWaalsContact C-N 3.29Å; R282-L284 PolarHBondContact O-N 2.94Å; L284-E286 VanDerWaalsContact C-N 3.32Å; L284-E286 PolarHBondContact O-N 3.46Å; L284-Q287 WeakPolarHBondContact O-CB 3.06Å; L284-Q287 PolarHBondContact O-N 2.86Å; L284-H288 PolarHBondContact O-N 2.99Å
285	R	80.3	Confident	76.5	Confident	164 Å²	164	82.7 Å²	82.7	62%	0.619	43%	0.428	S	S	*	.	H	α-helix	trans	-61.9	-39.8	175.8	-73.2	178.1	-170.3	-171.8	6.2	112.2	E281 R282 H288 N289	E281-R285 VanDerWaalsContact O-CG 3.31Å; E281-R285 WeakPolarHBondContact O-CG 3.37Å; E281-R285 PolarHBondContact O-N 3.21Å; R282-R285 PolarHBondContact O-N 3.18Å; R285-H288 PolarHBondContact O-N 3.15Å; R285-N289 WeakPolarHBondContact O-CB 3.47Å; R285-N289 VanDerWaalsContact O-CG 3.23Å; R285-N289 PolarHBondContact O-N 2.69Å
286	E	77.6	Confident	76.6	Confident	44 Å²	44	84.8 Å²	84.8	21%	0.206	46%	0.457	C	S	.	.	H	α-helix	trans	-67	-37.6	176.3	-74.2	-176.1	-179.7	0	0	112.2	R282 A283 L284 N289 L290 Q313 R316	R282-E286 WeakPolarHBondContact O-CB 3.44Å; R282-E286 WeakPolarHBondContact O-CG 3.32Å; R282-E286 PolarHBondContact O-N 2.92Å; A283-E286 PolarHBondContact O-N 2.78Å; L284-E286 VanDerWaalsContact C-N 3.32Å; L284-E286 PolarHBondContact O-N 3.46Å; E286-N289 PolarHBondContact O-N 3.13Å; E286-L290 VanDerWaalsContact O-CB 3.29Å; E286-L290 WeakPolarHBondContact O-CB 3.42Å; E286-L290 PolarHBondContact O-N 2.93Å; E286-Q313 VanDerWaalsContact OE2-CG 3.22Å; E286-Q313 WeakPolarHBondContact OE2-CG 3.4Å; E286-Q313 PolarHBondContact OE2-NE2 3.32Å; E286-R316 IonicContact OE1-CZ 2.93Å; E286-R316 IonicContact OE1-NH1 3.91Å; E286-R316 PolarHBondContact OE1-NH1 3.47Å; E286-R316 IonicContact OE1-NH2 3.91Å; E286-R316 PolarHBondContact OE1-NH2 2.75Å; E286-R316 IonicContact OE2-CZ 3Å; E286-R316 IonicContact OE2-NH2 3.7Å; E286-R316 PolarHBondContact OE2-NH2 3.5Å
287	Q	77.4	Confident	76.3	Confident	108 Å²	108	83.3 Å²	83.3	51%	0.505	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-47.2	173	-174.7	179	7.3	0	0	111.4	A283 L284 N289 L290 D291	A283-Q287 WeakPolarHBondContact O-CB 3.09Å; A283-Q287 PolarHBondContact O-N 2.86Å; L284-Q287 WeakPolarHBondContact O-CB 3.06Å; L284-Q287 PolarHBondContact O-N 2.86Å; Q287-N289 VanDerWaalsContact C-N 3.34Å; Q287-N289 PolarHBondContact O-N 2.59Å; Q287-L290 WeakPolarHBondContact O-CA 3.46Å; Q287-L290 VanDerWaalsContact O-CB 3.29Å; Q287-L290 WeakPolarHBondContact O-CB 3.45Å; Q287-L290 PolarHBondContact O-N 3.24Å; Q287-L290 VanDerWaalsContact O-N 3.12Å; Q287-D291 PolarHBondContact O-N 2.86Å
288	H	81.6	Confident	76.4	Confident	95 Å²	95	80.5 Å²	80.5	44%	0.44	45%	0.446	S	S	.	.	H	α-helix	trans	-62	-42.3	176.4	-65.2	174.7	0	0	0	111.9	L284 R285 L290 D291 I292	L284-H288 PolarHBondContact O-N 2.99Å; R285-H288 PolarHBondContact O-N 3.15Å; H288-L290 VanDerWaalsContact C-N 3.27Å; H288-L290 PolarHBondContact O-N 3.01Å; H288-D291 PolarHBondContact O-N 2.74Å; H288-I292 VanDerWaalsContact O-CG1 3.28Å; H288-I292 WeakPolarHBondContact O-CG1 3.49Å; H288-I292 PolarHBondContact O-N 3.2Å
289	N	79.3	Confident	76.2	Confident	103 Å²	103	84 Å²	84	55%	0.551	46%	0.46	S	S	*	.	H	α-helix	trans	-62.9	-35.4	175	-75.2	-7	0	0	0	111.9	R285 E286 Q287 A293	R285-N289 WeakPolarHBondContact O-CB 3.47Å; R285-N289 VanDerWaalsContact O-CG 3.23Å; R285-N289 PolarHBondContact O-N 2.69Å; E286-N289 PolarHBondContact O-N 3.13Å; Q287-N289 VanDerWaalsContact C-N 3.34Å; Q287-N289 PolarHBondContact O-N 2.59Å; N289-A293 WeakPolarHBondContact O-CB 3.36Å; N289-A293 PolarHBondContact O-N 3.49Å
290	L	73.9	Confident	76.1	Confident	19 Å²	19	87.2 Å²	87.2	10%	0.099	47%	0.472	C	S	.	.	H	α-helix	trans	-64.4	-49.5	173.5	-171.1	167	0	0	0	110.4	E286 Q287 H288 I292 A293 T294 Y305 Q306 L309	E286-L290 VanDerWaalsContact O-CB 3.29Å; E286-L290 WeakPolarHBondContact O-CB 3.42Å; E286-L290 PolarHBondContact O-N 2.93Å; Q287-L290 WeakPolarHBondContact O-CA 3.46Å; Q287-L290 VanDerWaalsContact O-CB 3.29Å; Q287-L290 WeakPolarHBondContact O-CB 3.45Å; Q287-L290 PolarHBondContact O-N 3.24Å; Q287-L290 VanDerWaalsContact O-N 3.12Å; H288-L290 VanDerWaalsContact C-N 3.27Å; H288-L290 PolarHBondContact O-N 3.01Å; L290-I292 VanDerWaalsContact C-N 3.31Å; L290-I292 PolarHBondContact O-N 3.15Å; L290-A293 PolarHBondContact O-N 3.21Å; L290-T294 HydrophobicContact CD2-CG2 3.76Å; L290-T294 HydrophobicContact CG-CG2 4.24Å; L290-T294 VanDerWaalsContact O-CB 3.25Å; L290-T294 WeakPolarHBondContact O-CB 3.27Å; L290-T294 VanDerWaalsContact O-CG2 3.23Å; L290-T294 WeakPolarHBondContact O-CG2 2.94Å; L290-T294 PolarHBondContact O-N 3.44Å; L290-T294 PolarHBondContact O-OG1 3.46Å; L290-Y305 HydrophobicContact CG-CD1 3.97Å; L290-Y305 HydrophobicContact CG-CE1 4.21Å; L290-Q306 HydrophobicContact CD1-CB 4.43Å; L290-Q306 HydrophobicContact CD1-CG 3.59Å; L290-Q306 HydrophobicContact CD2-CG 3.94Å; L290-Q306 HydrophobicContact CG-CG 4.37Å; L290-L309 HydrophobicContact CB-CD1 4.01Å; L290-L309 HydrophobicContact CD1-CD1 3.3Å; L290-L309 HydrophobicContact CG-CD1 3.69Å
291	D	76.2	Confident	76	Confident	74 Å²	74	85.6 Å²	85.6	40%	0.396	47%	0.467	S	S	.	.	H	α-helix	trans	-60.9	-41.7	-179.7	-68.2	-24.7	0	0	0	111.2	Q287 H288 A295	Q287-D291 PolarHBondContact O-N 2.86Å; H288-D291 PolarHBondContact O-N 2.74Å; D291-A295 WeakPolarHBondContact O-CB 3.44Å; D291-A295 PolarHBondContact O-N 3.47Å
292	I	76.4	Confident	76.1	Confident	130 Å²	130	85 Å²	85	67%	0.667	46%	0.46	S	S	*	.	H	α-helix	trans	-66.4	-46.8	175.8	-64.3	165.2	0	0	0	111.3	H288 L290 T294	H288-I292 VanDerWaalsContact O-CG1 3.28Å; H288-I292 WeakPolarHBondContact O-CG1 3.49Å; H288-I292 PolarHBondContact O-N 3.2Å; L290-I292 VanDerWaalsContact C-N 3.31Å; L290-I292 PolarHBondContact O-N 3.15Å; I292-T294 VanDerWaalsContact C-N 3.3Å; I292-T294 PolarHBondContact O-N 2.88Å
293	A	73	Confident	76.1	Confident	48 Å²	48	83.5 Å²	83.5	40%	0.397	46%	0.459	S	S	.	.	H	α-helix	trans	-69.4	-27.8	-179.3	0	0	0	0	0	112.9	N289 L290	N289-A293 WeakPolarHBondContact O-CB 3.36Å; N289-A293 PolarHBondContact O-N 3.49Å; L290-A293 PolarHBondContact O-N 3.21Å
294	T	70.4	Confident	76.1	Confident	6 Å²	6	83.9 Å²	83.9	4%	0.037	45%	0.45	C	S	.	.	H	α-helix	trans	-100.3	-4.5	-177.7	65.6	0	0	0	0	113.9	L290 I292 G296 M297 R302 Y305	L290-T294 HydrophobicContact CD2-CG2 3.76Å; L290-T294 HydrophobicContact CG-CG2 4.24Å; L290-T294 VanDerWaalsContact O-CB 3.25Å; L290-T294 WeakPolarHBondContact O-CB 3.27Å; L290-T294 VanDerWaalsContact O-CG2 3.23Å; L290-T294 WeakPolarHBondContact O-CG2 2.94Å; L290-T294 PolarHBondContact O-N 3.44Å; L290-T294 PolarHBondContact O-OG1 3.46Å; I292-T294 VanDerWaalsContact C-N 3.3Å; I292-T294 PolarHBondContact O-N 2.88Å; T294-G296 PolarHBondContact O-N 2.89Å; T294-G296 VanDerWaalsContact O-N 3.11Å; T294-M297 HydrophobicContact CG2-SD 3.94Å; T294-M297 WeakPolarHBondContact O-CB 3.46Å; T294-M297 PolarHBondContact O-N 2.99Å; T294-R302 HydrophobicContact CG2-CB 4.47Å; T294-R302 HydrophobicContact CG2-CG 4.16Å; T294-Y305 HydrophobicContact CG2-CD1 3.72Å; T294-Y305 HydrophobicContact CG2-CE1 4.4Å; T294-Y305 HydrophobicContact CG2-CG 4.3Å
295	A	72.6	Confident	76.3	Confident	89 Å²	89	83.8 Å²	83.8	74%	0.736	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.4	177.8	0	0	0	0	0	113.4	D291	D291-A295 WeakPolarHBondContact O-CB 3.44Å; D291-A295 PolarHBondContact O-N 3.47Å
296	G	74.4	Confident	76.4	Confident	83 Å²	83	79.8 Å²	79.8	86%	0.856	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-0.1	174.2	0	0	0	0	0	115.1	T294	T294-G296 PolarHBondContact O-N 2.89Å; T294-G296 VanDerWaalsContact O-N 3.11Å
297	M	71.5	Confident	76.7	Confident	76 Å²	76	79.1 Å²	79.1	37%	0.374	43%	0.434	S	S	.	.	S	Bend	trans	-94.9	144.2	-176.6	-66.4	-174.1	176.3	0	0	110.9	T294 Q301	T294-M297 HydrophobicContact CG2-SD 3.94Å; T294-M297 WeakPolarHBondContact O-CB 3.46Å; T294-M297 PolarHBondContact O-N 2.99Å; M297-Q301 HydrophobicContact CB-CB 3.99Å; M297-Q301 HydrophobicContact SD-CB 4.48Å
298	G	75.7	Confident	77	Confident	44 Å²	44	76.2 Å²	76.2	45%	0.454	42%	0.421	S	S	.	.			trans	-65.9	157.5	172.8	0	0	0	0	0	112.2	K300 Q301 R302	G298-K300 VanDerWaalsContact C-N 3.26Å; G298-K300 PolarHBondContact O-N 3.11Å; G298-K300 VanDerWaalsContact O-N 3.13Å; G298-Q301 WeakPolarHBondContact O-CA 3.26Å; G298-Q301 WeakPolarHBondContact O-CB 3.22Å; G298-Q301 PolarHBondContact O-N 3.03Å; G298-R302 PolarHBondContact O-N 3.32Å
299	D	73.5	Confident	77.1	Confident	105 Å²	105	72.9 Å²	72.9	56%	0.561	41%	0.406	S	S	*	.	H	α-helix	trans	-52.2	-40.6	-176.8	-77.4	-48.7	0	0	0	113.9	R302 Q303	D299-R302 PolarHBondContact O-N 3.34Å; D299-R302 IonicContact OD1-CZ 2.74Å; D299-R302 IonicContact OD1-NE 2.73Å; D299-R302 IonicContact OD1-NH2 3.61Å; D299-R302 PolarHBondContact OD1-NH2 3.02Å; D299-Q303 WeakPolarHBondContact O-CG 3.41Å; D299-Q303 PolarHBondContact O-N 2.89Å
300	K	73.8	Confident	77.4	Confident	118 Å²	118	75.7 Å²	75.7	51%	0.513	41%	0.409	S	S	.	.	H	α-helix	trans	-63.8	-41	176.3	-66.1	-170.8	-176.1	-171.8	0	112.3	G298 R304	G298-K300 VanDerWaalsContact C-N 3.26Å; G298-K300 PolarHBondContact O-N 3.11Å; G298-K300 VanDerWaalsContact O-N 3.13Å; K300-R304 WeakPolarHBondContact O-CG 3.45Å; K300-R304 PolarHBondContact O-N 2.97Å; K300-R304 VanDerWaalsContact O-N 3.12Å
301	Q	76.1	Confident	78.1	Confident	112 Å²	112	75.9 Å²	75.9	52%	0.523	41%	0.41	S	S	.	.	H	α-helix	trans	-68.2	-40.3	176.6	-75.6	-179.4	-16.4	0	0	110.9	M297 G298 R304 Y305	M297-Q301 HydrophobicContact CB-CB 3.99Å; M297-Q301 HydrophobicContact SD-CB 4.48Å; G298-Q301 WeakPolarHBondContact O-CA 3.26Å; G298-Q301 WeakPolarHBondContact O-CB 3.22Å; G298-Q301 PolarHBondContact O-N 3.03Å; Q301-R304 WeakPolarHBondContact O-CB 3.48Å; Q301-R304 PolarHBondContact O-N 2.82Å; Q301-Y305 WeakPolarHBondContact O-CB 3.2Å; Q301-Y305 PolarHBondContact O-N 2.92Å
302	R	77.9	Confident	78.6	Confident	97 Å²	97	77 Å²	77	37%	0.366	41%	0.409	S	S	.	.	H	α-helix	trans	-59.5	-46.8	174.2	-175.9	176.3	64.9	164	-4.7	111.7	T294 G298 D299 R304 Y305 Q306	T294-R302 HydrophobicContact CG2-CB 4.47Å; T294-R302 HydrophobicContact CG2-CG 4.16Å; G298-R302 PolarHBondContact O-N 3.32Å; D299-R302 PolarHBondContact O-N 3.34Å; D299-R302 IonicContact OD1-CZ 2.74Å; D299-R302 IonicContact OD1-NE 2.73Å; D299-R302 IonicContact OD1-NH2 3.61Å; D299-R302 PolarHBondContact OD1-NH2 3.02Å; R302-R304 VanDerWaalsContact C-N 3.35Å; R302-R304 PolarHBondContact O-N 3.04Å; R302-Y305 PolarHBondContact O-N 2.73Å; R302-Q306 HydrophobicContact CG-CG 4.49Å; R302-Q306 WeakPolarHBondContact O-CB 3.48Å; R302-Q306 VanDerWaalsContact O-CG 3.32Å; R302-Q306 WeakPolarHBondContact O-CG 3.42Å; R302-Q306 PolarHBondContact O-N 2.95Å
303	Q	78.5	Confident	79	Confident	101 Å²	101	73.4 Å²	73.4	47%	0.472	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-41.8	176.6	-74.2	177.7	-7.5	0	0	112.4	D299 Q306 A307 W359	D299-Q303 WeakPolarHBondContact O-CG 3.41Å; D299-Q303 PolarHBondContact O-N 2.89Å; Q303-Q306 PolarHBondContact O-N 2.89Å; Q303-A307 WeakPolarHBondContact O-CB 3.49Å; Q303-A307 PolarHBondContact O-N 2.88Å; Q303-W359 HydrophobicContact CB-CH2 3.86Å; Q303-W359 HydrophobicContact CB-CZ2 4.4Å
304	R	79.7	Confident	79.6	Confident	56 Å²	56	74.3 Å²	74.3	21%	0.211	39%	0.385	C	S	.	.	H	α-helix	trans	-60.5	-45.9	174.5	-76.2	174.1	-175.8	-175.1	9.4	112.4	K300 Q301 R302 A307 Q308 W359 E363	K300-R304 WeakPolarHBondContact O-CG 3.45Å; K300-R304 PolarHBondContact O-N 2.97Å; K300-R304 VanDerWaalsContact O-N 3.12Å; Q301-R304 WeakPolarHBondContact O-CB 3.48Å; Q301-R304 PolarHBondContact O-N 2.82Å; R302-R304 VanDerWaalsContact C-N 3.35Å; R302-R304 PolarHBondContact O-N 3.04Å; R304-A307 PolarHBondContact O-N 2.98Å; R304-Q308 WeakPolarHBondContact O-CG 3.27Å; R304-Q308 PolarHBondContact O-N 3.2Å; R304-W359 HydrophobicContact CG-CD2 3.4Å; R304-W359 VanDerWaalsContact CG-CE2 3.49Å; R304-W359 HydrophobicContact CG-CE3 3.77Å; R304-W359 HydrophobicContact CG-CG 3.72Å; R304-W359 HydrophobicContact CG-CH2 4.26Å; R304-W359 HydrophobicContact CG-CZ2 3.95Å; R304-W359 HydrophobicContact CG-CZ3 4.17Å; R304-E363 IonicContact CZ-OE1 3.76Å; R304-E363 IonicContact NH1-OE1 3.44Å; R304-E363 PolarHBondContact NH1-OE1 2.79Å; R304-E363 IonicContact NH1-OE2 3.46Å; R304-E363 IonicContact NH2-OE1 3.9Å; R304-E363 PolarHBondContact NH2-OE1 3.35Å; R304-E363 IonicContact NH2-OE2 2.87Å
305	Y	82	Confident	80.5	Confident	87 Å²	87	76 Å²	76	34%	0.341	39%	0.391	S	S	.	.	H	α-helix	trans	-67	-42.7	-178.3	-166	-104.7	0	0	0	111	L290 T294 Q301 R302 A307 Q308 L309	L290-Y305 HydrophobicContact CG-CD1 3.97Å; L290-Y305 HydrophobicContact CG-CE1 4.21Å; T294-Y305 HydrophobicContact CG2-CD1 3.72Å; T294-Y305 HydrophobicContact CG2-CE1 4.4Å; T294-Y305 HydrophobicContact CG2-CG 4.3Å; Q301-Y305 WeakPolarHBondContact O-CB 3.2Å; Q301-Y305 PolarHBondContact O-N 2.92Å; R302-Y305 PolarHBondContact O-N 2.73Å; Y305-A307 PolarHBondContact O-N 3.44Å; Y305-Q308 PolarHBondContact O-N 3.29Å; Y305-L309 HydrophobicContact CD1-CD1 3.55Å; Y305-L309 HydrophobicContact CD1-CG 4.22Å; Y305-L309 HydrophobicContact CE1-CD1 3.29Å; Y305-L309 HydrophobicContact CE1-CG 3.99Å; Y305-L309 HydrophobicContact CG-CD1 4.5Å; Y305-L309 WeakPolarHBondContact O-CB 3.23Å; Y305-L309 WeakPolarHBondContact O-CG 3.35Å; Y305-L309 PolarHBondContact O-N 3.16Å
306	Q	82.7	Confident	80.9	Confident	80 Å²	80	76.5 Å²	76.5	37%	0.374	37%	0.374	S	S	.	.	H	α-helix	trans	-57.3	-48.1	171.8	-75.7	174.6	-1.7	0	0	112.1	L290 R302 Q303 Q308 L309 R310	L290-Q306 HydrophobicContact CD1-CB 4.43Å; L290-Q306 HydrophobicContact CD1-CG 3.59Å; L290-Q306 HydrophobicContact CD2-CG 3.94Å; L290-Q306 HydrophobicContact CG-CG 4.37Å; R302-Q306 HydrophobicContact CG-CG 4.49Å; R302-Q306 WeakPolarHBondContact O-CB 3.48Å; R302-Q306 VanDerWaalsContact O-CG 3.32Å; R302-Q306 WeakPolarHBondContact O-CG 3.42Å; R302-Q306 PolarHBondContact O-N 2.95Å; Q303-Q306 PolarHBondContact O-N 2.89Å; Q306-Q308 VanDerWaalsContact C-N 3.34Å; Q306-Q308 PolarHBondContact O-N 3.36Å; Q306-L309 PolarHBondContact O-N 3.21Å; Q306-R310 PolarHBondContact O-N 2.97Å
307	A	83.3	Confident	81.4	Confident	30 Å²	30	77.5 Å²	77.5	25%	0.248	36%	0.356	C	S	.	.	H	α-helix	trans	-61.2	-42.4	178.3	0	0	0	0	0	112	Q303 R304 Y305 I311 W359	Q303-A307 WeakPolarHBondContact O-CB 3.49Å; Q303-A307 PolarHBondContact O-N 2.88Å; R304-A307 PolarHBondContact O-N 2.98Å; Y305-A307 PolarHBondContact O-N 3.44Å; A307-I311 WeakPolarHBondContact O-CG1 3.46Å; A307-I311 PolarHBondContact O-N 2.91Å; A307-W359 HydrophobicContact CB-CZ2 4.2Å
308	Q	84.8	Confident	82.1	Confident	47 Å²	47	78.2 Å²	78.2	22%	0.22	36%	0.359	C	S	.	.	H	α-helix	trans	-68.2	-37.4	176.6	-72.4	-176.5	21	0	0	113	R304 Y305 Q306 R312	R304-Q308 WeakPolarHBondContact O-CG 3.27Å; R304-Q308 PolarHBondContact O-N 3.2Å; Y305-Q308 PolarHBondContact O-N 3.29Å; Q306-Q308 VanDerWaalsContact C-N 3.34Å; Q306-Q308 PolarHBondContact O-N 3.36Å; Q308-R312 WeakPolarHBondContact O-CG 3.41Å; Q308-R312 PolarHBondContact O-N 3.22Å; Q308-R312 VanDerWaalsContact OE1-NH2 3.08Å
309	L	84.3	Confident	82.6	Confident	25 Å²	25	78 Å²	78	13%	0.131	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-43.6	177.5	-81.6	175	0	0	0	111.5	L290 Y305 Q306 I311 R312 Q313	L290-L309 HydrophobicContact CB-CD1 4.01Å; L290-L309 HydrophobicContact CD1-CD1 3.3Å; L290-L309 HydrophobicContact CG-CD1 3.69Å; Y305-L309 HydrophobicContact CD1-CD1 3.55Å; Y305-L309 HydrophobicContact CD1-CG 4.22Å; Y305-L309 HydrophobicContact CE1-CD1 3.29Å; Y305-L309 HydrophobicContact CE1-CG 3.99Å; Y305-L309 HydrophobicContact CG-CD1 4.5Å; Y305-L309 WeakPolarHBondContact O-CB 3.23Å; Y305-L309 WeakPolarHBondContact O-CG 3.35Å; Y305-L309 PolarHBondContact O-N 3.16Å; Q306-L309 PolarHBondContact O-N 3.21Å; L309-I311 VanDerWaalsContact C-N 3.34Å; L309-I311 PolarHBondContact O-N 3.44Å; L309-R312 CarbonylContact O-C 3.6Å; L309-R312 PolarHBondContact O-N 3.46Å; L309-R312 VanDerWaalsContact O-N 3.08Å; L309-Q313 WeakPolarHBondContact O-CG 3.19Å; L309-Q313 PolarHBondContact O-N 2.93Å
310	R	85.5	Confident	83	Confident	162 Å²	162	75 Å²	75	61%	0.611	33%	0.33	S	S	*	.	H	α-helix	trans	-56.8	-46.4	176.7	-175.1	177	172.6	171.1	2.7	112.2	Q306 R312 Q313 E314	Q306-R310 PolarHBondContact O-N 2.97Å; R310-R312 VanDerWaalsContact C-N 3.29Å; R310-R312 PolarHBondContact O-N 3.25Å; R310-Q313 WeakPolarHBondContact O-CB 3.37Å; R310-Q313 PolarHBondContact O-N 3.3Å; R310-Q313 VanDerWaalsContact O-N 3.11Å; R310-E314 IonicContact CZ-OE1 3.72Å; R310-E314 IonicContact NE-OE1 3.61Å; R310-E314 PolarHBondContact NE-OE1 2.99Å; R310-E314 IonicContact NH2-OE1 2.74Å; R310-E314 PolarHBondContact O-N 2.89Å
311	I	87.4	Confident	83.4	Confident	24 Å²	24	75.3 Å²	75.3	12%	0.123	33%	0.333	C	S	.	.	H	α-helix	trans	-57.8	-42.2	176.3	-67.9	169.7	0	0	0	111.3	A307 L309 Y315 L348 Q351 L352 N355	A307-I311 WeakPolarHBondContact O-CG1 3.46Å; A307-I311 PolarHBondContact O-N 2.91Å; L309-I311 VanDerWaalsContact C-N 3.34Å; L309-I311 PolarHBondContact O-N 3.44Å; I311-Y315 PolarHBondContact O-N 3.41Å; I311-Y315 VanDerWaalsContact O-N 3.15Å; I311-L348 HydrophobicContact CG2-CD1 3.64Å; I311-Q351 HydrophobicContact CG2-CB 3.89Å; I311-L352 HydrophobicContact CB-CD2 4.21Å; I311-L352 HydrophobicContact CD1-CD2 4.34Å; I311-L352 HydrophobicContact CG2-CD2 3.8Å; I311-L352 HydrophobicContact CG2-CG 4Å; I311-N355 HydrophobicContact CD1-CB 3.67Å; I311-N355 VanDerWaalsContact CD1-ND2 3.26Å; I311-N355 WeakPolarHBondContact CD1-ND2 3.42Å
312	R	86.5	Confident	83.8	Confident	97 Å²	97	71.8 Å²	71.8	37%	0.366	32%	0.317	S	S	.	.	H	α-helix	trans	-71.7	-30.5	177.9	-65.8	176.1	-139.6	-95.5	4.5	112.8	Q308 L309 R310 R316	Q308-R312 WeakPolarHBondContact O-CG 3.41Å; Q308-R312 PolarHBondContact O-N 3.22Å; Q308-R312 VanDerWaalsContact OE1-NH2 3.08Å; L309-R312 CarbonylContact O-C 3.6Å; L309-R312 PolarHBondContact O-N 3.46Å; L309-R312 VanDerWaalsContact O-N 3.08Å; R310-R312 VanDerWaalsContact C-N 3.29Å; R310-R312 PolarHBondContact O-N 3.25Å; R312-R316 WeakPolarHBondContact O-CG 3.46Å; R312-R316 PolarHBondContact O-N 2.49Å; R312-R316 PolarHBondContact O-NE 2.76Å
