A0A087XLL9_POEFO Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A087XLL9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 740 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	29.2	Very low	252 Å²	252	170.3 Å²	170.3	100%	1.241	84%	0.838	S	S	*	*				0	84.3	0	-76.9	173.5	135.6	0	0	108.9
2	S	27.1	Very low	29.9	Very low	114 Å²	114	165.3 Å²	165.3	80%	0.797	83%	0.831	S	S	*	*			trans	-89.2	125.5	177.4	52.3	0	0	0	0	109.2	Q4	S2-Q4 PolarHBondContact O-N 3.12Å; S2-Q4 VanDerWaalsContact O-N 3.12Å
3	K	27.4	Very low	30.9	Very low	207 Å²	207	159.1 Å²	159.1	90%	0.9	80%	0.797	S	S	*	*			trans	-65.9	109.7	176.7	-76.7	176.7	174.1	177	0	108.8	T5	K3-T5 PolarHBondContact O-N 3.09Å
4	Q	27.5	Very low	32.5	Very low	188 Å²	188	151.1 Å²	151.1	88%	0.879	76%	0.762	S	S	*	*			trans	-63.2	105	163.5	-81.4	174.7	-23	0	0	108.9	S2 R6	S2-Q4 PolarHBondContact O-N 3.12Å; S2-Q4 VanDerWaalsContact O-N 3.12Å; Q4-R6 PolarHBondContact O-N 3.17Å; Q4-R6 VanDerWaalsContact O-N 3.09Å
5	T	26	Very low	34.1	Very low	127 Å²	127	148.7 Å²	148.7	78%	0.779	75%	0.745	S	S	*	*			trans	-74.1	95.2	163.4	-1.3	0	0	0	0	107.9	K3 W7	K3-T5 PolarHBondContact O-N 3.09Å; T5-W7 PolarHBondContact O-N 3.47Å
6	R	25.8	Very low	36.3	Very low	238 Å²	238	149.5 Å²	149.5	90%	0.898	75%	0.745	S	S	*	*			trans	-66.3	95.6	171.8	-137.1	179.6	-171.4	-179.1	2.3	108.1	Q4 T8	Q4-R6 PolarHBondContact O-N 3.17Å; Q4-R6 VanDerWaalsContact O-N 3.09Å; R6-T8 PolarHBondContact O-N 3.02Å
7	W	30.7	Very low	38.9	Very low	218 Å²	218	143.5 Å²	143.5	83%	0.826	72%	0.716	S	S	*	*			trans	-71.6	121.9	172	-106.4	75.2	0	0	0	109.5	T5	T5-W7 PolarHBondContact O-N 3.47Å
8	T	26.3	Very low	41.3	Very low	96 Å²	96	136.3 Å²	136.3	59%	0.589	68%	0.682	S	S	*	*			trans	-82.5	133.4	172.2	44.9	0	0	0	0	110.3	R6 K10	R6-T8 PolarHBondContact O-N 3.02Å; T8-K10 PolarHBondContact O-N 2.95Å
9	P	33.9	Very low	43.8	Very low	134 Å²	134	129.2 Å²	129.2	87%	0.87	65%	0.646	S	S	*	*	S	Bend	trans	-78.7	55	-176.3	32.2	-35.7	0	0	0	113
10	K	32.8	Very low	46.1	Very low	159 Å²	159	126.1 Å²	126.1	69%	0.691	63%	0.627	S	S	*	*			trans	-111.7	-12	-173	-90.4	-173	175.1	-179.3	0	117.7	T8	T8-K10 PolarHBondContact O-N 2.95Å
11	D	32.8	Very low	48.1	Very low	140 Å²	140	126.6 Å²	126.6	75%	0.749	63%	0.627	S	S	*	*	S	Bend	trans	-119.4	17.6	-167.4	-64.8	-37.7	0	0	0	117.1
12	C	37.4	Very low	50.9	Low	111 Å²	111	116.5 Å²	116.5	75%	0.75	58%	0.577	S	S	*	*			trans	-138.4	27.9	175.4	-74.2	0	0	0	0	114.6
13	E	43	Very low	54	Low	84 Å²	84	112.8 Å²	112.8	39%	0.393	55%	0.547	S	S	.	.			trans	-81.7	127.6	164.8	-81.2	-168.2	150.9	0	0	109.2	K15 Y20	E13-K15 HydrophobicContact CB-CD 4.49Å; E13-K15 HydrophobicContact CB-CG 3.77Å; E13-K15 PolarHBondContact O-N 3.36Å; E13-K15 WeakPolarHBondContact OE2-CE 3.4Å; E13-Y20 WeakPolarHBondContact OE2-CE2 3.24Å; E13-Y20 PolarHBondContact OE2-OH 3.36Å
14	P	53.3	Low	57.2	Low	48 Å²	48	109 Å²	109	31%	0.312	54%	0.536	S	S	.	.			trans	-72.1	65.5	169.8	30.3	-32.8	0	0	0	110.3	Q16 L17	P14-Q16 PolarHBondContact O-N 2.87Å; P14-L17 HydrophobicContact CB-CD1 4.17Å; P14-L17 HydrophobicContact CB-CG 4.39Å; P14-L17 HydrophobicContact CG-CD1 4.36Å; P14-L17 PolarHBondContact O-N 3.43Å
15	K	55.9	Low	60.4	Low	115 Å²	115	106.8 Å²	106.8	50%	0.5	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-3.8	177.4	-65.2	-177.5	177.6	168.8	0	113.8	E13 Y20	E13-K15 HydrophobicContact CB-CD 4.49Å; E13-K15 HydrophobicContact CB-CG 3.77Å; E13-K15 PolarHBondContact O-N 3.36Å; E13-K15 WeakPolarHBondContact OE2-CE 3.4Å; K15-Y20 HydrophobicContact CB-CD1 4.49Å; K15-Y20 HydrophobicContact CB-CE1 4.34Å; K15-Y20 HydrophobicContact CG-CE1 4.03Å; K15-Y20 HydrophobicContact CG-CE2 4.2Å
16	Q	70.1	Confident	63.7	Low	161 Å²	161	100.8 Å²	100.8	75%	0.752	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-18.4	-179.3	-64.8	-178.2	-0.9	0	0	113.4	P14 R200	P14-Q16 PolarHBondContact O-N 2.87Å; Q16-R200 VanDerWaalsContact O-CZ 3.3Å; Q16-R200 PolarHBondContact O-NH1 3Å
17	L	79.5	Confident	67	Low	48 Å²	48	90.2 Å²	90.2	25%	0.251	45%	0.448	S	S	.	.	S	Bend	trans	-75.6	139.7	-178.1	-66.9	175.4	0	0	0	111.7	P14 I19 Y20 Q49	P14-L17 HydrophobicContact CB-CD1 4.17Å; P14-L17 HydrophobicContact CB-CG 4.39Å; P14-L17 HydrophobicContact CG-CD1 4.36Å; P14-L17 PolarHBondContact O-N 3.43Å; L17-I19 VanDerWaalsContact C-N 3.28Å; L17-I19 HydrophobicContact CB-CG2 4.32Å; L17-I19 PolarHBondContact O-N 3.28Å; L17-Y20 WeakPolarHBondContact O-CB 3.41Å; L17-Y20 PolarHBondContact O-N 2.87Å; L17-Y20 VanDerWaalsContact O-N 3.09Å; L17-Q49 HydrophobicContact CD1-CG 3.77Å
18	P	83.4	Confident	70.1	Confident	14 Å²	14	85.4 Å²	85.4	9%	0.091	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-53.7	-40.5	-177.9	-27.1	33.7	0	0	0	114.2	Y20 Q21 I197 P198 R200	P18-Y20 PolarHBondContact O-N 3.33Å; P18-Y20 VanDerWaalsContact O-N 3.1Å; P18-Q21 PolarHBondContact O-N 3.37Å; P18-I197 HydrophobicContact CB-CG2 4.19Å; P18-P198 WeakPolarHBondContact CB-O 3.31Å; P18-R200 HydrophobicContact CG-CB 4.44Å; P18-R200 HydrophobicContact CG-CG 4.05Å
19	I	88.6	Confident	73.4	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-60.3	-24.2	-178.5	-164.8	168.1	0	0	0	113.9	L17 Q21 H22 K23 L26 S44 Q49 L50 Y53 I197	L17-I19 VanDerWaalsContact C-N 3.28Å; L17-I19 HydrophobicContact CB-CG2 4.32Å; L17-I19 PolarHBondContact O-N 3.28Å; I19-Q21 VanDerWaalsContact C-N 3.34Å; I19-Q21 PolarHBondContact O-N 3.21Å; I19-H22 PolarHBondContact O-N 2.51Å; I19-H22 VanDerWaalsContact O-N 3.13Å; I19-K23 PolarHBondContact O-N 3.03Å; I19-L26 HydrophobicContact CD1-CD2 3.83Å; I19-L26 HydrophobicContact CG1-CD2 3.92Å; I19-S44 WeakPolarHBondContact CB-O 3.27Å; I19-S44 VanDerWaalsContact CG2-O 3.25Å; I19-S44 WeakPolarHBondContact CG2-O 3.37Å; I19-S44 PolarHBondContact N-O 2.83Å; I19-Q49 HydrophobicContact CG2-CB 3.75Å; I19-Q49 HydrophobicContact CG2-CG 3.87Å; I19-L50 HydrophobicContact CD1-CB 4.26Å; I19-Y53 HydrophobicContact CG1-CE2 4.21Å; I19-Y53 HydrophobicContact CG2-CE2 4.3Å; I19-I197 HydrophobicContact CB-CD1 4.29Å; I19-I197 HydrophobicContact CB-CG2 4.33Å; I19-I197 HydrophobicContact CD1-CD1 3.65Å; I19-I197 HydrophobicContact CG1-CD1 3.67Å; I19-I197 HydrophobicContact CG1-CG1 4.48Å
20	Y	88.9	Confident	76.3	Confident	68 Å²	68	75.5 Å²	75.5	27%	0.267	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-61	-41.3	-178.2	-176.9	-96.6	0	0	0	112.4	E13 K15 L17 P18 H22 K23	E13-Y20 WeakPolarHBondContact OE2-CE2 3.24Å; E13-Y20 PolarHBondContact OE2-OH 3.36Å; K15-Y20 HydrophobicContact CB-CD1 4.49Å; K15-Y20 HydrophobicContact CB-CE1 4.34Å; K15-Y20 HydrophobicContact CG-CE1 4.03Å; K15-Y20 HydrophobicContact CG-CE2 4.2Å; L17-Y20 WeakPolarHBondContact O-CB 3.41Å; L17-Y20 PolarHBondContact O-N 2.87Å; L17-Y20 VanDerWaalsContact O-N 3.09Å; P18-Y20 PolarHBondContact O-N 3.33Å; P18-Y20 VanDerWaalsContact O-N 3.1Å; Y20-H22 PolarHBondContact O-N 3.4Å; Y20-H22 VanDerWaalsContact O-N 3.1Å; Y20-K23 WeakPolarHBondContact O-CB 3.25Å; Y20-K23 PolarHBondContact O-N 3.02Å; Y20-K23 VanDerWaalsContact O-N 3.17Å
21	Q	88.4	Confident	79.2	Confident	137 Å²	137	74.4 Å²	74.4	64%	0.64	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-63	-21	180	-62.5	-178.3	-4.7	0	0	112.6	P18 I19	P18-Q21 PolarHBondContact O-N 3.37Å; I19-Q21 VanDerWaalsContact C-N 3.34Å; I19-Q21 PolarHBondContact O-N 3.21Å
22	H	90.6	Very high	82.1	Confident	39 Å²	39	73.5 Å²	73.5	18%	0.181	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-105.9	3	-176	-62.8	-84.9	0	0	0	113.3	I19 Y20 N24 K25 L26 F195 P198	I19-H22 PolarHBondContact O-N 2.51Å; I19-H22 VanDerWaalsContact O-N 3.13Å; Y20-H22 PolarHBondContact O-N 3.4Å; Y20-H22 VanDerWaalsContact O-N 3.1Å; H22-N24 PolarHBondContact O-N 2.91Å; H22-K25 PolarHBondContact O-N 3.36Å; H22-L26 VanDerWaalsContact O-CB 3.31Å; H22-L26 WeakPolarHBondContact O-CB 3.45Å; H22-L26 PolarHBondContact O-N 3.02Å; H22-F195 HydrophobicContact CB-CE1 3.92Å; H22-F195 HydrophobicContact CB-CZ 3.91Å; H22-P198 WeakPolarHBondContact NE2-CD 3.11Å
23	K	92.8	Very high	84.6	Confident	37 Å²	37	69.4 Å²	69.4	16%	0.161	33%	0.333	C	S	.	.	H	α-helix	trans	-46.4	-56.8	-173.6	177.8	177.9	-177.9	176.9	0	113.7	I19 Y20 L26 I27 Y53	I19-K23 PolarHBondContact O-N 3.03Å; Y20-K23 WeakPolarHBondContact O-CB 3.25Å; Y20-K23 PolarHBondContact O-N 3.02Å; Y20-K23 VanDerWaalsContact O-N 3.17Å; K23-L26 PolarHBondContact O-N 2.78Å; K23-I27 HydrophobicContact CG-CD1 3.95Å; K23-I27 WeakPolarHBondContact O-CG1 3.23Å; K23-I27 PolarHBondContact O-N 3.27Å; K23-Y53 HydrophobicContact CB-CD2 4.18Å; K23-Y53 HydrophobicContact CB-CE2 3.99Å; K23-Y53 HydrophobicContact CD-CD1 3.84Å; K23-Y53 HydrophobicContact CD-CD2 4.44Å; K23-Y53 HydrophobicContact CD-CE1 3.81Å; K23-Y53 HydrophobicContact CD-CE2 4.41Å; K23-Y53 HydrophobicContact CD-CG 4.17Å; K23-Y53 HydrophobicContact CG-CD1 4.04Å; K23-Y53 HydrophobicContact CG-CD2 3.8Å; K23-Y53 HydrophobicContact CG-CE1 4.23Å; K23-Y53 HydrophobicContact CG-CE2 3.99Å; K23-Y53 HydrophobicContact CG-CG 3.83Å
24	N	94.3	Very high	87	Confident	128 Å²	128	67.5 Å²	67.5	68%	0.684	33%	0.327	S	S	*	.	H	α-helix	trans	-67.2	-41.8	-174.8	-67.7	-21.9	0	0	0	112.3	H22 L26 I27 Q28	H22-N24 PolarHBondContact O-N 2.91Å; N24-L26 VanDerWaalsContact C-N 3.32Å; N24-L26 PolarHBondContact O-N 3.28Å; N24-I27 PolarHBondContact O-N 2.92Å; N24-Q28 PolarHBondContact O-N 3.15Å; N24-Q28 VanDerWaalsContact O-N 3.07Å
25	K	94.9	Very high	89	Confident	141 Å²	141	66 Å²	66	61%	0.613	32%	0.316	S	S	*	.	H	α-helix	trans	-63.9	-39.5	177	-67.9	-177.8	177.1	179.8	0	111.3	H22 Q28 A29 F195	H22-K25 PolarHBondContact O-N 3.36Å; K25-Q28 PolarHBondContact O-N 3.27Å; K25-A29 WeakPolarHBondContact O-CB 3.2Å; K25-A29 PolarHBondContact O-N 3.47Å; K25-F195 HydrophobicContact CB-CE2 3.9Å; K25-F195 HydrophobicContact CB-CZ 3.98Å
26	L	94.5	Very high	90.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.4	-44.6	178.9	-176.8	56.7	0	0	0	111.9	I19 H22 K23 N24 Q28 A29 V30 L36 V38 L50 F195 I197	I19-L26 HydrophobicContact CD1-CD2 3.83Å; I19-L26 HydrophobicContact CG1-CD2 3.92Å; H22-L26 VanDerWaalsContact O-CB 3.31Å; H22-L26 WeakPolarHBondContact O-CB 3.45Å; H22-L26 PolarHBondContact O-N 3.02Å; K23-L26 PolarHBondContact O-N 2.78Å; N24-L26 VanDerWaalsContact C-N 3.32Å; N24-L26 PolarHBondContact O-N 3.28Å; L26-Q28 VanDerWaalsContact C-N 3.29Å; L26-Q28 PolarHBondContact O-N 3.1Å; L26-A29 PolarHBondContact O-N 2.7Å; L26-V30 WeakPolarHBondContact O-CG2 3.16Å; L26-V30 PolarHBondContact O-N 3.21Å; L26-L36 HydrophobicContact CD1-CD2 4.29Å; L26-V38 HydrophobicContact CD1-CG1 4.33Å; L26-V38 HydrophobicContact CD1-CG2 3.84Å; L26-L50 HydrophobicContact CD1-CD1 4.49Å; L26-L50 HydrophobicContact CD2-CD1 3.6Å; L26-L50 HydrophobicContact CD2-CD2 4.3Å; L26-L50 HydrophobicContact CD2-CG 4.36Å; L26-L50 HydrophobicContact CG-CD1 3.74Å; L26-F195 HydrophobicContact CB-CE1 4.19Å; L26-F195 HydrophobicContact CB-CE2 4.46Å; L26-F195 HydrophobicContact CB-CZ 4.07Å; L26-F195 HydrophobicContact CD1-CB 4.42Å; L26-F195 HydrophobicContact CD1-CD1 3.77Å; L26-F195 HydrophobicContact CD1-CD2 4.39Å; L26-F195 HydrophobicContact CD1-CE1 4.11Å; L26-F195 HydrophobicContact CD1-CG 3.93Å; L26-I197 HydrophobicContact CD2-CD1 4.48Å
27	I	95.7	Very high	92.1	Very high	16 Å²	16	53 Å²	53	8%	0.082	26%	0.257	C	S	.	.	H	α-helix	trans	-58.3	-43.6	173.7	-68.7	162.9	0	0	0	110.6	K23 N24 V30 R31 A57 F59	K23-I27 HydrophobicContact CG-CD1 3.95Å; K23-I27 WeakPolarHBondContact O-CG1 3.23Å; K23-I27 PolarHBondContact O-N 3.27Å; N24-I27 PolarHBondContact O-N 2.92Å; I27-V30 PolarHBondContact O-N 2.9Å; I27-R31 WeakPolarHBondContact O-CG 3.28Å; I27-R31 PolarHBondContact O-N 2.68Å; I27-A57 HydrophobicContact CD1-CB 4.16Å; I27-A57 HydrophobicContact CG1-CB 4.31Å; I27-A57 HydrophobicContact CG2-CB 3.68Å; I27-F59 HydrophobicContact CG2-CE2 4.43Å
28	Q	95.6	Very high	92.8	Very high	118 Å²	118	50.8 Å²	50.8	55%	0.551	25%	0.245	S	C	*	.	H	α-helix	trans	-65.2	-41.6	178.4	-171.4	176.1	7.3	0	0	112.1	N24 K25 L26 V30 R31 N32	N24-Q28 PolarHBondContact O-N 3.15Å; N24-Q28 VanDerWaalsContact O-N 3.07Å; K25-Q28 PolarHBondContact O-N 3.27Å; L26-Q28 VanDerWaalsContact C-N 3.29Å; L26-Q28 PolarHBondContact O-N 3.1Å; Q28-V30 VanDerWaalsContact C-N 3.34Å; Q28-V30 PolarHBondContact O-N 3.46Å; Q28-R31 PolarHBondContact O-N 3.06Å; Q28-N32 WeakPolarHBondContact O-CB 3.44Å; Q28-N32 VanDerWaalsContact O-CG 3.23Å; Q28-N32 PolarHBondContact O-N 3.19Å; Q28-N32 PolarHBondContact O-OD1 2.85Å
29	A	95.6	Very high	93.2	Very high	21 Å²	21	50.6 Å²	50.6	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-44.4	175.2	0	0	0	0	0	111.7	K25 L26 R31 N32 S33 L36 F195	K25-A29 WeakPolarHBondContact O-CB 3.2Å; K25-A29 PolarHBondContact O-N 3.47Å; L26-A29 PolarHBondContact O-N 2.7Å; A29-R31 PolarHBondContact O-N 3.45Å; A29-N32 PolarHBondContact O-N 2.57Å; A29-S33 PolarHBondContact O-N 3.16Å; A29-S33 PolarHBondContact O-OG 2.64Å; A29-L36 HydrophobicContact CB-CD1 4.07Å; A29-L36 HydrophobicContact CB-CD2 3.9Å; A29-F195 HydrophobicContact CB-CD2 3.97Å
30	V	95.4	Very high	93.1	Very high	1 Å²	1	51 Å²	51	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-38.1	176.4	176.8	0	0	0	0	111.8	L26 I27 Q28 N32 S33 L36 L54 F59 K172 V174	L26-V30 WeakPolarHBondContact O-CG2 3.16Å; L26-V30 PolarHBondContact O-N 3.21Å; I27-V30 PolarHBondContact O-N 2.9Å; Q28-V30 VanDerWaalsContact C-N 3.34Å; Q28-V30 PolarHBondContact O-N 3.46Å; V30-N32 VanDerWaalsContact C-N 3.35Å; V30-N32 PolarHBondContact O-N 3.24Å; V30-S33 VanDerWaalsContact O-O 3.06Å; V30-L36 HydrophobicContact CB-CD2 4.42Å; V30-L36 HydrophobicContact CG2-CD2 3.48Å; V30-L36 VanDerWaalsContact CG2-CD2 3.48Å; V30-L54 HydrophobicContact CB-CD2 4.05Å; V30-L54 HydrophobicContact CG1-CD1 4.34Å; V30-L54 HydrophobicContact CG1-CD2 3.87Å; V30-L54 HydrophobicContact CG2-CD2 4.14Å; V30-F59 HydrophobicContact CB-CZ 4.41Å; V30-F59 HydrophobicContact CG1-CE1 4.06Å; V30-F59 HydrophobicContact CG1-CZ 3.84Å; V30-K172 HydrophobicContact CG1-CB 4.17Å; V30-K172 HydrophobicContact CG1-CG 4.27Å; V30-K172 WeakPolarHBondContact O-CD 3.49Å; V30-K172 WeakPolarHBondContact O-CE 3.44Å; V30-K172 PolarHBondContact O-NZ 3Å; V30-V174 HydrophobicContact CG1-CG2 4.2Å; V30-V174 HydrophobicContact CG2-CG2 3.97Å
31	R	93.4	Very high	92.5	Very high	136 Å²	136	52 Å²	52	51%	0.513	26%	0.255	S	S	.	.	H	α-helix	trans	-63.5	-41.2	176.1	-75.2	-177.2	177.5	160.9	-2	112.1	I27 Q28 A29 S33 A57 F59 K172	I27-R31 WeakPolarHBondContact O-CG 3.28Å; I27-R31 PolarHBondContact O-N 2.68Å; Q28-R31 PolarHBondContact O-N 3.06Å; A29-R31 PolarHBondContact O-N 3.45Å; R31-S33 PolarHBondContact O-N 3.27Å; R31-A57 PolarHBondContact NH2-O 2.93Å; R31-F59 HydrophobicContact CG-CE1 4.39Å; R31-F59 HydrophobicContact CG-CE2 4.06Å; R31-F59 HydrophobicContact CG-CZ 3.47Å; R31-F59 VanDerWaalsContact CG-CZ 3.47Å; R31-K172 PolarHBondContact O-NZ 2.95Å
32	N	92.9	Very high	91.9	Very high	120 Å²	120	47.2 Å²	47.2	64%	0.642	24%	0.235	S	C	*	.	H	α-helix	trans	-81.5	-12	-171.6	-68.8	-3.5	0	0	0	114.5	Q28 A29 V30	Q28-N32 WeakPolarHBondContact O-CB 3.44Å; Q28-N32 VanDerWaalsContact O-CG 3.23Å; Q28-N32 PolarHBondContact O-N 3.19Å; Q28-N32 PolarHBondContact O-OD1 2.85Å; A29-N32 PolarHBondContact O-N 2.57Å; V30-N32 VanDerWaalsContact C-N 3.35Å; V30-N32 PolarHBondContact O-N 3.24Å
33	S	90.9	Very high	91.1	Very high	25 Å²	25	48 Å²	48	18%	0.175	25%	0.253	C	S	.	.			trans	-129.2	145.2	-173.4	-52.6	0	0	0	0	111.1	A29 V30 R31 F35 K172 P193	A29-S33 PolarHBondContact O-N 3.16Å; A29-S33 PolarHBondContact O-OG 2.64Å; V30-S33 VanDerWaalsContact O-O 3.06Å; R31-S33 PolarHBondContact O-N 3.27Å; S33-F35 WeakPolarHBondContact CB-O 3.44Å; S33-K172 WeakPolarHBondContact O-CD 3.44Å; S33-K172 PolarHBondContact O-NZ 3.41Å; S33-P193 WeakPolarHBondContact OG-CG 3.34Å
34	T	92	Very high	90.6	Very high	44 Å²	44	46.4 Å²	46.4	27%	0.27	25%	0.247	S	C	.	.	S	Bend	trans	-76.8	-46.7	170.9	-56.3	0	0	0	0	109.8	L171 V173	T34-L171 WeakPolarHBondContact CG2-O 3.36Å; T34-V173 PolarHBondContact O-N 2.94Å
35	F	94.9	Very high	90.2	Very high	17 Å²	17	40.7 Å²	40.7	8%	0.075	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.6	172.7	-61.1	-83.4	0	0	0	109.3	S33 F157 V173 F189 C192	S33-F35 WeakPolarHBondContact CB-O 3.44Å; F35-F157 HydrophobicContact CZ-CB 3.96Å; F35-V173 WeakPolarHBondContact CA-O 3.25Å; F35-V173 HydrophobicContact CD1-CB 3.63Å; F35-V173 HydrophobicContact CD1-CG1 3.89Å; F35-V173 HydrophobicContact CD1-CG2 4.21Å; F35-V173 HydrophobicContact CE1-CB 3.84Å; F35-V173 HydrophobicContact CE1-CG1 4.08Å; F35-V173 HydrophobicContact CE1-CG2 3.9Å; F35-F189 HydrophobicContact CB-CB 4.1Å; F35-F189 HydrophobicContact CB-CD1 4.37Å; F35-F189 HydrophobicContact CB-CG 4.28Å; F35-F189 AromaticContact CD1-CD1 3.32Å; F35-F189 HydrophobicContact CD1-CD1 3.32Å; F35-F189 AromaticContact CD1-CE1 3.52Å; F35-F189 HydrophobicContact CD1-CE1 3.52Å; F35-F189 AromaticContact CD1-CG 4Å; F35-F189 HydrophobicContact CD1-CG 4Å; F35-F189 HydrophobicContact CD1-CZ 4.34Å; F35-F189 HydrophobicContact CD2-CD1 4.29Å; F35-F189 AromaticContact CE1-CD1 3.55Å; F35-F189 HydrophobicContact CE1-CD1 3.55Å; F35-F189 AromaticContact CE1-CE1 3.48Å; F35-F189 HydrophobicContact CE1-CE1 3.48Å; F35-F189 VanDerWaalsContact CE1-CE1 3.48Å; F35-F189 HydrophobicContact CE2-CD1 4.47Å; F35-F189 HydrophobicContact CG-CB 4.23Å; F35-F189 AromaticContact CG-CD1 3.74Å; F35-F189 HydrophobicContact CG-CD1 3.74Å; F35-F189 HydrophobicContact CG-CE1 4.39Å; F35-F189 HydrophobicContact CG-CG 4.14Å; F35-F189 HydrophobicContact CZ-CD1 4.13Å; F35-F189 HydrophobicContact CZ-CE1 4.31Å; F35-C192 HydrophobicContact CB-CB 3.86Å
36	L	96.1	Very high	90	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	129.5	174.6	179.9	72.5	0	0	0	109.4	L26 A29 V30 V38 V173 V174 V175 P193 F195	L26-L36 HydrophobicContact CD1-CD2 4.29Å; A29-L36 HydrophobicContact CB-CD1 4.07Å; A29-L36 HydrophobicContact CB-CD2 3.9Å; V30-L36 HydrophobicContact CB-CD2 4.42Å; V30-L36 HydrophobicContact CG2-CD2 3.48Å; V30-L36 VanDerWaalsContact CG2-CD2 3.48Å; L36-V38 HydrophobicContact CD2-CG2 3.79Å; L36-V38 HydrophobicContact CG-CG2 4.05Å; L36-V173 PolarHBondContact N-O 3.47Å; L36-V174 CarbonylContact O-C 3.59Å; L36-V174 WeakPolarHBondContact O-CA 3.5Å; L36-V175 PolarHBondContact O-N 3.03Å; L36-P193 HydrophobicContact CD1-CB 4.13Å; L36-P193 HydrophobicContact CD1-CG 3.89Å; L36-F195 HydrophobicContact CD1-CB 4.3Å
37	I	96.3	Very high	89.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	129.7	170	-65	158.6	0	0	0	108.3	T39 V175 T182 L185 C192 P193 V194 F195	I37-T39 HydrophobicContact CG2-CG2 4.04Å; I37-V175 CarbonylContact C-O 3.57Å; I37-V175 WeakPolarHBondContact CA-O 3.4Å; I37-V175 HydrophobicContact CG1-CB 4.25Å; I37-T182 HydrophobicContact CG2-CG2 4.43Å; I37-L185 VanDerWaalsContact CD1-C 3.42Å; I37-L185 HydrophobicContact CD1-CB 3.51Å; I37-L185 HydrophobicContact CG1-CB 4.25Å; I37-C192 WeakPolarHBondContact CD1-SG 3.35Å; I37-P193 PolarHBondContact N-O 3.12Å; I37-V194 HydrophobicContact CB-CG2 4.21Å; I37-V194 HydrophobicContact CD1-CG2 4.25Å; I37-V194 HydrophobicContact CG2-CG1 4.21Å; I37-V194 HydrophobicContact CG2-CG2 4.48Å; I37-V194 CarbonylContact O-C 3.51Å; I37-V194 WeakPolarHBondContact O-CA 3.39Å; I37-F195 PolarHBondContact O-N 3.3Å
38	V	94.8	Very high	89.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	118.3	176.2	-179.6	0	0	0	0	108.7	L26 L36 K46 L50 V174 V175 M176 S177 F195 I197	L26-V38 HydrophobicContact CD1-CG1 4.33Å; L26-V38 HydrophobicContact CD1-CG2 3.84Å; L36-V38 HydrophobicContact CD2-CG2 3.79Å; L36-V38 HydrophobicContact CG-CG2 4.05Å; V38-K46 HydrophobicContact CG1-CD 4.27Å; V38-L50 HydrophobicContact CG2-CD2 4.35Å; V38-V174 HydrophobicContact CB-CG1 4.33Å; V38-V174 HydrophobicContact CG2-CG1 3.59Å; V38-V175 PolarHBondContact N-O 3Å; V38-M176 HydrophobicContact CB-CG 4.32Å; V38-M176 VanDerWaalsContact O-CA 3.3Å; V38-M176 WeakPolarHBondContact O-CA 3.47Å; V38-S177 PolarHBondContact O-N 2.98Å; V38-F195 WeakPolarHBondContact CA-O 3.11Å; V38-F195 HydrophobicContact CG2-CB 4.44Å; V38-I197 HydrophobicContact CG1-CD1 3.64Å; V38-I197 HydrophobicContact CG1-CG1 4.41Å
39	T	91.3	Very high	89.4	Confident	11 Å²	11	30.5 Å²	30.5	7%	0.067	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	152.8	177	54.8	0	0	0	0	112.6	I37 S177 T182 V194 F195 I197	I37-T39 HydrophobicContact CG2-CG2 4.04Å; T39-S177 WeakPolarHBondContact CA-O 2.97Å; T39-T182 HydrophobicContact CG2-CG2 3.11Å; T39-V194 HydrophobicContact CG2-CG1 4.5Å; T39-F195 PolarHBondContact N-O 2.88Å; T39-I197 WeakPolarHBondContact O-CB 3.35Å; T39-I197 PolarHBondContact O-N 3.13Å
40	G	85.3	Confident	89.4	Confident	8 Å²	8	29.6 Å²	29.6	8%	0.082	17%	0.168	C	C	.	.			trans	165.2	153.3	176	0	0	0	0	0	108.8	K46 S177 A178 I197	G40-K46 WeakPolarHBondContact O-CE 3.48Å; G40-K46 PolarHBondContact O-NZ 3.27Å; G40-S177 PolarHBondContact N-O 3.47Å; G40-A178 WeakPolarHBondContact O-CA 3.39Å; G40-I197 WeakPolarHBondContact CA-O 3.31Å
41	E	77.4	Confident	89.4	Confident	89 Å²	89	29.5 Å²	29.5	42%	0.416	17%	0.168	S	C	.	.			trans	-68.4	166.1	-175	-65.7	165.8	148.3	0	0	112.3	G43 S44 K46 G199 V201	E41-G43 PolarHBondContact O-N 3.31Å; E41-S44 VanDerWaalsContact O-CB 3.3Å; E41-S44 WeakPolarHBondContact O-CB 3.44Å; E41-S44 PolarHBondContact O-N 3.39Å; E41-S44 PolarHBondContact O-OG 3.44Å; E41-K46 PolarHBondContact O-NZ 3.34Å; E41-G199 WeakPolarHBondContact OE2-CA 3.44Å; E41-V201 VanDerWaalsContact OE1-CG2 3.24Å; E41-V201 WeakPolarHBondContact OE1-CG2 3.38Å; E41-V201 WeakPolarHBondContact OE2-CG2 3.23Å
42	T	75.5	Confident	89.6	Confident	37 Å²	37	23.7 Å²	23.7	23%	0.227	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	132.1	175.2	50	0	0	0	0	110.2	A178 R363 R366	T42-A178 HydrophobicContact CG2-CB 4.08Å; T42-R363 PolarHBondContact OG1-NH2 3.14Å; T42-R366 PolarHBondContact OG1-NH2 2.82Å
43	G	74.5	Confident	89.7	Confident	54 Å²	54	18.3 Å²	18.3	56%	0.557	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.3	-6.3	-171.9	0	0	0	0	0	115	E41 G45	E41-G43 PolarHBondContact O-N 3.31Å; G43-G45 PolarHBondContact O-N 3.02Å
44	S	81.6	Confident	89.9	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.028	11%	0.109	C	C	.	.	S	Bend	trans	-66.5	-17	173.3	53.7	0	0	0	0	114.4	I19 E41 K46	I19-S44 WeakPolarHBondContact CB-O 3.27Å; I19-S44 VanDerWaalsContact CG2-O 3.25Å; I19-S44 WeakPolarHBondContact CG2-O 3.37Å; I19-S44 PolarHBondContact N-O 2.83Å; E41-S44 VanDerWaalsContact O-CB 3.3Å; E41-S44 WeakPolarHBondContact O-CB 3.44Å; E41-S44 PolarHBondContact O-N 3.39Å; E41-S44 PolarHBondContact O-OG 3.44Å; S44-K46 WeakPolarHBondContact OG-CG 3.37Å
45	G	85.4	Confident	90.1	Very high	9 Å²	9	16.1 Å²	16.1	9%	0.093	10%	0.101	C	C	.	.	S	Bend	trans	97.1	10.6	179.5	0	0	0	0	0	115.5	G43 T47 T48 Q49	G43-G45 PolarHBondContact O-N 3.02Å; G45-T47 PolarHBondContact O-N 3.49Å; G45-T48 PolarHBondContact O-N 3.12Å; G45-Q49 VanDerWaalsContact O-CB 3.24Å; G45-Q49 WeakPolarHBondContact O-CB 3.43Å; G45-Q49 WeakPolarHBondContact O-CG 3.38Å; G45-Q49 PolarHBondContact O-N 2.73Å