313	Q	85	Confident	84	Confident	54 Å²	54	69.4 Å²	69.4	25%	0.252	31%	0.31	S	S	.	.	H	α-helix	trans	-68	-50.1	174.9	-75.8	173.9	-9.8	0	0	111	E286 L309 R310 Y315 R316 Q317	E286-Q313 VanDerWaalsContact OE2-CG 3.22Å; E286-Q313 WeakPolarHBondContact OE2-CG 3.4Å; E286-Q313 PolarHBondContact OE2-NE2 3.32Å; L309-Q313 WeakPolarHBondContact O-CG 3.19Å; L309-Q313 PolarHBondContact O-N 2.93Å; R310-Q313 WeakPolarHBondContact O-CB 3.37Å; R310-Q313 PolarHBondContact O-N 3.3Å; R310-Q313 VanDerWaalsContact O-N 3.11Å; Q313-Y315 VanDerWaalsContact C-N 3.33Å; Q313-Y315 PolarHBondContact O-N 3.49Å; Q313-R316 PolarHBondContact O-N 2.9Å; Q313-R316 VanDerWaalsContact O-N 3.1Å; Q313-Q317 WeakPolarHBondContact O-CG 3.18Å; Q313-Q317 PolarHBondContact O-N 3.17Å
314	E	85.8	Confident	84	Confident	67 Å²	67	67.9 Å²	67.9	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-58.3	-44.4	177.9	-71	175.1	-171	0	0	111.3	R310 R316 Q317 Q318	R310-E314 IonicContact CZ-OE1 3.72Å; R310-E314 IonicContact NE-OE1 3.61Å; R310-E314 PolarHBondContact NE-OE1 2.99Å; R310-E314 IonicContact NH2-OE1 2.74Å; R310-E314 PolarHBondContact O-N 2.89Å; E314-R316 PolarHBondContact O-N 3.24Å; E314-Q317 PolarHBondContact O-N 3.33Å; E314-Q318 WeakPolarHBondContact O-CG 3.46Å; E314-Q318 PolarHBondContact O-N 2.65Å
315	Y	89	Confident	84	Confident	41 Å²	41	69.1 Å²	69.1	16%	0.161	32%	0.316	C	S	.	.	H	α-helix	trans	-57.6	-44.8	173.8	169.8	-100.8	0	0	0	113	I311 Q313 Q318 L319 L344 L348	I311-Y315 PolarHBondContact O-N 3.41Å; I311-Y315 VanDerWaalsContact O-N 3.15Å; Q313-Y315 VanDerWaalsContact C-N 3.33Å; Q313-Y315 PolarHBondContact O-N 3.49Å; Y315-Q318 PolarHBondContact O-N 3.03Å; Y315-L319 HydrophobicContact CE1-CD1 3.96Å; Y315-L319 HydrophobicContact CE2-CD1 4.24Å; Y315-L319 WeakPolarHBondContact O-CB 3.43Å; Y315-L319 PolarHBondContact O-N 2.82Å; Y315-L319 VanDerWaalsContact OH-CD1 3.31Å; Y315-L319 WeakPolarHBondContact OH-CD1 3.49Å; Y315-L344 HydrophobicContact CD2-CB 4.22Å; Y315-L344 VanDerWaalsContact CE2-C 3.46Å; Y315-L344 HydrophobicContact CE2-CB 3.73Å; Y315-L344 WeakPolarHBondContact CE2-O 3.34Å; Y315-L348 HydrophobicContact CD1-CD2 3.69Å; Y315-L348 HydrophobicContact CD2-CB 3.7Å; Y315-L348 HydrophobicContact CD2-CD2 4.07Å; Y315-L348 HydrophobicContact CD2-CG 4.34Å; Y315-L348 HydrophobicContact CE1-CD2 3.89Å; Y315-L348 HydrophobicContact CE2-CB 4.09Å; Y315-L348 HydrophobicContact CE2-CD2 4.23Å; Y315-L348 HydrophobicContact CG-CB 4.06Å; Y315-L348 HydrophobicContact CG-CD1 4.2Å; Y315-L348 HydrophobicContact CG-CD2 3.78Å; Y315-L348 HydrophobicContact CG-CG 4.22Å
316	R	82.6	Confident	83.7	Confident	100 Å²	100	65.3 Å²	65.3	38%	0.377	30%	0.302	S	S	.	.	H	α-helix	trans	-67.4	-37.4	179.6	-77.9	179.3	-68.8	173.4	9.2	112.3	E286 R312 Q313 E314 L319 Q320	E286-R316 IonicContact OE1-CZ 2.93Å; E286-R316 IonicContact OE1-NH1 3.91Å; E286-R316 PolarHBondContact OE1-NH1 3.47Å; E286-R316 IonicContact OE1-NH2 3.91Å; E286-R316 PolarHBondContact OE1-NH2 2.75Å; E286-R316 IonicContact OE2-CZ 3Å; E286-R316 IonicContact OE2-NH2 3.7Å; E286-R316 PolarHBondContact OE2-NH2 3.5Å; R312-R316 WeakPolarHBondContact O-CG 3.46Å; R312-R316 PolarHBondContact O-N 2.49Å; R312-R316 PolarHBondContact O-NE 2.76Å; Q313-R316 PolarHBondContact O-N 2.9Å; Q313-R316 VanDerWaalsContact O-N 3.1Å; E314-R316 PolarHBondContact O-N 3.24Å; R316-L319 PolarHBondContact O-N 2.94Å; R316-Q320 WeakPolarHBondContact O-CG 3.11Å; R316-Q320 PolarHBondContact O-N 3.23Å
317	Q	84.6	Confident	83.4	Confident	105 Å²	105	68.3 Å²	68.3	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-62.6	-45.8	174.5	-73.1	178.4	-3.3	0	0	111.3	Q313 E314 L319 Q320 Q321	Q313-Q317 WeakPolarHBondContact O-CG 3.18Å; Q313-Q317 PolarHBondContact O-N 3.17Å; E314-Q317 PolarHBondContact O-N 3.33Å; Q317-L319 VanDerWaalsContact C-N 3.31Å; Q317-L319 PolarHBondContact O-N 3.36Å; Q317-Q320 PolarHBondContact O-N 2.92Å; Q317-Q321 WeakPolarHBondContact O-CG 3.17Å; Q317-Q321 PolarHBondContact O-N 2.96Å
318	Q	86.3	Confident	82.7	Confident	90 Å²	90	74.4 Å²	74.4	42%	0.421	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-39.9	175.8	-71	179	6	0	0	111.9	E314 Y315 Q321 L322 L344	E314-Q318 WeakPolarHBondContact O-CG 3.46Å; E314-Q318 PolarHBondContact O-N 2.65Å; Y315-Q318 PolarHBondContact O-N 3.03Å; Q318-Q321 PolarHBondContact O-N 2.88Å; Q318-L322 WeakPolarHBondContact O-CB 3.44Å; Q318-L322 PolarHBondContact O-N 3.36Å; Q318-L344 HydrophobicContact CB-CD1 4.45Å; Q318-L344 HydrophobicContact CB-CD2 4.21Å
319	L	85.8	Confident	82.1	Confident	40 Å²	40	79.9 Å²	79.9	21%	0.209	36%	0.357	C	S	.	.	H	α-helix	trans	-67.7	-38.8	178.8	-161.8	137.7	0	0	0	112.1	Y315 R316 Q317 L322 E323	Y315-L319 HydrophobicContact CE1-CD1 3.96Å; Y315-L319 HydrophobicContact CE2-CD1 4.24Å; Y315-L319 WeakPolarHBondContact O-CB 3.43Å; Y315-L319 PolarHBondContact O-N 2.82Å; Y315-L319 VanDerWaalsContact OH-CD1 3.31Å; Y315-L319 WeakPolarHBondContact OH-CD1 3.49Å; R316-L319 PolarHBondContact O-N 2.94Å; Q317-L319 VanDerWaalsContact C-N 3.31Å; Q317-L319 PolarHBondContact O-N 3.36Å; L319-L322 PolarHBondContact O-N 3.41Å; L319-E323 WeakPolarHBondContact O-CB 3.5Å; L319-E323 PolarHBondContact O-N 3.28Å
320	Q	81.9	Confident	81.6	Confident	43 Å²	43	81.7 Å²	81.7	20%	0.201	38%	0.381	C	S	.	.	H	α-helix	trans	-67.5	-39.6	173.3	-76.9	177.4	4.5	0	0	113	D279 R316 Q317 L322 E323 N324	D279-Q320 PolarHBondContact OD1-OE1 3.07Å; R316-Q320 WeakPolarHBondContact O-CG 3.11Å; R316-Q320 PolarHBondContact O-N 3.23Å; Q317-Q320 PolarHBondContact O-N 2.92Å; Q320-L322 VanDerWaalsContact C-N 3.35Å; Q320-E323 PolarHBondContact O-N 3.07Å; Q320-N324 WeakPolarHBondContact O-CB 3.4Å; Q320-N324 PolarHBondContact O-N 3.4Å; Q320-N324 PolarHBondContact O-ND2 3.38Å
321	Q	82.7	Confident	81.2	Confident	124 Å²	124	76.6 Å²	76.6	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-61.4	-46.5	173.4	-74.9	179	-2.5	0	0	110.7	Q317 Q318 E323 N324 D325	Q317-Q321 WeakPolarHBondContact O-CG 3.17Å; Q317-Q321 PolarHBondContact O-N 2.96Å; Q318-Q321 PolarHBondContact O-N 2.88Å; Q321-E323 VanDerWaalsContact C-N 3.32Å; Q321-E323 PolarHBondContact O-N 3.37Å; Q321-N324 PolarHBondContact O-N 2.92Å; Q321-D325 WeakPolarHBondContact O-CB 3.47Å; Q321-D325 PolarHBondContact O-N 3.09Å
322	L	84	Confident	80.7	Confident	38 Å²	38	80.6 Å²	80.6	20%	0.199	38%	0.383	C	S	.	.	H	α-helix	trans	-58.6	-43.7	175.2	-178.3	67.5	0	0	0	111.6	Q318 L319 Q320 S326 Y337 A340 E341 L344	Q318-L322 WeakPolarHBondContact O-CB 3.44Å; Q318-L322 PolarHBondContact O-N 3.36Å; L319-L322 PolarHBondContact O-N 3.41Å; Q320-L322 VanDerWaalsContact C-N 3.35Å; L322-S326 WeakPolarHBondContact O-CB 3.26Å; L322-S326 PolarHBondContact O-N 2.95Å; L322-S326 PolarHBondContact O-OG 3.42Å; L322-Y337 HydrophobicContact CD2-CD2 4.38Å; L322-Y337 HydrophobicContact CD2-CE2 4.11Å; L322-Y337 HydrophobicContact CG-CD2 4.15Å; L322-Y337 HydrophobicContact CG-CE2 3.87Å; L322-A340 HydrophobicContact CD1-CB 3.99Å; L322-A340 HydrophobicContact CD2-CB 3.72Å; L322-A340 HydrophobicContact CG-CB 4.49Å; L322-E341 HydrophobicContact CD2-CG 4.16Å; L322-L344 HydrophobicContact CB-CD1 4.41Å; L322-L344 HydrophobicContact CD2-CD1 3.69Å
323	E	82.3	Confident	80.3	Confident	47 Å²	47	77.9 Å²	77.9	22%	0.22	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-49	176.6	-178	178.2	176.2	0	0	111.6	L319 Q320 Q321 S326 R327 Y332	L319-E323 WeakPolarHBondContact O-CB 3.5Å; L319-E323 PolarHBondContact O-N 3.28Å; Q320-E323 PolarHBondContact O-N 3.07Å; Q321-E323 VanDerWaalsContact C-N 3.32Å; Q321-E323 PolarHBondContact O-N 3.37Å; E323-S326 PolarHBondContact O-N 3.46Å; E323-R327 HydrophobicContact CG-CG 4.42Å; E323-R327 WeakPolarHBondContact O-CB 3.21Å; E323-R327 VanDerWaalsContact O-CG 3.31Å; E323-R327 WeakPolarHBondContact O-CG 3.47Å; E323-R327 PolarHBondContact O-N 3.43Å; E323-R327 IonicContact OE1-CZ 3.42Å; E323-R327 IonicContact OE1-NE 2.91Å; E323-R327 PolarHBondContact OE1-NE 2.94Å; E323-R327 IonicContact OE1-NH2 3.99Å; E323-R327 PolarHBondContact OE1-NH2 3.39Å; E323-Y332 HydrophobicContact CG-CD2 4.16Å; E323-Y332 HydrophobicContact CG-CE2 3.81Å
324	N	78	Confident	80.3	Confident	69 Å²	69	77.7 Å²	77.7	37%	0.369	39%	0.388	S	S	.	.	H	α-helix	trans	-61.8	-47.2	-179.5	-74	-25.4	0	0	0	111.7	Q320 Q321 S326 R327 Q328	Q320-N324 WeakPolarHBondContact O-CB 3.4Å; Q320-N324 PolarHBondContact O-N 3.4Å; Q320-N324 PolarHBondContact O-ND2 3.38Å; Q321-N324 PolarHBondContact O-N 2.92Å; N324-S326 VanDerWaalsContact C-N 3.31Å; N324-S326 PolarHBondContact O-N 3.19Å; N324-R327 PolarHBondContact O-N 2.88Å; N324-Q328 WeakPolarHBondContact O-CB 3.45Å; N324-Q328 VanDerWaalsContact O-CG 3.29Å; N324-Q328 WeakPolarHBondContact O-CG 3.43Å; N324-Q328 PolarHBondContact O-N 2.93Å
325	D	78.9	Confident	80.3	Confident	82 Å²	82	79 Å²	79	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-63.3	-39.9	177.6	-75.8	-4.4	0	0	0	111.4	Q321 Q328 K329	Q321-D325 WeakPolarHBondContact O-CB 3.47Å; Q321-D325 PolarHBondContact O-N 3.09Å; D325-Q328 PolarHBondContact O-N 3.49Å; D325-K329 WeakPolarHBondContact O-CB 3.42Å; D325-K329 WeakPolarHBondContact O-CG 3.41Å; D325-K329 PolarHBondContact O-N 3.5Å
326	S	77.3	Confident	80	Confident	7 Å²	7	82.4 Å²	82.4	5%	0.049	42%	0.415	C	S	.	.	H	α-helix	trans	-72.6	-36	-179.4	-59.8	0	0	0	0	112.5	L322 E323 N324 G330 T331 Y332 Y337	L322-S326 WeakPolarHBondContact O-CB 3.26Å; L322-S326 PolarHBondContact O-N 2.95Å; L322-S326 PolarHBondContact O-OG 3.42Å; E323-S326 PolarHBondContact O-N 3.46Å; N324-S326 VanDerWaalsContact C-N 3.31Å; N324-S326 PolarHBondContact O-N 3.19Å; S326-G330 CarbonylContact O-C 3.45Å; S326-G330 WeakPolarHBondContact O-CA 3.42Å; S326-G330 PolarHBondContact O-N 3.03Å; S326-T331 WeakPolarHBondContact CA-OG1 3.31Å; S326-T331 WeakPolarHBondContact CB-OG1 3.32Å; S326-T331 PolarHBondContact O-N 3.35Å; S326-Y332 PolarHBondContact O-N 2.98Å; S326-Y332 VanDerWaalsContact O-N 3.09Å; S326-Y337 VanDerWaalsContact OG-CD2 3.27Å; S326-Y337 WeakPolarHBondContact OG-CD2 3.36Å
327	R	75.3	Confident	80	Confident	142 Å²	142	78.2 Å²	78.2	54%	0.536	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-40.9	172.2	-75.2	177	-179	-101.6	5.4	111.2	E323 N324 G330 Y332	E323-R327 HydrophobicContact CG-CG 4.42Å; E323-R327 WeakPolarHBondContact O-CB 3.21Å; E323-R327 VanDerWaalsContact O-CG 3.31Å; E323-R327 WeakPolarHBondContact O-CG 3.47Å; E323-R327 PolarHBondContact O-N 3.43Å; E323-R327 IonicContact OE1-CZ 3.42Å; E323-R327 IonicContact OE1-NE 2.91Å; E323-R327 PolarHBondContact OE1-NE 2.94Å; E323-R327 IonicContact OE1-NH2 3.99Å; E323-R327 PolarHBondContact OE1-NH2 3.39Å; N324-R327 PolarHBondContact O-N 2.88Å; R327-G330 PolarHBondContact O-N 3.31Å; R327-Y332 HydrophobicContact CG-CD2 4.09Å; R327-Y332 HydrophobicContact CG-CG 3.93Å
328	Q	68.3	Low	80.2	Confident	158 Å²	158	79.2 Å²	79.2	74%	0.738	40%	0.398	S	S	*	.	H	α-helix	trans	-66.4	-39.9	177.2	-73.8	177.8	26.3	0	0	112.7	N324 D325 G330	N324-Q328 WeakPolarHBondContact O-CB 3.45Å; N324-Q328 VanDerWaalsContact O-CG 3.29Å; N324-Q328 WeakPolarHBondContact O-CG 3.43Å; N324-Q328 PolarHBondContact O-N 2.93Å; D325-Q328 PolarHBondContact O-N 3.49Å; Q328-G330 VanDerWaalsContact C-N 3.33Å
329	K	72.7	Confident	80.3	Confident	162 Å²	162	81.8 Å²	81.8	70%	0.704	40%	0.404	S	S	*	.	H	α-helix	trans	-83.9	-6.3	178.3	-67.6	177.1	-177.9	172.6	0	113.7	D325 T331	D325-K329 WeakPolarHBondContact O-CB 3.42Å; D325-K329 WeakPolarHBondContact O-CG 3.41Å; D325-K329 PolarHBondContact O-N 3.5Å; K329-T331 HydrophobicContact CB-CG2 4.32Å; K329-T331 PolarHBondContact O-N 3.34Å
330	G	73.4	Confident	80.4	Confident	63 Å²	63	81.4 Å²	81.4	65%	0.649	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	14.8	-176.3	0	0	0	0	0	114.4	S326 R327 Q328 Y332	S326-G330 CarbonylContact O-C 3.45Å; S326-G330 WeakPolarHBondContact O-CA 3.42Å; S326-G330 PolarHBondContact O-N 3.03Å; R327-G330 PolarHBondContact O-N 3.31Å; Q328-G330 VanDerWaalsContact C-N 3.33Å; G330-Y332 VanDerWaalsContact C-N 3.34Å
331	T	77.8	Confident	80.6	Confident	55 Å²	55	82.3 Å²	82.3	34%	0.337	41%	0.411	S	S	.	.			trans	-90.4	1.6	176.4	57.2	0	0	0	0	112.7	S326 K329 G333 T334 Y337	S326-T331 WeakPolarHBondContact CA-OG1 3.31Å; S326-T331 WeakPolarHBondContact CB-OG1 3.32Å; S326-T331 PolarHBondContact O-N 3.35Å; K329-T331 HydrophobicContact CB-CG2 4.32Å; K329-T331 PolarHBondContact O-N 3.34Å; T331-G333 PolarHBondContact O-N 3.32Å; T331-T334 WeakPolarHBondContact O-CB 3.33Å; T331-T334 WeakPolarHBondContact O-CG2 3.47Å; T331-T334 PolarHBondContact O-N 3.02Å; T331-T334 PolarHBondContact O-OG1 2.84Å; T331-Y337 WeakPolarHBondContact O-CB 3.47Å
332	Y	77.1	Confident	80.9	Confident	108 Å²	108	82.8 Å²	82.8	42%	0.424	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	127.6	178.3	-176.6	-102.3	0	0	0	111.4	E323 S326 R327 G330 T334 Y337	E323-Y332 HydrophobicContact CG-CD2 4.16Å; E323-Y332 HydrophobicContact CG-CE2 3.81Å; S326-Y332 PolarHBondContact O-N 2.98Å; S326-Y332 VanDerWaalsContact O-N 3.09Å; R327-Y332 HydrophobicContact CG-CD2 4.09Å; R327-Y332 HydrophobicContact CG-CG 3.93Å; G330-Y332 VanDerWaalsContact C-N 3.34Å; Y332-T334 VanDerWaalsContact C-N 3.3Å; Y332-T334 PolarHBondContact O-N 2.87Å; Y332-Y337 HydrophobicContact CD2-CD2 4.43Å; Y332-Y337 HydrophobicContact CD2-CE1 4.12Å; Y332-Y337 AromaticContact CD2-CE2 3.97Å; Y332-Y337 HydrophobicContact CD2-CE2 3.97Å; Y332-Y337 AromaticContact CD2-CZ 3.83Å; Y332-Y337 AromaticContact CE2-CE1 3.91Å; Y332-Y337 HydrophobicContact CE2-CE1 3.91Å; Y332-Y337 HydrophobicContact CE2-CE2 4.28Å; Y332-Y337 AromaticContact CE2-CZ 3.69Å
333	G	78.4	Confident	81.2	Confident	41 Å²	41	85.7 Å²	85.7	42%	0.423	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	2.4	-179.2	0	0	0	0	0	115.4	T331	T331-G333 PolarHBondContact O-N 3.32Å
334	T	84.4	Confident	81.5	Confident	50 Å²	50	84.8 Å²	84.8	31%	0.307	43%	0.429	S	S	.	.	S	Bend	trans	-71.4	167.2	169.3	66.9	0	0	0	0	111.2	T331 Y332 D336 Y337 R338	T331-T334 WeakPolarHBondContact O-CB 3.33Å; T331-T334 WeakPolarHBondContact O-CG2 3.47Å; T331-T334 PolarHBondContact O-N 3.02Å; T331-T334 PolarHBondContact O-OG1 2.84Å; Y332-T334 VanDerWaalsContact C-N 3.3Å; Y332-T334 PolarHBondContact O-N 2.87Å; T334-D336 VanDerWaalsContact C-N 3.26Å; T334-D336 PolarHBondContact O-N 3.32Å; T334-Y337 PolarHBondContact O-N 2.9Å; T334-Y337 PolarHBondContact OG1-N 3.38Å; T334-R338 PolarHBondContact O-N 3.26Å
335	E	85	Confident	82.1	Confident	95 Å²	95	88.2 Å²	88.2	44%	0.444	44%	0.441	S	S	.	.	H	α-helix	trans	-63.5	-34.2	175	-169.7	59.7	-165.2	0	0	112.1	Y337 R338 R339	E335-Y337 PolarHBondContact O-N 2.82Å; E335-R338 PolarHBondContact O-N 2.96Å; E335-R338 IonicContact OE2-NH1 3.93Å; E335-R338 PolarHBondContact OE2-NH1 3.39Å; E335-R339 WeakPolarHBondContact O-CG 3.33Å; E335-R339 PolarHBondContact O-N 3.13Å
336	D	82.7	Confident	82.7	Confident	112 Å²	112	85.9 Å²	85.9	60%	0.599	44%	0.436	S	S	*	.	H	α-helix	trans	-65.1	-38.9	176	-62.9	-41.4	0	0	0	112.1	T334 R339 A340	T334-D336 VanDerWaalsContact C-N 3.26Å; T334-D336 PolarHBondContact O-N 3.32Å; D336-R339 PolarHBondContact O-N 2.84Å; D336-A340 WeakPolarHBondContact O-CB 3.36Å; D336-A340 PolarHBondContact O-N 3.39Å
337	Y	84.2	Confident	83.3	Confident	11 Å²	11	87 Å²	87	4%	0.043	44%	0.444	C	S	.	.	H	α-helix	trans	-61.7	-45	173.4	176	-96.5	0	0	0	111.4	L322 S326 T331 Y332 T334 E335 R339 A340 E341	L322-Y337 HydrophobicContact CD2-CD2 4.38Å; L322-Y337 HydrophobicContact CD2-CE2 4.11Å; L322-Y337 HydrophobicContact CG-CD2 4.15Å; L322-Y337 HydrophobicContact CG-CE2 3.87Å; S326-Y337 VanDerWaalsContact OG-CD2 3.27Å; S326-Y337 WeakPolarHBondContact OG-CD2 3.36Å; T331-Y337 WeakPolarHBondContact O-CB 3.47Å; Y332-Y337 HydrophobicContact CD2-CD2 4.43Å; Y332-Y337 HydrophobicContact CD2-CE1 4.12Å; Y332-Y337 AromaticContact CD2-CE2 3.97Å; Y332-Y337 HydrophobicContact CD2-CE2 3.97Å; Y332-Y337 AromaticContact CD2-CZ 3.83Å; Y332-Y337 AromaticContact CE2-CE1 3.91Å; Y332-Y337 HydrophobicContact CE2-CE1 3.91Å; Y332-Y337 HydrophobicContact CE2-CE2 4.28Å; Y332-Y337 AromaticContact CE2-CZ 3.69Å; T334-Y337 PolarHBondContact O-N 2.9Å; T334-Y337 PolarHBondContact OG1-N 3.38Å; E335-Y337 PolarHBondContact O-N 2.82Å; Y337-R339 PolarHBondContact O-N 2.84Å; Y337-A340 WeakPolarHBondContact O-CB 3.44Å; Y337-A340 PolarHBondContact O-N 3.48Å; Y337-E341 HydrophobicContact CD1-CG 4.29Å; Y337-E341 HydrophobicContact CE1-CG 3.78Å; Y337-E341 WeakPolarHBondContact CE1-OE1 3.38Å; Y337-E341 HydrophobicContact CE2-CG 4.48Å; Y337-E341 PolarHBondContact O-N 2.89Å; Y337-E341 PolarHBondContact OH-OE1 3.29Å
338	R	87.7	Confident	84	Confident	126 Å²	126	81.7 Å²	81.7	48%	0.475	43%	0.426	S	S	.	.	H	α-helix	trans	-62	-42.5	176.5	-69.7	-173.8	-172.9	132.7	4.2	112.5	T334 E335 A340 E341 E342	T334-R338 PolarHBondContact O-N 3.26Å; E335-R338 PolarHBondContact O-N 2.96Å; E335-R338 IonicContact OE2-NH1 3.93Å; E335-R338 PolarHBondContact OE2-NH1 3.39Å; R338-A340 VanDerWaalsContact C-N 3.31Å; R338-A340 PolarHBondContact O-N 3.44Å; R338-E341 WeakPolarHBondContact O-CB 3.49Å; R338-E341 PolarHBondContact O-N 3.27Å; R338-E342 WeakPolarHBondContact O-CG 3.41Å; R338-E342 PolarHBondContact O-N 2.95Å
339	R	89	Confident	85.1	Confident	145 Å²	145	81.3 Å²	81.3	55%	0.547	42%	0.421	S	S	.	.	H	α-helix	trans	-60.6	-42	174.9	-72.2	173.1	-179.9	-177.9	-2.2	111.5	E335 D336 Y337 E342 V343	E335-R339 WeakPolarHBondContact O-CG 3.33Å; E335-R339 PolarHBondContact O-N 3.13Å; D336-R339 PolarHBondContact O-N 2.84Å; Y337-R339 PolarHBondContact O-N 2.84Å; R339-E342 PolarHBondContact O-N 2.97Å; R339-V343 VanDerWaalsContact O-CG2 3.31Å; R339-V343 WeakPolarHBondContact O-CG2 3.36Å; R339-V343 PolarHBondContact O-N 3.29Å
340	A	86.8	Confident	86	Confident	32 Å²	32	81.5 Å²	81.5	26%	0.264	42%	0.418	S	S	.	.	H	α-helix	trans	-63.1	-43.1	175.4	0	0	0	0	0	111.8	L322 D336 Y337 R338 E342 V343 L344	L322-A340 HydrophobicContact CD1-CB 3.99Å; L322-A340 HydrophobicContact CD2-CB 3.72Å; L322-A340 HydrophobicContact CG-CB 4.49Å; D336-A340 WeakPolarHBondContact O-CB 3.36Å; D336-A340 PolarHBondContact O-N 3.39Å; Y337-A340 WeakPolarHBondContact O-CB 3.44Å; Y337-A340 PolarHBondContact O-N 3.48Å; R338-A340 VanDerWaalsContact C-N 3.31Å; R338-A340 PolarHBondContact O-N 3.44Å; A340-E342 PolarHBondContact O-N 3.41Å; A340-V343 PolarHBondContact O-N 3.34Å; A340-L344 WeakPolarHBondContact O-CG 3.38Å; A340-L344 PolarHBondContact O-N 2.91Å