46	K	90.1	Very high	90	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.017	12%	0.123	C	C	.	.	H	α-helix	trans	-51.1	-57.8	-179.9	-58.3	-173.9	-50.9	-64.7	0	112.8	V38 G40 E41 S44 T48 L50 M176 I197	V38-K46 HydrophobicContact CG1-CD 4.27Å; G40-K46 WeakPolarHBondContact O-CE 3.48Å; G40-K46 PolarHBondContact O-NZ 3.27Å; E41-K46 PolarHBondContact O-NZ 3.34Å; S44-K46 WeakPolarHBondContact OG-CG 3.37Å; K46-T48 PolarHBondContact O-N 3.19Å; K46-L50 WeakPolarHBondContact O-CB 3.5Å; K46-L50 PolarHBondContact O-N 2.97Å; K46-M176 HydrophobicContact CB-CE 4.39Å; K46-M176 HydrophobicContact CB-SD 3.77Å; K46-I197 HydrophobicContact CD-CD1 4.4Å; K46-I197 HydrophobicContact CG-CD1 3.94Å
47	T	90.4	Very high	89.9	Confident	25 Å²	25	21.7 Å²	21.7	15%	0.153	13%	0.131	C	C	.	.	H	α-helix	trans	-62.2	-38.4	-174.3	-49.2	0	0	0	0	113.9	G45 V78 Y112 D137	G45-T47 PolarHBondContact O-N 3.49Å; T47-V78 HydrophobicContact CG2-CB 4.35Å; T47-V78 HydrophobicContact CG2-CG1 3.66Å; T47-V78 HydrophobicContact CG2-CG2 3.79Å; T47-Y112 PolarHBondContact O-OH 3.38Å; T47-D137 WeakPolarHBondContact CB-OD2 3.3Å; T47-D137 WeakPolarHBondContact CG2-OD2 3.4Å; T47-D137 PolarHBondContact OG1-OD2 3.13Å
48	T	90.3	Very high	89.8	Confident	26 Å²	26	22.6 Å²	22.6	16%	0.16	14%	0.141	C	C	.	.	H	α-helix	trans	-91.3	-42.7	-176.4	56	0	0	0	0	112.1	G45 K46 Q52 V78 V82	G45-T48 PolarHBondContact O-N 3.12Å; K46-T48 PolarHBondContact O-N 3.19Å; T48-Q52 WeakPolarHBondContact O-CG 3.22Å; T48-Q52 PolarHBondContact O-NE2 3.24Å; T48-V78 HydrophobicContact CG2-CG1 4.41Å; T48-V82 HydrophobicContact CG2-CG2 4.21Å
49	Q	93.5	Very high	89.7	Confident	6 Å²	6	23 Å²	23	3%	0.028	14%	0.143	C	C	.	.	H	α-helix	trans	-92.5	-37.1	-168.3	-55.3	-56.1	-67.8	0	0	114.1	L17 I19 G45 Q52 Y53 E85	L17-Q49 HydrophobicContact CD1-CG 3.77Å; I19-Q49 HydrophobicContact CG2-CB 3.75Å; I19-Q49 HydrophobicContact CG2-CG 3.87Å; G45-Q49 VanDerWaalsContact O-CB 3.24Å; G45-Q49 WeakPolarHBondContact O-CB 3.43Å; G45-Q49 WeakPolarHBondContact O-CG 3.38Å; G45-Q49 PolarHBondContact O-N 2.73Å; Q49-Q52 WeakPolarHBondContact O-CB 3.26Å; Q49-Q52 PolarHBondContact O-N 2.79Å; Q49-Y53 HydrophobicContact CB-CD2 4.49Å; Q49-Y53 HydrophobicContact CB-CE1 4.22Å; Q49-Y53 HydrophobicContact CB-CE2 3.87Å; Q49-Y53 WeakPolarHBondContact O-CD1 3.49Å; Q49-Y53 PolarHBondContact O-N 3.27Å; Q49-E85 PolarHBondContact NE2-OE2 3.22Å
50	L	95.3	Very high	89.7	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-46.6	-178.7	178.7	54.8	0	0	0	112.3	I19 L26 V38 K46 Q52 Y53 L54 I135 V174 M176	I19-L50 HydrophobicContact CD1-CB 4.26Å; L26-L50 HydrophobicContact CD1-CD1 4.49Å; L26-L50 HydrophobicContact CD2-CD1 3.6Å; L26-L50 HydrophobicContact CD2-CD2 4.3Å; L26-L50 HydrophobicContact CD2-CG 4.36Å; L26-L50 HydrophobicContact CG-CD1 3.74Å; V38-L50 HydrophobicContact CG2-CD2 4.35Å; K46-L50 WeakPolarHBondContact O-CB 3.5Å; K46-L50 PolarHBondContact O-N 2.97Å; L50-Q52 VanDerWaalsContact C-N 3.26Å; L50-Q52 PolarHBondContact O-N 2.95Å; L50-Y53 PolarHBondContact O-N 3.34Å; L50-Y53 VanDerWaalsContact O-N 3.08Å; L50-L54 HydrophobicContact CD1-CD1 4.19Å; L50-L54 HydrophobicContact CD1-CD2 4.13Å; L50-L54 HydrophobicContact CD1-CG 3.87Å; L50-L54 HydrophobicContact CG-CD1 4.24Å; L50-L54 HydrophobicContact CG-CG 4.34Å; L50-L54 WeakPolarHBondContact O-CG 3.25Å; L50-L54 PolarHBondContact O-N 2.94Å; L50-I135 HydrophobicContact CG-CD1 4.43Å; L50-V174 HydrophobicContact CD2-CG1 3.93Å; L50-M176 HydrophobicContact CB-CE 3.59Å; L50-M176 HydrophobicContact CD2-CE 3.2Å; L50-M176 HydrophobicContact CG-CE 3.78Å
51	P	96.4	Very high	89.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.2	-40.4	177.1	-24.8	35.8	0	0	0	112.5	L54 H55 V67 L110 Y112 I135	P51-L54 PolarHBondContact O-N 3.47Å; P51-H55 WeakPolarHBondContact O-CB 3.26Å; P51-H55 PolarHBondContact O-N 3.3Å; P51-V67 HydrophobicContact CB-CG2 3.95Å; P51-V67 HydrophobicContact CG-CG2 3.63Å; P51-L110 HydrophobicContact CB-CD1 4.45Å; P51-L110 HydrophobicContact CB-CD2 4.38Å; P51-Y112 WeakPolarHBondContact CG-OH 3.5Å; P51-I135 HydrophobicContact CB-CD1 4.5Å; P51-I135 HydrophobicContact CG-CD1 3.98Å
52	Q	95.7	Very high	90.1	Very high	14 Å²	14	32.2 Å²	32.2	7%	0.065	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-39	176.4	-64.8	-178.4	65.7	0	0	112.3	T48 Q49 L50 H55 Q56 V82 E85 M86 L110	T48-Q52 WeakPolarHBondContact O-CG 3.22Å; T48-Q52 PolarHBondContact O-NE2 3.24Å; Q49-Q52 WeakPolarHBondContact O-CB 3.26Å; Q49-Q52 PolarHBondContact O-N 2.79Å; L50-Q52 VanDerWaalsContact C-N 3.26Å; L50-Q52 PolarHBondContact O-N 2.95Å; Q52-H55 WeakPolarHBondContact O-CB 3.31Å; Q52-H55 PolarHBondContact O-N 3.38Å; Q52-Q56 VanDerWaalsContact O-CG 3.26Å; Q52-Q56 WeakPolarHBondContact O-CG 3.37Å; Q52-Q56 PolarHBondContact O-N 2.92Å; Q52-V82 HydrophobicContact CG-CG1 3.91Å; Q52-E85 PolarHBondContact NE2-OE2 3.22Å; Q52-M86 HydrophobicContact CG-CG 4.18Å; Q52-M86 HydrophobicContact CG-SD 3.97Å; Q52-L110 HydrophobicContact CG-CD1 4.5Å
53	Y	95.9	Very high	90.9	Very high	6 Å²	6	31.3 Å²	31.3	2%	0.024	18%	0.176	C	C	.	.	H	α-helix	trans	-66.5	-38.9	176.6	-62.8	-17.6	0	0	0	112.2	I19 K23 Q49 L50 Q56 A57	I19-Y53 HydrophobicContact CG1-CE2 4.21Å; I19-Y53 HydrophobicContact CG2-CE2 4.3Å; K23-Y53 HydrophobicContact CB-CD2 4.18Å; K23-Y53 HydrophobicContact CB-CE2 3.99Å; K23-Y53 HydrophobicContact CD-CD1 3.84Å; K23-Y53 HydrophobicContact CD-CD2 4.44Å; K23-Y53 HydrophobicContact CD-CE1 3.81Å; K23-Y53 HydrophobicContact CD-CE2 4.41Å; K23-Y53 HydrophobicContact CD-CG 4.17Å; K23-Y53 HydrophobicContact CG-CD1 4.04Å; K23-Y53 HydrophobicContact CG-CD2 3.8Å; K23-Y53 HydrophobicContact CG-CE1 4.23Å; K23-Y53 HydrophobicContact CG-CE2 3.99Å; K23-Y53 HydrophobicContact CG-CG 3.83Å; Q49-Y53 HydrophobicContact CB-CD2 4.49Å; Q49-Y53 HydrophobicContact CB-CE1 4.22Å; Q49-Y53 HydrophobicContact CB-CE2 3.87Å; Q49-Y53 WeakPolarHBondContact O-CD1 3.49Å; Q49-Y53 PolarHBondContact O-N 3.27Å; L50-Y53 PolarHBondContact O-N 3.34Å; L50-Y53 VanDerWaalsContact O-N 3.08Å; Y53-Q56 PolarHBondContact O-N 3.17Å; Y53-A57 VanDerWaalsContact O-CB 3.25Å; Y53-A57 WeakPolarHBondContact O-CB 3.15Å; Y53-A57 PolarHBondContact O-N 3.47Å
54	L	95.9	Very high	91.9	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.1	-38	175	-62	-177.9	0	0	0	111.7	V30 L50 P51 A57 G58 F59 I65 V133 I135	V30-L54 HydrophobicContact CB-CD2 4.05Å; V30-L54 HydrophobicContact CG1-CD1 4.34Å; V30-L54 HydrophobicContact CG1-CD2 3.87Å; V30-L54 HydrophobicContact CG2-CD2 4.14Å; L50-L54 HydrophobicContact CD1-CD1 4.19Å; L50-L54 HydrophobicContact CD1-CD2 4.13Å; L50-L54 HydrophobicContact CD1-CG 3.87Å; L50-L54 HydrophobicContact CG-CD1 4.24Å; L50-L54 HydrophobicContact CG-CG 4.34Å; L50-L54 WeakPolarHBondContact O-CG 3.25Å; L50-L54 PolarHBondContact O-N 2.94Å; P51-L54 PolarHBondContact O-N 3.47Å; L54-A57 PolarHBondContact O-N 3.12Å; L54-G58 PolarHBondContact O-N 3.24Å; L54-F59 HydrophobicContact CB-CB 4.41Å; L54-F59 HydrophobicContact CB-CD2 3.99Å; L54-F59 HydrophobicContact CB-CG 4.36Å; L54-F59 HydrophobicContact CD2-CD2 3.87Å; L54-F59 HydrophobicContact CD2-CE2 3.63Å; L54-F59 HydrophobicContact CD2-CZ 4.19Å; L54-F59 WeakPolarHBondContact O-CD2 3.27Å; L54-F59 PolarHBondContact O-N 2.99Å; L54-F59 VanDerWaalsContact O-N 3.17Å; L54-I65 HydrophobicContact CB-CD1 3.86Å; L54-V133 HydrophobicContact CD1-CG1 3.86Å; L54-V133 HydrophobicContact CD1-CG2 4.46Å; L54-I135 HydrophobicContact CD1-CD1 4.06Å
55	H	95.1	Very high	92.6	Very high	24 Å²	24	30.8 Å²	30.8	11%	0.111	16%	0.158	C	C	.	.	H	α-helix	trans	-56.8	-53.9	170.8	-179.9	-106.1	0	0	0	111.3	P51 Q52 A57 G58 Y60 I65 E93 L110	P51-H55 WeakPolarHBondContact O-CB 3.26Å; P51-H55 PolarHBondContact O-N 3.3Å; Q52-H55 WeakPolarHBondContact O-CB 3.31Å; Q52-H55 PolarHBondContact O-N 3.38Å; H55-A57 PolarHBondContact O-N 3.07Å; H55-G58 PolarHBondContact O-N 3.43Å; H55-Y60 AromaticContact CD2-CD1 3.59Å; H55-Y60 AromaticContact CD2-CG 3.89Å; H55-Y60 AromaticContact NE2-CD1 3.83Å; H55-Y60 VanDerWaalsContact O-CD1 3.25Å; H55-Y60 WeakPolarHBondContact O-CD1 3.42Å; H55-Y60 WeakPolarHBondContact O-CE1 3.4Å; H55-I65 HydrophobicContact CB-CD1 4.25Å; H55-E93 IonicContact CE1-OE1 2.65Å; H55-E93 PolarHBondContact CE1-OE1 3.48Å; H55-E93 IonicContact ND1-OE1 3.43Å; H55-E93 IonicContact NE2-OE1 3.3Å; H55-E93 PolarHBondContact NE2-OE1 3.1Å; H55-L110 HydrophobicContact CB-CD1 4.4Å; H55-L110 HydrophobicContact CB-CD2 4.14Å
56	Q	93.8	Very high	93.2	Very high	113 Å²	113	30.3 Å²	30.3	53%	0.528	15%	0.153	S	C	.	.	H	α-helix	trans	-60.6	-32.1	177.9	-69.7	170.3	10.5	0	0	113	Q52 Y53 G58	Q52-Q56 VanDerWaalsContact O-CG 3.26Å; Q52-Q56 WeakPolarHBondContact O-CG 3.37Å; Q52-Q56 PolarHBondContact O-N 2.92Å; Y53-Q56 PolarHBondContact O-N 3.17Å; Q56-G58 PolarHBondContact O-N 3.19Å
57	A	94.3	Very high	93.6	Very high	24 Å²	24	30.1 Å²	30.1	20%	0.198	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-0.9	177.4	0	0	0	0	0	114	I27 R31 Y53 L54 H55 F59	I27-A57 HydrophobicContact CD1-CB 4.16Å; I27-A57 HydrophobicContact CG1-CB 4.31Å; I27-A57 HydrophobicContact CG2-CB 3.68Å; R31-A57 PolarHBondContact NH2-O 2.93Å; Y53-A57 VanDerWaalsContact O-CB 3.25Å; Y53-A57 WeakPolarHBondContact O-CB 3.15Å; Y53-A57 PolarHBondContact O-N 3.47Å; L54-A57 PolarHBondContact O-N 3.12Å; H55-A57 PolarHBondContact O-N 3.07Å; A57-F59 HydrophobicContact CB-CD2 3.94Å; A57-F59 HydrophobicContact CB-CE2 4.01Å
58	G	93.3	Very high	93.9	Very high	19 Å²	19	29 Å²	29	20%	0.196	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	13.4	172.7	0	0	0	0	0	115.5	L54 H55 Q56 Y60 K61	L54-G58 PolarHBondContact O-N 3.24Å; H55-G58 PolarHBondContact O-N 3.43Å; Q56-G58 PolarHBondContact O-N 3.19Å; G58-Y60 PolarHBondContact O-N 2.87Å; G58-K61 WeakPolarHBondContact O-CG 3.45Å; G58-K61 PolarHBondContact O-N 3.08Å
59	F	92.8	Very high	94.1	Very high	9 Å²	9	27.9 Å²	27.9	4%	0.039	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-62.9	-22.6	178.6	-79.1	-93.4	0	0	0	112.9	I27 V30 R31 L54 A57 K61 I65 S132 V133 F169 K172	I27-F59 HydrophobicContact CG2-CE2 4.43Å; V30-F59 HydrophobicContact CB-CZ 4.41Å; V30-F59 HydrophobicContact CG1-CE1 4.06Å; V30-F59 HydrophobicContact CG1-CZ 3.84Å; R31-F59 HydrophobicContact CG-CE1 4.39Å; R31-F59 HydrophobicContact CG-CE2 4.06Å; R31-F59 HydrophobicContact CG-CZ 3.47Å; R31-F59 VanDerWaalsContact CG-CZ 3.47Å; L54-F59 HydrophobicContact CB-CB 4.41Å; L54-F59 HydrophobicContact CB-CD2 3.99Å; L54-F59 HydrophobicContact CB-CG 4.36Å; L54-F59 HydrophobicContact CD2-CD2 3.87Å; L54-F59 HydrophobicContact CD2-CE2 3.63Å; L54-F59 HydrophobicContact CD2-CZ 4.19Å; L54-F59 WeakPolarHBondContact O-CD2 3.27Å; L54-F59 PolarHBondContact O-N 2.99Å; L54-F59 VanDerWaalsContact O-N 3.17Å; A57-F59 HydrophobicContact CB-CD2 3.94Å; A57-F59 HydrophobicContact CB-CE2 4.01Å; F59-K61 PolarHBondContact O-N 2.66Å; F59-I65 HydrophobicContact CB-CD1 4.17Å; F59-I65 HydrophobicContact CB-CG1 4.47Å; F59-S132 WeakPolarHBondContact O-CB 3.4Å; F59-S132 PolarHBondContact O-OG 3.22Å; F59-V133 HydrophobicContact CB-CG2 3.88Å; F59-V133 HydrophobicContact CD1-CG2 3.51Å; F59-V133 HydrophobicContact CE1-CG2 4.29Å; F59-V133 HydrophobicContact CG-CG2 3.93Å; F59-F169 AromaticContact CD1-CE2 3.73Å; F59-F169 HydrophobicContact CD1-CE2 3.73Å; F59-F169 AromaticContact CD1-CZ 3.61Å; F59-F169 HydrophobicContact CD1-CZ 3.61Å; F59-F169 HydrophobicContact CE1-CE2 4.04Å; F59-F169 HydrophobicContact CE1-CZ 4.24Å; F59-F169 HydrophobicContact CG-CZ 4.47Å; F59-K172 HydrophobicContact CD1-CG 4.48Å; F59-K172 HydrophobicContact CE1-CG 3.97Å
60	Y	90.4	Very high	93.8	Very high	100 Å²	100	29 Å²	29	39%	0.392	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-68.1	-14.2	179.9	71.4	-86.2	0	0	0	115	H55 G58 D62 G63 V109	H55-Y60 AromaticContact CD2-CD1 3.59Å; H55-Y60 AromaticContact CD2-CG 3.89Å; H55-Y60 AromaticContact NE2-CD1 3.83Å; H55-Y60 VanDerWaalsContact O-CD1 3.25Å; H55-Y60 WeakPolarHBondContact O-CD1 3.42Å; H55-Y60 WeakPolarHBondContact O-CE1 3.4Å; G58-Y60 PolarHBondContact O-N 2.87Å; Y60-D62 VanDerWaalsContact C-N 3.26Å; Y60-D62 PolarHBondContact O-N 2.93Å; Y60-G63 CarbonylContact C-O 3.56Å; Y60-G63 WeakPolarHBondContact CA-O 3.42Å; Y60-G63 PolarHBondContact O-N 3.07Å; Y60-G63 VanDerWaalsContact O-O 3.11Å; Y60-V109 HydrophobicContact CD2-CG1 4.34Å; Y60-V109 HydrophobicContact CG-CG1 3.95Å
61	K	88.3	Confident	93.3	Very high	160 Å²	160	32.5 Å²	32.5	70%	0.696	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-66.4	-29.1	-176.2	-69.9	178.8	175.6	-177.9	0	113.2	G58 F59	G58-K61 WeakPolarHBondContact O-CG 3.45Å; G58-K61 PolarHBondContact O-N 3.08Å; F59-K61 PolarHBondContact O-N 2.66Å
62	D	83.9	Confident	92.7	Very high	42 Å²	42	37.6 Å²	37.6	23%	0.225	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-100.5	2	-178.3	-77.4	14.8	0	0	0	113	Y60 S168 F169	Y60-D62 VanDerWaalsContact C-N 3.26Å; Y60-D62 PolarHBondContact O-N 2.93Å; D62-S168 WeakPolarHBondContact OD2-CA 3.32Å; D62-S168 WeakPolarHBondContact OD2-CB 3.17Å; D62-S168 PolarHBondContact OD2-N 2.72Å; D62-S168 PolarHBondContact OD2-OG 3.19Å; D62-F169 HydrophobicContact CB-CE1 3.87Å; D62-F169 HydrophobicContact CB-CZ 4.12Å; D62-F169 VanDerWaalsContact OD2-CD1 3.23Å; D62-F169 WeakPolarHBondContact OD2-CD1 3.18Å; D62-F169 WeakPolarHBondContact OD2-CE1 3.38Å
63	G	91.7	Very high	91.9	Very high	18 Å²	18	40 Å²	40	19%	0.186	19%	0.194	C	C	.	.	S	Bend	trans	147.4	171.5	-175.6	0	0	0	0	0	112.4	Y60 Q130 S132	Y60-G63 CarbonylContact C-O 3.56Å; Y60-G63 WeakPolarHBondContact CA-O 3.42Å; Y60-G63 PolarHBondContact O-N 3.07Å; Y60-G63 VanDerWaalsContact O-O 3.11Å; G63-Q130 CarbonylContact C-O 3.56Å; G63-Q130 WeakPolarHBondContact CA-O 3.32Å; G63-S132 PolarHBondContact O-OG 2.84Å; G63-S132 VanDerWaalsContact O-OG 3.08Å
64	K	95.6	Very high	91.4	Very high	46 Å²	46	40 Å²	40	20%	0.2	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	159	179.5	-59.3	-180	-175.6	179.4	0	111.7	T108 V109 Q130 Y131 S132	K64-T108 VanDerWaalsContact CD-O 3.25Å; K64-T108 WeakPolarHBondContact CD-O 3.45Å; K64-T108 WeakPolarHBondContact CE-O 3.43Å; K64-T108 WeakPolarHBondContact CG-O 3.43Å; K64-V109 WeakPolarHBondContact CA-O 3.48Å; K64-V109 WeakPolarHBondContact CB-O 3.43Å; K64-Q130 PolarHBondContact N-O 3.12Å; K64-Y131 HydrophobicContact CB-CD1 3.81Å; K64-Y131 HydrophobicContact CB-CE1 3.99Å; K64-Y131 CarbonylContact O-C 3.57Å; K64-Y131 VanDerWaalsContact O-CA 3.29Å; K64-Y131 WeakPolarHBondContact O-CA 3.29Å; K64-S132 PolarHBondContact O-N 3.42Å
65	I	97.6	Very high	91	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	109.3	168.1	-60.3	164.4	0	0	0	107	L54 H55 F59 V67 V109 L110 K111 V133 I135	L54-I65 HydrophobicContact CB-CD1 3.86Å; H55-I65 HydrophobicContact CB-CD1 4.25Å; F59-I65 HydrophobicContact CB-CD1 4.17Å; F59-I65 HydrophobicContact CB-CG1 4.47Å; I65-V67 HydrophobicContact CG2-CG2 4.47Å; I65-V109 PolarHBondContact N-O 3.19Å; I65-L110 HydrophobicContact CB-CD2 3.62Å; I65-L110 HydrophobicContact CD1-CD2 3.71Å; I65-L110 HydrophobicContact CG1-CD2 4.18Å; I65-L110 HydrophobicContact CG2-CD2 4.05Å; I65-K111 PolarHBondContact O-N 3.33Å; I65-V133 WeakPolarHBondContact CA-O 3.41Å; I65-V133 HydrophobicContact CG1-CB 4.21Å; I65-V133 HydrophobicContact CG1-CG2 4.31Å; I65-V133 HydrophobicContact CG2-CB 4.2Å; I65-V133 HydrophobicContact CG2-CG1 4.48Å; I65-I135 HydrophobicContact CG2-CD1 4.27Å
66	G	97.7	Very high	90.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.9	177	0	0	0	0	0	110.6	K111 V133 V134 I135	G66-K111 CarbonylContact C-O 3.6Å; G66-K111 WeakPolarHBondContact CA-O 3.4Å; G66-V133 PolarHBondContact N-O 2.91Å; G66-V134 CarbonylContact O-C 3.55Å; G66-V134 WeakPolarHBondContact O-CA 3.27Å; G66-I135 PolarHBondContact O-N 3.32Å
67	V	98	Very high	90	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	116.5	174.7	-168.8	0	0	0	0	108.4	P51 I65 K111 Y112 M113 I135 D137	P51-V67 HydrophobicContact CB-CG2 3.95Å; P51-V67 HydrophobicContact CG-CG2 3.63Å; I65-V67 HydrophobicContact CG2-CG2 4.47Å; V67-K111 PolarHBondContact N-O 3.23Å; V67-Y112 HydrophobicContact CB-CD1 3.68Å; V67-Y112 HydrophobicContact CB-CE1 3.73Å; V67-Y112 HydrophobicContact CB-CG 4.38Å; V67-Y112 HydrophobicContact CG1-CD1 3.93Å; V67-Y112 HydrophobicContact CG1-CE1 3.76Å; V67-Y112 HydrophobicContact CG2-CD1 4.26Å; V67-Y112 HydrophobicContact CG2-CE1 3.9Å; V67-Y112 CarbonylContact O-C 3.59Å; V67-Y112 WeakPolarHBondContact O-CA 3.22Å; V67-M113 PolarHBondContact O-N 2.82Å; V67-I135 CarbonylContact C-O 3.6Å; V67-I135 WeakPolarHBondContact CA-O 3.49Å; V67-I135 HydrophobicContact CB-CB 4.44Å; V67-I135 HydrophobicContact CG1-CB 4.14Å; V67-I135 HydrophobicContact CG1-CG2 4.14Å; V67-I135 HydrophobicContact CG2-CB 4.33Å; V67-I135 HydrophobicContact CG2-CD1 4.2Å; V67-D137 HydrophobicContact CG1-CB 4.42Å
68	T	97.1	Very high	89.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	149	175.4	79	0	0	0	0	111.3	M113 D115 L118 I135 L136 D137	T68-M113 CarbonylContact C-O 3.58Å; T68-M113 WeakPolarHBondContact CA-O 3.42Å; T68-M113 HydrophobicContact CG2-CG 4.26Å; T68-D115 WeakPolarHBondContact CB-OD1 3.48Å; T68-D115 PolarHBondContact OG1-OD1 3.29Å; T68-L118 HydrophobicContact CG2-CB 3.91Å; T68-L118 HydrophobicContact CG2-CD2 3.44Å; T68-L118 VanDerWaalsContact CG2-CD2 3.44Å; T68-L118 HydrophobicContact CG2-CG 4.3Å; T68-I135 PolarHBondContact N-O 2.97Å; T68-L136 HydrophobicContact CG2-CD2 3.77Å; T68-L136 WeakPolarHBondContact OG1-CA 3.07Å; T68-L136 WeakPolarHBondContact OG1-CD2 3.33Å; T68-D137 VanDerWaalsContact O-CB 3.26Å; T68-D137 WeakPolarHBondContact O-CB 3.4Å; T68-D137 PolarHBondContact O-N 3.5Å
69	Q	93.1	Very high	89.8	Confident	4 Å²	4	36.3 Å²	36.3	2%	0.019	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	136.7	171.6	-71.3	-69	-30.7	0	0	108.1	R71 A74 A75 M113 T114 D115 D137	Q69-R71 PolarHBondContact O-N 3.35Å; Q69-A74 HydrophobicContact CB-CB 4.37Å; Q69-A74 HydrophobicContact CG-CB 4.45Å; Q69-A75 HydrophobicContact CB-CB 4.07Å; Q69-A75 HydrophobicContact CG-CB 4.38Å; Q69-M113 PolarHBondContact N-O 3.09Å; Q69-T114 VanDerWaalsContact O-CA 3.28Å; Q69-T114 WeakPolarHBondContact O-CA 3.44Å; Q69-D115 PolarHBondContact O-N 3.33Å; Q69-D137 PolarHBondContact NE2-OD2 3.27Å
70	P	88	Confident	89.5	Confident	29 Å²	29	39.6 Å²	39.6	19%	0.188	19%	0.19	C	C	.	.	S	Bend	trans	-64.9	-28	177.8	23.7	-32.2	0	0	0	112	D115 E138 E141	P70-D115 WeakPolarHBondContact CA-OD2 3.43Å; P70-E138 HydrophobicContact CG-CB 3.87Å; P70-E141 HydrophobicContact CB-CB 4.36Å; P70-E141 HydrophobicContact CG-CB 4.07Å; P70-E141 HydrophobicContact CG-CG 4.04Å
71	R	85	Confident	89.4	Confident	74 Å²	74	41.1 Å²	41.1	28%	0.279	20%	0.195	S	C	.	.	S	Bend	trans	-108.5	134.2	-175.7	-56.1	-170.1	-168.4	-109.9	-15.1	113	Q69 V73 A74 A75 E141 S318	Q69-R71 PolarHBondContact O-N 3.35Å; R71-V73 PolarHBondContact O-N 3.08Å; R71-A74 HydrophobicContact CB-CB 4.1Å; R71-A74 PolarHBondContact O-N 2.87Å; R71-A75 PolarHBondContact O-N 3.41Å; R71-A75 VanDerWaalsContact O-N 3.1Å; R71-E141 IonicContact CZ-OE1 2.8Å; R71-E141 IonicContact CZ-OE2 2.89Å; R71-E141 VanDerWaalsContact CZ-OE2 3.26Å; R71-E141 IonicContact NE-OE1 3.94Å; R71-E141 PolarHBondContact NE-OE1 3.24Å; R71-E141 IonicContact NE-OE2 2.65Å; R71-E141 PolarHBondContact NE-OE2 3.17Å; R71-E141 IonicContact NH2-OE1 3.46Å; R71-E141 IonicContact NH2-OE2 3.16Å; R71-E141 PolarHBondContact NH2-OE2 3.28Å; R71-S318 VanDerWaalsContact CD-OG 3.26Å; R71-S318 WeakPolarHBondContact CD-OG 3.31Å; R71-S318 PolarHBondContact NE-OG 3.5Å
72	R	83.3	Confident	89.6	Confident	108 Å²	108	33.5 Å²	33.5	41%	0.408	16%	0.162	S	C	.	.	H	α-helix	trans	-54.3	-48.6	174.7	174.1	170.7	175.3	-167.3	2.1	112.9	A74 A75 I76 V98 D101 T114	R72-A74 VanDerWaalsContact C-N 3.3Å; R72-A74 PolarHBondContact O-N 3.48Å; R72-A75 PolarHBondContact O-N 2.98Å; R72-I76 HydrophobicContact CG-CD1 3.9Å; R72-I76 WeakPolarHBondContact O-CG1 3.47Å; R72-I76 PolarHBondContact O-N 2.97Å; R72-V98 HydrophobicContact CB-CB 4.5Å; R72-V98 HydrophobicContact CG-CB 3.87Å; R72-V98 HydrophobicContact CG-CG1 4.08Å; R72-V98 HydrophobicContact CG-CG2 3.69Å; R72-D101 IonicContact CZ-OD2 2.66Å; R72-D101 IonicContact NH2-OD2 2.8Å; R72-D101 PolarHBondContact NH2-OD2 2.73Å; R72-T114 HydrophobicContact CB-CG2 4.36Å
73	V	80.3	Confident	90.1	Very high	64 Å²	64	31.7 Å²	31.7	39%	0.388	15%	0.153	S	C	.	.	H	α-helix	trans	-62.7	-41	-177.5	177.1	0	0	0	0	110.7	R71 I76 T77	R71-V73 PolarHBondContact O-N 3.08Å; V73-I76 PolarHBondContact O-N 3.43Å; V73-T77 HydrophobicContact CG1-CG2 4.06Å; V73-T77 WeakPolarHBondContact O-CG2 3.29Å; V73-T77 PolarHBondContact O-N 2.9Å; V73-T77 PolarHBondContact O-OG1 3.15Å
74	A	83.4	Confident	90	Very high	5 Å²	5	37 Å²	37	4%	0.041	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-47.1	178	0	0	0	0	0	111.7	Q69 R71 R72 I76 T77 V78	Q69-A74 HydrophobicContact CB-CB 4.37Å; Q69-A74 HydrophobicContact CG-CB 4.45Å; R71-A74 HydrophobicContact CB-CB 4.1Å; R71-A74 PolarHBondContact O-N 2.87Å; R72-A74 VanDerWaalsContact C-N 3.3Å; R72-A74 PolarHBondContact O-N 3.48Å; A74-I76 VanDerWaalsContact C-N 3.32Å; A74-I76 PolarHBondContact O-N 2.92Å; A74-T77 PolarHBondContact O-N 2.78Å; A74-T77 PolarHBondContact O-OG1 2.7Å; A74-V78 WeakPolarHBondContact O-CB 3.29Å; A74-V78 WeakPolarHBondContact O-CG2 3.18Å; A74-V78 PolarHBondContact O-N 2.79Å
75	A	89	Confident	89.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.5	-46.3	176.9	0	0	0	0	0	112.3	Q69 R71 R72 A79 V98	Q69-A75 HydrophobicContact CB-CB 4.07Å; Q69-A75 HydrophobicContact CG-CB 4.38Å; R71-A75 PolarHBondContact O-N 3.41Å; R71-A75 VanDerWaalsContact O-N 3.1Å; R72-A75 PolarHBondContact O-N 2.98Å; A75-A79 VanDerWaalsContact O-CB 3.27Å; A75-A79 WeakPolarHBondContact O-CB 3.46Å; A75-A79 PolarHBondContact O-N 2.86Å; A75-A79 VanDerWaalsContact O-N 3.13Å; A75-V98 HydrophobicContact CB-CG1 3.76Å
76	I	85.3	Confident	89.6	Confident	27 Å²	27	39.1 Å²	39.1	14%	0.138	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-51	-179	-62.7	169.7	0	0	0	111.2	R72 V73 A74 A79 Q80 Y96 V98	R72-I76 HydrophobicContact CG-CD1 3.9Å; R72-I76 WeakPolarHBondContact O-CG1 3.47Å; R72-I76 PolarHBondContact O-N 2.97Å; V73-I76 PolarHBondContact O-N 3.43Å; A74-I76 VanDerWaalsContact C-N 3.32Å; A74-I76 PolarHBondContact O-N 2.92Å; I76-A79 PolarHBondContact O-N 3Å; I76-Q80 WeakPolarHBondContact O-CB 3.41Å; I76-Q80 WeakPolarHBondContact O-CG 3.46Å; I76-Q80 PolarHBondContact O-N 2.72Å; I76-Y96 HydrophobicContact CD1-CE2 4.25Å; I76-Y96 HydrophobicContact CG1-CD1 4.43Å; I76-Y96 HydrophobicContact CG1-CD2 3.76Å; I76-Y96 HydrophobicContact CG1-CE1 4.36Å; I76-Y96 HydrophobicContact CG1-CE2 3.71Å; I76-Y96 HydrophobicContact CG1-CG 4.15Å; I76-Y96 HydrophobicContact CG2-CD1 4.35Å; I76-Y96 HydrophobicContact CG2-CE1 3.99Å; I76-V98 HydrophobicContact CD1-CG2 4.22Å; I76-V98 HydrophobicContact CG1-CG1 4.2Å; I76-V98 HydrophobicContact CG1-CG2 4.45Å
77	T	82.4	Confident	89.4	Confident	56 Å²	56	46.1 Å²	46.1	34%	0.344	22%	0.221	S	C	.	.	H	α-helix	trans	-71.5	-35.3	-173.2	57.4	0	0	0	0	112.1	V73 A74 Q80 R81	V73-T77 HydrophobicContact CG1-CG2 4.06Å; V73-T77 WeakPolarHBondContact O-CG2 3.29Å; V73-T77 PolarHBondContact O-N 2.9Å; V73-T77 PolarHBondContact O-OG1 3.15Å; A74-T77 PolarHBondContact O-N 2.78Å; A74-T77 PolarHBondContact O-OG1 2.7Å; T77-Q80 PolarHBondContact O-N 3.2Å; T77-R81 WeakPolarHBondContact O-CB 3.35Å; T77-R81 PolarHBondContact O-N 3.02Å