341	E	86.2	Confident	86.7	Confident	61 Å²	61	81.8 Å²	81.8	29%	0.285	40%	0.402	S	S	.	.	H	α-helix	trans	-60.5	-42.3	172.9	-73.2	-171.3	149.1	0	0	112.4	L322 Y337 R338 V343 L344 K345	L322-E341 HydrophobicContact CD2-CG 4.16Å; Y337-E341 HydrophobicContact CD1-CG 4.29Å; Y337-E341 HydrophobicContact CE1-CG 3.78Å; Y337-E341 WeakPolarHBondContact CE1-OE1 3.38Å; Y337-E341 HydrophobicContact CE2-CG 4.48Å; Y337-E341 PolarHBondContact O-N 2.89Å; Y337-E341 PolarHBondContact OH-OE1 3.29Å; R338-E341 WeakPolarHBondContact O-CB 3.49Å; R338-E341 PolarHBondContact O-N 3.27Å; E341-V343 PolarHBondContact O-N 3.47Å; E341-L344 PolarHBondContact O-N 3.48Å; E341-K345 VanDerWaalsContact O-CB 3.3Å; E341-K345 WeakPolarHBondContact O-CB 3.5Å; E341-K345 PolarHBondContact O-N 2.95Å
342	E	89.7	Confident	87.2	Confident	134 Å²	134	80.5 Å²	80.5	63%	0.626	39%	0.393	S	S	*	.	H	α-helix	trans	-62.6	-41.5	176.7	-76.7	-178	177	0	0	112.2	R338 R339 A340 K345 G346	R338-E342 WeakPolarHBondContact O-CG 3.41Å; R338-E342 PolarHBondContact O-N 2.95Å; R339-E342 PolarHBondContact O-N 2.97Å; A340-E342 PolarHBondContact O-N 3.41Å; E342-K345 PolarHBondContact O-N 2.93Å; E342-G346 PolarHBondContact O-N 2.92Å
343	V	90.4	Very high	87.8	Confident	99 Å²	99	79 Å²	79	60%	0.6	39%	0.393	S	S	*	.	H	α-helix	trans	-62.2	-46.3	174.9	170.5	0	0	0	0	110.8	R339 A340 E341 K345 G346 S347	R339-V343 VanDerWaalsContact O-CG2 3.31Å; R339-V343 WeakPolarHBondContact O-CG2 3.36Å; R339-V343 PolarHBondContact O-N 3.29Å; A340-V343 PolarHBondContact O-N 3.34Å; E341-V343 PolarHBondContact O-N 3.47Å; V343-K345 VanDerWaalsContact C-N 3.35Å; V343-K345 PolarHBondContact O-N 3.42Å; V343-G346 PolarHBondContact O-N 2.9Å; V343-S347 PolarHBondContact O-N 3.41Å
344	L	88.5	Confident	88.3	Confident	29 Å²	29	83.6 Å²	83.6	15%	0.152	40%	0.403	C	S	.	.	H	α-helix	trans	-60.9	-44.6	176.2	-70.7	179.2	0	0	0	111.1	Y315 Q318 L322 A340 E341 G346 S347 L348	Y315-L344 HydrophobicContact CD2-CB 4.22Å; Y315-L344 VanDerWaalsContact CE2-C 3.46Å; Y315-L344 HydrophobicContact CE2-CB 3.73Å; Y315-L344 WeakPolarHBondContact CE2-O 3.34Å; Q318-L344 HydrophobicContact CB-CD1 4.45Å; Q318-L344 HydrophobicContact CB-CD2 4.21Å; L322-L344 HydrophobicContact CB-CD1 4.41Å; L322-L344 HydrophobicContact CD2-CD1 3.69Å; A340-L344 WeakPolarHBondContact O-CG 3.38Å; A340-L344 PolarHBondContact O-N 2.91Å; E341-L344 PolarHBondContact O-N 3.48Å; L344-G346 VanDerWaalsContact C-N 3.34Å; L344-G346 PolarHBondContact O-N 3.38Å; L344-S347 WeakPolarHBondContact O-CB 3.27Å; L344-S347 PolarHBondContact O-N 3.09Å; L344-L348 PolarHBondContact O-N 3.43Å
345	K	90.4	Very high	88.3	Confident	141 Å²	141	82.2 Å²	82.2	61%	0.613	39%	0.394	S	S	*	.	H	α-helix	trans	-64.8	-39.2	179.2	-174.1	178.1	-179.8	-180	0	111.7	E341 E342 V343 L348 K349	E341-K345 VanDerWaalsContact O-CB 3.3Å; E341-K345 WeakPolarHBondContact O-CB 3.5Å; E341-K345 PolarHBondContact O-N 2.95Å; E342-K345 PolarHBondContact O-N 2.93Å; V343-K345 VanDerWaalsContact C-N 3.35Å; V343-K345 PolarHBondContact O-N 3.42Å; K345-L348 PolarHBondContact O-N 2.93Å; K345-K349 PolarHBondContact O-N 3.01Å; K345-K349 VanDerWaalsContact O-N 3.07Å
346	G	92.5	Very high	88.2	Confident	32 Å²	32	83.1 Å²	83.1	33%	0.33	40%	0.396	S	S	.	.	H	α-helix	trans	-62.3	-41.8	172.2	0	0	0	0	0	112.1	E342 V343 L344 K349 R350	E342-G346 PolarHBondContact O-N 2.92Å; V343-G346 PolarHBondContact O-N 2.9Å; L344-G346 VanDerWaalsContact C-N 3.34Å; L344-G346 PolarHBondContact O-N 3.38Å; G346-K349 PolarHBondContact O-N 2.98Å; G346-R350 WeakPolarHBondContact O-CG 3.35Å; G346-R350 PolarHBondContact O-N 2.85Å; G346-R350 VanDerWaalsContact O-N 3.1Å
347	S	88.5	Confident	88.4	Confident	32 Å²	32	86 Å²	86	22%	0.224	40%	0.398	C	S	.	.	H	α-helix	trans	-60.2	-49.4	173.7	-165.6	0	0	0	0	112	V343 L344 K349 R350 Q351	V343-S347 PolarHBondContact O-N 3.41Å; L344-S347 WeakPolarHBondContact O-CB 3.27Å; L344-S347 PolarHBondContact O-N 3.09Å; S347-K349 VanDerWaalsContact C-N 3.3Å; S347-K349 PolarHBondContact O-N 2.98Å; S347-R350 WeakPolarHBondContact O-CB 3.4Å; S347-R350 PolarHBondContact O-N 3.38Å; S347-R350 VanDerWaalsContact O-N 3.09Å; S347-Q351 PolarHBondContact O-N 3.47Å
348	L	89.9	Confident	88.3	Confident	29 Å²	29	91.5 Å²	91.5	15%	0.152	42%	0.42	C	S	.	.	H	α-helix	trans	-55.1	-45.4	176.5	173.4	64.9	0	0	0	111.8	I311 Y315 L344 K345 R350 Q351 L352	I311-L348 HydrophobicContact CG2-CD1 3.64Å; Y315-L348 HydrophobicContact CD1-CD2 3.69Å; Y315-L348 HydrophobicContact CD2-CB 3.7Å; Y315-L348 HydrophobicContact CD2-CD2 4.07Å; Y315-L348 HydrophobicContact CD2-CG 4.34Å; Y315-L348 HydrophobicContact CE1-CD2 3.89Å; Y315-L348 HydrophobicContact CE2-CB 4.09Å; Y315-L348 HydrophobicContact CE2-CD2 4.23Å; Y315-L348 HydrophobicContact CG-CB 4.06Å; Y315-L348 HydrophobicContact CG-CD1 4.2Å; Y315-L348 HydrophobicContact CG-CD2 3.78Å; Y315-L348 HydrophobicContact CG-CG 4.22Å; L344-L348 PolarHBondContact O-N 3.43Å; K345-L348 PolarHBondContact O-N 2.93Å; L348-R350 VanDerWaalsContact C-N 3.33Å; L348-R350 PolarHBondContact O-N 2.95Å; L348-Q351 PolarHBondContact O-N 3.26Å; L348-L352 HydrophobicContact CD1-CD1 3.85Å; L348-L352 HydrophobicContact CD1-CG 3.97Å; L348-L352 HydrophobicContact CG-CD1 3.97Å; L348-L352 HydrophobicContact CG-CG 4.44Å; L348-L352 WeakPolarHBondContact O-CB 3.3Å; L348-L352 WeakPolarHBondContact O-CG 3.44Å; L348-L352 PolarHBondContact O-N 3.37Å
349	K	92.4	Very high	87.9	Confident	150 Å²	150	86.8 Å²	86.8	65%	0.652	40%	0.402	S	S	*	.	H	α-helix	trans	-62.9	-40.3	179.2	-171.4	175.3	-179.6	178.4	0	111.7	K345 G346 S347 N353	K345-K349 PolarHBondContact O-N 3.01Å; K345-K349 VanDerWaalsContact O-N 3.07Å; G346-K349 PolarHBondContact O-N 2.98Å; S347-K349 VanDerWaalsContact C-N 3.3Å; S347-K349 PolarHBondContact O-N 2.98Å; K349-N353 WeakPolarHBondContact O-CB 3.44Å; K349-N353 VanDerWaalsContact O-CG 3.27Å; K349-N353 PolarHBondContact O-N 3.33Å
350	R	90.8	Very high	87.5	Confident	167 Å²	167	85.6 Å²	85.6	63%	0.63	40%	0.403	S	S	*	.	H	α-helix	trans	-63.8	-50.5	175.8	-73.1	-174.5	-68.4	-168.7	0.8	111.4	G346 S347 L348 L352 N353 E354	G346-R350 WeakPolarHBondContact O-CG 3.35Å; G346-R350 PolarHBondContact O-N 2.85Å; G346-R350 VanDerWaalsContact O-N 3.1Å; S347-R350 WeakPolarHBondContact O-CB 3.4Å; S347-R350 PolarHBondContact O-N 3.38Å; S347-R350 VanDerWaalsContact O-N 3.09Å; L348-R350 VanDerWaalsContact C-N 3.33Å; L348-R350 PolarHBondContact O-N 2.95Å; R350-L352 PolarHBondContact O-N 3.41Å; R350-N353 PolarHBondContact O-N 2.89Å; R350-N353 VanDerWaalsContact O-N 3.14Å; R350-E354 WeakPolarHBondContact O-CB 3.15Å; R350-E354 PolarHBondContact O-N 3.03Å
351	Q	87.5	Confident	87.1	Confident	68 Å²	68	90.2 Å²	90.2	32%	0.318	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-42.4	178.9	-71.5	-178.5	-19.7	0	0	112.7	I311 S347 L348 N353 E354 N355	I311-Q351 HydrophobicContact CG2-CB 3.89Å; S347-Q351 PolarHBondContact O-N 3.47Å; L348-Q351 PolarHBondContact O-N 3.26Å; Q351-N353 VanDerWaalsContact C-N 3.34Å; Q351-N353 PolarHBondContact O-N 3.05Å; Q351-E354 PolarHBondContact O-N 2.83Å; Q351-N355 VanDerWaalsContact O-CB 3.28Å; Q351-N355 WeakPolarHBondContact O-CB 3.42Å; Q351-N355 PolarHBondContact O-N 3.37Å
352	L	88.1	Confident	86.5	Confident	28 Å²	28	89.5 Å²	89.5	15%	0.147	42%	0.417	C	S	.	.	H	α-helix	trans	-65.4	-37.3	176.1	-72.7	175.9	0	0	0	112.3	I311 L348 R350 K356	I311-L352 HydrophobicContact CB-CD2 4.21Å; I311-L352 HydrophobicContact CD1-CD2 4.34Å; I311-L352 HydrophobicContact CG2-CD2 3.8Å; I311-L352 HydrophobicContact CG2-CG 4Å; L348-L352 HydrophobicContact CD1-CD1 3.85Å; L348-L352 HydrophobicContact CD1-CG 3.97Å; L348-L352 HydrophobicContact CG-CD1 3.97Å; L348-L352 HydrophobicContact CG-CG 4.44Å; L348-L352 WeakPolarHBondContact O-CB 3.3Å; L348-L352 WeakPolarHBondContact O-CG 3.44Å; L348-L352 PolarHBondContact O-N 3.37Å; R350-L352 PolarHBondContact O-N 3.41Å; L352-K356 WeakPolarHBondContact O-CG 3.5Å; L352-K356 PolarHBondContact O-N 3.04Å
353	N	90.9	Very high	85.5	Confident	77 Å²	77	87.8 Å²	87.8	41%	0.412	41%	0.409	S	S	.	.	H	α-helix	trans	-70.2	-40.5	176.7	-79.3	-9.4	0	0	0	112.1	K349 R350 Q351 K356 R357	K349-N353 WeakPolarHBondContact O-CB 3.44Å; K349-N353 VanDerWaalsContact O-CG 3.27Å; K349-N353 PolarHBondContact O-N 3.33Å; R350-N353 PolarHBondContact O-N 2.89Å; R350-N353 VanDerWaalsContact O-N 3.14Å; Q351-N353 VanDerWaalsContact C-N 3.34Å; Q351-N353 PolarHBondContact O-N 3.05Å; N353-K356 WeakPolarHBondContact O-CB 3.46Å; N353-K356 PolarHBondContact O-N 3.45Å; N353-R357 PolarHBondContact O-N 3.11Å
354	E	87.7	Confident	84.6	Confident	138 Å²	138	87.7 Å²	87.7	65%	0.645	41%	0.408	S	S	*	.	H	α-helix	trans	-63.6	-45.6	174.9	-172.9	176.5	-180	0	0	111.1	R350 Q351 K356 R357 Y358	R350-E354 WeakPolarHBondContact O-CB 3.15Å; R350-E354 PolarHBondContact O-N 3.03Å; Q351-E354 PolarHBondContact O-N 2.83Å; E354-K356 VanDerWaalsContact C-N 3.3Å; E354-K356 PolarHBondContact O-N 2.91Å; E354-R357 PolarHBondContact O-N 2.87Å; E354-R357 VanDerWaalsContact O-N 3.12Å; E354-Y358 PolarHBondContact O-N 3.09Å
355	N	84.9	Confident	83.2	Confident	20 Å²	20	88.2 Å²	88.2	11%	0.107	42%	0.417	C	S	.	.	H	α-helix	trans	-58.4	-41.7	174.4	-169.6	12.8	0	0	0	111.4	I311 Q351 Y358 W359	I311-N355 HydrophobicContact CD1-CB 3.67Å; I311-N355 VanDerWaalsContact CD1-ND2 3.26Å; I311-N355 WeakPolarHBondContact CD1-ND2 3.42Å; Q351-N355 VanDerWaalsContact O-CB 3.28Å; Q351-N355 WeakPolarHBondContact O-CB 3.42Å; Q351-N355 PolarHBondContact O-N 3.37Å; N355-Y358 PolarHBondContact O-N 2.81Å; N355-W359 PolarHBondContact O-N 3.23Å; N355-W359 VanDerWaalsContact O-N 3.12Å; N355-W359 PolarHBondContact OD1-NE1 3.02Å
356	K	84.2	Confident	81.9	Confident	115 Å²	115	85.7 Å²	85.7	50%	0.5	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-45.5	174.1	-76.6	175.8	-177.9	-177.2	0	112.6	L352 N353 E354 W359 Q360	L352-K356 WeakPolarHBondContact O-CG 3.5Å; L352-K356 PolarHBondContact O-N 3.04Å; N353-K356 WeakPolarHBondContact O-CB 3.46Å; N353-K356 PolarHBondContact O-N 3.45Å; E354-K356 VanDerWaalsContact C-N 3.3Å; E354-K356 PolarHBondContact O-N 2.91Å; K356-W359 PolarHBondContact O-N 2.9Å; K356-Q360 WeakPolarHBondContact O-CG 3.5Å; K356-Q360 PolarHBondContact O-N 3.4Å; K356-Q360 VanDerWaalsContact O-N 3.1Å
357	R	86	Confident	80.2	Confident	171 Å²	171	87 Å²	87	65%	0.645	42%	0.422	S	S	*	.	H	α-helix	trans	-62.1	-46	177.7	-75.1	-179.7	173.2	-174.4	-3.9	111.4	N353 E354 W359 Q360 E361	N353-R357 PolarHBondContact O-N 3.11Å; E354-R357 PolarHBondContact O-N 2.87Å; E354-R357 VanDerWaalsContact O-N 3.12Å; R357-W359 VanDerWaalsContact C-N 3.3Å; R357-W359 PolarHBondContact O-N 3.44Å; R357-Q360 WeakPolarHBondContact O-CB 3.21Å; R357-Q360 PolarHBondContact O-N 2.85Å; R357-Q360 VanDerWaalsContact O-N 3.08Å; R357-E361 WeakPolarHBondContact O-CG 3.34Å; R357-E361 PolarHBondContact O-N 3.45Å
358	Y	83.1	Confident	78.8	Confident	128 Å²	128	89.3 Å²	89.3	50%	0.502	43%	0.431	S	S	.	.	H	α-helix	trans	-53.1	-45.8	175	170.8	-100	0	0	0	112.1	E354 N355 E361 L362	E354-Y358 PolarHBondContact O-N 3.09Å; N355-Y358 PolarHBondContact O-N 2.81Å; Y358-E361 PolarHBondContact O-N 2.82Å; Y358-L362 HydrophobicContact CE1-CD2 4.45Å; Y358-L362 VanDerWaalsContact O-CB 3.26Å; Y358-L362 WeakPolarHBondContact O-CB 3.38Å; Y358-L362 PolarHBondContact O-N 3.1Å
359	W	78.4	Confident	76.9	Confident	26 Å²	26	95.1 Å²	95.1	10%	0.098	45%	0.451	C	S	.	.	H	α-helix	trans	-68.9	-33.7	178.1	-72	114.3	0	0	0	113.9	Q303 R304 A307 N355 K356 R357 L362 E363	Q303-W359 HydrophobicContact CB-CH2 3.86Å; Q303-W359 HydrophobicContact CB-CZ2 4.4Å; R304-W359 HydrophobicContact CG-CD2 3.4Å; R304-W359 VanDerWaalsContact CG-CE2 3.49Å; R304-W359 HydrophobicContact CG-CE3 3.77Å; R304-W359 HydrophobicContact CG-CG 3.72Å; R304-W359 HydrophobicContact CG-CH2 4.26Å; R304-W359 HydrophobicContact CG-CZ2 3.95Å; R304-W359 HydrophobicContact CG-CZ3 4.17Å; A307-W359 HydrophobicContact CB-CZ2 4.2Å; N355-W359 PolarHBondContact O-N 3.23Å; N355-W359 VanDerWaalsContact O-N 3.12Å; N355-W359 PolarHBondContact OD1-NE1 3.02Å; K356-W359 PolarHBondContact O-N 2.9Å; R357-W359 VanDerWaalsContact C-N 3.3Å; R357-W359 PolarHBondContact O-N 3.44Å; W359-L362 HydrophobicContact CE3-CD2 3.66Å; W359-L362 HydrophobicContact CZ3-CD2 3.53Å; W359-E363 WeakPolarHBondContact O-CG 3.4Å; W359-E363 PolarHBondContact O-N 2.93Å
360	Q	80.8	Confident	75	Confident	121 Å²	121	94.5 Å²	94.5	57%	0.565	45%	0.449	S	S	*	.	H	α-helix	trans	-68.1	-45.7	174.9	-72.6	174.1	-21.2	0	0	111	K356 R357 L362 E363 V364	K356-Q360 WeakPolarHBondContact O-CG 3.5Å; K356-Q360 PolarHBondContact O-N 3.4Å; K356-Q360 VanDerWaalsContact O-N 3.1Å; R357-Q360 WeakPolarHBondContact O-CB 3.21Å; R357-Q360 PolarHBondContact O-N 2.85Å; R357-Q360 VanDerWaalsContact O-N 3.08Å; Q360-L362 VanDerWaalsContact C-N 3.33Å; Q360-L362 PolarHBondContact O-N 3Å; Q360-E363 WeakPolarHBondContact O-CB 3.35Å; Q360-E363 PolarHBondContact O-N 2.91Å; Q360-V364 WeakPolarHBondContact O-CG2 3.42Å; Q360-V364 PolarHBondContact O-N 3.32Å
361	E	77	Confident	73.5	Confident	129 Å²	129	89.7 Å²	89.7	60%	0.603	44%	0.436	S	S	*	.	H	α-helix	trans	-63.7	-39.4	175.9	-71.8	173	-164.7	0	0	111.4	R357 Y358 E363 V364 A365	R357-E361 WeakPolarHBondContact O-CG 3.34Å; R357-E361 PolarHBondContact O-N 3.45Å; Y358-E361 PolarHBondContact O-N 2.82Å; E361-E363 VanDerWaalsContact C-N 3.34Å; E361-E363 PolarHBondContact O-N 3.48Å; E361-V364 PolarHBondContact O-N 2.97Å; E361-A365 VanDerWaalsContact O-CB 3.22Å; E361-A365 WeakPolarHBondContact O-CB 3.04Å; E361-A365 PolarHBondContact O-N 2.6Å
362	L	73.8	Confident	72	Confident	46 Å²	46	87.8 Å²	87.8	24%	0.241	43%	0.434	C	S	.	.	H	α-helix	trans	-63.8	-38.2	174.3	-170.6	70.5	0	0	0	111.8	Y358 W359 Q360 Q366	Y358-L362 HydrophobicContact CE1-CD2 4.45Å; Y358-L362 VanDerWaalsContact O-CB 3.26Å; Y358-L362 WeakPolarHBondContact O-CB 3.38Å; Y358-L362 PolarHBondContact O-N 3.1Å; W359-L362 HydrophobicContact CE3-CD2 3.66Å; W359-L362 HydrophobicContact CZ3-CD2 3.53Å; Q360-L362 VanDerWaalsContact C-N 3.33Å; Q360-L362 PolarHBondContact O-N 3Å; L362-Q366 HydrophobicContact CG-CG 4.43Å; L362-Q366 WeakPolarHBondContact O-CB 3.34Å; L362-Q366 WeakPolarHBondContact O-CG 3.27Å; L362-Q366 PolarHBondContact O-N 2.89Å
363	E	69.4	Low	70.2	Confident	97 Å²	97	87.6 Å²	87.6	45%	0.453	44%	0.436	S	S	.	.	H	α-helix	trans	-65.1	-45.2	173.5	-80.5	178.7	160.7	0	0	112.4	R304 W359 Q360 E361 Q366 G367	R304-E363 IonicContact CZ-OE1 3.76Å; R304-E363 IonicContact NH1-OE1 3.44Å; R304-E363 PolarHBondContact NH1-OE1 2.79Å; R304-E363 IonicContact NH1-OE2 3.46Å; R304-E363 IonicContact NH2-OE1 3.9Å; R304-E363 PolarHBondContact NH2-OE1 3.35Å; R304-E363 IonicContact NH2-OE2 2.87Å; W359-E363 WeakPolarHBondContact O-CG 3.4Å; W359-E363 PolarHBondContact O-N 2.93Å; Q360-E363 WeakPolarHBondContact O-CB 3.35Å; Q360-E363 PolarHBondContact O-N 2.91Å; E361-E363 VanDerWaalsContact C-N 3.34Å; E361-E363 PolarHBondContact O-N 3.48Å; E363-Q366 PolarHBondContact O-N 3.42Å; E363-G367 PolarHBondContact O-N 3.43Å
364	V	70.7	Confident	68.2	Low	97 Å²	97	88.5 Å²	88.5	59%	0.588	44%	0.439	S	S	*	.	H	α-helix	trans	-62.2	-47.3	176.8	173.4	0	0	0	0	110	Q360 E361 Q366 G367 D368	Q360-V364 WeakPolarHBondContact O-CG2 3.42Å; Q360-V364 PolarHBondContact O-N 3.32Å; E361-V364 PolarHBondContact O-N 2.97Å; V364-Q366 VanDerWaalsContact C-N 3.33Å; V364-Q366 PolarHBondContact O-N 2.84Å; V364-G367 PolarHBondContact O-N 3.26Å; V364-D368 PolarHBondContact O-N 2.92Å
365	A	60	Low	66.7	Low	41 Å²	41	88.3 Å²	88.3	34%	0.339	43%	0.432	S	S	.	.	H	α-helix	trans	-65.5	-32.5	179	0	0	0	0	0	113.3	E361 N371	E361-A365 VanDerWaalsContact O-CB 3.22Å; E361-A365 WeakPolarHBondContact O-CB 3.04Å; E361-A365 PolarHBondContact O-N 2.6Å; A365-N371 PolarHBondContact O-ND2 3.46Å; A365-N371 VanDerWaalsContact O-ND2 3.12Å
366	Q	62.9	Low	65.1	Low	87 Å²	87	89 Å²	89	41%	0.407	44%	0.441	S	S	.	.	H	α-helix	trans	-78.9	-29.5	173.6	-74.7	-179.9	9.9	0	0	112.8	L362 E363 V364	L362-Q366 HydrophobicContact CG-CG 4.43Å; L362-Q366 WeakPolarHBondContact O-CB 3.34Å; L362-Q366 WeakPolarHBondContact O-CG 3.27Å; L362-Q366 PolarHBondContact O-N 2.89Å; E363-Q366 PolarHBondContact O-N 3.42Å; V364-Q366 VanDerWaalsContact C-N 3.33Å; V364-Q366 PolarHBondContact O-N 2.84Å
367	G	56.5	Low	63.3	Low	61 Å²	61	87.9 Å²	87.9	63%	0.629	44%	0.436	S	S	*	.	H	α-helix	trans	-76.5	-24.5	175.1	0	0	0	0	0	113	E363 V364 W369	E363-G367 PolarHBondContact O-N 3.43Å; V364-G367 PolarHBondContact O-N 3.26Å; G367-W369 PolarHBondContact O-N 3.44Å
368	D	59.3	Low	61.6	Low	79 Å²	79	84.9 Å²	84.9	42%	0.422	43%	0.43	S	S	.	.			trans	-66.8	95.9	170.4	-87.5	-28.2	0	0	0	110.5	V364 K370 N371 G372	V364-D368 PolarHBondContact O-N 2.92Å; D368-K370 PolarHBondContact O-N 3.42Å; D368-N371 HydrophobicContact CB-CB 4.46Å; D368-N371 WeakPolarHBondContact O-CB 3.49Å; D368-N371 PolarHBondContact O-N 2.86Å; D368-G372 PolarHBondContact O-N 3.02Å
369	W	50.6	Low	60.1	Low	151 Å²	151	83.3 Å²	83.3	57%	0.572	43%	0.43	S	S	*	.	H	α-helix	trans	-50.7	-32	175.7	70.3	-89.2	0	0	0	112.5	G367 N371 G372 A373 M435	G367-W369 PolarHBondContact O-N 3.44Å; W369-N371 VanDerWaalsContact C-N 3.35Å; W369-N371 PolarHBondContact O-N 3.38Å; W369-G372 CarbonylContact O-C 3.6Å; W369-G372 WeakPolarHBondContact O-CA 3.39Å; W369-G372 PolarHBondContact O-N 2.98Å; W369-G372 VanDerWaalsContact O-N 3.13Å; W369-A373 HydrophobicContact CE3-CB 4.47Å; W369-A373 PolarHBondContact O-N 3.47Å; W369-M435 HydrophobicContact CZ3-CE 4.29Å
370	K	52.7	Low	58.4	Low	138 Å²	138	85.1 Å²	85.1	60%	0.6	44%	0.439	S	S	*	.	H	α-helix	trans	-57.8	-42.1	175.3	-177.3	-176	175.2	-174.7	0	112.4	D368 G372 A373 M374	D368-K370 PolarHBondContact O-N 3.42Å; K370-G372 VanDerWaalsContact C-N 3.34Å; K370-A373 PolarHBondContact O-N 2.94Å; K370-M374 WeakPolarHBondContact O-CB 3.47Å; K370-M374 PolarHBondContact O-N 3.3Å