78	V	88.9	Confident	89.2	Confident	20 Å²	20	47.4 Å²	47.4	12%	0.121	23%	0.23	C	C	.	.	H	α-helix	trans	-65.3	-46.2	173.2	172	0	0	0	0	110.2	T47 T48 A74 Q80 R81 V82 Y112	T47-V78 HydrophobicContact CG2-CB 4.35Å; T47-V78 HydrophobicContact CG2-CG1 3.66Å; T47-V78 HydrophobicContact CG2-CG2 3.79Å; T48-V78 HydrophobicContact CG2-CG1 4.41Å; A74-V78 WeakPolarHBondContact O-CB 3.29Å; A74-V78 WeakPolarHBondContact O-CG2 3.18Å; A74-V78 PolarHBondContact O-N 2.79Å; V78-Q80 VanDerWaalsContact C-N 3.33Å; V78-Q80 PolarHBondContact O-N 3.38Å; V78-R81 PolarHBondContact O-N 2.96Å; V78-V82 HydrophobicContact CG1-CG2 4.22Å; V78-V82 WeakPolarHBondContact O-CB 3.15Å; V78-V82 VanDerWaalsContact O-CG2 3.31Å; V78-V82 WeakPolarHBondContact O-CG2 3.44Å; V78-V82 PolarHBondContact O-N 3.27Å; V78-Y112 HydrophobicContact CB-CD1 4.35Å; V78-Y112 HydrophobicContact CB-CE1 4.37Å; V78-Y112 HydrophobicContact CG1-CD1 3.68Å; V78-Y112 HydrophobicContact CG1-CE1 3.27Å; V78-Y112 HydrophobicContact CG1-CG 4.47Å
79	A	93.2	Very high	89	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-44.1	177	0	0	0	0	0	112	A75 I76 R81 V82 A83 L90 V94 Y96 Y112	A75-A79 VanDerWaalsContact O-CB 3.27Å; A75-A79 WeakPolarHBondContact O-CB 3.46Å; A75-A79 PolarHBondContact O-N 2.86Å; A75-A79 VanDerWaalsContact O-N 3.13Å; I76-A79 PolarHBondContact O-N 3Å; A79-R81 VanDerWaalsContact C-N 3.34Å; A79-R81 PolarHBondContact O-N 2.53Å; A79-V82 PolarHBondContact O-N 3.35Å; A79-A83 VanDerWaalsContact O-CB 3.29Å; A79-A83 WeakPolarHBondContact O-CB 3.36Å; A79-A83 PolarHBondContact O-N 2.74Å; A79-L90 HydrophobicContact CB-CD1 3.96Å; A79-V94 HydrophobicContact CB-CG1 4.42Å; A79-V94 WeakPolarHBondContact O-CG1 3.29Å; A79-Y96 HydrophobicContact CB-CD1 4.24Å; A79-Y96 HydrophobicContact CB-CG 4.48Å; A79-Y112 HydrophobicContact CB-CD2 3.76Å; A79-Y112 HydrophobicContact CB-CG 4.04Å
80	Q	88.2	Confident	89	Confident	78 Å²	78	54.7 Å²	54.7	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-58.1	-46.1	174	-78.5	172.4	-4.5	0	0	111.9	I76 T77 V78 A83 Q84 L90	I76-Q80 WeakPolarHBondContact O-CB 3.41Å; I76-Q80 WeakPolarHBondContact O-CG 3.46Å; I76-Q80 PolarHBondContact O-N 2.72Å; T77-Q80 PolarHBondContact O-N 3.2Å; V78-Q80 VanDerWaalsContact C-N 3.33Å; V78-Q80 PolarHBondContact O-N 3.38Å; Q80-A83 PolarHBondContact O-N 2.58Å; Q80-Q84 VanDerWaalsContact O-CG 3.32Å; Q80-Q84 WeakPolarHBondContact O-CG 3.34Å; Q80-Q84 PolarHBondContact O-N 3.32Å; Q80-Q84 VanDerWaalsContact O-N 3.08Å; Q80-L90 HydrophobicContact CG-CD1 4.48Å; Q80-L90 HydrophobicContact CG-CD2 3.57Å
81	R	87.1	Confident	89.2	Confident	133 Å²	133	53.9 Å²	53.9	50%	0.502	27%	0.27	S	S	.	.	H	α-helix	trans	-63.6	-44.4	179.1	176.9	60.3	-175.2	-170.4	3.1	111.8	T77 V78 A79 Q84 E85	T77-R81 WeakPolarHBondContact O-CB 3.35Å; T77-R81 PolarHBondContact O-N 3.02Å; V78-R81 PolarHBondContact O-N 2.96Å; A79-R81 VanDerWaalsContact C-N 3.34Å; A79-R81 PolarHBondContact O-N 2.53Å; R81-Q84 WeakPolarHBondContact O-CB 3.42Å; R81-Q84 PolarHBondContact O-N 2.98Å; R81-E85 IonicContact CZ-OE1 2.93Å; R81-E85 IonicContact NE-OE1 3.15Å; R81-E85 PolarHBondContact NE-OE1 2.97Å; R81-E85 IonicContact NH2-OE1 2.8Å; R81-E85 PolarHBondContact NH2-OE1 2.79Å; R81-E85 VanDerWaalsContact NH2-OE1 3.15Å; R81-E85 WeakPolarHBondContact O-CG 3.39Å; R81-E85 PolarHBondContact O-N 2.86Å
82	V	93.4	Very high	89.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.2	-36.7	-179.1	172	0	0	0	0	111	T48 Q52 V78 A79 Q84 E85 M86 V94 L110 Y112	T48-V82 HydrophobicContact CG2-CG2 4.21Å; Q52-V82 HydrophobicContact CG-CG1 3.91Å; V78-V82 HydrophobicContact CG1-CG2 4.22Å; V78-V82 WeakPolarHBondContact O-CB 3.15Å; V78-V82 VanDerWaalsContact O-CG2 3.31Å; V78-V82 WeakPolarHBondContact O-CG2 3.44Å; V78-V82 PolarHBondContact O-N 3.27Å; A79-V82 PolarHBondContact O-N 3.35Å; V82-Q84 VanDerWaalsContact C-N 3.3Å; V82-Q84 PolarHBondContact O-N 3.13Å; V82-E85 PolarHBondContact O-N 2.8Å; V82-M86 HydrophobicContact CG1-CG 4.39Å; V82-M86 HydrophobicContact CG1-SD 4.06Å; V82-M86 WeakPolarHBondContact O-CB 3.26Å; V82-M86 WeakPolarHBondContact O-CG 3.3Å; V82-M86 PolarHBondContact O-N 2.8Å; V82-V94 HydrophobicContact CB-CG1 4.34Å; V82-V94 HydrophobicContact CG1-CG1 4.18Å; V82-V94 HydrophobicContact CG1-CG2 4.12Å; V82-L110 HydrophobicContact CG1-CD1 4.24Å; V82-Y112 HydrophobicContact CB-CE2 4.18Å; V82-Y112 HydrophobicContact CG1-CE2 4.2Å; V82-Y112 HydrophobicContact CG2-CE2 4.3Å; V82-Y112 WeakPolarHBondContact CG2-OH 3.39Å
83	A	93.8	Very high	90.1	Very high	3 Å²	3	55.5 Å²	55.5	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-41	171.7	0	0	0	0	0	112	A79 Q80 N87 C88 L90 V94	A79-A83 VanDerWaalsContact O-CB 3.29Å; A79-A83 WeakPolarHBondContact O-CB 3.36Å; A79-A83 PolarHBondContact O-N 2.74Å; Q80-A83 PolarHBondContact O-N 2.58Å; A83-N87 PolarHBondContact O-N 3.09Å; A83-C88 PolarHBondContact O-N 2.86Å; A83-L90 HydrophobicContact CB-CB 4.29Å; A83-L90 HydrophobicContact CB-CD1 4.09Å; A83-V94 HydrophobicContact CB-CB 4.03Å; A83-V94 HydrophobicContact CB-CG1 4.24Å
84	Q	90.6	Very high	90.9	Very high	129 Å²	129	52.5 Å²	52.5	60%	0.603	26%	0.26	S	S	*	.	H	α-helix	trans	-64.9	-45	173.4	-70.4	170.1	-3.5	0	0	112.1	Q80 R81 V82 M86 N87	Q80-Q84 VanDerWaalsContact O-CG 3.32Å; Q80-Q84 WeakPolarHBondContact O-CG 3.34Å; Q80-Q84 PolarHBondContact O-N 3.32Å; Q80-Q84 VanDerWaalsContact O-N 3.08Å; R81-Q84 WeakPolarHBondContact O-CB 3.42Å; R81-Q84 PolarHBondContact O-N 2.98Å; V82-Q84 VanDerWaalsContact C-N 3.3Å; V82-Q84 PolarHBondContact O-N 3.13Å; Q84-M86 VanDerWaalsContact C-N 3.3Å; Q84-M86 PolarHBondContact O-N 2.82Å; Q84-N87 PolarHBondContact O-N 3.17Å; Q84-N87 VanDerWaalsContact O-N 3.12Å
85	E	90.6	Very high	91.6	Very high	49 Å²	49	52.2 Å²	52.2	23%	0.229	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-35.5	178.5	-72.8	178.2	-175.4	0	0	112.4	Q49 Q52 R81 V82 N87	Q49-E85 PolarHBondContact NE2-OE2 3.22Å; Q52-E85 PolarHBondContact NE2-OE2 3.22Å; R81-E85 IonicContact CZ-OE1 2.93Å; R81-E85 IonicContact NE-OE1 3.15Å; R81-E85 PolarHBondContact NE-OE1 2.97Å; R81-E85 IonicContact NH2-OE1 2.8Å; R81-E85 PolarHBondContact NH2-OE1 2.79Å; R81-E85 VanDerWaalsContact NH2-OE1 3.15Å; R81-E85 WeakPolarHBondContact O-CG 3.39Å; R81-E85 PolarHBondContact O-N 2.86Å; V82-E85 PolarHBondContact O-N 2.8Å; E85-N87 VanDerWaalsContact C-N 3.31Å
86	M	92.9	Very high	91.9	Very high	42 Å²	42	53.3 Å²	53.3	21%	0.207	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.4	175.7	-67.6	-173.4	63.9	0	0	113.8	Q52 V82 Q84 C88 E93 V94 L110	Q52-M86 HydrophobicContact CG-CG 4.18Å; Q52-M86 HydrophobicContact CG-SD 3.97Å; V82-M86 HydrophobicContact CG1-CG 4.39Å; V82-M86 HydrophobicContact CG1-SD 4.06Å; V82-M86 WeakPolarHBondContact O-CB 3.26Å; V82-M86 WeakPolarHBondContact O-CG 3.3Å; V82-M86 PolarHBondContact O-N 2.8Å; Q84-M86 VanDerWaalsContact C-N 3.3Å; Q84-M86 PolarHBondContact O-N 2.82Å; M86-C88 VanDerWaalsContact C-N 3.26Å; M86-C88 PolarHBondContact O-N 2.73Å; M86-E93 HydrophobicContact CE-CG 4.38Å; M86-E93 VanDerWaalsContact CE-OE1 3.28Å; M86-E93 WeakPolarHBondContact CE-OE1 3.33Å; M86-V94 HydrophobicContact SD-CG2 3.71Å; M86-L110 HydrophobicContact CE-CD1 4.4Å; M86-L110 HydrophobicContact SD-CD1 3.58Å; M86-L110 VanDerWaalsContact SD-CD1 3.58Å
87	N	93.4	Very high	92.4	Very high	147 Å²	147	53.8 Å²	53.8	79%	0.786	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	40	-174.5	-64.6	-60.5	0	0	0	113.7	A83 Q84 E85	A83-N87 PolarHBondContact O-N 3.09Å; Q84-N87 PolarHBondContact O-N 3.17Å; Q84-N87 VanDerWaalsContact O-N 3.12Å; E85-N87 VanDerWaalsContact C-N 3.31Å
88	C	93.4	Very high	92.7	Very high	28 Å²	28	51.2 Å²	51.2	19%	0.189	25%	0.248	C	C	.	.			trans	-115.2	157.9	177.5	75	0	0	0	0	111.9	A83 M86 E93 V94	A83-C88 PolarHBondContact O-N 2.86Å; M86-C88 VanDerWaalsContact C-N 3.26Å; M86-C88 PolarHBondContact O-N 2.73Å; C88-E93 HydrophobicContact CB-CB 4.19Å; C88-V94 VanDerWaalsContact SG-CG2 3.55Å
89	T	93.6	Very high	92.5	Very high	108 Å²	108	54.8 Å²	54.8	66%	0.663	26%	0.26	S	S	*	.			trans	-73.4	128.3	171.7	-48.1	0	0	0	0	109.8	G91 R92	T89-G91 PolarHBondContact O-N 3.45Å; T89-R92 WeakPolarHBondContact O-CB 3.36Å; T89-R92 PolarHBondContact O-N 3.19Å; T89-R92 VanDerWaalsContact O-N 3.1Å
90	L	92.8	Very high	91.9	Very high	49 Å²	49	55.7 Å²	55.7	26%	0.257	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-57.3	136.3	173.5	-174	71.8	0	0	0	110.5	A79 Q80 A83 R92 V94 Y96	A79-L90 HydrophobicContact CB-CD1 3.96Å; Q80-L90 HydrophobicContact CG-CD1 4.48Å; Q80-L90 HydrophobicContact CG-CD2 3.57Å; A83-L90 HydrophobicContact CB-CB 4.29Å; A83-L90 HydrophobicContact CB-CD1 4.09Å; L90-R92 VanDerWaalsContact C-N 3.31Å; L90-V94 CarbonylContact C-O 3.5Å; L90-Y96 HydrophobicContact CD1-CD1 4.32Å; L90-Y96 HydrophobicContact CD2-CD1 4.13Å; L90-Y96 HydrophobicContact CD2-CE1 3.87Å; L90-Y96 HydrophobicContact CG-CD1 4.49Å
91	G	92.1	Very high	91.7	Very high	12 Å²	12	54 Å²	54	12%	0.124	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	-13.1	-175.3	0	0	0	0	0	114	T89 V94 C103 T104 S105 T108	T89-G91 PolarHBondContact O-N 3.45Å; G91-V94 PolarHBondContact N-O 3.46Å; G91-C103 WeakPolarHBondContact CA-O 3.3Å; G91-T104 CarbonylContact O-C 3.35Å; G91-S105 VanDerWaalsContact O-CB 3.24Å; G91-S105 WeakPolarHBondContact O-CB 3.09Å; G91-S105 PolarHBondContact O-N 3.06Å; G91-S105 PolarHBondContact O-OG 3.13Å; G91-T108 PolarHBondContact O-OG1 3.35Å
92	R	93.3	Very high	91.8	Very high	155 Å²	155	51.8 Å²	51.8	59%	0.585	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-109.7	169.1	-160.2	-177.4	-176	-166.3	-0.8	109.5	T89 L90 V94 D107 T108	T89-R92 WeakPolarHBondContact O-CB 3.36Å; T89-R92 PolarHBondContact O-N 3.19Å; T89-R92 VanDerWaalsContact O-N 3.1Å; L90-R92 VanDerWaalsContact C-N 3.31Å; R92-V94 PolarHBondContact O-N 3.43Å; R92-D107 HydrophobicContact CG-CB 3.71Å; R92-D107 IonicContact CZ-OD2 3.72Å; R92-D107 IonicContact NE-OD2 3.76Å; R92-D107 PolarHBondContact NE-OD2 3.25Å; R92-D107 IonicContact NH2-OD2 3.57Å; R92-D107 CarbonylContact O-C 3.54Å; R92-T108 WeakPolarHBondContact O-CA 3.46Å; R92-T108 VanDerWaalsContact O-CB 3.27Å; R92-T108 WeakPolarHBondContact O-CB 3.29Å; R92-T108 PolarHBondContact O-N 2.91Å; R92-T108 PolarHBondContact O-OG1 3.12Å
93	E	95	Very high	91.7	Very high	61 Å²	61	53.5 Å²	53.5	29%	0.285	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-39.5	-176.3	-172.9	176.2	178.6	0	0	113.2	H55 M86 C88 V109 L110	H55-E93 IonicContact CE1-OE1 2.65Å; H55-E93 PolarHBondContact CE1-OE1 3.48Å; H55-E93 IonicContact ND1-OE1 3.43Å; H55-E93 IonicContact NE2-OE1 3.3Å; H55-E93 PolarHBondContact NE2-OE1 3.1Å; M86-E93 HydrophobicContact CE-CG 4.38Å; M86-E93 VanDerWaalsContact CE-OE1 3.28Å; M86-E93 WeakPolarHBondContact CE-OE1 3.33Å; C88-E93 HydrophobicContact CB-CB 4.19Å; E93-V109 PolarHBondContact O-N 3.13Å; E93-L110 PolarHBondContact O-N 3.31Å
94	V	97.6	Very high	91.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.9	172.7	-177.6	0	0	0	0	108.6	A79 V82 A83 M86 C88 L90 G91 R92 L110 Y112	A79-V94 HydrophobicContact CB-CG1 4.42Å; A79-V94 WeakPolarHBondContact O-CG1 3.29Å; V82-V94 HydrophobicContact CB-CG1 4.34Å; V82-V94 HydrophobicContact CG1-CG1 4.18Å; V82-V94 HydrophobicContact CG1-CG2 4.12Å; A83-V94 HydrophobicContact CB-CB 4.03Å; A83-V94 HydrophobicContact CB-CG1 4.24Å; M86-V94 HydrophobicContact SD-CG2 3.71Å; C88-V94 VanDerWaalsContact SG-CG2 3.55Å; L90-V94 CarbonylContact C-O 3.5Å; G91-V94 PolarHBondContact N-O 3.46Å; R92-V94 PolarHBondContact O-N 3.43Å; V94-L110 WeakPolarHBondContact CA-O 3.49Å; V94-L110 HydrophobicContact CG1-CB 4.47Å; V94-L110 HydrophobicContact CG2-CB 4.16Å; V94-L110 HydrophobicContact CG2-CD1 4.23Å; V94-Y112 HydrophobicContact CG1-CD2 4.23Å; V94-Y112 HydrophobicContact CG1-CE2 4.15Å
95	G	96.9	Very high	92	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	171.8	179.3	0	0	0	0	0	112.3	C103 L110 Y112	G95-C103 CarbonylContact C-O 3.55Å; G95-C103 WeakPolarHBondContact CA-O 3.37Å; G95-L110 PolarHBondContact N-O 3.41Å; G95-Y112 PolarHBondContact O-N 2.86Å
96	Y	95.9	Very high	92	Very high	23 Å²	23	58.2 Å²	58.2	9%	0.09	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	152.4	172.4	73.6	-97.6	0	0	0	112.9	I76 A79 L90 V98 D101 C103 T104 Y112	I76-Y96 HydrophobicContact CD1-CE2 4.25Å; I76-Y96 HydrophobicContact CG1-CD1 4.43Å; I76-Y96 HydrophobicContact CG1-CD2 3.76Å; I76-Y96 HydrophobicContact CG1-CE1 4.36Å; I76-Y96 HydrophobicContact CG1-CE2 3.71Å; I76-Y96 HydrophobicContact CG1-CG 4.15Å; I76-Y96 HydrophobicContact CG2-CD1 4.35Å; I76-Y96 HydrophobicContact CG2-CE1 3.99Å; A79-Y96 HydrophobicContact CB-CD1 4.24Å; A79-Y96 HydrophobicContact CB-CG 4.48Å; L90-Y96 HydrophobicContact CD1-CD1 4.32Å; L90-Y96 HydrophobicContact CD2-CD1 4.13Å; L90-Y96 HydrophobicContact CD2-CE1 3.87Å; L90-Y96 HydrophobicContact CG-CD1 4.49Å; Y96-V98 HydrophobicContact CD2-CG1 4.16Å; Y96-V98 HydrophobicContact CD2-CG2 4.4Å; Y96-V98 HydrophobicContact CE2-CG2 4.29Å; Y96-D101 WeakPolarHBondContact CE2-OD1 3.43Å; Y96-D101 PolarHBondContact OH-OD1 3.22Å; Y96-C103 HydrophobicContact CD1-CB 3.84Å; Y96-C103 HydrophobicContact CD2-CB 4.4Å; Y96-C103 HydrophobicContact CE1-CB 3.4Å; Y96-C103 VanDerWaalsContact CE1-CB 3.4Å; Y96-C103 HydrophobicContact CE2-CB 4Å; Y96-C103 HydrophobicContact CG-CB 4.31Å; Y96-C103 VanDerWaalsContact CZ-CB 3.48Å; Y96-C103 PolarHBondContact N-O 3.43Å; Y96-C103 CarbonylContact O-C 3.51Å; Y96-C103 PolarHBondContact O-N 2.96Å; Y96-T104 WeakPolarHBondContact O-CG2 3.07Å; Y96-Y112 CarbonylContact C-O 3.56Å; Y96-Y112 WeakPolarHBondContact CA-O 3.4Å; Y96-Y112 WeakPolarHBondContact CB-O 3.32Å
97	Q	94.5	Very high	92	Very high	36 Å²	36	60.4 Å²	60.4	17%	0.168	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	119	170.5	-169.5	-178.6	30.3	0	0	111.1	D102 T104 Y112 M113 T114 E121	Q97-D102 HydrophobicContact CG-CB 4.16Å; Q97-D102 PolarHBondContact NE2-OD2 2.87Å; Q97-T104 HydrophobicContact CB-CG2 4.46Å; Q97-Y112 PolarHBondContact N-O 3.43Å; Q97-M113 HydrophobicContact CB-CB 4.33Å; Q97-M113 WeakPolarHBondContact O-CA 3.43Å; Q97-M113 WeakPolarHBondContact O-CB 3.38Å; Q97-T114 PolarHBondContact O-N 3.33Å; Q97-E121 PolarHBondContact OE1-OE1 3.26Å
98	V	90.3	Very high	92.1	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.012	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	169.3	177.2	-54.7	0	0	0	0	109.5	R72 A75 I76 Y96 F100 D101 T114 C117	R72-V98 HydrophobicContact CB-CB 4.5Å; R72-V98 HydrophobicContact CG-CB 3.87Å; R72-V98 HydrophobicContact CG-CG1 4.08Å; R72-V98 HydrophobicContact CG-CG2 3.69Å; A75-V98 HydrophobicContact CB-CG1 3.76Å; I76-V98 HydrophobicContact CD1-CG2 4.22Å; I76-V98 HydrophobicContact CG1-CG1 4.2Å; I76-V98 HydrophobicContact CG1-CG2 4.45Å; Y96-V98 HydrophobicContact CD2-CG1 4.16Å; Y96-V98 HydrophobicContact CD2-CG2 4.4Å; Y96-V98 HydrophobicContact CE2-CG2 4.29Å; V98-F100 PolarHBondContact O-N 2.92Å; V98-D101 HydrophobicContact CG2-CB 3.63Å; V98-D101 WeakPolarHBondContact CG2-O 3.19Å; V98-D101 PolarHBondContact N-O 3.41Å; V98-D101 PolarHBondContact O-N 3.21Å; V98-D101 VanDerWaalsContact O-N 3.08Å; V98-T114 HydrophobicContact CB-CG2 4.04Å; V98-T114 HydrophobicContact CG1-CG2 3.88Å; V98-C117 VanDerWaalsContact C-SG 3.53Å
99	R	84.3	Confident	92.2	Very high	96 Å²	96	53.6 Å²	53.6	36%	0.362	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	121.2	178.8	-171.5	178.5	163.4	-169.9	-13.8	110	P457	R99-P457 HydrophobicContact CG-CB 4.21Å; R99-P457 PolarHBondContact NE-O 2.9Å; R99-P457 PolarHBondContact NH1-O 2.95Å; R99-P457 PolarHBondContact NH2-O 3.42Å
100	F	80.9	Confident	92.4	Very high	19 Å²	19	48.5 Å²	48.5	8%	0.083	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	19.7	-177.5	-43	-65.5	0	0	0	118.7	V98 P457 L458 V556 Q559 L560	V98-F100 PolarHBondContact O-N 2.92Å; F100-P457 HydrophobicContact CD1-CG 4.35Å; F100-P457 HydrophobicContact CE1-CG 3.42Å; F100-P457 VanDerWaalsContact CE1-CG 3.42Å; F100-P457 HydrophobicContact CZ-CG 3.68Å; F100-L458 HydrophobicContact CZ-CD2 4.34Å; F100-V556 HydrophobicContact CB-CG2 3.93Å; F100-V556 HydrophobicContact CD1-CB 4.45Å; F100-V556 HydrophobicContact CD1-CG1 4.1Å; F100-V556 HydrophobicContact CD1-CG2 4.25Å; F100-V556 HydrophobicContact CD2-CB 4.22Å; F100-V556 HydrophobicContact CD2-CG1 4.04Å; F100-V556 HydrophobicContact CD2-CG2 3.3Å; F100-V556 HydrophobicContact CE1-CG1 3.76Å; F100-V556 HydrophobicContact CE2-CB 4.33Å; F100-V556 HydrophobicContact CE2-CG1 3.67Å; F100-V556 HydrophobicContact CE2-CG2 3.71Å; F100-V556 HydrophobicContact CG-CB 4.27Å; F100-V556 HydrophobicContact CG-CG1 4.24Å; F100-V556 HydrophobicContact CG-CG2 3.6Å; F100-V556 HydrophobicContact CZ-CG1 3.53Å; F100-V556 HydrophobicContact CZ-CG2 4.36Å; F100-Q559 VanDerWaalsContact C-NE2 3.3Å; F100-Q559 HydrophobicContact CD1-CB 4.44Å; F100-Q559 PolarHBondContact O-NE2 3.41Å; F100-L560 HydrophobicContact CE1-CD2 4.14Å; F100-L560 HydrophobicContact CE1-CG 4.42Å
101	D	82.4	Confident	92.6	Very high	43 Å²	43	46.5 Å²	46.5	23%	0.23	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	110.6	-177	177.7	1.6	0	0	0	109	R72 Y96 V98	R72-D101 IonicContact CZ-OD2 2.66Å; R72-D101 IonicContact NH2-OD2 2.8Å; R72-D101 PolarHBondContact NH2-OD2 2.73Å; Y96-D101 WeakPolarHBondContact CE2-OD1 3.43Å; Y96-D101 PolarHBondContact OH-OD1 3.22Å; V98-D101 HydrophobicContact CG2-CB 3.63Å; V98-D101 WeakPolarHBondContact CG2-O 3.19Å; V98-D101 PolarHBondContact N-O 3.41Å; V98-D101 PolarHBondContact O-N 3.21Å; V98-D101 VanDerWaalsContact O-N 3.08Å
102	D	89.8	Confident	92.9	Very high	85 Å²	85	46 Å²	46	46%	0.455	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	115.1	-175.4	-166.2	-21.3	0	0	0	109.7	Q97 T104	Q97-D102 HydrophobicContact CG-CB 4.16Å; Q97-D102 PolarHBondContact NE2-OD2 2.87Å; D102-T104 WeakPolarHBondContact OD1-CB 3.4Å; D102-T104 WeakPolarHBondContact OD1-CG2 3.28Å; D102-T104 PolarHBondContact OD1-N 3.32Å; D102-T104 VanDerWaalsContact OD1-N 3.16Å; D102-T104 PolarHBondContact OD1-OG1 3.32Å
103	C	92.4	Very high	93.1	Very high	36 Å²	36	38.6 Å²	38.6	24%	0.243	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	67.4	175.2	-169.6	0	0	0	0	108.1	G91 G95 Y96	G91-C103 WeakPolarHBondContact CA-O 3.3Å; G95-C103 CarbonylContact C-O 3.55Å; G95-C103 WeakPolarHBondContact CA-O 3.37Å; Y96-C103 HydrophobicContact CD1-CB 3.84Å; Y96-C103 HydrophobicContact CD2-CB 4.4Å; Y96-C103 HydrophobicContact CE1-CB 3.4Å; Y96-C103 VanDerWaalsContact CE1-CB 3.4Å; Y96-C103 HydrophobicContact CE2-CB 4Å; Y96-C103 HydrophobicContact CG-CB 4.31Å; Y96-C103 VanDerWaalsContact CZ-CB 3.48Å; Y96-C103 PolarHBondContact N-O 3.43Å; Y96-C103 CarbonylContact O-C 3.51Å; Y96-C103 PolarHBondContact O-N 2.96Å
104	T	94.7	Very high	93.1	Very high	43 Å²	43	36.5 Å²	36.5	26%	0.264	19%	0.187	S	C	.	.			trans	-132.9	162	174.9	65.7	0	0	0	0	111.2	G91 Y96 Q97 D102 T108 K111	G91-T104 CarbonylContact O-C 3.35Å; Y96-T104 WeakPolarHBondContact O-CG2 3.07Å; Q97-T104 HydrophobicContact CB-CG2 4.46Å; D102-T104 WeakPolarHBondContact OD1-CB 3.4Å; D102-T104 WeakPolarHBondContact OD1-CG2 3.28Å; D102-T104 PolarHBondContact OD1-N 3.32Å; D102-T104 VanDerWaalsContact OD1-N 3.16Å; D102-T104 PolarHBondContact OD1-OG1 3.32Å; T104-T108 HydrophobicContact CG2-CG2 4.29Å; T104-K111 HydrophobicContact CG2-CD 4.23Å; T104-K111 HydrophobicContact CG2-CG 4.15Å
105	S	94.4	Very high	93	Very high	45 Å²	45	36.7 Å²	36.7	32%	0.315	19%	0.188	S	C	.	.			trans	-138.9	179.9	174.4	64.3	0	0	0	0	110.5	G91 D107 T108	G91-S105 VanDerWaalsContact O-CB 3.24Å; G91-S105 WeakPolarHBondContact O-CB 3.09Å; G91-S105 PolarHBondContact O-N 3.06Å; G91-S105 PolarHBondContact O-OG 3.13Å; S105-D107 PolarHBondContact O-N 3.39Å; S105-D107 PolarHBondContact OG-N 3.37Å; S105-T108 PolarHBondContact N-OG1 3.15Å; S105-T108 WeakPolarHBondContact O-CB 3.34Å; S105-T108 PolarHBondContact O-N 3.21Å; S105-T108 VanDerWaalsContact O-N 3.15Å; S105-T108 PolarHBondContact O-OG1 3.08Å
106	Q	90.9	Very high	92.7	Very high	192 Å²	192	37.6 Å²	37.6	90%	0.897	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-28.7	173.5	-65.7	-176.5	-4.6	0	0	112.1	T108	Q106-T108 PolarHBondContact O-N 2.96Å
107	D	93	Very high	92.6	Very high	88 Å²	88	36.6 Å²	36.6	47%	0.471	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-6.8	176.9	-71.6	-4.7	0	0	0	112.9	R92 S105 V109	R92-D107 HydrophobicContact CG-CB 3.71Å; R92-D107 IonicContact CZ-OD2 3.72Å; R92-D107 IonicContact NE-OD2 3.76Å; R92-D107 PolarHBondContact NE-OD2 3.25Å; R92-D107 IonicContact NH2-OD2 3.57Å; R92-D107 CarbonylContact O-C 3.54Å; S105-D107 PolarHBondContact O-N 3.39Å; S105-D107 PolarHBondContact OG-N 3.37Å; D107-V109 PolarHBondContact O-N 2.83Å
108	T	95.9	Very high	92.7	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	19%	0.186	C	C	.	.			trans	-71.7	119.1	-176.5	-56.7	0	0	0	0	112.4	K64 G91 R92 T104 S105 Q106 L110 K111	K64-T108 VanDerWaalsContact CD-O 3.25Å; K64-T108 WeakPolarHBondContact CD-O 3.45Å; K64-T108 WeakPolarHBondContact CE-O 3.43Å; K64-T108 WeakPolarHBondContact CG-O 3.43Å; G91-T108 PolarHBondContact O-OG1 3.35Å; R92-T108 WeakPolarHBondContact O-CA 3.46Å; R92-T108 VanDerWaalsContact O-CB 3.27Å; R92-T108 WeakPolarHBondContact O-CB 3.29Å; R92-T108 PolarHBondContact O-N 2.91Å; R92-T108 PolarHBondContact O-OG1 3.12Å; T104-T108 HydrophobicContact CG2-CG2 4.29Å; S105-T108 PolarHBondContact N-OG1 3.15Å; S105-T108 WeakPolarHBondContact O-CB 3.34Å; S105-T108 PolarHBondContact O-N 3.21Å; S105-T108 VanDerWaalsContact O-N 3.15Å; S105-T108 PolarHBondContact O-OG1 3.08Å; Q106-T108 PolarHBondContact O-N 2.96Å; T108-L110 WeakPolarHBondContact CG2-O 3.37Å; T108-K111 HydrophobicContact CG2-CB 4.24Å
109	V	95.7	Very high	92.8	Very high	31 Å²	31	35.1 Å²	35.1	19%	0.188	19%	0.187	C	C	.	.			trans	-105	-46.9	-179.5	172.5	0	0	0	0	111	Y60 K64 I65 E93 D107	Y60-V109 HydrophobicContact CD2-CG1 4.34Å; Y60-V109 HydrophobicContact CG-CG1 3.95Å; K64-V109 WeakPolarHBondContact CA-O 3.48Å; K64-V109 WeakPolarHBondContact CB-O 3.43Å; I65-V109 PolarHBondContact N-O 3.19Å; E93-V109 PolarHBondContact O-N 3.13Å; D107-V109 PolarHBondContact O-N 2.83Å
110	L	97.6	Very high	93.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	113.5	173.6	-65.5	-169.7	0	0	0	109.1	P51 Q52 H55 I65 V82 M86 E93 V94 G95 T108	P51-L110 HydrophobicContact CB-CD1 4.45Å; P51-L110 HydrophobicContact CB-CD2 4.38Å; Q52-L110 HydrophobicContact CG-CD1 4.5Å; H55-L110 HydrophobicContact CB-CD1 4.4Å; H55-L110 HydrophobicContact CB-CD2 4.14Å; I65-L110 HydrophobicContact CB-CD2 3.62Å; I65-L110 HydrophobicContact CD1-CD2 3.71Å; I65-L110 HydrophobicContact CG1-CD2 4.18Å; I65-L110 HydrophobicContact CG2-CD2 4.05Å; V82-L110 HydrophobicContact CG1-CD1 4.24Å; M86-L110 HydrophobicContact CE-CD1 4.4Å; M86-L110 HydrophobicContact SD-CD1 3.58Å; M86-L110 VanDerWaalsContact SD-CD1 3.58Å; E93-L110 PolarHBondContact O-N 3.31Å; V94-L110 WeakPolarHBondContact CA-O 3.49Å; V94-L110 HydrophobicContact CG1-CB 4.47Å; V94-L110 HydrophobicContact CG2-CB 4.16Å; V94-L110 HydrophobicContact CG2-CD1 4.23Å; G95-L110 PolarHBondContact N-O 3.41Å; T108-L110 WeakPolarHBondContact CG2-O 3.37Å