371	N	58.7	Low	56.5	Low	66 Å²	66	82.2 Å²	82.2	35%	0.353	43%	0.429	S	S	.	.	H	α-helix	trans	-71.1	-33.2	177.2	-67.3	-20.8	0	0	0	111.3	A365 D368 W369 R375	A365-N371 PolarHBondContact O-ND2 3.46Å; A365-N371 VanDerWaalsContact O-ND2 3.12Å; D368-N371 HydrophobicContact CB-CB 4.46Å; D368-N371 WeakPolarHBondContact O-CB 3.49Å; D368-N371 PolarHBondContact O-N 2.86Å; W369-N371 VanDerWaalsContact C-N 3.35Å; W369-N371 PolarHBondContact O-N 3.38Å; N371-R375 WeakPolarHBondContact O-CB 3.18Å; N371-R375 PolarHBondContact O-N 3.41Å
372	G	55.7	Low	55.1	Low	28 Å²	28	80 Å²	80	29%	0.289	43%	0.433	S	S	.	.	H	α-helix	trans	-62.1	-48.8	170.5	0	0	0	0	0	112.1	D368 W369 K370 R375 A376	D368-G372 PolarHBondContact O-N 3.02Å; W369-G372 CarbonylContact O-C 3.6Å; W369-G372 WeakPolarHBondContact O-CA 3.39Å; W369-G372 PolarHBondContact O-N 2.98Å; W369-G372 VanDerWaalsContact O-N 3.13Å; K370-G372 VanDerWaalsContact C-N 3.34Å; G372-R375 PolarHBondContact O-N 2.91Å; G372-A376 WeakPolarHBondContact O-CB 3.47Å; G372-A376 PolarHBondContact O-N 3.03Å
373	A	51.4	Low	53.7	Low	23 Å²	23	84.9 Å²	84.9	19%	0.19	46%	0.459	C	S	.	.	H	α-helix	trans	-62.5	-43.4	176.7	0	0	0	0	0	112.1	W369 K370 A376 F377 M435	W369-A373 HydrophobicContact CE3-CB 4.47Å; W369-A373 PolarHBondContact O-N 3.47Å; K370-A373 PolarHBondContact O-N 2.94Å; A373-A376 PolarHBondContact O-N 3.42Å; A373-F377 WeakPolarHBondContact O-CB 3.14Å; A373-F377 PolarHBondContact O-N 3.46Å; A373-M435 HydrophobicContact CB-CE 4.37Å; A373-M435 HydrophobicContact CB-SD 3.69Å
374	M	48.8	Very low	52.2	Low	96 Å²	96	82 Å²	82	47%	0.473	45%	0.452	S	S	.	.	H	α-helix	trans	-63.2	-43.2	176.2	-169.4	67.7	75.3	0	0	111.9	K370 F377 Q378	K370-M374 WeakPolarHBondContact O-CB 3.47Å; K370-M374 PolarHBondContact O-N 3.3Å; M374-F377 PolarHBondContact O-N 2.84Å; M374-Q378 WeakPolarHBondContact O-CB 3.42Å; M374-Q378 WeakPolarHBondContact O-CG 3.2Å; M374-Q378 PolarHBondContact O-N 3.34Å
375	R	56.2	Low	51	Low	134 Å²	134	86 Å²	86	51%	0.506	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-41.2	173.4	-95.7	-173.1	-60.1	147.8	4.1	112.4	N371 G372 F377 Q378 N379	N371-R375 WeakPolarHBondContact O-CB 3.18Å; N371-R375 PolarHBondContact O-N 3.41Å; G372-R375 PolarHBondContact O-N 2.91Å; R375-F377 VanDerWaalsContact C-N 3.33Å; R375-Q378 PolarHBondContact O-N 2.82Å; R375-N379 WeakPolarHBondContact O-CB 3.44Å; R375-N379 VanDerWaalsContact O-CG 3.24Å; R375-N379 PolarHBondContact O-N 3.39Å
376	A	51	Low	50.5	Low	35 Å²	35	90.1 Å²	90.1	29%	0.289	49%	0.486	S	S	.	.	H	α-helix	trans	-61.8	-43.7	176.5	0	0	0	0	0	110.8	G372 A373 F380	G372-A376 WeakPolarHBondContact O-CB 3.47Å; G372-A376 PolarHBondContact O-N 3.03Å; A373-A376 PolarHBondContact O-N 3.42Å; A376-F380 WeakPolarHBondContact O-CB 3.44Å; A376-F380 PolarHBondContact O-N 2.91Å
377	F	46.9	Very low	49.4	Very low	91 Å²	91	86.6 Å²	86.6	40%	0.399	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-46.3	174.7	-171.2	-100	0	0	0	111.8	A373 M374 R375 F380 T381 F395	A373-F377 WeakPolarHBondContact O-CB 3.14Å; A373-F377 PolarHBondContact O-N 3.46Å; M374-F377 PolarHBondContact O-N 2.84Å; R375-F377 VanDerWaalsContact C-N 3.33Å; F377-F380 WeakPolarHBondContact O-CB 3.38Å; F377-F380 PolarHBondContact O-N 3.29Å; F377-T381 HydrophobicContact CD1-CG2 4.24Å; F377-T381 HydrophobicContact CE1-CG2 3.88Å; F377-T381 HydrophobicContact CZ-CG2 4.06Å; F377-T381 WeakPolarHBondContact O-CG2 3.42Å; F377-T381 PolarHBondContact O-N 2.95Å; F377-T381 PolarHBondContact O-OG1 3.48Å; F377-F395 AromaticContact CE2-CE2 3.95Å; F377-F395 HydrophobicContact CE2-CE2 3.95Å; F377-F395 HydrophobicContact CE2-CZ 4.32Å
378	Q	49.2	Very low	48.6	Very low	109 Å²	109	87.6 Å²	87.6	51%	0.509	48%	0.475	S	S	.	.	H	α-helix	trans	-62.4	-46.8	177.9	-76.5	178	-0.7	0	0	112.6	M374 R375 F380 T381 A382	M374-Q378 WeakPolarHBondContact O-CB 3.42Å; M374-Q378 WeakPolarHBondContact O-CG 3.2Å; M374-Q378 PolarHBondContact O-N 3.34Å; R375-Q378 PolarHBondContact O-N 2.82Å; Q378-F380 VanDerWaalsContact C-N 3.3Å; Q378-F380 PolarHBondContact O-N 3.42Å; Q378-T381 WeakPolarHBondContact CA-OG1 3.47Å; Q378-T381 PolarHBondContact O-N 2.93Å; Q378-T381 PolarHBondContact O-OG1 3.17Å; Q378-A382 WeakPolarHBondContact O-CB 3.48Å; Q378-A382 PolarHBondContact O-N 3.36Å
379	N	52	Low	47.9	Very low	94 Å²	94	85.5 Å²	85.5	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-62.3	-39.2	176	-71.5	-4	0	0	0	111.1	R375 A382 D383	R375-N379 WeakPolarHBondContact O-CB 3.44Å; R375-N379 VanDerWaalsContact O-CG 3.24Å; R375-N379 PolarHBondContact O-N 3.39Å; N379-A382 PolarHBondContact O-N 2.84Å; N379-D383 PolarHBondContact O-N 2.9Å
380	F	42.6	Very low	47.5	Very low	65 Å²	65	80.9 Å²	80.9	29%	0.285	46%	0.46	S	S	.	.	H	α-helix	trans	-64	-39.6	175	-174.8	-95.8	0	0	0	112.4	A376 F377 Q378 T390 M438	A376-F380 WeakPolarHBondContact O-CB 3.44Å; A376-F380 PolarHBondContact O-N 2.91Å; F377-F380 WeakPolarHBondContact O-CB 3.38Å; F377-F380 PolarHBondContact O-N 3.29Å; Q378-F380 VanDerWaalsContact C-N 3.3Å; Q378-F380 PolarHBondContact O-N 3.42Å; F380-T390 HydrophobicContact CZ-CG2 3.77Å; F380-M438 HydrophobicContact CD2-CE 4.38Å; F380-M438 HydrophobicContact CE2-CE 4.37Å
381	T	41.1	Very low	46.9	Very low	59 Å²	59	75 Å²	75	36%	0.362	44%	0.438	S	S	.	.	H	α-helix	trans	-73.8	-29.6	176.6	54	0	0	0	0	113.8	F377 Q378 D383 A387	F377-T381 HydrophobicContact CD1-CG2 4.24Å; F377-T381 HydrophobicContact CE1-CG2 3.88Å; F377-T381 HydrophobicContact CZ-CG2 4.06Å; F377-T381 WeakPolarHBondContact O-CG2 3.42Å; F377-T381 PolarHBondContact O-N 2.95Å; F377-T381 PolarHBondContact O-OG1 3.48Å; Q378-T381 WeakPolarHBondContact CA-OG1 3.47Å; Q378-T381 PolarHBondContact O-N 2.93Å; Q378-T381 PolarHBondContact O-OG1 3.17Å; T381-D383 VanDerWaalsContact C-N 3.33Å; T381-A387 HydrophobicContact CG2-CB 4.24Å
382	A	48.5	Very low	45.9	Very low	82 Å²	82	78 Å²	78	68%	0.678	45%	0.449	S	S	*	.	H	α-helix	trans	-70.8	-30.5	177.5	0	0	0	0	0	112.2	Q378 N379	Q378-A382 WeakPolarHBondContact O-CB 3.48Å; Q378-A382 PolarHBondContact O-N 3.36Å; N379-A382 PolarHBondContact O-N 2.84Å
383	D	44.6	Very low	45.4	Very low	150 Å²	150	83.2 Å²	83.2	80%	0.802	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	0.6	-175.3	-81.3	-17.4	0	0	0	115	N379 T381	N379-D383 PolarHBondContact O-N 2.9Å; T381-D383 VanDerWaalsContact C-N 3.33Å
384	A	37.3	Very low	45	Very low	37 Å²	37	86.8 Å²	86.8	31%	0.306	48%	0.48	S	S	.	.			trans	-153.6	115.5	-179.7	0	0	0	0	0	115.3	N386 A387	A384-N386 PolarHBondContact O-N 2.87Å; A384-A387 VanDerWaalsContact O-CB 3.25Å; A384-A387 WeakPolarHBondContact O-CB 3.49Å; A384-A387 PolarHBondContact O-N 3.17Å
385	D	44.6	Very low	44.6	Very low	179 Å²	179	87.2 Å²	87.2	96%	0.957	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-4.6	160.4	-84.5	-36.2	0	0	0	114.1
386	N	49.1	Very low	43.9	Very low	128 Å²	128	84 Å²	84	68%	0.684	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	18.7	173.6	-77	-26.3	0	0	0	113.5	A384 A388 G389 T390	A384-N386 PolarHBondContact O-N 2.87Å; N386-A388 VanDerWaalsContact C-N 3.29Å; N386-A388 PolarHBondContact O-N 3.43Å; N386-G389 PolarHBondContact O-N 2.75Å; N386-T390 PolarHBondContact O-N 2.95Å; N386-T390 PolarHBondContact O-OG1 3.4Å
387	A	41.5	Very low	43.7	Very low	14 Å²	14	87.2 Å²	87.2	12%	0.116	49%	0.491	C	S	.	.	H	α-helix	trans	-60.8	-36.6	-178.6	0	0	0	0	0	112.6	T381 A384 G389 T390 A391	T381-A387 HydrophobicContact CG2-CB 4.24Å; A384-A387 VanDerWaalsContact O-CB 3.25Å; A384-A387 WeakPolarHBondContact O-CB 3.49Å; A384-A387 PolarHBondContact O-N 3.17Å; A387-G389 PolarHBondContact O-N 3.47Å; A387-T390 PolarHBondContact O-N 2.88Å; A387-A391 WeakPolarHBondContact O-CA 3.4Å; A387-A391 WeakPolarHBondContact O-CB 3.45Å; A387-A391 PolarHBondContact O-N 3.48Å
388	A	37.9	Very low	43.4	Very low	81 Å²	81	84.2 Å²	84.2	67%	0.669	48%	0.483	S	S	*	.	H	α-helix	trans	-58.7	-50.1	178.5	0	0	0	0	0	111.1	N386 T390 E392	N386-A388 VanDerWaalsContact C-N 3.29Å; N386-A388 PolarHBondContact O-N 3.43Å; A388-T390 PolarHBondContact O-N 3.15Å; A388-E392 WeakPolarHBondContact O-CA 3.41Å; A388-E392 WeakPolarHBondContact O-CB 3.46Å; A388-E392 PolarHBondContact O-N 3.3Å
389	G	45.3	Very low	42.8	Very low	36 Å²	36	86 Å²	86	37%	0.371	49%	0.489	S	S	.	.	H	α-helix	trans	-69.1	-34.4	-179.1	0	0	0	0	0	113.9	N386 A387 Q393	N386-G389 PolarHBondContact O-N 2.75Å; A387-G389 PolarHBondContact O-N 3.47Å; G389-Q393 WeakPolarHBondContact O-CG 3.27Å; G389-Q393 PolarHBondContact O-N 3.46Å
390	T	42.6	Very low	42.5	Very low	53 Å²	53	84.6 Å²	84.6	33%	0.325	49%	0.487	S	S	.	.	H	α-helix	trans	-80.1	-40.9	-178.9	-39.1	0	0	0	0	111.7	F380 N386 A387 A388 E392 Q393 M394	F380-T390 HydrophobicContact CZ-CG2 3.77Å; N386-T390 PolarHBondContact O-N 2.95Å; N386-T390 PolarHBondContact O-OG1 3.4Å; A387-T390 PolarHBondContact O-N 2.88Å; A388-T390 PolarHBondContact O-N 3.15Å; T390-E392 VanDerWaalsContact C-N 3.35Å; T390-Q393 PolarHBondContact O-N 2.92Å; T390-M394 WeakPolarHBondContact O-CG 3.48Å; T390-M394 PolarHBondContact O-N 3.39Å
391	A	40.5	Very low	42.5	Very low	15 Å²	15	84.3 Å²	84.3	12%	0.124	49%	0.493	C	S	.	.	H	α-helix	trans	-66.2	-39.9	171.7	0	0	0	0	0	110.4	A387 M394 F395	A387-A391 WeakPolarHBondContact O-CA 3.4Å; A387-A391 WeakPolarHBondContact O-CB 3.45Å; A387-A391 PolarHBondContact O-N 3.48Å; A391-M394 PolarHBondContact O-N 3.01Å; A391-F395 HydrophobicContact CB-CD2 4.21Å; A391-F395 HydrophobicContact CB-CE2 4.33Å; A391-F395 WeakPolarHBondContact O-CB 3.29Å; A391-F395 WeakPolarHBondContact O-CD2 3.37Å; A391-F395 PolarHBondContact O-N 3.45Å
392	E	36.7	Very low	42.2	Very low	128 Å²	128	83 Å²	83	60%	0.598	49%	0.489	S	S	*	.	H	α-helix	trans	-58.7	-46.8	173.1	-177.4	178.5	-165.5	0	0	110.7	A388 T390 M394 T396	A388-E392 WeakPolarHBondContact O-CA 3.41Å; A388-E392 WeakPolarHBondContact O-CB 3.46Å; A388-E392 PolarHBondContact O-N 3.3Å; T390-E392 VanDerWaalsContact C-N 3.35Å; E392-M394 PolarHBondContact O-N 3.36Å; E392-T396 WeakPolarHBondContact O-CA 3.19Å; E392-T396 WeakPolarHBondContact O-CB 3.48Å; E392-T396 PolarHBondContact O-N 3.02Å; E392-T396 PolarHBondContact O-OG1 3.46Å
393	Q	45.7	Very low	41.6	Very low	139 Å²	139	80.3 Å²	80.3	65%	0.65	47%	0.469	S	S	*	.	H	α-helix	trans	-61.6	-41.8	174.1	-79.8	178.7	-3.8	0	0	112.6	G389 T390 T396 V397	G389-Q393 WeakPolarHBondContact O-CG 3.27Å; G389-Q393 PolarHBondContact O-N 3.46Å; T390-Q393 PolarHBondContact O-N 2.92Å; Q393-T396 PolarHBondContact O-N 3.17Å; Q393-V397 VanDerWaalsContact O-CG2 3.28Å; Q393-V397 WeakPolarHBondContact O-CG2 3.12Å; Q393-V397 PolarHBondContact O-N 2.63Å
394	M	43	Very low	41.3	Very low	97 Å²	97	78.8 Å²	78.8	48%	0.478	46%	0.46	S	S	.	.	H	α-helix	trans	-69.6	-45.9	179.8	-74.5	-156.9	173.6	0	0	112.9	T390 A391 E392 T396 V397 A398 M438	T390-M394 WeakPolarHBondContact O-CG 3.48Å; T390-M394 PolarHBondContact O-N 3.39Å; A391-M394 PolarHBondContact O-N 3.01Å; E392-M394 PolarHBondContact O-N 3.36Å; M394-T396 VanDerWaalsContact C-N 3.28Å; M394-T396 PolarHBondContact O-N 3.35Å; M394-V397 PolarHBondContact O-N 3Å; M394-A398 WeakPolarHBondContact O-CB 3.31Å; M394-A398 PolarHBondContact O-N 2.96Å; M394-M438 HydrophobicContact CE-CE 3.79Å; M394-M438 HydrophobicContact CE-SD 4.35Å; M394-M438 HydrophobicContact SD-CE 3.69Å; M394-M438 HydrophobicContact SD-SD 4.06Å
395	F	40.8	Very low	41.5	Very low	106 Å²	106	78.4 Å²	78.4	47%	0.465	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-35.3	173	-78	-63.4	0	0	0	110.7	F377 A391 A398 F399	F377-F395 AromaticContact CE2-CE2 3.95Å; F377-F395 HydrophobicContact CE2-CE2 3.95Å; F377-F395 HydrophobicContact CE2-CZ 4.32Å; A391-F395 HydrophobicContact CB-CD2 4.21Å; A391-F395 HydrophobicContact CB-CE2 4.33Å; A391-F395 WeakPolarHBondContact O-CB 3.29Å; A391-F395 WeakPolarHBondContact O-CD2 3.37Å; A391-F395 PolarHBondContact O-N 3.45Å; F395-A398 PolarHBondContact O-N 2.82Å; F395-F399 HydrophobicContact CB-CD2 4.23Å; F395-F399 HydrophobicContact CD1-CD2 4.25Å; F395-F399 HydrophobicContact CD1-CE2 4.05Å; F395-F399 WeakPolarHBondContact O-CA 3.38Å; F395-F399 WeakPolarHBondContact O-CB 3.36Å; F395-F399 WeakPolarHBondContact O-CD2 3.14Å; F395-F399 PolarHBondContact O-N 2.82Å
396	T	41.8	Very low	41	Very low	67 Å²	67	74.3 Å²	74.3	41%	0.411	44%	0.435	S	S	.	.	H	α-helix	trans	-66.5	-39.9	175.1	-62.7	0	0	0	0	111	E392 Q393 M394 S400	E392-T396 WeakPolarHBondContact O-CA 3.19Å; E392-T396 WeakPolarHBondContact O-CB 3.48Å; E392-T396 PolarHBondContact O-N 3.02Å; E392-T396 PolarHBondContact O-OG1 3.46Å; Q393-T396 PolarHBondContact O-N 3.17Å; M394-T396 VanDerWaalsContact C-N 3.28Å; M394-T396 PolarHBondContact O-N 3.35Å; T396-S400 WeakPolarHBondContact O-CA 3.29Å; T396-S400 WeakPolarHBondContact O-CB 3.4Å; T396-S400 PolarHBondContact O-N 3.04Å; T396-S400 PolarHBondContact O-OG 3.33Å
397	V	45.2	Very low	40.6	Very low	102 Å²	102	70.5 Å²	70.5	62%	0.618	42%	0.421	S	S	*	.	H	α-helix	trans	-65	-46.1	174.3	170.8	0	0	0	0	110.4	Q393 M394 S401	Q393-V397 VanDerWaalsContact O-CG2 3.28Å; Q393-V397 WeakPolarHBondContact O-CG2 3.12Å; Q393-V397 PolarHBondContact O-N 2.63Å; M394-V397 PolarHBondContact O-N 3Å; V397-S401 WeakPolarHBondContact O-CB 3.29Å; V397-S401 PolarHBondContact O-N 3.3Å; V397-S401 PolarHBondContact O-OG 3.39Å
398	A	40.8	Very low	40.5	Very low	28 Å²	28	73.4 Å²	73.4	23%	0.231	44%	0.438	C	S	.	.	H	α-helix	trans	-67.8	-42.4	179.4	0	0	0	0	0	113.2	M394 F395 S401 A402 I431	M394-A398 WeakPolarHBondContact O-CB 3.31Å; M394-A398 PolarHBondContact O-N 2.96Å; F395-A398 PolarHBondContact O-N 2.82Å; A398-S401 PolarHBondContact O-OG 3.28Å; A398-A402 WeakPolarHBondContact O-CB 3.4Å; A398-A402 PolarHBondContact O-N 3.47Å; A398-I431 HydrophobicContact CB-CD1 4.42Å
399	F	37.6	Very low	40.4	Very low	145 Å²	145	73.1 Å²	73.1	64%	0.636	42%	0.422	S	S	*	.	H	α-helix	trans	-81.2	-21.5	177.7	-85.2	-77.2	0	0	0	113.1	F395 G403	F395-F399 HydrophobicContact CB-CD2 4.23Å; F395-F399 HydrophobicContact CD1-CD2 4.25Å; F395-F399 HydrophobicContact CD1-CE2 4.05Å; F395-F399 WeakPolarHBondContact O-CA 3.38Å; F395-F399 WeakPolarHBondContact O-CB 3.36Å; F395-F399 WeakPolarHBondContact O-CD2 3.14Å; F395-F399 PolarHBondContact O-N 2.82Å; F399-G403 WeakPolarHBondContact O-CA 3.44Å; F399-G403 PolarHBondContact O-N 2.88Å
400	S	46	Very low	40	Very low	65 Å²	65	75.8 Å²	75.8	46%	0.455	43%	0.433	S	S	.	.	H	α-helix	trans	-78	-36.5	170.1	-63.8	0	0	0	0	110.4	T396 G403 N404	T396-S400 WeakPolarHBondContact O-CA 3.29Å; T396-S400 WeakPolarHBondContact O-CB 3.4Å; T396-S400 PolarHBondContact O-N 3.04Å; T396-S400 PolarHBondContact O-OG 3.33Å; S400-G403 PolarHBondContact O-N 3.01Å; S400-N404 PolarHBondContact O-N 3.08Å
401	S	41.8	Very low	40.1	Very low	59 Å²	59	78.8 Å²	78.8	41%	0.413	45%	0.452	S	S	.	.	H	α-helix	trans	-68.2	-46.6	172	72.8	0	0	0	0	111.2	V397 A398 G403 N404 A405	V397-S401 WeakPolarHBondContact O-CB 3.29Å; V397-S401 PolarHBondContact O-N 3.3Å; V397-S401 PolarHBondContact O-OG 3.39Å; A398-S401 PolarHBondContact O-OG 3.28Å; S401-G403 VanDerWaalsContact C-N 3.29Å; S401-G403 PolarHBondContact O-N 3.04Å; S401-N404 PolarHBondContact O-N 3.41Å; S401-A405 PolarHBondContact O-N 3.06Å
402	A	34.7	Very low	40.4	Very low	33 Å²	33	82.3 Å²	82.3	27%	0.273	47%	0.472	S	S	.	.	H	α-helix	trans	-68.6	-30.6	173.7	0	0	0	0	0	112.1	A398 A405 L406	A398-A402 WeakPolarHBondContact O-CB 3.4Å; A398-A402 PolarHBondContact O-N 3.47Å; A402-A405 CarbonylContact O-C 3.51Å; A402-A405 WeakPolarHBondContact O-CA 3.37Å; A402-A405 WeakPolarHBondContact O-CB 3.38Å; A402-A405 PolarHBondContact O-N 3.35Å; A402-A405 VanDerWaalsContact O-N 3.12Å; A402-L406 WeakPolarHBondContact O-CB 3.22Å; A402-L406 PolarHBondContact O-N 2.8Å
403	G	35.4	Very low	40.6	Very low	25 Å²	25	78.4 Å²	78.4	26%	0.258	47%	0.466	S	S	.	.	H	α-helix	trans	-70.3	-34.2	177.9	0	0	0	0	0	111.3	F399 S400 S401 A405 L406 A407	F399-G403 WeakPolarHBondContact O-CA 3.44Å; F399-G403 PolarHBondContact O-N 2.88Å; S400-G403 PolarHBondContact O-N 3.01Å; S401-G403 VanDerWaalsContact C-N 3.29Å; S401-G403 PolarHBondContact O-N 3.04Å; G403-A405 VanDerWaalsContact C-N 3.35Å; G403-L406 PolarHBondContact O-N 3.46Å; G403-A407 WeakPolarHBondContact O-CA 3.49Å; G403-A407 WeakPolarHBondContact O-CB 3.33Å; G403-A407 PolarHBondContact O-N 2.85Å
404	N	38.9	Very low	40.4	Very low	117 Å²	117	81.4 Å²	81.4	63%	0.626	48%	0.477	S	S	*	.	H	α-helix	trans	-67.4	-36.5	166.6	-83.7	-11.1	0	0	0	111.6	S400 S401 T408	S400-N404 PolarHBondContact O-N 3.08Å; S401-N404 PolarHBondContact O-N 3.41Å; N404-T408 WeakPolarHBondContact O-CB 3.38Å; N404-T408 PolarHBondContact O-N 3.12Å; N404-T408 PolarHBondContact O-OG1 3.24Å
405	A	41.1	Very low	40.2	Very low	30 Å²	30	84 Å²	84	25%	0.248	49%	0.492	C	S	.	.	H	α-helix	trans	-67.1	-40.9	174	0	0	0	0	0	112.2	S401 A402 G403 F409	S401-A405 PolarHBondContact O-N 3.06Å; A402-A405 CarbonylContact O-C 3.51Å; A402-A405 WeakPolarHBondContact O-CA 3.37Å; A402-A405 WeakPolarHBondContact O-CB 3.38Å; A402-A405 PolarHBondContact O-N 3.35Å; A402-A405 VanDerWaalsContact O-N 3.12Å; G403-A405 VanDerWaalsContact C-N 3.35Å; A405-F409 WeakPolarHBondContact O-CB 3.18Å; A405-F409 PolarHBondContact O-N 3.39Å
406	L	35.4	Very low	40.4	Very low	92 Å²	92	84.9 Å²	84.9	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-75.1	-40.9	178.8	-172.6	68.7	0	0	0	112	A402 G403 T408 F409 C410 F420	A402-L406 WeakPolarHBondContact O-CB 3.22Å; A402-L406 PolarHBondContact O-N 2.8Å; G403-L406 PolarHBondContact O-N 3.46Å; L406-T408 VanDerWaalsContact C-N 3.35Å; L406-F409 HydrophobicContact CD1-CD1 4.27Å; L406-F409 CarbonylContact O-C 3.56Å; L406-F409 WeakPolarHBondContact O-CA 3.35Å; L406-F409 WeakPolarHBondContact O-CB 3.47Å; L406-F409 PolarHBondContact O-N 3.44Å; L406-C410 WeakPolarHBondContact O-CB 3.49Å; L406-C410 PolarHBondContact O-N 3.27Å; L406-C410 PolarHBondContact O-SG 3.32Å; L406-C410 VanDerWaalsContact O-SG 3.36Å; L406-F420 HydrophobicContact CD1-CE2 4.13Å; L406-F420 HydrophobicContact CD1-CZ 4.27Å
407	A	38.9	Very low	40.3	Very low	48 Å²	48	88.6 Å²	88.6	40%	0.397	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-45.9	173.3	0	0	0	0	0	109.2	G403 F409 C410 T411	G403-A407 WeakPolarHBondContact O-CA 3.49Å; G403-A407 WeakPolarHBondContact O-CB 3.33Å; G403-A407 PolarHBondContact O-N 2.85Å; A407-F409 VanDerWaalsContact C-N 3.26Å; A407-F409 PolarHBondContact O-N 2.89Å; A407-C410 PolarHBondContact O-N 3.25Å; A407-C410 VanDerWaalsContact O-N 3.17Å; A407-T411 WeakPolarHBondContact O-CB 3.36Å; A407-T411 WeakPolarHBondContact O-CG2 3.48Å; A407-T411 PolarHBondContact O-N 2.91Å; A407-T411 PolarHBondContact O-OG1 2.88Å
408	T	40.5	Very low	40.2	Very low	76 Å²	76	92 Å²	92	47%	0.466	52%	0.519	S	S	.	.	H	α-helix	trans	-58.6	-41.1	172.8	-57.4	0	0	0	0	110.3	N404 L406 T411 T412	N404-T408 WeakPolarHBondContact O-CB 3.38Å; N404-T408 PolarHBondContact O-N 3.12Å; N404-T408 PolarHBondContact O-OG1 3.24Å; L406-T408 VanDerWaalsContact C-N 3.35Å; T408-T411 PolarHBondContact O-OG1 3.46Å; T408-T412 HydrophobicContact CG2-CG2 4.19Å; T408-T412 WeakPolarHBondContact O-CB 3.46Å; T408-T412 PolarHBondContact O-N 2.85Å; T408-T412 PolarHBondContact O-OG1 2.8Å
409	F	36.6	Very low	40.5	Very low	75 Å²	75	94.3 Å²	94.3	33%	0.329	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-44.9	174.8	176.7	-97.9	0	0	0	113.3	A405 L406 A407 G413 F417 F420	A405-F409 WeakPolarHBondContact O-CB 3.18Å; A405-F409 PolarHBondContact O-N 3.39Å; L406-F409 HydrophobicContact CD1-CD1 4.27Å; L406-F409 CarbonylContact O-C 3.56Å; L406-F409 WeakPolarHBondContact O-CA 3.35Å; L406-F409 WeakPolarHBondContact O-CB 3.47Å; L406-F409 PolarHBondContact O-N 3.44Å; A407-F409 VanDerWaalsContact C-N 3.26Å; A407-F409 PolarHBondContact O-N 2.89Å; F409-G413 PolarHBondContact O-N 2.79Å; F409-F417 HydrophobicContact CE2-CE2 4.39Å; F409-F417 HydrophobicContact CZ-CE2 4.24Å; F409-F417 HydrophobicContact CZ-CZ 4.47Å; F409-F420 HydrophobicContact CB-CD2 3.82Å; F409-F420 HydrophobicContact CB-CE2 3.92Å; F409-F420 HydrophobicContact CD1-CD2 4.45Å; F409-F420 HydrophobicContact CD1-CE2 4.17Å; F409-F420 HydrophobicContact CD2-CB 4.01Å; F409-F420 HydrophobicContact CD2-CD1 4.48Å; F409-F420 AromaticContact CD2-CD2 3.39Å; F409-F420 HydrophobicContact CD2-CD2 3.39Å; F409-F420 AromaticContact CD2-CE2 3.93Å; F409-F420 HydrophobicContact CD2-CE2 3.93Å; F409-F420 AromaticContact CD2-CG 3.7Å; F409-F420 HydrophobicContact CD2-CG 3.7Å; F409-F420 HydrophobicContact CE2-CB 4.23Å; F409-F420 HydrophobicContact CE2-CD1 4.32Å; F409-F420 HydrophobicContact CE2-CD2 4.03Å; F409-F420 HydrophobicContact CE2-CE2 4.49Å; F409-F420 AromaticContact CE2-CG 3.92Å; F409-F420 HydrophobicContact CE2-CG 3.92Å; F409-F420 AromaticContact CG-CD2 3.64Å; F409-F420 HydrophobicContact CG-CD2 3.64Å; F409-F420 AromaticContact CG-CE2 3.74Å; F409-F420 HydrophobicContact CG-CE2 3.74Å; F409-F420 HydrophobicContact CG-CG 4.37Å
410	C	36.7	Very low	40.6	Very low	91 Å²	91	89.8 Å²	89.8	62%	0.615	51%	0.513	S	S	*	.	H	α-helix	trans	-69.8	-40.3	178.2	-71	0	0	0	0	112.2	L406 A407	L406-C410 WeakPolarHBondContact O-CB 3.49Å; L406-C410 PolarHBondContact O-N 3.27Å; L406-C410 PolarHBondContact O-SG 3.32Å; L406-C410 VanDerWaalsContact O-SG 3.36Å; A407-C410 PolarHBondContact O-N 3.25Å; A407-C410 VanDerWaalsContact O-N 3.17Å
411	T	43.2	Very low	40.3	Very low	116 Å²	116	90.4 Å²	90.4	71%	0.712	52%	0.515	S	S	*	.	H	α-helix	trans	-80.7	-33.2	-177.4	56.6	0	0	0	0	112.8	A407 T408 G413	A407-T411 WeakPolarHBondContact O-CB 3.36Å; A407-T411 WeakPolarHBondContact O-CG2 3.48Å; A407-T411 PolarHBondContact O-N 2.91Å; A407-T411 PolarHBondContact O-OG1 2.88Å; T408-T411 PolarHBondContact O-OG1 3.46Å; T411-G413 PolarHBondContact O-N 3.43Å
412	T	47.9	Very low	40.3	Very low	90 Å²	90	91.2 Å²	91.2	55%	0.552	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	17.6	174.8	61.8	0	0	0	0	112.8	T408 K414	T408-T412 HydrophobicContact CG2-CG2 4.19Å; T408-T412 WeakPolarHBondContact O-CB 3.46Å; T408-T412 PolarHBondContact O-N 2.85Å; T408-T412 PolarHBondContact O-OG1 2.8Å; T412-K414 PolarHBondContact O-N 3.25Å
413	G	40.7	Very low	40.5	Very low	46 Å²	46	91.7 Å²	91.7	47%	0.474	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-33.6	101.7	179.9	0	0	0	0	0	112.7	F409 T411	F409-G413 PolarHBondContact O-N 2.79Å; T411-G413 PolarHBondContact O-N 3.43Å
414	K	41	Very low	40.6	Very low	202 Å²	202	94.9 Å²	94.9	88%	0.878	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	145.5	-1.1	148.1	-78.1	171.9	-176.6	-177.1	0	116.5	T412	T412-K414 PolarHBondContact O-N 3.25Å
415	L	38.5	Very low	40.5	Very low	151 Å²	151	95.2 Å²	95.2	79%	0.791	53%	0.533	S	S	*	.	S	Bend	trans	-133.6	105.3	-175.9	-68	169.3	0	0	0	113.6
416	N	46.8	Very low	40.4	Very low	125 Å²	125	97.2 Å²	97.2	67%	0.668	55%	0.546	S	S	*	.			trans	92.3	79.9	164.2	-59.1	-31.2	0	0	0	118.9	K418 S419	N416-K418 PolarHBondContact O-N 3.32Å; N416-S419 PolarHBondContact O-N 3.42Å; N416-S419 PolarHBondContact O-OG 2.81Å
417	F	37.8	Very low	40.6	Very low	145 Å²	145	94.8 Å²	94.8	64%	0.636	53%	0.533	S	S	*	.	H	α-helix	trans	-48.8	-20.7	163.3	-117.3	-93	0	0	0	115.3	F409 F420 T421	F409-F417 HydrophobicContact CE2-CE2 4.39Å; F409-F417 HydrophobicContact CZ-CE2 4.24Å; F409-F417 HydrophobicContact CZ-CZ 4.47Å; F417-F420 PolarHBondContact O-N 2.61Å; F417-T421 PolarHBondContact O-N 2.77Å; F417-T421 PolarHBondContact O-OG1 3.29Å; F417-T421 VanDerWaalsContact O-OG1 3.11Å
418	K	44.8	Very low	40.3	Very low	173 Å²	173	96.3 Å²	96.3	75%	0.752	53%	0.533	S	S	*	.	H	α-helix	trans	-70.8	-31.8	-179.3	-169.5	176.9	-179.1	-177.2	0	113.4	N416 T421 S422	N416-K418 PolarHBondContact O-N 3.32Å; K418-T421 PolarHBondContact O-OG1 2.94Å; K418-S422 PolarHBondContact O-N 3.25Å; K418-S422 PolarHBondContact O-OG 2.87Å
419	S	45.4	Very low	40.1	Very low	77 Å²	77	94.6 Å²	94.6	54%	0.538	53%	0.526	S	S	.	.	H	α-helix	trans	-80.4	-30.4	174.3	59.2	0	0	0	0	111.7	N416 S422 S423	N416-S419 PolarHBondContact O-N 3.42Å; N416-S419 PolarHBondContact O-OG 2.81Å; S419-S422 PolarHBondContact O-N 3.39Å; S419-S423 PolarHBondContact O-N 3.01Å; S419-S423 PolarHBondContact O-OG 3.39Å
420	F	40.4	Very low	40.2	Very low	49 Å²	49	99.2 Å²	99.2	22%	0.215	54%	0.541	C	S	.	.	H	α-helix	trans	-63.5	-44.7	175	-174.8	-105.4	0	0	0	112	L406 F409 F417 S423 L424	L406-F420 HydrophobicContact CD1-CE2 4.13Å; L406-F420 HydrophobicContact CD1-CZ 4.27Å; F409-F420 HydrophobicContact CB-CD2 3.82Å; F409-F420 HydrophobicContact CB-CE2 3.92Å; F409-F420 HydrophobicContact CD1-CD2 4.45Å; F409-F420 HydrophobicContact CD1-CE2 4.17Å; F409-F420 HydrophobicContact CD2-CB 4.01Å; F409-F420 HydrophobicContact CD2-CD1 4.48Å; F409-F420 AromaticContact CD2-CD2 3.39Å; F409-F420 HydrophobicContact CD2-CD2 3.39Å; F409-F420 AromaticContact CD2-CE2 3.93Å; F409-F420 HydrophobicContact CD2-CE2 3.93Å; F409-F420 AromaticContact CD2-CG 3.7Å; F409-F420 HydrophobicContact CD2-CG 3.7Å; F409-F420 HydrophobicContact CE2-CB 4.23Å; F409-F420 HydrophobicContact CE2-CD1 4.32Å; F409-F420 HydrophobicContact CE2-CD2 4.03Å; F409-F420 HydrophobicContact CE2-CE2 4.49Å; F409-F420 AromaticContact CE2-CG 3.92Å; F409-F420 HydrophobicContact CE2-CG 3.92Å; F409-F420 AromaticContact CG-CD2 3.64Å; F409-F420 HydrophobicContact CG-CD2 3.64Å; F409-F420 AromaticContact CG-CE2 3.74Å; F409-F420 HydrophobicContact CG-CE2 3.74Å; F409-F420 HydrophobicContact CG-CG 4.37Å; F417-F420 PolarHBondContact O-N 2.61Å; F420-S423 PolarHBondContact O-OG 3.05Å; F420-S423 VanDerWaalsContact O-OG 3.08Å; F420-L424 WeakPolarHBondContact O-CB 3.33Å; F420-L424 PolarHBondContact O-N 3.33Å
421	T	40.1	Very low	40.2	Very low	79 Å²	79	98.3 Å²	98.3	49%	0.485	53%	0.53	S	S	.	.	H	α-helix	trans	-71.5	-34.9	176.7	39.6	0	0	0	0	113.5	F417 K418 L425	F417-T421 PolarHBondContact O-N 2.77Å; F417-T421 PolarHBondContact O-OG1 3.29Å; F417-T421 VanDerWaalsContact O-OG1 3.11Å; K418-T421 PolarHBondContact O-OG1 2.94Å; T421-L425 VanDerWaalsContact O-CB 3.3Å; T421-L425 WeakPolarHBondContact O-CB 3.45Å; T421-L425 PolarHBondContact O-N 2.85Å
422	S	42.5	Very low	39.9	Very low	76 Å²	76	96.9 Å²	96.9	53%	0.531	52%	0.516	S	S	.	.	H	α-helix	trans	-69.3	-39	177.8	-70	0	0	0	0	112.8	K418 S419 S426	K418-S422 PolarHBondContact O-N 3.25Å; K418-S422 PolarHBondContact O-OG 2.87Å; S419-S422 PolarHBondContact O-N 3.39Å; S422-S426 VanDerWaalsContact O-CB 3.26Å; S422-S426 WeakPolarHBondContact O-CB 3.31Å; S422-S426 PolarHBondContact O-N 3.02Å
423	S	37.8	Very low	39.4	Very low	43 Å²	43	94.9 Å²	94.9	30%	0.301	51%	0.509	S	S	.	.	H	α-helix	trans	-68	-44.7	176.8	52	0	0	0	0	111.5	S419 F420 L425 S426 D427	S419-S423 PolarHBondContact O-N 3.01Å; S419-S423 PolarHBondContact O-OG 3.39Å; F420-S423 PolarHBondContact O-OG 3.05Å; F420-S423 VanDerWaalsContact O-OG 3.08Å; S423-L425 VanDerWaalsContact C-N 3.33Å; S423-L425 PolarHBondContact O-N 2.92Å; S423-S426 PolarHBondContact O-N 3.21Å; S423-D427 WeakPolarHBondContact O-CB 3.46Å; S423-D427 PolarHBondContact O-N 2.85Å
424	L	38.1	Very low	39.2	Very low	91 Å²	91	98 Å²	98	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-60.2	-42.6	175.9	-163.7	81.3	0	0	0	111.9	F420 M428	F420-L424 WeakPolarHBondContact O-CB 3.33Å; F420-L424 PolarHBondContact O-N 3.33Å; L424-M428 WeakPolarHBondContact O-CB 3.43Å; L424-M428 VanDerWaalsContact O-CG 3.22Å; L424-M428 WeakPolarHBondContact O-CG 3.25Å; L424-M428 PolarHBondContact O-N 3.22Å
425	L	37.3	Very low	38.8	Very low	125 Å²	125	91.3 Å²	91.3	65%	0.654	48%	0.483	S	S	*	.	H	α-helix	trans	-72.9	-36.1	-178	-160.1	71.1	0	0	0	112.4	T421 S423 A429	T421-L425 VanDerWaalsContact O-CB 3.3Å; T421-L425 WeakPolarHBondContact O-CB 3.45Å; T421-L425 PolarHBondContact O-N 2.85Å; S423-L425 VanDerWaalsContact C-N 3.33Å; S423-L425 PolarHBondContact O-N 2.92Å; L425-A429 PolarHBondContact O-N 3.49Å
426	S	38.6	Very low	38.7	Very low	72 Å²	72	87.5 Å²	87.5	50%	0.503	47%	0.474	S	S	.	.	H	α-helix	trans	-68.1	-38.9	174.1	-174.9	0	0	0	0	111.9	S422 S423 A429 R430	S422-S426 VanDerWaalsContact O-CB 3.26Å; S422-S426 WeakPolarHBondContact O-CB 3.31Å; S422-S426 PolarHBondContact O-N 3.02Å; S423-S426 PolarHBondContact O-N 3.21Å; S426-A429 WeakPolarHBondContact O-CB 3.44Å; S426-A429 PolarHBondContact O-N 3.15Å; S426-R430 PolarHBondContact O-N 3.15Å
427	D	38.7	Very low	38.1	Very low	41 Å²	41	87.3 Å²	87.3	22%	0.219	47%	0.47	C	S	.	.	H	α-helix	trans	-74.9	-33.7	176.7	-79	-15.7	0	0	0	112.1	S423 A429 R430 I431	S423-D427 WeakPolarHBondContact O-CB 3.46Å; S423-D427 PolarHBondContact O-N 2.85Å; D427-A429 VanDerWaalsContact C-N 3.29Å; D427-A429 PolarHBondContact O-N 3.36Å; D427-R430 PolarHBondContact O-N 3.24Å; D427-I431 WeakPolarHBondContact O-CG1 3.46Å; D427-I431 PolarHBondContact O-N 3.36Å
428	M	33.4	Very low	38.2	Very low	80 Å²	80	84.9 Å²	84.9	39%	0.394	46%	0.462	S	S	.	.	H	α-helix	trans	-61	-39.6	167.3	-77.3	-175.8	72.5	0	0	111.3	L424 R430 I431 M432	L424-M428 WeakPolarHBondContact O-CB 3.43Å; L424-M428 VanDerWaalsContact O-CG 3.22Å; L424-M428 WeakPolarHBondContact O-CG 3.25Å; L424-M428 PolarHBondContact O-N 3.22Å; M428-R430 VanDerWaalsContact C-N 3.33Å; M428-R430 PolarHBondContact O-N 2.86Å; M428-I431 PolarHBondContact O-N 3.41Å; M428-M432 WeakPolarHBondContact O-CB 3.27Å; M428-M432 WeakPolarHBondContact O-CG 3.28Å; M428-M432 PolarHBondContact O-N 2.74Å
429	A	36.8	Very low	37.6	Very low	39 Å²	39	84.2 Å²	84.2	32%	0.322	46%	0.462	S	S	.	.	H	α-helix	trans	-64.2	-37.3	174.8	0	0	0	0	0	112.3	L425 S426 D427 M432 A433	L425-A429 PolarHBondContact O-N 3.49Å; S426-A429 WeakPolarHBondContact O-CB 3.44Å; S426-A429 PolarHBondContact O-N 3.15Å; D427-A429 VanDerWaalsContact C-N 3.29Å; D427-A429 PolarHBondContact O-N 3.36Å; A429-M432 HydrophobicContact CB-CE 4.3Å; A429-M432 PolarHBondContact O-N 3.21Å; A429-A433 VanDerWaalsContact O-CB 3.24Å; A429-A433 WeakPolarHBondContact O-CB 3.46Å; A429-A433 PolarHBondContact O-N 2.83Å
430	R	37.8	Very low	37	Very low	172 Å²	172	83.7 Å²	83.7	65%	0.649	46%	0.462	S	S	*	.	H	α-helix	trans	-68.6	-40.4	172.4	-95.8	178.8	171.3	175.9	-2.4	113.2	S426 D427 M428 M432 A433 Q434	S426-R430 PolarHBondContact O-N 3.15Å; D427-R430 PolarHBondContact O-N 3.24Å; M428-R430 VanDerWaalsContact C-N 3.33Å; M428-R430 PolarHBondContact O-N 2.86Å; R430-M432 VanDerWaalsContact C-N 3.32Å; R430-A433 PolarHBondContact O-N 3.32Å; R430-Q434 VanDerWaalsContact O-CB 3.28Å; R430-Q434 WeakPolarHBondContact O-CB 3.46Å; R430-Q434 WeakPolarHBondContact O-CG 3.25Å; R430-Q434 PolarHBondContact O-N 2.64Å
431	I	36.1	Very low	36.6	Very low	73 Å²	73	87.5 Å²	87.5	37%	0.374	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-42	172.9	-70.4	166.8	0	0	0	109.7	A398 D427 M428 M435	A398-I431 HydrophobicContact CB-CD1 4.42Å; D427-I431 WeakPolarHBondContact O-CG1 3.46Å; D427-I431 PolarHBondContact O-N 3.36Å; M428-I431 PolarHBondContact O-N 3.41Å; I431-M435 HydrophobicContact CG2-CE 3.7Å; I431-M435 HydrophobicContact CG2-SD 4.44Å; I431-M435 VanDerWaalsContact O-CB 3.27Å; I431-M435 WeakPolarHBondContact O-CB 3.24Å; I431-M435 VanDerWaalsContact O-CG 3.29Å; I431-M435 WeakPolarHBondContact O-CG 3.48Å; I431-M435 PolarHBondContact O-N 2.81Å
432	M	37.1	Very low	36.1	Very low	85 Å²	85	94 Å²	94	42%	0.419	51%	0.51	S	S	.	.	H	α-helix	trans	-64.1	-42.3	174.6	-73.4	-171.9	-62.7	0	0	112.1	M428 A429 R430 M435 A436	M428-M432 WeakPolarHBondContact O-CB 3.27Å; M428-M432 WeakPolarHBondContact O-CG 3.28Å; M428-M432 PolarHBondContact O-N 2.74Å; A429-M432 HydrophobicContact CB-CE 4.3Å; A429-M432 PolarHBondContact O-N 3.21Å; R430-M432 VanDerWaalsContact C-N 3.32Å; M432-M435 HydrophobicContact CG-CE 4.38Å; M432-A436 WeakPolarHBondContact O-CB 3.44Å; M432-A436 PolarHBondContact O-N 2.99Å
433	A	37.4	Very low	35.6	Very low	48 Å²	48	92.9 Å²	92.9	40%	0.397	51%	0.511	S	S	.	.	H	α-helix	trans	-69.8	-40.8	177.6	0	0	0	0	0	112.1	A429 R430 A436 M437	A429-A433 VanDerWaalsContact O-CB 3.24Å; A429-A433 WeakPolarHBondContact O-CB 3.46Å; A429-A433 PolarHBondContact O-N 2.83Å; R430-A433 PolarHBondContact O-N 3.32Å; A433-A436 PolarHBondContact O-N 3.18Å; A433-M437 WeakPolarHBondContact O-CG 3.38Å; A433-M437 PolarHBondContact O-N 3.46Å
434	Q	37.2	Very low	35.4	Very low	112 Å²	112	94.1 Å²	94.1	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-39.1	174.4	-78.9	-179.5	-29.8	0	0	111.4	R430 A436 M437 M438	R430-Q434 VanDerWaalsContact O-CB 3.28Å; R430-Q434 WeakPolarHBondContact O-CB 3.46Å; R430-Q434 WeakPolarHBondContact O-CG 3.25Å; R430-Q434 PolarHBondContact O-N 2.64Å; Q434-A436 VanDerWaalsContact C-N 3.32Å; Q434-A436 PolarHBondContact O-N 3.1Å; Q434-M437 HydrophobicContact CB-CE 4.47Å; Q434-M437 HydrophobicContact CG-CE 3.79Å; Q434-M437 CarbonylContact O-C 3.33Å; Q434-M437 PolarHBondContact O-N 2.99Å; Q434-M438 VanDerWaalsContact O-CG 3.31Å; Q434-M438 WeakPolarHBondContact O-CG 3.42Å; Q434-M438 PolarHBondContact O-N 3.44Å
435	M	33	Very low	35.2	Very low	61 Å²	61	92.8 Å²	92.8	30%	0.3	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-38.5	170.3	-79.7	-170.8	-63	0	0	112.1	W369 A373 I431 M432 M438	W369-M435 HydrophobicContact CZ3-CE 4.29Å; A373-M435 HydrophobicContact CB-CE 4.37Å; A373-M435 HydrophobicContact CB-SD 3.69Å; I431-M435 HydrophobicContact CG2-CE 3.7Å; I431-M435 HydrophobicContact CG2-SD 4.44Å; I431-M435 VanDerWaalsContact O-CB 3.27Å; I431-M435 WeakPolarHBondContact O-CB 3.24Å; I431-M435 VanDerWaalsContact O-CG 3.29Å; I431-M435 WeakPolarHBondContact O-CG 3.48Å; I431-M435 PolarHBondContact O-N 2.81Å; M432-M435 HydrophobicContact CG-CE 4.38Å; M435-M438 PolarHBondContact O-N 3.05Å
436	A	34.8	Very low	35	Very low	72 Å²	72	92.2 Å²	92.2	60%	0.595	53%	0.531	S	S	*	.	H	α-helix	trans	-67.5	-37	173.9	0	0	0	0	0	112.1	M432 A433 Q434 M438	M432-A436 WeakPolarHBondContact O-CB 3.44Å; M432-A436 PolarHBondContact O-N 2.99Å; A433-A436 PolarHBondContact O-N 3.18Å; Q434-A436 VanDerWaalsContact C-N 3.32Å; Q434-A436 PolarHBondContact O-N 3.1Å; A436-M438 VanDerWaalsContact C-N 3.29Å; A436-M438 PolarHBondContact O-N 2.97Å
437	M	36.3	Very low	34.9	Very low	120 Å²	120	95.3 Å²	95.3	59%	0.591	54%	0.542	S	S	*	.	H	α-helix	trans	-68.6	-23.6	173.8	-73.3	-168.7	-70.7	0	0	113.1	A433 Q434 Q439 A440	A433-M437 WeakPolarHBondContact O-CG 3.38Å; A433-M437 PolarHBondContact O-N 3.46Å; Q434-M437 HydrophobicContact CB-CE 4.47Å; Q434-M437 HydrophobicContact CG-CE 3.79Å; Q434-M437 CarbonylContact O-C 3.33Å; Q434-M437 PolarHBondContact O-N 2.99Å; M437-Q439 VanDerWaalsContact C-N 3.28Å; M437-Q439 PolarHBondContact O-N 3.16Å; M437-A440 CarbonylContact O-C 3.55Å; M437-A440 WeakPolarHBondContact O-CA 3.42Å; M437-A440 PolarHBondContact O-N 3.46Å
438	M	39.1	Very low	34.9	Very low	94 Å²	94	101 Å²	101	46%	0.463	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	-10.2	-177.9	-78.3	177.4	83.8	0	0	115	F380 M394 Q434 M435 A436	F380-M438 HydrophobicContact CD2-CE 4.38Å; F380-M438 HydrophobicContact CE2-CE 4.37Å; M394-M438 HydrophobicContact CE-CE 3.79Å; M394-M438 HydrophobicContact CE-SD 4.35Å; M394-M438 HydrophobicContact SD-CE 3.69Å; M394-M438 HydrophobicContact SD-SD 4.06Å; Q434-M438 VanDerWaalsContact O-CG 3.31Å; Q434-M438 WeakPolarHBondContact O-CG 3.42Å; Q434-M438 PolarHBondContact O-N 3.44Å; M435-M438 PolarHBondContact O-N 3.05Å; A436-M438 VanDerWaalsContact C-N 3.29Å; A436-M438 PolarHBondContact O-N 2.97Å
439	Q	31.6	Very low	35.3	Very low	160 Å²	160	99.5 Å²	99.5	75%	0.748	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-7.4	162.7	-75.9	-143.7	-3.1	0	0	113.8	M437 V441	M437-Q439 VanDerWaalsContact C-N 3.28Å; M437-Q439 PolarHBondContact O-N 3.16Å; Q439-V441 PolarHBondContact O-N 3.27Å
440	A	32.4	Very low	35.7	Very low	66 Å²	66	101.9 Å²	101.9	55%	0.545	57%	0.573	S	S	.	*			trans	-102.7	75	-179.2	0	0	0	0	0	110.2	M437 K442	M437-A440 CarbonylContact O-C 3.55Å; M437-A440 WeakPolarHBondContact O-CA 3.42Å; M437-A440 PolarHBondContact O-N 3.46Å; A440-K442 PolarHBondContact O-N 3.04Å
441	V	33.4	Very low	36.6	Very low	129 Å²	129	96.8 Å²	96.8	78%	0.782	56%	0.561	S	S	*	*			trans	-62.2	92.8	160.3	177.2	0	0	0	0	108.3	Q439 G443	Q439-V441 PolarHBondContact O-N 3.27Å; V441-G443 PolarHBondContact O-N 3.25Å