111	K	97.9	Very high	93.6	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.035	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	111.5	-177.4	-176.4	175	171.1	-171.7	0	110.7	I65 G66 V67 T104 T108 M113 E121 Y131	I65-K111 PolarHBondContact O-N 3.33Å; G66-K111 CarbonylContact C-O 3.6Å; G66-K111 WeakPolarHBondContact CA-O 3.4Å; V67-K111 PolarHBondContact N-O 3.23Å; T104-K111 HydrophobicContact CG2-CD 4.23Å; T104-K111 HydrophobicContact CG2-CG 4.15Å; T108-K111 HydrophobicContact CG2-CB 4.24Å; K111-M113 HydrophobicContact CD-CE 4.42Å; K111-M113 HydrophobicContact CG-CE 4.39Å; K111-E121 IonicContact NZ-OE1 3.17Å; K111-E121 PolarHBondContact NZ-OE1 3.42Å; K111-E121 IonicContact NZ-OE2 3.39Å; K111-Y131 WeakPolarHBondContact CD-OH 3.33Å; K111-Y131 PolarHBondContact NZ-OH 3.47Å
112	Y	97.8	Very high	94.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132.3	171	-70.8	-90.8	0	0	0	110	T47 P51 V67 V78 A79 V82 V94 G95 Y96 Q97	T47-Y112 PolarHBondContact O-OH 3.38Å; P51-Y112 WeakPolarHBondContact CG-OH 3.5Å; V67-Y112 HydrophobicContact CB-CD1 3.68Å; V67-Y112 HydrophobicContact CB-CE1 3.73Å; V67-Y112 HydrophobicContact CB-CG 4.38Å; V67-Y112 HydrophobicContact CG1-CD1 3.93Å; V67-Y112 HydrophobicContact CG1-CE1 3.76Å; V67-Y112 HydrophobicContact CG2-CD1 4.26Å; V67-Y112 HydrophobicContact CG2-CE1 3.9Å; V67-Y112 CarbonylContact O-C 3.59Å; V67-Y112 WeakPolarHBondContact O-CA 3.22Å; V78-Y112 HydrophobicContact CB-CD1 4.35Å; V78-Y112 HydrophobicContact CB-CE1 4.37Å; V78-Y112 HydrophobicContact CG1-CD1 3.68Å; V78-Y112 HydrophobicContact CG1-CE1 3.27Å; V78-Y112 HydrophobicContact CG1-CG 4.47Å; A79-Y112 HydrophobicContact CB-CD2 3.76Å; A79-Y112 HydrophobicContact CB-CG 4.04Å; V82-Y112 HydrophobicContact CB-CE2 4.18Å; V82-Y112 HydrophobicContact CG1-CE2 4.2Å; V82-Y112 HydrophobicContact CG2-CE2 4.3Å; V82-Y112 WeakPolarHBondContact CG2-OH 3.39Å; V94-Y112 HydrophobicContact CG1-CD2 4.23Å; V94-Y112 HydrophobicContact CG1-CE2 4.15Å; G95-Y112 PolarHBondContact O-N 2.86Å; Y96-Y112 CarbonylContact C-O 3.56Å; Y96-Y112 WeakPolarHBondContact CA-O 3.4Å; Y96-Y112 WeakPolarHBondContact CB-O 3.32Å; Q97-Y112 PolarHBondContact N-O 3.43Å
113	M	97	Very high	94.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	164.6	-177.4	64.7	-170.1	121.5	0	0	112.6	V67 T68 Q69 Q97 K111 C117 L118 Y131	V67-M113 PolarHBondContact O-N 2.82Å; T68-M113 CarbonylContact C-O 3.58Å; T68-M113 WeakPolarHBondContact CA-O 3.42Å; T68-M113 HydrophobicContact CG2-CG 4.26Å; Q69-M113 PolarHBondContact N-O 3.09Å; Q97-M113 HydrophobicContact CB-CB 4.33Å; Q97-M113 WeakPolarHBondContact O-CA 3.43Å; Q97-M113 WeakPolarHBondContact O-CB 3.38Å; K111-M113 HydrophobicContact CD-CE 4.42Å; K111-M113 HydrophobicContact CG-CE 4.39Å; M113-C117 HydrophobicContact CB-CB 4.15Å; M113-L118 HydrophobicContact CE-CD1 4.08Å; M113-L118 HydrophobicContact CG-CB 4.4Å; M113-L118 HydrophobicContact SD-CB 3.79Å; M113-L118 HydrophobicContact SD-CD1 4.13Å; M113-Y131 HydrophobicContact CE-CE1 3.77Å; M113-Y131 WeakPolarHBondContact CE-OH 3.34Å
114	T	95.1	Very high	94	Very high	17 Å²	17	33.4 Å²	33.4	10%	0.104	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	151.9	168.2	53.4	0	0	0	0	111.1	Q69 R72 Q97 V98 G116 C117 L118	Q69-T114 VanDerWaalsContact O-CA 3.28Å; Q69-T114 WeakPolarHBondContact O-CA 3.44Å; R72-T114 HydrophobicContact CB-CG2 4.36Å; Q97-T114 PolarHBondContact O-N 3.33Å; V98-T114 HydrophobicContact CB-CG2 4.04Å; V98-T114 HydrophobicContact CG1-CG2 3.88Å; T114-G116 VanDerWaalsContact C-N 3.25Å; T114-G116 PolarHBondContact O-N 3.24Å; T114-C117 WeakPolarHBondContact O-CA 3.32Å; T114-C117 WeakPolarHBondContact O-CB 3.12Å; T114-C117 PolarHBondContact O-N 3.38Å; T114-C117 PolarHBondContact OG1-SG 3.49Å; T114-L118 PolarHBondContact O-N 2.92Å
115	D	94.6	Very high	93.8	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-48.5	-46.8	175.2	-55	-25.6	0	0	0	112.3	T68 Q69 P70 C117 L118 L119 S143 N145 T146 L149	T68-D115 WeakPolarHBondContact CB-OD1 3.48Å; T68-D115 PolarHBondContact OG1-OD1 3.29Å; Q69-D115 PolarHBondContact O-N 3.33Å; P70-D115 WeakPolarHBondContact CA-OD2 3.43Å; D115-C117 PolarHBondContact O-N 2.71Å; D115-L118 PolarHBondContact O-N 3.08Å; D115-L118 VanDerWaalsContact O-N 3.17Å; D115-L119 PolarHBondContact O-N 2.86Å; D115-S143 PolarHBondContact OD2-OG 2.88Å; D115-N145 HydrophobicContact CB-CB 3.6Å; D115-T146 PolarHBondContact OD1-OG1 3.12Å; D115-T146 PolarHBondContact OD2-OG1 2.89Å; D115-L149 HydrophobicContact CB-CD1 3.87Å; D115-L149 WeakPolarHBondContact O-CD1 3.47Å
116	G	92.3	Very high	93.5	Very high	19 Å²	19	34.2 Å²	34.2	20%	0.196	19%	0.193	C	C	.	.	H	α-helix	trans	-66.4	-17.2	178	0	0	0	0	0	115	T114 R120	T114-G116 VanDerWaalsContact C-N 3.25Å; T114-G116 PolarHBondContact O-N 3.24Å; G116-R120 WeakPolarHBondContact O-CG 3.42Å; G116-R120 PolarHBondContact O-N 2.99Å; G116-R120 PolarHBondContact O-NE 3.38Å
117	C	93.5	Very high	93.4	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.02	16%	0.155	C	C	.	.	H	α-helix	trans	-78.3	-45.6	171	-69.6	0	0	0	0	110.4	V98 M113 T114 D115 L119 R120 E121	V98-C117 VanDerWaalsContact C-SG 3.53Å; M113-C117 HydrophobicContact CB-CB 4.15Å; T114-C117 WeakPolarHBondContact O-CA 3.32Å; T114-C117 WeakPolarHBondContact O-CB 3.12Å; T114-C117 PolarHBondContact O-N 3.38Å; T114-C117 PolarHBondContact OG1-SG 3.49Å; D115-C117 PolarHBondContact O-N 2.71Å; C117-L119 VanDerWaalsContact C-N 3.28Å; C117-L119 PolarHBondContact O-N 2.74Å; C117-R120 PolarHBondContact O-N 3.01Å; C117-R120 VanDerWaalsContact O-N 3.15Å; C117-R120 PolarHBondContact SG-NH2 2.81Å; C117-E121 PolarHBondContact O-N 3.39Å
118	L	95.4	Very high	93.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.1	-41.1	174.1	-176.9	62.4	0	0	0	111.2	T68 M113 T114 D115 R120 E121 V122 L128 Y131 V134 L136 L149	T68-L118 HydrophobicContact CG2-CB 3.91Å; T68-L118 HydrophobicContact CG2-CD2 3.44Å; T68-L118 VanDerWaalsContact CG2-CD2 3.44Å; T68-L118 HydrophobicContact CG2-CG 4.3Å; M113-L118 HydrophobicContact CE-CD1 4.08Å; M113-L118 HydrophobicContact CG-CB 4.4Å; M113-L118 HydrophobicContact SD-CB 3.79Å; M113-L118 HydrophobicContact SD-CD1 4.13Å; T114-L118 PolarHBondContact O-N 2.92Å; D115-L118 PolarHBondContact O-N 3.08Å; D115-L118 VanDerWaalsContact O-N 3.17Å; L118-R120 VanDerWaalsContact C-N 3.28Å; L118-R120 PolarHBondContact O-N 3.37Å; L118-E121 CarbonylContact O-C 3.51Å; L118-E121 WeakPolarHBondContact O-CA 3.32Å; L118-E121 WeakPolarHBondContact O-CB 3.31Å; L118-E121 PolarHBondContact O-N 2.91Å; L118-V122 WeakPolarHBondContact O-CG2 3.46Å; L118-V122 PolarHBondContact O-N 3.15Å; L118-L128 HydrophobicContact CD1-CD1 4.39Å; L118-L128 HydrophobicContact CD1-CD2 3.98Å; L118-Y131 HydrophobicContact CD1-CE2 4.15Å; L118-V134 HydrophobicContact CD2-CG1 3.59Å; L118-L136 HydrophobicContact CD2-CD2 4.21Å; L118-L149 HydrophobicContact CB-CD1 4.3Å; L118-L149 HydrophobicContact CB-CD2 4.45Å; L118-L149 HydrophobicContact CD2-CD1 4.15Å; L118-L149 HydrophobicContact CD2-CD2 4.13Å; L118-L149 HydrophobicContact CG-CD2 4.09Å
119	L	92.9	Very high	93.1	Very high	7 Å²	7	24.7 Å²	24.7	4%	0.037	16%	0.155	C	C	.	.	H	α-helix	trans	-60	-37.5	177.5	-173.5	60.2	0	0	0	112.6	D115 C117 V122 L123 I148 L149 L152 T404	D115-L119 PolarHBondContact O-N 2.86Å; C117-L119 VanDerWaalsContact C-N 3.28Å; C117-L119 PolarHBondContact O-N 2.74Å; L119-V122 PolarHBondContact O-N 2.76Å; L119-L123 PolarHBondContact O-N 3.19Å; L119-L123 VanDerWaalsContact O-N 3.12Å; L119-I148 HydrophobicContact CD1-CG2 4.03Å; L119-I148 HydrophobicContact CD2-CG2 4.37Å; L119-L149 HydrophobicContact CB-CD2 4.11Å; L119-L149 HydrophobicContact CB-CG 4.45Å; L119-L149 HydrophobicContact CD1-CD2 4.05Å; L119-L152 HydrophobicContact CD1-CD1 3.38Å; L119-T404 HydrophobicContact CD1-CG2 3.9Å; L119-T404 HydrophobicContact CD2-CG2 3.98Å; L119-T404 HydrophobicContact CG-CG2 3.79Å
120	R	90.2	Very high	92.9	Very high	81 Å²	81	26.3 Å²	26.3	31%	0.306	16%	0.16	S	C	.	.	H	α-helix	trans	-69.2	-33.4	172.9	-74.2	-174.1	-65.1	151.8	4	112.9	G116 C117 L118 L123 A124	G116-R120 WeakPolarHBondContact O-CG 3.42Å; G116-R120 PolarHBondContact O-N 2.99Å; G116-R120 PolarHBondContact O-NE 3.38Å; C117-R120 PolarHBondContact O-N 3.01Å; C117-R120 VanDerWaalsContact O-N 3.15Å; C117-R120 PolarHBondContact SG-NH2 2.81Å; L118-R120 VanDerWaalsContact C-N 3.28Å; L118-R120 PolarHBondContact O-N 3.37Å; R120-L123 WeakPolarHBondContact O-CB 3.41Å; R120-L123 PolarHBondContact O-N 3.28Å; R120-A124 PolarHBondContact O-N 2.87Å
121	E	93	Very high	92.8	Very high	21 Å²	21	26.3 Å²	26.3	10%	0.098	16%	0.16	C	C	.	.	H	α-helix	trans	-69.7	-35	173.2	-69.2	-179.8	-138.6	0	0	112.1	Q97 K111 C117 L118 L123 A124 D125 Q130 Y131	Q97-E121 PolarHBondContact OE1-OE1 3.26Å; K111-E121 IonicContact NZ-OE1 3.17Å; K111-E121 PolarHBondContact NZ-OE1 3.42Å; K111-E121 IonicContact NZ-OE2 3.39Å; C117-E121 PolarHBondContact O-N 3.39Å; L118-E121 CarbonylContact O-C 3.51Å; L118-E121 WeakPolarHBondContact O-CA 3.32Å; L118-E121 WeakPolarHBondContact O-CB 3.31Å; L118-E121 PolarHBondContact O-N 2.91Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.46Å; E121-A124 PolarHBondContact O-N 2.84Å; E121-D125 PolarHBondContact O-N 2.8Å; E121-Q130 PolarHBondContact OE2-NE2 2.83Å; E121-Y131 VanDerWaalsContact CD-OH 3.31Å; E121-Y131 PolarHBondContact OE1-OH 3.17Å; E121-Y131 WeakPolarHBondContact OE2-CE2 3.48Å; E121-Y131 VanDerWaalsContact OE2-CZ 3.25Å; E121-Y131 PolarHBondContact OE2-OH 2.93Å
122	V	92.7	Very high	92.6	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.03	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-35.7	171.2	178.1	0	0	0	0	111.1	L118 L119 D125 P126 L128 L149 L152 L408	L118-V122 WeakPolarHBondContact O-CG2 3.46Å; L118-V122 PolarHBondContact O-N 3.15Å; L119-V122 PolarHBondContact O-N 2.76Å; V122-D125 CarbonylContact O-C 3.32Å; V122-D125 VanDerWaalsContact O-C 3.32Å; V122-P126 VanDerWaalsContact O-CA 3.3Å; V122-P126 WeakPolarHBondContact O-CA 3.48Å; V122-P126 WeakPolarHBondContact O-CD 3.42Å; V122-P126 WeakPolarHBondContact O-CG 3.44Å; V122-P126 VanDerWaalsContact O-N 3.11Å; V122-L128 HydrophobicContact CG2-CD1 4.05Å; V122-L128 HydrophobicContact CG2-CD2 3.68Å; V122-L128 HydrophobicContact CG2-CG 4.05Å; V122-L149 HydrophobicContact CG2-CD2 4.32Å; V122-L152 HydrophobicContact CG1-CD1 4.37Å; V122-L408 HydrophobicContact CG1-CD1 4.15Å; V122-L408 HydrophobicContact CG1-CD2 3.97Å; V122-L408 WeakPolarHBondContact O-CD2 3.41Å
123	L	89.4	Confident	92.6	Very high	44 Å²	44	25.9 Å²	25.9	23%	0.23	16%	0.158	C	C	.	.	H	α-helix	trans	-61.3	-42.4	173.1	-76.9	167.9	0	0	0	112.6	L119 R120 E121 T404 C407 L408 V454	L119-L123 PolarHBondContact O-N 3.19Å; L119-L123 VanDerWaalsContact O-N 3.12Å; R120-L123 WeakPolarHBondContact O-CB 3.41Å; R120-L123 PolarHBondContact O-N 3.28Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.46Å; L123-T404 HydrophobicContact CD1-CG2 3.94Å; L123-T404 HydrophobicContact CD2-CG2 3.97Å; L123-T404 HydrophobicContact CG-CG2 3.98Å; L123-C407 HydrophobicContact CD2-CB 3.83Å; L123-L408 HydrophobicContact CB-CD2 4.47Å; L123-L408 HydrophobicContact CD2-CD1 4.34Å; L123-L408 HydrophobicContact CD2-CD2 3.77Å; L123-L408 HydrophobicContact CD2-CG 3.61Å; L123-L408 HydrophobicContact CG-CD2 4.24Å; L123-L408 HydrophobicContact CG-CG 4.35Å; L123-V454 HydrophobicContact CD1-CG2 3.66Å; L123-V454 HydrophobicContact CD2-CG2 4.26Å
124	A	89.4	Confident	92.6	Very high	91 Å²	91	25.9 Å²	25.9	75%	0.752	16%	0.158	S	C	*	.	H	α-helix	trans	-78	-36.8	179.9	0	0	0	0	0	112.8	R120 E121	R120-A124 PolarHBondContact O-N 2.87Å; E121-A124 PolarHBondContact O-N 2.84Å