442	K	29.2	Very low	37.7	Very low	214 Å²	214	98 Å²	98	93%	0.93	57%	0.572	S	S	*	*	S	Bend	trans	54.9	-3.3	148.1	-73.2	-175.6	174.7	179.6	0	123.1	A440	A440-K442 PolarHBondContact O-N 3.04Å
443	G	31.7	Very low	39.1	Very low	53 Å²	53	94.4 Å²	94.4	55%	0.546	56%	0.555	S	S	.	*	S	Bend	trans	-120.8	-22	-170	0	0	0	0	0	119.7	V441	V441-G443 PolarHBondContact O-N 3.25Å
444	V	33.4	Very low	40.1	Very low	69 Å²	69	94.2 Å²	94.2	42%	0.418	55%	0.553	S	S	.	*			trans	-106.7	-0.7	-149.3	-152.7	0	0	0	0	114.8	S446 L447 F448	V444-S446 PolarHBondContact O-N 3.03Å; V444-S446 VanDerWaalsContact O-N 3.11Å; V444-L447 HydrophobicContact CG1-CB 3.79Å; V444-L447 HydrophobicContact CG1-CD1 4.19Å; V444-L447 PolarHBondContact O-N 2.86Å; V444-F448 HydrophobicContact CG1-CD2 3.49Å; V444-F448 VanDerWaalsContact CG1-CD2 3.49Å; V444-F448 HydrophobicContact CG1-CE2 3.74Å; V444-F448 PolarHBondContact O-N 3.24Å
445	G	33.6	Very low	41.7	Very low	63 Å²	63	97 Å²	97	65%	0.649	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	-33.1	179.8	0	0	0	0	0	113.6
446	S	33.5	Very low	43.5	Very low	113 Å²	113	96.5 Å²	96.5	79%	0.79	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-18.6	177.5	81.6	0	0	0	0	114.3	V444	V444-S446 PolarHBondContact O-N 3.03Å; V444-S446 VanDerWaalsContact O-N 3.11Å
447	L	35.9	Very low	45.5	Very low	137 Å²	137	95.5 Å²	95.5	72%	0.717	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-24.5	-178.2	-78.1	170.4	0	0	0	112.8	V444	V444-L447 HydrophobicContact CG1-CB 3.79Å; V444-L447 HydrophobicContact CG1-CD1 4.19Å; V444-L447 PolarHBondContact O-N 2.86Å
448	F	39.6	Very low	47.3	Very low	161 Å²	161	95.5 Å²	95.5	71%	0.706	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	5	-178.3	-87	-72.1	0	0	0	115.8	V444 F450	V444-F448 HydrophobicContact CG1-CD2 3.49Å; V444-F448 VanDerWaalsContact CG1-CD2 3.49Å; V444-F448 HydrophobicContact CG1-CE2 3.74Å; V444-F448 PolarHBondContact O-N 3.24Å; F448-F450 PolarHBondContact O-N 3.34Å; F448-F450 VanDerWaalsContact O-N 3.17Å
449	G	41.9	Very low	49	Very low	48 Å²	48	95.2 Å²	95.2	50%	0.495	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	55.3	37.2	174.6	0	0	0	0	0	112.9	T451	G449-T451 PolarHBondContact O-N 3.22Å
450	F	44.4	Very low	50.8	Low	89 Å²	89	96.7 Å²	96.7	39%	0.39	59%	0.586	S	S	.	*			trans	-76.5	113.4	178.3	-166.6	-94.6	0	0	0	108.7	F448 F477 A484 V486	F448-F450 PolarHBondContact O-N 3.34Å; F448-F450 VanDerWaalsContact O-N 3.17Å; F450-F477 AromaticContact CE2-CD1 3.97Å; F450-F477 HydrophobicContact CE2-CD1 3.97Å; F450-F477 AromaticContact CE2-CE1 3.69Å; F450-F477 HydrophobicContact CE2-CE1 3.69Å; F450-F477 HydrophobicContact CZ-CD1 4.25Å; F450-F477 AromaticContact CZ-CE1 3.71Å; F450-F477 HydrophobicContact CZ-CE1 3.71Å; F450-A484 WeakPolarHBondContact CD2-O 3.34Å; F450-V486 HydrophobicContact CE1-CB 4.41Å; F450-V486 HydrophobicContact CE1-CG2 4.25Å; F450-V486 HydrophobicContact CE2-CG2 4.05Å; F450-V486 HydrophobicContact CZ-CB 3.93Å; F450-V486 HydrophobicContact CZ-CG2 3.35Å
451	T	57.3	Low	52.5	Low	66 Å²	66	94.7 Å²	94.7	41%	0.405	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.8	124.8	175.4	65.7	0	0	0	0	109.2	G449 N453	G449-T451 PolarHBondContact O-N 3.22Å; T451-N453 PolarHBondContact OG1-OD1 3.26Å
452	T	60	Low	54	Low	98 Å²	98	92.9 Å²	92.9	60%	0.601	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.7	123.9	164.6	49.1	0	0	0	0	107.4	E489	T452-E489 VanDerWaalsContact C-OE1 3.24Å; T452-E489 VanDerWaalsContact CA-OE1 3.28Å; T452-E489 WeakPolarHBondContact CA-OE1 3.5Å; T452-E489 WeakPolarHBondContact CB-OE1 3.45Å
453	N	64.6	Low	55.9	Low	10 Å²	10	86.2 Å²	86.2	5%	0.053	54%	0.541	C	S	.	.			trans	-108.2	26.9	-173	-57.5	-41.5	0	0	0	112.5	T451 D455 G456 Y459 F478 V486 E489	T451-N453 PolarHBondContact OG1-OD1 3.26Å; N453-D455 PolarHBondContact O-N 2.9Å; N453-G456 PolarHBondContact O-N 3.24Å; N453-Y459 PolarHBondContact OD1-OH 3.35Å; N453-F478 WeakPolarHBondContact ND2-CZ 3.23Å; N453-V486 PolarHBondContact ND2-O 3.5Å; N453-E489 PolarHBondContact N-OE1 3.37Å
454	A	59.7	Low	57.8	Low	44 Å²	44	84.6 Å²	84.6	36%	0.364	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-34.9	177.1	0	0	0	0	0	114.7	G456 E489 A490	A454-G456 VanDerWaalsContact C-N 3.32Å; A454-E489 HydrophobicContact CB-CG 4.13Å; A454-E489 WeakPolarHBondContact CB-OE1 3.37Å; A454-E489 PolarHBondContact N-OE1 2.88Å; A454-A490 HydrophobicContact CB-CB 3.9Å
455	D	70.4	Confident	59.7	Low	171 Å²	171	85.3 Å²	85.3	91%	0.914	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.5	-179	-63.7	-29.5	0	0	0	113.6	N453	N453-D455 PolarHBondContact O-N 2.9Å
456	G	71.4	Confident	61.8	Low	49 Å²	49	88.5 Å²	88.5	51%	0.505	52%	0.521	S	S	.	.			trans	76.4	174.6	-173.3	0	0	0	0	0	113.8	N453 A454	N453-G456 PolarHBondContact O-N 3.24Å; A454-G456 VanDerWaalsContact C-N 3.32Å
457	G	76.9	Confident	63.9	Low	52 Å²	52	85.5 Å²	85.5	54%	0.536	49%	0.492	S	S	.	.			trans	178.7	167.8	179.8	0	0	0	0	0	113.6
458	V	74.5	Confident	66	Low	120 Å²	120	81.5 Å²	81.5	73%	0.727	48%	0.476	S	S	*	.			trans	-100.5	119.6	174	177.4	0	0	0	0	108.7	L498	V458-L498 HydrophobicContact CG1-CD1 3.58Å; V458-L498 HydrophobicContact CG2-CD1 4.31Å
459	Y	74.4	Confident	67.9	Low	88 Å²	88	76.6 Å²	76.6	35%	0.345	47%	0.471	S	S	.	.			trans	-125.3	143.5	-174.4	-57.4	-70.1	0	0	0	112	N453 L464 F478 F480	N453-Y459 PolarHBondContact OD1-OH 3.35Å; Y459-L464 HydrophobicContact CD2-CD1 4.32Å; Y459-L464 HydrophobicContact CG-CD1 4.15Å; Y459-F478 HydrophobicContact CE2-CZ 4.47Å; Y459-F480 HydrophobicContact CD1-CD1 4.33Å; Y459-F480 AromaticContact CD1-CE1 3.35Å; Y459-F480 HydrophobicContact CD1-CE1 3.35Å; Y459-F480 AromaticContact CD1-CZ 3.89Å; Y459-F480 HydrophobicContact CD1-CZ 3.89Å; Y459-F480 AromaticContact CE1-CE1 3.89Å; Y459-F480 HydrophobicContact CE1-CE1 3.89Å; Y459-F480 AromaticContact CE1-CZ 3.94Å; Y459-F480 HydrophobicContact CE1-CZ 3.94Å; Y459-F480 AromaticContact CG-CE1 3.76Å; Y459-F480 HydrophobicContact CG-CE1 3.76Å; Y459-F480 HydrophobicContact CG-CZ 4.47Å
460	Q	69	Low	69.9	Low	191 Å²	191	77.1 Å²	77.1	89%	0.893	47%	0.465	S	S	*	.			trans	-111.4	101.1	171.4	-172.2	173.3	-6.2	0	0	108.7
461	S	67.1	Low	71.7	Confident	24 Å²	24	77.4 Å²	77.4	17%	0.168	47%	0.473	C	S	.	.			trans	-145	145.5	170	81.5	0	0	0	0	111.3	D463 L464 A479	S461-D463 PolarHBondContact O-N 3.42Å; S461-L464 VanDerWaalsContact OG-CB 3.29Å; S461-L464 WeakPolarHBondContact OG-CB 3.34Å; S461-L464 WeakPolarHBondContact OG-CD1 3.38Å; S461-L464 WeakPolarHBondContact OG-CG 3.46Å; S461-L464 PolarHBondContact OG-N 3.41Å; S461-L464 VanDerWaalsContact OG-N 3.1Å; S461-A479 WeakPolarHBondContact CB-O 3.36Å; S461-A479 PolarHBondContact OG-O 3.01Å
462	A	65.3	Low	72.8	Confident	90 Å²	90	74.6 Å²	74.6	74%	0.744	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-35.6	176.8	0	0	0	0	0	111.1	S465	A462-S465 PolarHBondContact O-OG 2.95Å
463	D	69.6	Low	73.6	Confident	74 Å²	74	74.6 Å²	74.6	40%	0.396	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-75.3	-29.3	-176.1	-106.2	25.3	0	0	0	113.9	S461 S465 R466	S461-D463 PolarHBondContact O-N 3.42Å; D463-S465 PolarHBondContact O-N 3.46Å; D463-R466 WeakPolarHBondContact O-CD 3.4Å; D463-R466 WeakPolarHBondContact O-CG 3.47Å; D463-R466 PolarHBondContact O-N 3.39Å; D463-R466 IonicContact OD1-NH1 3.84Å; D463-R466 IonicContact OD2-CZ 2.59Å; D463-R466 IonicContact OD2-NH1 3.79Å; D463-R466 PolarHBondContact OD2-NH1 3.25Å
464	L	71.3	Confident	74	Confident	19 Å²	19	82 Å²	82	10%	0.099	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-66.6	-24.3	178.8	-83.6	172	0	0	0	112.9	Y459 S461 R466 Y467 S468 F478 M487 I495	Y459-L464 HydrophobicContact CD2-CD1 4.32Å; Y459-L464 HydrophobicContact CG-CD1 4.15Å; S461-L464 VanDerWaalsContact OG-CB 3.29Å; S461-L464 WeakPolarHBondContact OG-CB 3.34Å; S461-L464 WeakPolarHBondContact OG-CD1 3.38Å; S461-L464 WeakPolarHBondContact OG-CG 3.46Å; S461-L464 PolarHBondContact OG-N 3.41Å; S461-L464 VanDerWaalsContact OG-N 3.1Å; L464-R466 PolarHBondContact O-N 2.85Å; L464-R466 VanDerWaalsContact O-N 3.1Å; L464-Y467 PolarHBondContact O-N 2.83Å; L464-S468 PolarHBondContact O-N 2.89Å; L464-F478 HydrophobicContact CD1-CD2 3.93Å; L464-F478 HydrophobicContact CD1-CE2 3.78Å; L464-F478 HydrophobicContact CD2-CB 4.04Å; L464-F478 HydrophobicContact CD2-CD1 4.44Å; L464-F478 HydrophobicContact CD2-CD2 3.4Å; L464-F478 VanDerWaalsContact CD2-CD2 3.4Å; L464-F478 HydrophobicContact CD2-CE2 3.75Å; L464-F478 HydrophobicContact CD2-CG 3.74Å; L464-F478 HydrophobicContact CD2-CZ 4.43Å; L464-F478 HydrophobicContact CG-CD2 3.64Å; L464-F478 HydrophobicContact CG-CE2 4.01Å; L464-F478 HydrophobicContact CG-CG 4.38Å; L464-M487 HydrophobicContact CD2-SD 4.22Å; L464-I495 HydrophobicContact CD2-CD1 4.36Å
465	S	72.9	Confident	74.8	Confident	85 Å²	85	83.8 Å²	83.8	59%	0.594	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-55.9	-28.8	178.4	67.8	0	0	0	0	112.7	A462 D463 Y467 S468	A462-S465 PolarHBondContact O-OG 2.95Å; D463-S465 PolarHBondContact O-N 3.46Å; S465-Y467 PolarHBondContact O-N 3.41Å; S465-S468 VanDerWaalsContact O-CB 3.23Å; S465-S468 WeakPolarHBondContact O-CB 3.49Å; S465-S468 PolarHBondContact O-N 3.46Å; S465-S468 VanDerWaalsContact O-N 3.17Å
466	R	77.3	Confident	74.8	Confident	130 Å²	130	76.9 Å²	76.9	49%	0.491	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-66.7	-22.1	177.5	83.6	-165.3	-178	-150.1	-5.9	113.9	D463 L464	D463-R466 WeakPolarHBondContact O-CD 3.4Å; D463-R466 WeakPolarHBondContact O-CG 3.47Å; D463-R466 PolarHBondContact O-N 3.39Å; D463-R466 IonicContact OD1-NH1 3.84Å; D463-R466 IonicContact OD2-CZ 2.59Å; D463-R466 IonicContact OD2-NH1 3.79Å; D463-R466 PolarHBondContact OD2-NH1 3.25Å; L464-R466 PolarHBondContact O-N 2.85Å; L464-R466 VanDerWaalsContact O-N 3.1Å
467	Y	78.7	Confident	75	Confident	49 Å²	49	80.9 Å²	80.9	19%	0.192	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-102.2	-1.7	177.4	-57.6	-74	0	0	0	112.7	L464 S465 G469 T470 T476 M487 I495	L464-Y467 PolarHBondContact O-N 2.83Å; S465-Y467 PolarHBondContact O-N 3.41Å; Y467-G469 PolarHBondContact O-N 2.92Å; Y467-T470 WeakPolarHBondContact CA-OG1 3.46Å; Y467-T470 WeakPolarHBondContact O-CB 3.44Å; Y467-T470 PolarHBondContact O-N 3.41Å; Y467-T470 PolarHBondContact O-OG1 2.82Å; Y467-T476 HydrophobicContact CE1-CG2 4.13Å; Y467-M487 HydrophobicContact CD1-CE 3.85Å; Y467-M487 HydrophobicContact CD2-CE 3.45Å; Y467-M487 VanDerWaalsContact CD2-CE 3.45Å; Y467-M487 HydrophobicContact CD2-SD 4.46Å; Y467-M487 HydrophobicContact CE1-CE 3.85Å; Y467-M487 HydrophobicContact CE2-CE 3.42Å; Y467-M487 VanDerWaalsContact CE2-CE 3.42Å; Y467-M487 HydrophobicContact CG-CE 3.66Å; Y467-I495 HydrophobicContact CG-CD1 4.42Å; Y467-I495 WeakPolarHBondContact O-CB 3.21Å
468	S	80.8	Confident	74.9	Confident	54 Å²	54	78.8 Å²	78.8	38%	0.378	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	124	177.8	176.6	0	0	0	0	110.9	L464 S465 P497	L464-S468 PolarHBondContact O-N 2.89Å; S465-S468 VanDerWaalsContact O-CB 3.23Å; S465-S468 WeakPolarHBondContact O-CB 3.49Å; S465-S468 PolarHBondContact O-N 3.46Å; S465-S468 VanDerWaalsContact O-N 3.17Å; S468-P497 WeakPolarHBondContact OG-CD 3.43Å; S468-P497 WeakPolarHBondContact OG-CG 3.34Å
469	G	79.3	Confident	74.7	Confident	58 Å²	58	75 Å²	75	60%	0.598	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	6.6	-176.6	0	0	0	0	0	114.9	Y467 I495	Y467-G469 PolarHBondContact O-N 2.92Å; G469-I495 WeakPolarHBondContact CA-O 3.4Å; G469-I495 PolarHBondContact N-O 2.83Å
470	T	83.6	Confident	74.3	Confident	59 Å²	59	73 Å²	73	36%	0.362	41%	0.406	S	S	.	.			trans	-109.5	159	-179.4	72.3	0	0	0	0	112.4	Y467 I495	Y467-T470 WeakPolarHBondContact CA-OG1 3.46Å; Y467-T470 WeakPolarHBondContact O-CB 3.44Å; Y467-T470 PolarHBondContact O-N 3.41Å; Y467-T470 PolarHBondContact O-OG1 2.82Å; T470-I495 PolarHBondContact O-N 2.87Å
471	V	82.2	Confident	74	Confident	94 Å²	94	68.6 Å²	68.6	57%	0.57	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.6	170.6	179.6	0	0	0	0	109.1	P492 E493 A494	V471-P492 HydrophobicContact CG1-CB 3.82Å; V471-E493 CarbonylContact C-O 3.33Å; V471-E493 WeakPolarHBondContact CA-O 3.37Å; V471-A494 HydrophobicContact CG2-CB 4.17Å
472	V	79.9	Confident	73.5	Confident	8 Å²	8	77 Å²	77	5%	0.048	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	112.8	177.9	-174.2	0	0	0	0	108.5	R474 T476 M487 P492 E493 I495	V472-R474 VanDerWaalsContact CG1-O 3.28Å; V472-R474 WeakPolarHBondContact CG1-O 3.37Å; V472-T476 HydrophobicContact CG1-CG2 4.46Å; V472-T476 WeakPolarHBondContact CG1-OG1 3.18Å; V472-M487 HydrophobicContact CB-CE 4.47Å; V472-M487 HydrophobicContact CB-CG 4.46Å; V472-M487 HydrophobicContact CG1-CE 4.21Å; V472-M487 HydrophobicContact CG1-CG 4.09Å; V472-M487 HydrophobicContact CG2-CE 3.6Å; V472-M487 HydrophobicContact CG2-CG 4.38Å; V472-M487 HydrophobicContact CG2-SD 4.14Å; V472-P492 WeakPolarHBondContact O-CA 3.46Å; V472-E493 PolarHBondContact N-O 3.13Å; V472-E493 PolarHBondContact O-N 3.04Å; V472-I495 HydrophobicContact CG2-CD1 3.89Å; V472-I495 HydrophobicContact CG2-CG1 4.26Å
473	N	76	Confident	73.6	Confident	97 Å²	97	74.4 Å²	74.4	52%	0.519	42%	0.418	S	S	.	.			trans	-111.9	11.6	-173.6	66.9	-8.4	0	0	0	114.2	P492	N473-P492 HydrophobicContact CB-CB 4.34Å; N473-P492 HydrophobicContact CB-CG 4.32Å
474	R	74.4	Confident	73.6	Confident	165 Å²	165	72.7 Å²	72.7	62%	0.623	41%	0.414	S	S	*	.	S	Bend	trans	-145.5	150.1	177.2	63	-177.7	78.1	90.1	-2.5	108.7	V472 T476 G488	V472-R474 VanDerWaalsContact CG1-O 3.28Å; V472-R474 WeakPolarHBondContact CG1-O 3.37Å; R474-T476 PolarHBondContact O-N 2.76Å; R474-T476 PolarHBondContact O-OG1 2.85Å; R474-G488 CarbonylContact C-O 3.49Å
475	P	75.6	Confident	73.8	Confident	83 Å²	83	71.8 Å²	71.8	54%	0.539	41%	0.409	S	S	.	.			trans	-51.5	113.4	177.7	-27.2	34.6	0	0	0	110.8	V486 M487	P475-V486 HydrophobicContact CB-CG1 4.04Å; P475-M487 CarbonylContact C-O 3.5Å; P475-M487 WeakPolarHBondContact CA-O 3.27Å
476	T	70.3	Confident	73.9	Confident	25 Å²	25	68.1 Å²	68.1	15%	0.153	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.9	-175.7	-57.5	0	0	0	0	108.4	Y467 V472 R474 V486 M487	Y467-T476 HydrophobicContact CE1-CG2 4.13Å; V472-T476 HydrophobicContact CG1-CG2 4.46Å; V472-T476 WeakPolarHBondContact CG1-OG1 3.18Å; R474-T476 PolarHBondContact O-N 2.76Å; R474-T476 PolarHBondContact O-OG1 2.85Å; T476-V486 WeakPolarHBondContact O-CA 3.3Å; T476-M487 HydrophobicContact CG2-CE 3.39Å; T476-M487 PolarHBondContact N-O 2.67Å; T476-M487 WeakPolarHBondContact O-CG 3.38Å; T476-M487 PolarHBondContact O-N 3.26Å
477	F	76	Confident	73.8	Confident	134 Å²	134	62.2 Å²	62.2	59%	0.588	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	142.3	178.2	-67.8	-90	0	0	0	111.2	F450 G485 V486	F450-F477 AromaticContact CE2-CD1 3.97Å; F450-F477 HydrophobicContact CE2-CD1 3.97Å; F450-F477 AromaticContact CE2-CE1 3.69Å; F450-F477 HydrophobicContact CE2-CE1 3.69Å; F450-F477 HydrophobicContact CZ-CD1 4.25Å; F450-F477 AromaticContact CZ-CE1 3.71Å; F450-F477 HydrophobicContact CZ-CE1 3.71Å; F477-G485 WeakPolarHBondContact CA-O 3.23Å; F477-V486 HydrophobicContact CD1-CG2 3.22Å; F477-V486 HydrophobicContact CD2-CG2 4.26Å; F477-V486 HydrophobicContact CE1-CG2 3.2Å; F477-V486 HydrophobicContact CE2-CG2 4.23Å; F477-V486 HydrophobicContact CG-CG2 3.78Å; F477-V486 HydrophobicContact CZ-CG2 3.73Å
478	F	74.3	Confident	73.7	Confident	8 Å²	8	60 Å²	60	4%	0.035	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.3	171.5	66.6	-81.7	0	0	0	111.1	N453 Y459 L464 F480 A484 G485 M487	N453-F478 WeakPolarHBondContact ND2-CZ 3.23Å; Y459-F478 HydrophobicContact CE2-CZ 4.47Å; L464-F478 HydrophobicContact CD1-CD2 3.93Å; L464-F478 HydrophobicContact CD1-CE2 3.78Å; L464-F478 HydrophobicContact CD2-CB 4.04Å; L464-F478 HydrophobicContact CD2-CD1 4.44Å; L464-F478 HydrophobicContact CD2-CD2 3.4Å; L464-F478 VanDerWaalsContact CD2-CD2 3.4Å; L464-F478 HydrophobicContact CD2-CE2 3.75Å; L464-F478 HydrophobicContact CD2-CG 3.74Å; L464-F478 HydrophobicContact CD2-CZ 4.43Å; L464-F478 HydrophobicContact CG-CD2 3.64Å; L464-F478 HydrophobicContact CG-CE2 4.01Å; L464-F478 HydrophobicContact CG-CG 4.38Å; F478-F480 HydrophobicContact CD2-CD1 4.43Å; F478-F480 AromaticContact CD2-CE1 3.96Å; F478-F480 HydrophobicContact CD2-CE1 3.96Å; F478-F480 HydrophobicContact CD2-CZ 4.03Å; F478-F480 HydrophobicContact CE2-CD1 4.05Å; F478-F480 AromaticContact CE2-CE1 3.18Å; F478-F480 HydrophobicContact CE2-CE1 3.18Å; F478-F480 HydrophobicContact CE2-CE2 4.03Å; F478-F480 AromaticContact CE2-CZ 3.16Å; F478-F480 HydrophobicContact CE2-CZ 3.16Å; F478-F480 AromaticContact CZ-CE1 3.96Å; F478-F480 HydrophobicContact CZ-CE1 3.96Å; F478-F480 HydrophobicContact CZ-CE2 4.37Å; F478-F480 AromaticContact CZ-CZ 3.52Å; F478-F480 HydrophobicContact CZ-CZ 3.52Å; F478-A484 WeakPolarHBondContact O-CA 3.22Å; F478-G485 VanDerWaalsContact CD1-O 3.32Å; F478-G485 WeakPolarHBondContact CD1-O 3.25Å; F478-G485 PolarHBondContact N-O 3.08Å; F478-G485 PolarHBondContact O-N 2.74Å; F478-M487 HydrophobicContact CB-SD 4.41Å; F478-M487 HydrophobicContact CD1-CB 4.09Å; F478-M487 HydrophobicContact CD1-CG 3.79Å; F478-M487 HydrophobicContact CD1-SD 3.6Å; F478-M487 HydrophobicContact CE1-CB 3.75Å; F478-M487 HydrophobicContact CE1-CG 4Å; F478-M487 HydrophobicContact CE1-SD 4.05Å; F478-M487 HydrophobicContact CG-SD 4.16Å
479	A	71.2	Confident	73.4	Confident	41 Å²	41	60.6 Å²	60.6	34%	0.339	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	143	-178	0	0	0	0	0	111.4	S461	S461-A479 WeakPolarHBondContact CB-O 3.36Å; S461-A479 PolarHBondContact OG-O 3.01Å
480	F	65.4	Low	73.1	Confident	45 Å²	45	61.3 Å²	61.3	20%	0.197	35%	0.351	C	S	.	.			trans	-100.4	171.4	168.7	-59.8	-69.2	0	0	0	110.4	Y459 F478 K482 G483	Y459-F480 HydrophobicContact CD1-CD1 4.33Å; Y459-F480 AromaticContact CD1-CE1 3.35Å; Y459-F480 HydrophobicContact CD1-CE1 3.35Å; Y459-F480 AromaticContact CD1-CZ 3.89Å; Y459-F480 HydrophobicContact CD1-CZ 3.89Å; Y459-F480 AromaticContact CE1-CE1 3.89Å; Y459-F480 HydrophobicContact CE1-CE1 3.89Å; Y459-F480 AromaticContact CE1-CZ 3.94Å; Y459-F480 HydrophobicContact CE1-CZ 3.94Å; Y459-F480 AromaticContact CG-CE1 3.76Å; Y459-F480 HydrophobicContact CG-CE1 3.76Å; Y459-F480 HydrophobicContact CG-CZ 4.47Å; F478-F480 HydrophobicContact CD2-CD1 4.43Å; F478-F480 AromaticContact CD2-CE1 3.96Å; F478-F480 HydrophobicContact CD2-CE1 3.96Å; F478-F480 HydrophobicContact CD2-CZ 4.03Å; F478-F480 HydrophobicContact CE2-CD1 4.05Å; F478-F480 AromaticContact CE2-CE1 3.18Å; F478-F480 HydrophobicContact CE2-CE1 3.18Å; F478-F480 HydrophobicContact CE2-CE2 4.03Å; F478-F480 AromaticContact CE2-CZ 3.16Å; F478-F480 HydrophobicContact CE2-CZ 3.16Å; F478-F480 AromaticContact CZ-CE1 3.96Å; F478-F480 HydrophobicContact CZ-CE1 3.96Å; F478-F480 HydrophobicContact CZ-CE2 4.37Å; F478-F480 AromaticContact CZ-CZ 3.52Å; F478-F480 HydrophobicContact CZ-CZ 3.52Å; F480-K482 PolarHBondContact O-N 3.38Å; F480-G483 PolarHBondContact N-O 2.79Å
481	A	62.1	Low	72.7	Confident	99 Å²	99	59.8 Å²	59.8	82%	0.818	35%	0.347	S	S	*	.	S	Bend	trans	-57.5	-28.5	167	0	0	0	0	0	112.1
482	K	56.8	Low	72.6	Confident	199 Å²	199	60.2 Å²	60.2	87%	0.865	35%	0.352	S	S	*	.	S	Bend	trans	-141.3	109.3	171.1	-64.8	-177.1	-180	180	0	109.1	F480	F480-K482 PolarHBondContact O-N 3.38Å
483	G	67.3	Low	72.5	Confident	37 Å²	37	61.7 Å²	61.7	38%	0.381	36%	0.358	S	S	.	.	S	Bend	trans	99.8	-176.3	178.1	0	0	0	0	0	114.2	F480	F480-G483 PolarHBondContact N-O 2.79Å
484	A	69.7	Low	72.9	Confident	37 Å²	37	60.1 Å²	60.1	31%	0.306	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	149.9	177.8	0	0	0	0	0	109.7	F450 F478	F450-A484 WeakPolarHBondContact CD2-O 3.34Å; F478-A484 WeakPolarHBondContact O-CA 3.22Å
485	G	75.1	Confident	73.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	164.9	176.2	0	0	0	0	0	111.3	F477 F478	F477-G485 WeakPolarHBondContact CA-O 3.23Å; F478-G485 VanDerWaalsContact CD1-O 3.32Å; F478-G485 WeakPolarHBondContact CD1-O 3.25Å; F478-G485 PolarHBondContact N-O 3.08Å; F478-G485 PolarHBondContact O-N 2.74Å
486	V	76.9	Confident	73.8	Confident	8 Å²	8	54.2 Å²	54.2	5%	0.048	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.7	166.7	166.2	0	0	0	0	109.5	F450 N453 P475 T476 F477 E489	F450-V486 HydrophobicContact CE1-CB 4.41Å; F450-V486 HydrophobicContact CE1-CG2 4.25Å; F450-V486 HydrophobicContact CE2-CG2 4.05Å; F450-V486 HydrophobicContact CZ-CB 3.93Å; F450-V486 HydrophobicContact CZ-CG2 3.35Å; N453-V486 PolarHBondContact ND2-O 3.5Å; P475-V486 HydrophobicContact CB-CG1 4.04Å; T476-V486 WeakPolarHBondContact O-CA 3.3Å; F477-V486 HydrophobicContact CD1-CG2 3.22Å; F477-V486 HydrophobicContact CD2-CG2 4.26Å; F477-V486 HydrophobicContact CE1-CG2 3.2Å; F477-V486 HydrophobicContact CE2-CG2 4.23Å; F477-V486 HydrophobicContact CG-CG2 3.78Å; F477-V486 HydrophobicContact CZ-CG2 3.73Å; V486-E489 HydrophobicContact CG1-CB 4.14Å
487	M	74.4	Confident	74.4	Confident	6 Å²	6	56 Å²	56	3%	0.03	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	154.4	175.1	59.6	-166.6	-167.4	0	0	108.9	L464 Y467 V472 P475 T476 F478 E493 I495	L464-M487 HydrophobicContact CD2-SD 4.22Å; Y467-M487 HydrophobicContact CD1-CE 3.85Å; Y467-M487 HydrophobicContact CD2-CE 3.45Å; Y467-M487 VanDerWaalsContact CD2-CE 3.45Å; Y467-M487 HydrophobicContact CD2-SD 4.46Å; Y467-M487 HydrophobicContact CE1-CE 3.85Å; Y467-M487 HydrophobicContact CE2-CE 3.42Å; Y467-M487 VanDerWaalsContact CE2-CE 3.42Å; Y467-M487 HydrophobicContact CG-CE 3.66Å; V472-M487 HydrophobicContact CB-CE 4.47Å; V472-M487 HydrophobicContact CB-CG 4.46Å; V472-M487 HydrophobicContact CG1-CE 4.21Å; V472-M487 HydrophobicContact CG1-CG 4.09Å; V472-M487 HydrophobicContact CG2-CE 3.6Å; V472-M487 HydrophobicContact CG2-CG 4.38Å; V472-M487 HydrophobicContact CG2-SD 4.14Å; P475-M487 CarbonylContact C-O 3.5Å; P475-M487 WeakPolarHBondContact CA-O 3.27Å; T476-M487 HydrophobicContact CG2-CE 3.39Å; T476-M487 PolarHBondContact N-O 2.67Å; T476-M487 WeakPolarHBondContact O-CG 3.38Å; T476-M487 PolarHBondContact O-N 3.26Å; F478-M487 HydrophobicContact CB-SD 4.41Å; F478-M487 HydrophobicContact CD1-CB 4.09Å; F478-M487 HydrophobicContact CD1-CG 3.79Å; F478-M487 HydrophobicContact CD1-SD 3.6Å; F478-M487 HydrophobicContact CE1-CB 3.75Å; F478-M487 HydrophobicContact CE1-CG 4Å; F478-M487 HydrophobicContact CE1-SD 4.05Å; F478-M487 HydrophobicContact CG-SD 4.16Å; M487-E493 WeakPolarHBondContact CA-OE2 3.49Å; M487-E493 WeakPolarHBondContact CB-OE2 3.43Å; M487-I495 HydrophobicContact CE-CD1 3.97Å; M487-I495 HydrophobicContact SD-CD1 3.29Å; M487-I495 WeakPolarHBondContact SD-CD1 3.25Å
488	G	76.7	Confident	74.7	Confident	4 Å²	4	53.1 Å²	53.1	4%	0.041	34%	0.336	C	S	.	.	S	Bend	trans	75.7	24.9	-175.6	0	0	0	0	0	113.5	R474 G491 E493	R474-G488 CarbonylContact C-O 3.49Å; G488-G491 WeakPolarHBondContact CA-O 3.31Å; G488-E493 WeakPolarHBondContact CA-OE1 3.34Å; G488-E493 PolarHBondContact N-OE1 3.43Å; G488-E493 PolarHBondContact N-OE2 3.4Å
489	E	75.4	Confident	75	Confident	65 Å²	65	59.2 Å²	59.2	30%	0.304	36%	0.359	S	S	.	.	S	Bend	trans	-85.8	-33.8	179.2	66.8	-169.7	-175.2	0	0	112.5	T452 N453 A454 V486 E493	T452-E489 VanDerWaalsContact C-OE1 3.24Å; T452-E489 VanDerWaalsContact CA-OE1 3.28Å; T452-E489 WeakPolarHBondContact CA-OE1 3.5Å; T452-E489 WeakPolarHBondContact CB-OE1 3.45Å; N453-E489 PolarHBondContact N-OE1 3.37Å; A454-E489 HydrophobicContact CB-CG 4.13Å; A454-E489 WeakPolarHBondContact CB-OE1 3.37Å; A454-E489 PolarHBondContact N-OE1 2.88Å; V486-E489 HydrophobicContact CG1-CB 4.14Å; E489-E493 PolarHBondContact N-OE1 3.11Å
490	A	73	Confident	75.5	Confident	73 Å²	73	65.3 Å²	65.3	60%	0.603	37%	0.373	S	S	*	.	S	Bend	trans	-90.7	-3.8	179	0	0	0	0	0	113.2	A454	A454-A490 HydrophobicContact CB-CB 3.9Å
491	G	73.9	Confident	76.1	Confident	27 Å²	27	64.3 Å²	64.3	28%	0.278	38%	0.375	S	S	.	.	S	Bend	trans	137.2	-166.6	-176.9	0	0	0	0	0	111.8	G488 E493	G488-G491 WeakPolarHBondContact CA-O 3.31Å; G491-E493 PolarHBondContact O-N 3.45Å
492	P	80.6	Confident	76.8	Confident	103 Å²	103	65.4 Å²	65.4	67%	0.669	38%	0.384	S	S	*	.			trans	-61.1	114.7	175.4	-22.4	34.3	0	0	0	112.1	V471 V472 N473	V471-P492 HydrophobicContact CG1-CB 3.82Å; V472-P492 WeakPolarHBondContact O-CA 3.46Å; N473-P492 HydrophobicContact CB-CB 4.34Å; N473-P492 HydrophobicContact CB-CG 4.32Å
493	E	78	Confident	78	Confident	39 Å²	39	61 Å²	61	18%	0.182	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.9	178.9	-74.5	166	-145.9	0	0	110.1	V471 V472 M487 G488 E489 G491	V471-E493 CarbonylContact C-O 3.33Å; V471-E493 WeakPolarHBondContact CA-O 3.37Å; V472-E493 PolarHBondContact N-O 3.13Å; V472-E493 PolarHBondContact O-N 3.04Å; M487-E493 WeakPolarHBondContact CA-OE2 3.49Å; M487-E493 WeakPolarHBondContact CB-OE2 3.43Å; G488-E493 WeakPolarHBondContact CA-OE1 3.34Å; G488-E493 PolarHBondContact N-OE1 3.43Å; G488-E493 PolarHBondContact N-OE2 3.4Å; E489-E493 PolarHBondContact N-OE1 3.11Å; G491-E493 PolarHBondContact O-N 3.45Å
494	A	84.2	Confident	78.8	Confident	64 Å²	64	60.9 Å²	60.9	53%	0.529	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.6	178.4	0	0	0	0	0	111.1	V471 L496	V471-A494 HydrophobicContact CG2-CB 4.17Å; A494-L496 HydrophobicContact CB-CG 4.42Å
495	I	84.1	Confident	79.6	Confident	32 Å²	32	66.2 Å²	66.2	16%	0.164	39%	0.386	C	S	.	.			trans	-102.9	110.6	178.2	-57.1	-162.2	0	0	0	108.5	L464 Y467 G469 T470 V472 M487	L464-I495 HydrophobicContact CD2-CD1 4.36Å; Y467-I495 HydrophobicContact CG-CD1 4.42Å; Y467-I495 WeakPolarHBondContact O-CB 3.21Å; G469-I495 WeakPolarHBondContact CA-O 3.4Å; G469-I495 PolarHBondContact N-O 2.83Å; T470-I495 PolarHBondContact O-N 2.87Å; V472-I495 HydrophobicContact CG2-CD1 3.89Å; V472-I495 HydrophobicContact CG2-CG1 4.26Å; M487-I495 HydrophobicContact CE-CD1 3.97Å; M487-I495 HydrophobicContact SD-CD1 3.29Å; M487-I495 WeakPolarHBondContact SD-CD1 3.25Å
496	L	84.5	Confident	80	Confident	93 Å²	93	71.3 Å²	71.3	49%	0.487	41%	0.412	S	S	.	.			trans	-118.6	131.3	-172.7	-60.2	175.1	0	0	0	110.4	A494 V508	A494-L496 HydrophobicContact CB-CG 4.42Å; L496-V508 HydrophobicContact CB-CG1 4.06Å; L496-V508 HydrophobicContact CB-CG2 4.04Å; L496-V508 HydrophobicContact CD1-CG1 3.61Å; L496-V508 HydrophobicContact CD1-CG2 4.46Å; L496-V508 HydrophobicContact CG-CG1 4.43Å
497	P	82.2	Confident	80.3	Confident	61 Å²	61	72.2 Å²	72.2	40%	0.396	42%	0.424	S	S	.	.			trans	-69.3	138.9	176.1	28.8	-32.5	0	0	0	110.1	S468	S468-P497 WeakPolarHBondContact OG-CD 3.43Å; S468-P497 WeakPolarHBondContact OG-CG 3.34Å
498	L	82.7	Confident	80.6	Confident	75 Å²	75	76 Å²	76	39%	0.393	45%	0.447	S	S	.	.			trans	-76.9	133.8	170	-62	-179.9	0	0	0	109.9	V458 G507 V508	V458-L498 HydrophobicContact CG1-CD1 3.58Å; V458-L498 HydrophobicContact CG2-CD1 4.31Å; L498-G507 WeakPolarHBondContact CA-O 3.2Å; L498-V508 HydrophobicContact CD2-CG2 3.86Å
499	R	80.3	Confident	80.4	Confident	136 Å²	136	79.6 Å²	79.6	51%	0.513	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	152.3	172.9	-65.2	-173.6	176.7	-157.6	1.9	109.5	L506 G507 V509	R499-L506 WeakPolarHBondContact O-CA 3.25Å; R499-G507 PolarHBondContact N-O 2.86Å; R499-G507 PolarHBondContact O-N 3.48Å; R499-V509 HydrophobicContact CB-CG2 4.17Å
500	R	82.9	Confident	80	Confident	169 Å²	169	80.4 Å²	80.4	64%	0.638	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	121.3	171.6	-167.7	172.2	-59.9	-80.5	0.2	109	G504 K505 L506	R500-G504 PolarHBondContact NH1-O 3.41Å; R500-K505 CarbonylContact C-O 3.56Å; R500-K505 WeakPolarHBondContact CA-O 3.49Å; R500-L506 HydrophobicContact CB-CD2 4.11Å
501	G	76.7	Confident	79.4	Confident	23 Å²	23	82.5 Å²	82.5	24%	0.237	49%	0.487	C	S	.	.			trans	-70.9	168.6	172.4	0	0	0	0	0	112.2	D503 G504 K505	G501-D503 PolarHBondContact O-N 2.87Å; G501-G504 PolarHBondContact O-N 3.12Å; G501-K505 PolarHBondContact N-O 2.89Å
502	A	78.4	Confident	78.4	Confident	122 Å²	122	86.6 Å²	86.6	100%	1.008	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-22	174	0	0	0	0	0	112.8	G504	A502-G504 PolarHBondContact O-N 3.37Å
503	D	81.7	Confident	76.6	Confident	106 Å²	106	84.9 Å²	84.9	57%	0.567	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-0.4	173	69.8	-20.8	0	0	0	113.4	G501 K505	G501-D503 PolarHBondContact O-N 2.87Å; D503-K505 VanDerWaalsContact C-N 3.29Å; D503-K505 PolarHBondContact O-N 3.1Å; D503-K505 PolarHBondContact OD1-N 3.49Å; D503-K505 VanDerWaalsContact OD2-CD 3.27Å; D503-K505 WeakPolarHBondContact OD2-CD 3.27Å; D503-K505 WeakPolarHBondContact OD2-CG 3.29Å
504	G	83.6	Confident	74.9	Confident	35 Å²	35	85.6 Å²	85.6	36%	0.361	53%	0.525	S	S	.	.	S	Bend	trans	80.4	-1.2	-178.9	0	0	0	0	0	114.7	R500 G501 A502	R500-G504 PolarHBondContact NH1-O 3.41Å; G501-G504 PolarHBondContact O-N 3.12Å; A502-G504 PolarHBondContact O-N 3.37Å
505	K	86.5	Confident	72.8	Confident	149 Å²	149	89.2 Å²	89.2	65%	0.648	55%	0.547	S	S	*	.			trans	-83.6	150.2	179	-63.5	-176.6	-170.4	164.9	0	111.5	R500 G501 D503	R500-K505 CarbonylContact C-O 3.56Å; R500-K505 WeakPolarHBondContact CA-O 3.49Å; G501-K505 PolarHBondContact N-O 2.89Å; D503-K505 VanDerWaalsContact C-N 3.29Å; D503-K505 PolarHBondContact O-N 3.1Å; D503-K505 PolarHBondContact OD1-N 3.49Å; D503-K505 VanDerWaalsContact OD2-CD 3.27Å; D503-K505 WeakPolarHBondContact OD2-CD 3.27Å; D503-K505 WeakPolarHBondContact OD2-CG 3.29Å
506	L	82.6	Confident	70.6	Confident	107 Å²	107	90.2 Å²	90.2	56%	0.56	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.8	128.4	171.6	-69.8	174.2	0	0	0	109.4	R499 R500	R499-L506 WeakPolarHBondContact O-CA 3.25Å; R500-L506 HydrophobicContact CB-CD2 4.11Å
507	G	84.3	Confident	68.3	Low	28 Å²	28	92.6 Å²	92.6	29%	0.289	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-158.2	172.3	178.3	0	0	0	0	0	112.1	L498 R499 V509	L498-G507 WeakPolarHBondContact CA-O 3.2Å; R499-G507 PolarHBondContact N-O 2.86Å; R499-G507 PolarHBondContact O-N 3.48Å; G507-V509 PolarHBondContact O-N 3.47Å
508	V	81.2	Confident	66.3	Low	86 Å²	86	94.9 Å²	94.9	52%	0.521	59%	0.588	S	S	.	*			trans	-80.3	113.8	167.9	176.1	0	0	0	0	107.2	L496 L498	L496-V508 HydrophobicContact CB-CG1 4.06Å; L496-V508 HydrophobicContact CB-CG2 4.04Å; L496-V508 HydrophobicContact CD1-CG1 3.61Å; L496-V508 HydrophobicContact CD1-CG2 4.46Å; L496-V508 HydrophobicContact CG-CG1 4.43Å; L498-V508 HydrophobicContact CD2-CG2 3.86Å
509	V	72.3	Confident	64.2	Low	79 Å²	79	98.7 Å²	98.7	48%	0.479	61%	0.606	S	S	.	*			trans	-99.7	118	174.4	-178.8	0	0	0	0	107.5	R499 G507 D511	R499-V509 HydrophobicContact CB-CG2 4.17Å; G507-V509 PolarHBondContact O-N 3.47Å; V509-D511 PolarHBondContact O-N 3.49Å
510	A	66.1	Low	62.3	Low	82 Å²	82	100 Å²	100	68%	0.678	62%	0.615	S	S	*	*			trans	-69.7	107.8	163.6	0	0	0	0	0	107	T512	A510-T512 VanDerWaalsContact C-N 3.34Å; A510-T512 PolarHBondContact O-N 2.7Å
511	D	60	Low	60.6	Low	117 Å²	117	95.7 Å²	95.7	63%	0.626	62%	0.616	S	S	*	*			trans	-70.1	94.9	173.7	-171.1	5.2	0	0	0	108.4	V509 G513	V509-D511 PolarHBondContact O-N 3.49Å; D511-G513 PolarHBondContact O-N 3.18Å; D511-G513 VanDerWaalsContact OD1-CA 3.25Å; D511-G513 WeakPolarHBondContact OD1-CA 3.24Å; D511-G513 PolarHBondContact OD1-N 2.86Å
512	T	54.2	Low	59	Low	112 Å²	112	97.9 Å²	97.9	69%	0.687	63%	0.626	S	S	*	*			trans	-87.7	19.1	168.5	61	0	0	0	0	111.2	A510 G514	A510-T512 VanDerWaalsContact C-N 3.34Å; A510-T512 PolarHBondContact O-N 2.7Å; T512-G514 PolarHBondContact O-N 3.17Å
513	G	42.6	Very low	57.5	Low	67 Å²	67	100.4 Å²	100.4	69%	0.691	62%	0.617	S	S	*	*			trans	-69.7	32.8	-172.5	0	0	0	0	0	116.6	D511	D511-G513 PolarHBondContact O-N 3.18Å; D511-G513 VanDerWaalsContact OD1-CA 3.25Å; D511-G513 WeakPolarHBondContact OD1-CA 3.24Å; D511-G513 PolarHBondContact OD1-N 2.86Å
514	G	41.2	Very low	55.8	Low	54 Å²	54	100.1 Å²	100.1	56%	0.557	61%	0.609	S	S	*	*			trans	-97	119.8	157.3	0	0	0	0	0	108.9	T512 G516	T512-G514 PolarHBondContact O-N 3.17Å; G514-G516 PolarHBondContact O-N 3.29Å
515	S	40.1	Very low	54.2	Low	141 Å²	141	105.9 Å²	105.9	99%	0.986	63%	0.631	S	S	*	*	S	Bend	trans	-59.7	30.4	166.3	-64.9	0	0	0	0	114.6
516	G	39.3	Very low	52.3	Low	53 Å²	53	102.1 Å²	102.1	55%	0.546	62%	0.617	S	S	.	*	S	Bend	trans	-99.8	107.4	165	0	0	0	0	0	107.7	G514 V518	G514-G516 PolarHBondContact O-N 3.29Å; G516-V518 PolarHBondContact O-N 3.45Å
517	M	34.6	Very low	51	Low	143 Å²	143	100.8 Å²	100.8	70%	0.704	63%	0.629	S	S	*	*			trans	-31.1	111.6	168.2	-173.7	72.2	172.8	0	0	110.6	M519	M517-M519 HydrophobicContact CG-CG 4.37Å; M517-M519 PolarHBondContact O-N 2.83Å
518	V	42	Very low	49.3	Very low	109 Å²	109	102.9 Å²	102.9	66%	0.661	63%	0.633	S	S	*	*			trans	-69	85.9	173.6	-177.3	0	0	0	0	106.5	G516 F520	G516-V518 PolarHBondContact O-N 3.45Å; V518-F520 PolarHBondContact O-N 2.88Å
519	M	37.3	Very low	48	Very low	155 Å²	155	105.5 Å²	105.5	76%	0.764	64%	0.644	S	S	*	*			trans	-64.6	100.7	167.8	-74.3	-82.8	-131.1	0	0	106.2	M517 A521	M517-M519 HydrophobicContact CG-CG 4.37Å; M517-M519 PolarHBondContact O-N 2.83Å; M519-A521 PolarHBondContact O-N 3.36Å
520	F	41.5	Very low	46.7	Very low	163 Å²	163	104.9 Å²	104.9	72%	0.715	64%	0.638	S	S	*	*			trans	-67.8	91.6	166.6	-139.6	-90.3	0	0	0	106.6	V518 P522	V518-F520 PolarHBondContact O-N 2.88Å; F520-P522 VanDerWaalsContact C-CD 3.43Å; F520-P522 WeakPolarHBondContact O-CD 3.31Å
521	A	45.6	Very low	46.2	Very low	78 Å²	78	107.9 Å²	107.9	65%	0.645	64%	0.643	S	S	*	*			trans	-100.3	84.9	174.8	0	0	0	0	0	107.6	M519 Q523	M519-A521 PolarHBondContact O-N 3.36Å; A521-Q523 PolarHBondContact O-N 3.01Å
522	P	43.7	Very low	45.7	Very low	70 Å²	70	103.5 Å²	103.5	46%	0.455	63%	0.625	S	S	.	*			trans	-58.3	113.2	175.7	23.4	-31.7	0	0	0	109	F520 Y524	F520-P522 VanDerWaalsContact C-CD 3.43Å; F520-P522 WeakPolarHBondContact O-CD 3.31Å; P522-Y524 HydrophobicContact CB-CD2 4.3Å; P522-Y524 HydrophobicContact CB-CE2 3.65Å; P522-Y524 HydrophobicContact CG-CE2 3.71Å; P522-Y524 PolarHBondContact O-N 2.76Å
523	Q	47.7	Very low	45.7	Very low	175 Å²	175	104.9 Å²	104.9	82%	0.818	63%	0.634	S	S	*	*			trans	-80.3	103	170.8	-81.4	-174.3	-3.6	0	0	108.3	A521 N525	A521-Q523 PolarHBondContact O-N 3.01Å; Q523-N525 PolarHBondContact O-N 2.93Å
524	Y	46.5	Very low	46.2	Very low	100 Å²	100	109 Å²	109	39%	0.392	64%	0.64	S	S	.	*			trans	-87.1	104.1	168.6	-60	-79	0	0	0	108.9	P522 I526 L548 A552	P522-Y524 HydrophobicContact CB-CD2 4.3Å; P522-Y524 HydrophobicContact CB-CE2 3.65Å; P522-Y524 HydrophobicContact CG-CE2 3.71Å; P522-Y524 PolarHBondContact O-N 2.76Å; Y524-I526 PolarHBondContact O-N 3.35Å; Y524-L548 HydrophobicContact CD1-CD1 3.89Å; Y524-L548 HydrophobicContact CE1-CD1 4.41Å; Y524-L548 HydrophobicContact CG-CD1 4.15Å; Y524-L548 HydrophobicContact CG-CD2 4.07Å; Y524-L548 HydrophobicContact CG-CG 4.36Å; Y524-A552 HydrophobicContact CD2-CB 4.35Å; Y524-A552 HydrophobicContact CE2-CB 3.52Å
525	N	48.4	Very low	46.7	Very low	156 Å²	156	109.1 Å²	109.1	83%	0.834	64%	0.642	S	S	*	*			trans	-77.1	106.6	172.5	-79.8	-11.6	0	0	0	109.5	Q523	Q523-N525 PolarHBondContact O-N 2.93Å
526	I	47.3	Very low	47.3	Very low	70 Å²	70	109.8 Å²	109.8	36%	0.359	63%	0.629	S	S	.	*			trans	-99.8	113	176.8	-47	172.5	0	0	0	108.7	Y524 I528 V544 V545 L548	Y524-I526 PolarHBondContact O-N 3.35Å; I526-I528 HydrophobicContact CB-CG1 4.44Å; I526-I528 HydrophobicContact CG2-CG1 3.71Å; I526-I528 PolarHBondContact O-N 2.82Å; I526-V544 HydrophobicContact CG2-CG1 4.4Å; I526-V545 HydrophobicContact CD1-CG2 4.08Å; I526-L548 HydrophobicContact CD1-CD2 3.28Å; I526-L548 HydrophobicContact CG1-CD2 3.63Å
527	G	54.6	Low	47.8	Very low	78 Å²	78	111.5 Å²	111.5	80%	0.804	63%	0.625	S	S	*	*			trans	-78.7	99.2	162.5	0	0	0	0	0	109	N529	G527-N529 PolarHBondContact O-N 2.89Å
528	I	50	Low	48.9	Very low	73 Å²	73	105.6 Å²	105.6	37%	0.374	60%	0.601	S	S	.	*			trans	-83.5	103.1	173.1	-59.3	174	0	0	0	107.5	I526 N530 A541 V545	I526-I528 HydrophobicContact CB-CG1 4.44Å; I526-I528 HydrophobicContact CG2-CG1 3.71Å; I526-I528 PolarHBondContact O-N 2.82Å; I528-N530 PolarHBondContact O-N 2.92Å; I528-A541 HydrophobicContact CG2-CB 3.53Å; I528-V545 HydrophobicContact CD1-CG2 4.12Å
529	N	53.2	Low	49.8	Very low	141 Å²	141	106 Å²	106	75%	0.754	61%	0.605	S	S	*	*			trans	-77.4	104.1	169.1	-135.8	28.5	0	0	0	107.5	G527 D531	G527-N529 PolarHBondContact O-N 2.89Å; N529-D531 PolarHBondContact O-N 2.92Å
530	N	45.5	Very low	50.8	Low	65 Å²	65	102.1 Å²	102.1	35%	0.348	60%	0.598	S	S	.	*			trans	-87.4	86.6	-171.4	-162.9	0.7	0	0	0	109.7	I528 G532 G535 Q536	I528-N530 PolarHBondContact O-N 2.92Å; N530-G532 PolarHBondContact O-N 3.33Å; N530-G535 PolarHBondContact ND2-O 2.98Å; N530-Q536 PolarHBondContact OD1-O 2.74Å; N530-Q536 VanDerWaalsContact OD1-O 3.08Å
531	D	55.9	Low	51.4	Low	145 Å²	145	95 Å²	95	78%	0.775	57%	0.57	S	S	*	*			trans	-83.3	14	177.2	-60.1	-22.5	0	0	0	112.6	N529	N529-D531 PolarHBondContact O-N 2.92Å
532	G	49.3	Very low	52.2	Low	25 Å²	25	96.5 Å²	96.5	26%	0.258	57%	0.566	S	S	.	*			trans	-80.3	131.1	-179.8	0	0	0	0	0	113.4	N530 N534 G535	N530-G532 PolarHBondContact O-N 3.33Å; G532-N534 PolarHBondContact O-N 2.93Å; G532-G535 PolarHBondContact O-N 2.93Å
533	T	54.5	Low	53	Low	142 Å²	142	99.7 Å²	99.7	87%	0.871	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	6.7	-169.1	-27.7	0	0	0	0	117.1
534	N	53.1	Low	53.6	Low	152 Å²	152	95.4 Å²	95.4	81%	0.813	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.9	31.1	177.6	-94.4	-28.2	0	0	0	112	G532 Q536	G532-N534 PolarHBondContact O-N 2.93Å; N534-Q536 PolarHBondContact O-N 3.44Å; N534-Q536 VanDerWaalsContact O-N 3.11Å
535	G	51.1	Low	54.4	Low	58 Å²	58	93.7 Å²	93.7	60%	0.598	56%	0.558	S	S	*	*	S	Bend	trans	71.8	0.9	-179.4	0	0	0	0	0	114.9	N530 G532	N530-G535 PolarHBondContact ND2-O 2.98Å; G532-G535 PolarHBondContact O-N 2.93Å
536	Q	53.4	Low	55.1	Low	155 Å²	155	93 Å²	93	72%	0.724	55%	0.545	S	S	*	.			trans	-73.3	132.9	169.6	-66.9	-175.8	-9.8	0	0	110	N530 N534 G538	N530-Q536 PolarHBondContact OD1-O 2.74Å; N530-Q536 VanDerWaalsContact OD1-O 3.08Å; N534-Q536 PolarHBondContact O-N 3.44Å; N534-Q536 VanDerWaalsContact O-N 3.11Å; Q536-G538 PolarHBondContact O-N 3.49Å
537	I	49.6	Very low	56.1	Low	89 Å²	89	93.4 Å²	93.4	46%	0.456	55%	0.548	S	S	.	.			trans	-57.6	110.5	177.3	-65	177.2	0	0	0	108.5	A541 L542	I537-A541 HydrophobicContact CG2-CB 3.56Å; I537-L542 HydrophobicContact CG2-CD1 4.29Å; I537-L542 HydrophobicContact CG2-CG 4.02Å
538	G	56.5	Low	56.5	Low	19 Å²	19	92 Å²	92	20%	0.196	52%	0.522	C	S	.	.			trans	-57.8	151.1	178.2	0	0	0	0	0	111.8	Q536 A540 A541 L542	Q536-G538 PolarHBondContact O-N 3.49Å; G538-A540 PolarHBondContact O-N 3.2Å; G538-A541 WeakPolarHBondContact O-CB 3.17Å; G538-A541 PolarHBondContact O-N 2.97Å; G538-L542 PolarHBondContact O-N 3.34Å
539	P	60.8	Low	57.2	Low	116 Å²	116	90.5 Å²	90.5	75%	0.753	52%	0.524	S	S	*	.	H	α-helix	trans	-57.3	-27	-176.7	19.9	-31	0	0	0	113.4	K543	P539-K543 WeakPolarHBondContact O-CB 3.24Å; P539-K543 PolarHBondContact O-N 2.86Å
540	A	58.2	Low	57.8	Low	74 Å²	74	89.8 Å²	89.8	61%	0.612	51%	0.514	S	S	*	.	H	α-helix	trans	-65.6	-41.5	173.6	0	0	0	0	0	112.7	G538 K543 V544	G538-A540 PolarHBondContact O-N 3.2Å; A540-K543 WeakPolarHBondContact O-CB 3.35Å; A540-K543 PolarHBondContact O-N 3.05Å; A540-V544 WeakPolarHBondContact O-CG2 3.45Å; A540-V544 PolarHBondContact O-N 3.45Å
541	A	55.6	Low	58.8	Low	15 Å²	15	93.1 Å²	93.1	12%	0.124	53%	0.525	C	S	.	.	H	α-helix	trans	-68.8	-39.4	177.3	0	0	0	0	0	111.7	I528 I537 G538 K543 V544 V545	I528-A541 HydrophobicContact CG2-CB 3.53Å; I537-A541 HydrophobicContact CG2-CB 3.56Å; G538-A541 WeakPolarHBondContact O-CB 3.17Å; G538-A541 PolarHBondContact O-N 2.97Å; A541-K543 VanDerWaalsContact C-N 3.28Å; A541-K543 PolarHBondContact O-N 3.05Å; A541-V544 PolarHBondContact O-N 3.39Å; A541-V545 WeakPolarHBondContact O-CG2 3.28Å; A541-V545 PolarHBondContact O-N 3.2Å
542	L	61	Low	58.9	Low	109 Å²	109	87.4 Å²	87.4	57%	0.571	50%	0.498	S	S	*	.	H	α-helix	trans	-58.5	-40.4	170.8	-100.8	151.5	0	0	0	111.9	I537 G538 V545 Y546	I537-L542 HydrophobicContact CG2-CD1 4.29Å; I537-L542 HydrophobicContact CG2-CG 4.02Å; G538-L542 PolarHBondContact O-N 3.34Å; L542-V545 PolarHBondContact O-N 3.48Å; L542-Y546 WeakPolarHBondContact O-CB 3.27Å; L542-Y546 PolarHBondContact O-N 3.36Å
543	K	60.9	Low	59.6	Low	137 Å²	137	88.8 Å²	88.8	60%	0.596	51%	0.507	S	S	*	.	H	α-helix	trans	-65.8	-42.8	176.3	-165.7	179.3	-179	-179.4	0	112.3	P539 A540 A541 V545 Y546 D547	P539-K543 WeakPolarHBondContact O-CB 3.24Å; P539-K543 PolarHBondContact O-N 2.86Å; A540-K543 WeakPolarHBondContact O-CB 3.35Å; A540-K543 PolarHBondContact O-N 3.05Å; A541-K543 VanDerWaalsContact C-N 3.28Å; A541-K543 PolarHBondContact O-N 3.05Å; K543-V545 PolarHBondContact O-N 3.32Å; K543-Y546 PolarHBondContact O-N 2.93Å; K543-D547 WeakPolarHBondContact O-CB 3.49Å; K543-D547 PolarHBondContact O-N 3.3Å
544	V	61.2	Low	60.2	Low	85 Å²	85	84.4 Å²	84.4	52%	0.515	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-44.1	176	172	0	0	0	0	111.4	I526 A540 A541 L548	I526-V544 HydrophobicContact CG2-CG1 4.4Å; A540-V544 WeakPolarHBondContact O-CG2 3.45Å; A540-V544 PolarHBondContact O-N 3.45Å; A541-V544 PolarHBondContact O-N 3.39Å; V544-L548 VanDerWaalsContact O-CB 3.25Å; V544-L548 WeakPolarHBondContact O-CB 3.47Å; V544-L548 PolarHBondContact O-N 3.33Å
545	V	61.5	Low	60.6	Low	64 Å²	64	80.2 Å²	80.2	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-64.3	-41.5	176.4	175.8	0	0	0	0	111	I526 I528 A541 L542 K543 G549	I526-V545 HydrophobicContact CD1-CG2 4.08Å; I528-V545 HydrophobicContact CD1-CG2 4.12Å; A541-V545 WeakPolarHBondContact O-CG2 3.28Å; A541-V545 PolarHBondContact O-N 3.2Å; L542-V545 PolarHBondContact O-N 3.48Å; K543-V545 PolarHBondContact O-N 3.32Å; V545-G549 PolarHBondContact O-N 3.41Å
546	Y	64.8	Low	61.3	Low	140 Å²	140	83 Å²	83	55%	0.549	46%	0.459	S	S	.	.	H	α-helix	trans	-65.1	-48	177.7	179.9	-94.6	0	0	0	112.7	L542 K543 L548 G549 K550	L542-Y546 WeakPolarHBondContact O-CB 3.27Å; L542-Y546 PolarHBondContact O-N 3.36Å; K543-Y546 PolarHBondContact O-N 2.93Å; Y546-L548 VanDerWaalsContact C-N 3.3Å; Y546-L548 PolarHBondContact O-N 3.08Å; Y546-G549 PolarHBondContact O-N 3.44Å; Y546-K550 HydrophobicContact CE1-CD 3.97Å; Y546-K550 PolarHBondContact O-N 2.92Å; Y546-K550 WeakPolarHBondContact OH-CE 3.39Å
547	D	68.1	Low	61.8	Low	80 Å²	80	80.4 Å²	80.4	43%	0.428	45%	0.448	S	S	.	.	H	α-helix	trans	-65.2	-36.6	179.9	-72.6	-23	0	0	0	111.1	K543 K550 K551	K543-D547 WeakPolarHBondContact O-CB 3.49Å; K543-D547 PolarHBondContact O-N 3.3Å; D547-K550 PolarHBondContact O-N 3.04Å; D547-K551 WeakPolarHBondContact O-CB 3.44Å; D547-K551 PolarHBondContact O-N 2.9Å
548	L	62.2	Low	62.4	Low	48 Å²	48	82.8 Å²	82.8	25%	0.251	46%	0.457	S	S	.	.	H	α-helix	trans	-65.5	-44.5	171.9	-174.9	82.3	0	0	0	111.8	Y524 I526 V544 Y546 K550 K551 A552	Y524-L548 HydrophobicContact CD1-CD1 3.89Å; Y524-L548 HydrophobicContact CE1-CD1 4.41Å; Y524-L548 HydrophobicContact CG-CD1 4.15Å; Y524-L548 HydrophobicContact CG-CD2 4.07Å; Y524-L548 HydrophobicContact CG-CG 4.36Å; I526-L548 HydrophobicContact CD1-CD2 3.28Å; I526-L548 HydrophobicContact CG1-CD2 3.63Å; V544-L548 VanDerWaalsContact O-CB 3.25Å; V544-L548 WeakPolarHBondContact O-CB 3.47Å; V544-L548 PolarHBondContact O-N 3.33Å; Y546-L548 VanDerWaalsContact C-N 3.3Å; Y546-L548 PolarHBondContact O-N 3.08Å; L548-K550 VanDerWaalsContact C-N 3.26Å; L548-K550 PolarHBondContact O-N 3.11Å; L548-K551 PolarHBondContact O-N 3.15Å; L548-K551 VanDerWaalsContact O-N 3.11Å; L548-A552 WeakPolarHBondContact O-CB 3.5Å; L548-A552 PolarHBondContact O-N 3.35Å
549	G	64.3	Low	62.6	Low	41 Å²	41	87.1 Å²	87.1	42%	0.423	47%	0.473	S	S	.	.	H	α-helix	trans	-57.8	-41.6	175.6	0	0	0	0	0	111.8	V545 Y546 A553	V545-G549 PolarHBondContact O-N 3.41Å; Y546-G549 PolarHBondContact O-N 3.44Å; G549-A553 VanDerWaalsContact O-CB 3.3Å; G549-A553 WeakPolarHBondContact O-CB 3.45Å; G549-A553 PolarHBondContact O-N 3.29Å
550	K	66.7	Low	62.4	Low	127 Å²	127	83.2 Å²	83.2	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-62.2	-45.1	172.7	-110.9	-176.1	178.6	177.8	0	112.3	Y546 D547 L548 A553 A554	Y546-K550 HydrophobicContact CE1-CD 3.97Å; Y546-K550 PolarHBondContact O-N 2.92Å; Y546-K550 WeakPolarHBondContact OH-CE 3.39Å; D547-K550 PolarHBondContact O-N 3.04Å; L548-K550 VanDerWaalsContact C-N 3.26Å; L548-K550 PolarHBondContact O-N 3.11Å; K550-A553 PolarHBondContact O-N 3.09Å; K550-A554 WeakPolarHBondContact O-CB 3.4Å; K550-A554 PolarHBondContact O-N 3Å
551	K	65.6	Low	62.3	Low	134 Å²	134	82.6 Å²	82.6	58%	0.583	44%	0.439	S	S	*	.	H	α-helix	trans	-66.5	-45	-179.9	-167.7	175	-179	177.6	0	111.8	D547 L548 A553 A554 D555	D547-K551 WeakPolarHBondContact O-CB 3.44Å; D547-K551 PolarHBondContact O-N 2.9Å; L548-K551 PolarHBondContact O-N 3.15Å; L548-K551 VanDerWaalsContact O-N 3.11Å; K551-A553 VanDerWaalsContact C-N 3.33Å; K551-A553 PolarHBondContact O-N 3.06Å; K551-A554 PolarHBondContact O-N 3.29Å; K551-D555 WeakPolarHBondContact O-CB 3.43Å; K551-D555 PolarHBondContact O-N 3.03Å
552	A	58	Low	62.1	Low	25 Å²	25	90.7 Å²	90.7	21%	0.207	47%	0.467	C	S	.	.	H	α-helix	trans	-60.9	-41.5	175.8	0	0	0	0	0	111.8	Y524 L548 F556	Y524-A552 HydrophobicContact CD2-CB 4.35Å; Y524-A552 HydrophobicContact CE2-CB 3.52Å; L548-A552 WeakPolarHBondContact O-CB 3.5Å; L548-A552 PolarHBondContact O-N 3.35Å; A552-F556 VanDerWaalsContact O-CB 3.28Å; A552-F556 WeakPolarHBondContact O-CB 3.48Å; A552-F556 PolarHBondContact O-N 3.48Å
553	A	64.7	Low	61.7	Low	54 Å²	54	93.5 Å²	93.5	45%	0.446	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-41.3	174.5	0	0	0	0	0	112.1	G549 K550 K551 F556 M557	G549-A553 VanDerWaalsContact O-CB 3.3Å; G549-A553 WeakPolarHBondContact O-CB 3.45Å; G549-A553 PolarHBondContact O-N 3.29Å; K550-A553 PolarHBondContact O-N 3.09Å; K551-A553 VanDerWaalsContact C-N 3.33Å; K551-A553 PolarHBondContact O-N 3.06Å; A553-F556 PolarHBondContact O-N 2.93Å; A553-M557 WeakPolarHBondContact O-CB 3.15Å; A553-M557 WeakPolarHBondContact O-CG 3.33Å; A553-M557 PolarHBondContact O-N 2.96Å
554	A	66.3	Low	61.6	Low	51 Å²	51	90.8 Å²	90.8	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-45.3	177.4	0	0	0	0	0	112.3	K550 K551 F556 M557 Q558	K550-A554 WeakPolarHBondContact O-CB 3.4Å; K550-A554 PolarHBondContact O-N 3Å; K551-A554 PolarHBondContact O-N 3.29Å; A554-F556 VanDerWaalsContact C-N 3.33Å; A554-F556 PolarHBondContact O-N 2.91Å; A554-M557 PolarHBondContact O-N 3.28Å; A554-Q558 WeakPolarHBondContact O-CB 3.39Å; A554-Q558 PolarHBondContact O-N 3.44Å
555	D	62.1	Low	61.2	Low	63 Å²	63	87.4 Å²	87.4	34%	0.337	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-41.5	177	-72.2	-15.4	0	0	0	110.6	K551 Q559	K551-D555 WeakPolarHBondContact O-CB 3.43Å; K551-D555 PolarHBondContact O-N 3.03Å; D555-Q559 PolarHBondContact O-N 3.48Å
556	F	65.2	Low	61.1	Low	116 Å²	116	94.7 Å²	94.7	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-48.3	173.8	-176.9	-98.7	0	0	0	111.6	A552 A553 A554 Q558 Q559 Q560	A552-F556 VanDerWaalsContact O-CB 3.28Å; A552-F556 WeakPolarHBondContact O-CB 3.48Å; A552-F556 PolarHBondContact O-N 3.48Å; A553-F556 PolarHBondContact O-N 2.93Å; A554-F556 VanDerWaalsContact C-N 3.33Å; A554-F556 PolarHBondContact O-N 2.91Å; F556-Q558 PolarHBondContact O-N 3.1Å; F556-Q559 PolarHBondContact O-N 3.26Å; F556-Q560 HydrophobicContact CD1-CG 3.99Å; F556-Q560 HydrophobicContact CD2-CG 4.49Å; F556-Q560 HydrophobicContact CE1-CG 3.65Å; F556-Q560 HydrophobicContact CE2-CG 4.19Å; F556-Q560 HydrophobicContact CG-CG 4.41Å; F556-Q560 HydrophobicContact CZ-CG 3.76Å; F556-Q560 WeakPolarHBondContact O-CB 3.46Å; F556-Q560 VanDerWaalsContact O-CG 3.25Å; F556-Q560 WeakPolarHBondContact O-CG 3.44Å; F556-Q560 PolarHBondContact O-N 3.41Å
557	M	63.9	Low	60.7	Low	101 Å²	101	91.4 Å²	91.4	50%	0.498	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-41.2	178.8	-72.7	-67.8	-66	0	0	112.4	A553 A554 Q560 A561 L567	A553-M557 WeakPolarHBondContact O-CB 3.15Å; A553-M557 WeakPolarHBondContact O-CG 3.33Å; A553-M557 PolarHBondContact O-N 2.96Å; A554-M557 PolarHBondContact O-N 3.28Å; M557-Q560 PolarHBondContact O-N 3.32Å; M557-A561 WeakPolarHBondContact O-CB 3.43Å; M557-A561 PolarHBondContact O-N 2.93Å; M557-L567 HydrophobicContact CE-CD1 3.59Å; M557-L567 HydrophobicContact SD-CD1 3.55Å; M557-L567 VanDerWaalsContact SD-CD1 3.55Å
558	Q	63.5	Low	59.7	Low	139 Å²	139	90.1 Å²	90.1	65%	0.65	49%	0.485	S	S	*	.	H	α-helix	trans	-63.4	-40.5	175.4	-89.8	-171.5	-11.7	0	0	112.2	A554 F556 A561 R562	A554-Q558 WeakPolarHBondContact O-CB 3.39Å; A554-Q558 PolarHBondContact O-N 3.44Å; F556-Q558 PolarHBondContact O-N 3.1Å; Q558-A561 PolarHBondContact O-N 3.05Å; Q558-R562 PolarHBondContact O-N 2.76Å
559	Q	60.1	Low	59.4	Low	110 Å²	110	90.6 Å²	90.6	51%	0.514	50%	0.501	S	S	.	.	H	α-helix	trans	-68.4	-38.8	175	-78.4	-175	-1.7	0	0	112.2	D555 F556 A561 R562	D555-Q559 PolarHBondContact O-N 3.48Å; F556-Q559 PolarHBondContact O-N 3.26Å; Q559-A561 PolarHBondContact O-N 3.47Å; Q559-R562 PolarHBondContact O-N 3.23Å
560	Q	55.7	Low	58.9	Low	35 Å²	35	92 Å²	92	16%	0.164	51%	0.508	C	S	.	.	H	α-helix	trans	-69	-22.7	176.5	-66.7	-61.3	-31.9	0	0	112.9	F556 M557 G565 R566 L567 S568	F556-Q560 HydrophobicContact CD1-CG 3.99Å; F556-Q560 HydrophobicContact CD2-CG 4.49Å; F556-Q560 HydrophobicContact CE1-CG 3.65Å; F556-Q560 HydrophobicContact CE2-CG 4.19Å; F556-Q560 HydrophobicContact CG-CG 4.41Å; F556-Q560 HydrophobicContact CZ-CG 3.76Å; F556-Q560 WeakPolarHBondContact O-CB 3.46Å; F556-Q560 VanDerWaalsContact O-CG 3.25Å; F556-Q560 WeakPolarHBondContact O-CG 3.44Å; F556-Q560 PolarHBondContact O-N 3.41Å; M557-Q560 PolarHBondContact O-N 3.32Å; Q560-G565 CarbonylContact O-C 3.34Å; Q560-G565 VanDerWaalsContact O-CA 3.29Å; Q560-G565 WeakPolarHBondContact O-CA 3.25Å; Q560-R566 VanDerWaalsContact OE1-CB 3.29Å; Q560-L567 HydrophobicContact CB-CB 3.98Å; Q560-L567 HydrophobicContact CB-CD1 3.82Å; Q560-L567 HydrophobicContact CB-CG 3.96Å; Q560-L567 CarbonylContact O-C 3.6Å; Q560-L567 WeakPolarHBondContact O-CA 3.36Å; Q560-L567 WeakPolarHBondContact O-CB 3.43Å; Q560-L567 PolarHBondContact O-N 3.04Å; Q560-L567 VanDerWaalsContact O-N 3.11Å; Q560-S568 PolarHBondContact O-N 3.48Å
561	A	56.1	Low	58	Low	60 Å²	60	96.5 Å²	96.5	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-84.7	-15.4	174.9	0	0	0	0	0	113.9	M557 Q558 Q559	M557-A561 WeakPolarHBondContact O-CB 3.43Å; M557-A561 PolarHBondContact O-N 2.93Å; Q558-A561 PolarHBondContact O-N 3.05Å; Q559-A561 PolarHBondContact O-N 3.47Å
562	R	51.9	Low	56.8	Low	186 Å²	186	104.3 Å²	104.3	70%	0.702	55%	0.549	S	S	*	.	S	Bend	trans	-68.6	153.2	172	-78	-179.1	164.9	-169	-4.5	110.5	Q558 Q559 G564 G565 S568	Q558-R562 PolarHBondContact O-N 2.76Å; Q559-R562 PolarHBondContact O-N 3.23Å; R562-G564 PolarHBondContact O-N 2.95Å; R562-G564 VanDerWaalsContact O-N 3.15Å; R562-G565 PolarHBondContact O-N 2.93Å; R562-S568 WeakPolarHBondContact O-CB 3.41Å
563	D	53.9	Low	56.8	Low	167 Å²	167	108.3 Å²	108.3	89%	0.893	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	120.7	175.3	-80.3	-19.1	0	0	0	110.7
564	G	57.8	Low	56.3	Low	80 Å²	80	111.1 Å²	111.1	83%	0.825	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	98.9	-7.7	-174.5	0	0	0	0	0	115.3	R562	R562-G564 PolarHBondContact O-N 2.95Å; R562-G564 VanDerWaalsContact O-N 3.15Å
565	G	53.7	Low	55.8	Low	14 Å²	14	114.4 Å²	114.4	14%	0.144	58%	0.581	C	S	.	*	S	Bend	trans	-76.9	154.2	170.6	0	0	0	0	0	112.5	Q560 R562 L567 S568	Q560-G565 CarbonylContact O-C 3.34Å; Q560-G565 VanDerWaalsContact O-CA 3.29Å; Q560-G565 WeakPolarHBondContact O-CA 3.25Å; R562-G565 PolarHBondContact O-N 2.93Å; G565-L567 PolarHBondContact O-N 3.33Å; G565-L567 VanDerWaalsContact O-N 3.15Å; G565-S568 VanDerWaalsContact O-CB 3.23Å; G565-S568 WeakPolarHBondContact O-CB 3.49Å; G565-S568 PolarHBondContact O-N 3.33Å; G565-S568 PolarHBondContact O-OG 3.33Å
566	R	58.4	Low	55.4	Low	218 Å²	218	117.5 Å²	117.5	82%	0.823	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-16.6	-178.7	-58.1	-177.3	103.2	176.7	6	113.4	Q560	Q560-R566 VanDerWaalsContact OE1-CB 3.29Å
567	L	56.5	Low	54.8	Low	70 Å²	70	117.6 Å²	117.6	37%	0.366	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.9	0.2	173.3	-64.7	173.6	0	0	0	112.7	M557 Q560 G565 G569 A570	M557-L567 HydrophobicContact CE-CD1 3.59Å; M557-L567 HydrophobicContact SD-CD1 3.55Å; M557-L567 VanDerWaalsContact SD-CD1 3.55Å; Q560-L567 HydrophobicContact CB-CB 3.98Å; Q560-L567 HydrophobicContact CB-CD1 3.82Å; Q560-L567 HydrophobicContact CB-CG 3.96Å; Q560-L567 CarbonylContact O-C 3.6Å; Q560-L567 WeakPolarHBondContact O-CA 3.36Å; Q560-L567 WeakPolarHBondContact O-CB 3.43Å; Q560-L567 PolarHBondContact O-N 3.04Å; Q560-L567 VanDerWaalsContact O-N 3.11Å; G565-L567 PolarHBondContact O-N 3.33Å; G565-L567 VanDerWaalsContact O-N 3.15Å; L567-G569 PolarHBondContact O-N 3.27Å; L567-A570 PolarHBondContact O-N 3.12Å; L567-A570 VanDerWaalsContact O-N 3.08Å
568	S	46.8	Very low	54.2	Low	54 Å²	54	118.7 Å²	118.7	38%	0.378	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.6	114.4	173.2	83.4	0	0	0	0	108	Q560 R562 G565	Q560-S568 PolarHBondContact O-N 3.48Å; R562-S568 WeakPolarHBondContact O-CB 3.41Å; G565-S568 VanDerWaalsContact O-CB 3.23Å; G565-S568 WeakPolarHBondContact O-CB 3.49Å; G565-S568 PolarHBondContact O-N 3.33Å; G565-S568 PolarHBondContact O-OG 3.33Å
569	G	55.7	Low	53.5	Low	57 Å²	57	117.2 Å²	117.2	59%	0.588	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	105.7	-5.6	-176.5	0	0	0	0	0	116.8	L567 Y571 R572	L567-G569 PolarHBondContact O-N 3.27Å; G569-Y571 VanDerWaalsContact C-N 3.27Å; G569-Y571 PolarHBondContact O-N 3.08Å; G569-R572 PolarHBondContact O-N 3.46Å
570	A	54.9	Low	53	Low	70 Å²	70	117.8 Å²	117.8	58%	0.579	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-17.4	177.4	0	0	0	0	0	114.1	L567	L567-A570 PolarHBondContact O-N 3.12Å; L567-A570 VanDerWaalsContact O-N 3.08Å
571	Y	46.3	Very low	52.8	Low	223 Å²	223	124.7 Å²	124.7	88%	0.875	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	44.8	173.3	-73.8	-80.1	0	0	0	112	G569	G569-Y571 VanDerWaalsContact C-N 3.27Å; G569-Y571 PolarHBondContact O-N 3.08Å
572	R	41.9	Very low	52.5	Low	297 Å²	297	130.5 Å²	130.5	100%	1.121	66%	0.663	S	S	*	*			trans	-111.6	0	163.4	-77.5	-163.5	-179.1	-179.7	2.9	110.9	G569	G569-R572 PolarHBondContact O-N 3.46Å

Retrieved 572 of 572 residues in 523.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).