125	D	91.1	Very high	92.7	Very high	38 Å²	38	25.1 Å²	25.1	20%	0.203	15%	0.153	C	C	.	.			trans	-141.1	90.4	-178.7	176.8	11.5	0	0	0	110.5	E121 V122 A127 L128 S129	E121-D125 PolarHBondContact O-N 2.8Å; V122-D125 CarbonylContact O-C 3.32Å; V122-D125 VanDerWaalsContact O-C 3.32Å; D125-A127 PolarHBondContact O-N 3.04Å; D125-A127 VanDerWaalsContact O-N 3.15Å; D125-A127 PolarHBondContact OD1-N 2.81Å; D125-A127 VanDerWaalsContact OD1-N 3.13Å; D125-L128 PolarHBondContact O-N 2.83Å; D125-L128 PolarHBondContact OD1-N 3.32Å; D125-S129 VanDerWaalsContact OD2-CB 3.29Å; D125-S129 WeakPolarHBondContact OD2-CB 3.49Å; D125-S129 PolarHBondContact OD2-N 3.18Å; D125-S129 PolarHBondContact OD2-OG 3.18Å
126	P	88.6	Confident	92.8	Very high	68 Å²	68	24.9 Å²	24.9	44%	0.442	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.8	179.8	-26.3	35	0	0	0	114.3	V122 L128 L408	V122-P126 VanDerWaalsContact O-CA 3.3Å; V122-P126 WeakPolarHBondContact O-CA 3.48Å; V122-P126 WeakPolarHBondContact O-CD 3.42Å; V122-P126 WeakPolarHBondContact O-CG 3.44Å; V122-P126 VanDerWaalsContact O-N 3.11Å; P126-L128 VanDerWaalsContact C-N 3.29Å; P126-L408 HydrophobicContact CG-CD2 4.49Å
127	A	87.8	Confident	92.9	Very high	13 Å²	13	24 Å²	24	11%	0.107	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-7.9	178.1	0	0	0	0	0	112.5	D125 S129 K165 R167	D125-A127 PolarHBondContact O-N 3.04Å; D125-A127 VanDerWaalsContact O-N 3.15Å; D125-A127 PolarHBondContact OD1-N 2.81Å; D125-A127 VanDerWaalsContact OD1-N 3.13Å; A127-S129 PolarHBondContact O-N 3.08Å; A127-K165 HydrophobicContact CB-CD 4.37Å; A127-R167 PolarHBondContact O-NH2 3.44Å
128	L	92.9	Very high	92.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.144	C	C	.	.			trans	49.7	38.5	-175.4	-69.6	179	0	0	0	112.6	L118 V122 D125 P126 Q130 Y131 V134 L153 F157 R167 L171	L118-L128 HydrophobicContact CD1-CD1 4.39Å; L118-L128 HydrophobicContact CD1-CD2 3.98Å; V122-L128 HydrophobicContact CG2-CD1 4.05Å; V122-L128 HydrophobicContact CG2-CD2 3.68Å; V122-L128 HydrophobicContact CG2-CG 4.05Å; D125-L128 PolarHBondContact O-N 2.83Å; D125-L128 PolarHBondContact OD1-N 3.32Å; P126-L128 VanDerWaalsContact C-N 3.29Å; L128-Q130 PolarHBondContact O-N 3.13Å; L128-Y131 HydrophobicContact CB-CD2 4.16Å; L128-Y131 HydrophobicContact CD2-CD2 4.12Å; L128-Y131 HydrophobicContact CD2-CE2 4.31Å; L128-Y131 PolarHBondContact O-N 3.37Å; L128-V134 HydrophobicContact CD1-CG2 4.09Å; L128-L153 HydrophobicContact CD1-CD2 3.83Å; L128-F157 HydrophobicContact CB-CZ 4.23Å; L128-F157 HydrophobicContact CD1-CE2 4.01Å; L128-F157 HydrophobicContact CD1-CZ 4.23Å; L128-F157 HydrophobicContact CG-CZ 4.42Å; L128-R167 PolarHBondContact O-NH2 3.4Å; L128-L171 HydrophobicContact CD1-CD2 4.43Å
129	S	90.2	Very high	92.5	Very high	68 Å²	68	24.4 Å²	24.4	48%	0.476	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-29.3	-169.6	64.6	0	0	0	0	114.2	D125 A127 Y131	D125-S129 VanDerWaalsContact OD2-CB 3.29Å; D125-S129 WeakPolarHBondContact OD2-CB 3.49Å; D125-S129 PolarHBondContact OD2-N 3.18Å; D125-S129 PolarHBondContact OD2-OG 3.18Å; A127-S129 PolarHBondContact O-N 3.08Å; S129-Y131 VanDerWaalsContact C-N 3.28Å; S129-Y131 PolarHBondContact O-N 2.85Å
130	Q	92	Very high	92.2	Very high	65 Å²	65	25.1 Å²	25.1	30%	0.304	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-12.9	177	70.6	178.8	-59.3	0	0	114.6	G63 K64 E121 L128	G63-Q130 CarbonylContact C-O 3.56Å; G63-Q130 WeakPolarHBondContact CA-O 3.32Å; K64-Q130 PolarHBondContact N-O 3.12Å; E121-Q130 PolarHBondContact OE2-NE2 2.83Å; L128-Q130 PolarHBondContact O-N 3.13Å
131	Y	95	Very high	91.8	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.4	-176.7	-63.4	-76.5	0	0	0	111.8	K64 K111 M113 L118 E121 L128 S129 V134 R167 L171	K64-Y131 HydrophobicContact CB-CD1 3.81Å; K64-Y131 HydrophobicContact CB-CE1 3.99Å; K64-Y131 CarbonylContact O-C 3.57Å; K64-Y131 VanDerWaalsContact O-CA 3.29Å; K64-Y131 WeakPolarHBondContact O-CA 3.29Å; K111-Y131 WeakPolarHBondContact CD-OH 3.33Å; K111-Y131 PolarHBondContact NZ-OH 3.47Å; M113-Y131 HydrophobicContact CE-CE1 3.77Å; M113-Y131 WeakPolarHBondContact CE-OH 3.34Å; L118-Y131 HydrophobicContact CD1-CE2 4.15Å; E121-Y131 VanDerWaalsContact CD-OH 3.31Å; E121-Y131 PolarHBondContact OE1-OH 3.17Å; E121-Y131 WeakPolarHBondContact OE2-CE2 3.48Å; E121-Y131 VanDerWaalsContact OE2-CZ 3.25Å; E121-Y131 PolarHBondContact OE2-OH 2.93Å; L128-Y131 HydrophobicContact CB-CD2 4.16Å; L128-Y131 HydrophobicContact CD2-CD2 4.12Å; L128-Y131 HydrophobicContact CD2-CE2 4.31Å; L128-Y131 PolarHBondContact O-N 3.37Å; S129-Y131 VanDerWaalsContact C-N 3.28Å; S129-Y131 PolarHBondContact O-N 2.85Å; Y131-V134 HydrophobicContact CG-CG2 4.39Å; Y131-R167 PolarHBondContact O-NE 3.02Å; Y131-R167 PolarHBondContact O-NH2 2.77Å; Y131-R167 VanDerWaalsContact O-NH2 3.15Å; Y131-L171 WeakPolarHBondContact O-CD1 3.26Å
132	S	94.8	Very high	91.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-27.3	168.2	64.3	0	0	0	0	112.3	F59 G63 K64 K172	F59-S132 WeakPolarHBondContact O-CB 3.4Å; F59-S132 PolarHBondContact O-OG 3.22Å; G63-S132 PolarHBondContact O-OG 2.84Å; G63-S132 VanDerWaalsContact O-OG 3.08Å; K64-S132 PolarHBondContact O-N 3.42Å; S132-K172 PolarHBondContact O-N 3.17Å
133	V	96.5	Very high	91.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	133.6	176.2	-173.7	0	0	0	0	109.5	L54 F59 I65 G66 I135 K172 V174	L54-V133 HydrophobicContact CD1-CG1 3.86Å; L54-V133 HydrophobicContact CD1-CG2 4.46Å; F59-V133 HydrophobicContact CB-CG2 3.88Å; F59-V133 HydrophobicContact CD1-CG2 3.51Å; F59-V133 HydrophobicContact CE1-CG2 4.29Å; F59-V133 HydrophobicContact CG-CG2 3.93Å; I65-V133 WeakPolarHBondContact CA-O 3.41Å; I65-V133 HydrophobicContact CG1-CB 4.21Å; I65-V133 HydrophobicContact CG1-CG2 4.31Å; I65-V133 HydrophobicContact CG2-CB 4.2Å; I65-V133 HydrophobicContact CG2-CG1 4.48Å; G66-V133 PolarHBondContact N-O 2.91Å; V133-I135 HydrophobicContact CG1-CG1 3.95Å; V133-K172 CarbonylContact C-O 3.34Å; V133-K172 WeakPolarHBondContact CA-O 3.02Å; V133-K172 HydrophobicContact CB-CB 4.39Å; V133-K172 HydrophobicContact CG1-CB 4.12Å; V133-K172 HydrophobicContact CG2-CB 4.07Å; V133-K172 HydrophobicContact CG2-CG 4.42Å; V133-V174 HydrophobicContact CG1-CG2 4.39Å
134	V	97.3	Very high	91.5	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.7	167.9	175.8	0	0	0	0	108.3	G66 L118 L128 Y131 L136 L153 L171 K172 V173 V174	G66-V134 CarbonylContact O-C 3.55Å; G66-V134 WeakPolarHBondContact O-CA 3.27Å; L118-V134 HydrophobicContact CD2-CG1 3.59Å; L128-V134 HydrophobicContact CD1-CG2 4.09Å; Y131-V134 HydrophobicContact CG-CG2 4.39Å; V134-L136 HydrophobicContact CG1-CD2 4.13Å; V134-L153 HydrophobicContact CG1-CD1 4.19Å; V134-L171 HydrophobicContact CG2-CD1 4.42Å; V134-L171 HydrophobicContact CG2-CD2 4.27Å; V134-K172 PolarHBondContact N-O 2.77Å; V134-V173 CarbonylContact O-C 3.59Å; V134-V173 VanDerWaalsContact O-CA 3.31Å; V134-V173 WeakPolarHBondContact O-CA 3.15Å; V134-V174 PolarHBondContact O-N 3.24Å
135	I	97.8	Very high	91.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.8	175.5	-55.3	-176.1	0	0	0	107.4	L50 P51 L54 I65 G66 V67 T68 V133 V174 M176	L50-I135 HydrophobicContact CG-CD1 4.43Å; P51-I135 HydrophobicContact CB-CD1 4.5Å; P51-I135 HydrophobicContact CG-CD1 3.98Å; L54-I135 HydrophobicContact CD1-CD1 4.06Å; I65-I135 HydrophobicContact CG2-CD1 4.27Å; G66-I135 PolarHBondContact O-N 3.32Å; V67-I135 CarbonylContact C-O 3.6Å; V67-I135 WeakPolarHBondContact CA-O 3.49Å; V67-I135 HydrophobicContact CB-CB 4.44Å; V67-I135 HydrophobicContact CG1-CB 4.14Å; V67-I135 HydrophobicContact CG1-CG2 4.14Å; V67-I135 HydrophobicContact CG2-CB 4.33Å; V67-I135 HydrophobicContact CG2-CD1 4.2Å; T68-I135 PolarHBondContact N-O 2.97Å; V133-I135 HydrophobicContact CG1-CG1 3.95Å; I135-V174 CarbonylContact C-O 3.41Å; I135-V174 VanDerWaalsContact CA-O 3.28Å; I135-V174 WeakPolarHBondContact CA-O 3.42Å; I135-V174 HydrophobicContact CG1-CB 4.14Å; I135-V174 HydrophobicContact CG2-CB 4.43Å; I135-M176 HydrophobicContact CD1-CE 4.14Å; I135-M176 HydrophobicContact CG2-CE 3.44Å; I135-M176 VanDerWaalsContact CG2-CE 3.44Å; I135-M176 HydrophobicContact CG2-CG 4.01Å; I135-M176 HydrophobicContact CG2-SD 3.73Å
136	L	96.4	Very high	91.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	105.8	169.3	-58.8	-178.6	0	0	0	108	T68 L118 V134 V139 L149 L150 L153 V174 M176	T68-L136 HydrophobicContact CG2-CD2 3.77Å; T68-L136 WeakPolarHBondContact OG1-CA 3.07Å; T68-L136 WeakPolarHBondContact OG1-CD2 3.33Å; L118-L136 HydrophobicContact CD2-CD2 4.21Å; V134-L136 HydrophobicContact CG1-CD2 4.13Å; L136-V139 HydrophobicContact CB-CG2 3.78Å; L136-V139 WeakPolarHBondContact O-CG2 3.35Å; L136-L149 HydrophobicContact CD2-CD1 4.18Å; L136-L150 HydrophobicContact CD1-CD2 3.44Å; L136-L150 VanDerWaalsContact CD1-CD2 3.44Å; L136-L150 HydrophobicContact CD1-CG 4.07Å; L136-L153 HydrophobicContact CD1-CD1 3.75Å; L136-L153 HydrophobicContact CD2-CD1 4.3Å; L136-L153 HydrophobicContact CG-CD1 4.16Å; L136-V174 PolarHBondContact N-O 3.34Å; L136-M176 PolarHBondContact O-N 3.45Å
137	D	94.1	Very high	92.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.086	C	C	.	.			trans	-98.7	157	-177.9	-162.2	14.1	0	0	0	112.6	T47 V67 T68 Q69 V139 M176	T47-D137 WeakPolarHBondContact CB-OD2 3.3Å; T47-D137 WeakPolarHBondContact CG2-OD2 3.4Å; T47-D137 PolarHBondContact OG1-OD2 3.13Å; V67-D137 HydrophobicContact CG1-CB 4.42Å; T68-D137 VanDerWaalsContact O-CB 3.26Å; T68-D137 WeakPolarHBondContact O-CB 3.4Å; T68-D137 PolarHBondContact O-N 3.5Å; Q69-D137 PolarHBondContact NE2-OD2 3.27Å; D137-V139 PolarHBondContact O-N 3.38Å; D137-M176 HydrophobicContact CB-CB 4.46Å; D137-M176 HydrophobicContact CB-SD 4.19Å; D137-M176 VanDerWaalsContact OD1-CB 3.23Å; D137-M176 WeakPolarHBondContact OD1-CB 3.49Å
138	E	89.6	Confident	92.4	Very high	10 Å²	10	15 Å²	15	5%	0.047	8%	0.081	C	C	.	.			trans	53.5	35.7	179.7	-57.9	-75	127.1	0	0	113.3	P70 H140 E141 M176	P70-E138 HydrophobicContact CG-CB 3.87Å; E138-H140 VanDerWaalsContact CD-CE1 3.43Å; E138-H140 PolarHBondContact O-N 2.82Å; E138-H140 IonicContact OE1-CE1 2.72Å; E138-H140 IonicContact OE2-CE1 2.6Å; E138-H140 PolarHBondContact OE2-CE1 3.15Å; E138-H140 IonicContact OE2-NE2 3.86Å; E138-H140 PolarHBondContact OE2-NE2 3.13Å; E138-E141 HydrophobicContact CB-CG 4.36Å; E138-E141 WeakPolarHBondContact O-CB 3.36Å; E138-E141 PolarHBondContact O-N 3.25Å; E138-M176 PolarHBondContact N-O 2.82Å
139	V	90.8	Very high	92.5	Very high	2 Å²	2	15 Å²	15	1%	0.012	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-60.4	-20.2	-176.9	171.3	0	0	0	0	113.3	L136 D137 E141 R142 T146 L150 V175 M176 L185	L136-V139 HydrophobicContact CB-CG2 3.78Å; L136-V139 WeakPolarHBondContact O-CG2 3.35Å; D137-V139 PolarHBondContact O-N 3.38Å; V139-E141 PolarHBondContact O-N 2.87Å; V139-R142 WeakPolarHBondContact O-CD 3.39Å; V139-R142 PolarHBondContact O-N 3.38Å; V139-T146 HydrophobicContact CB-CG2 4.2Å; V139-T146 HydrophobicContact CG1-CG2 3.88Å; V139-T146 HydrophobicContact CG2-CG2 3.86Å; V139-L150 HydrophobicContact CG1-CD1 3.88Å; V139-V175 HydrophobicContact CB-CG1 4.16Å; V139-V175 HydrophobicContact CG1-CG1 4.25Å; V139-V175 HydrophobicContact CG2-CG1 3.87Å; V139-M176 PolarHBondContact N-O 3.07Å; V139-L185 HydrophobicContact CG1-CD2 4.27Å
140	H	86.3	Confident	92.7	Very high	21 Å²	21	11.7 Å²	11.7	10%	0.097	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-66.3	-12.5	171.8	63	-82.4	0	0	0	114.5	E138 R142 A178 T179 Q359	E138-H140 VanDerWaalsContact CD-CE1 3.43Å; E138-H140 PolarHBondContact O-N 2.82Å; E138-H140 IonicContact OE1-CE1 2.72Å; E138-H140 IonicContact OE2-CE1 2.6Å; E138-H140 PolarHBondContact OE2-CE1 3.15Å; E138-H140 IonicContact OE2-NE2 3.86Å; E138-H140 PolarHBondContact OE2-NE2 3.13Å; H140-R142 PolarHBondContact O-N 3.05Å; H140-A178 PolarHBondContact ND1-N 2.95Å; H140-T179 HydrophobicContact CB-CG2 3.77Å; H140-T179 WeakPolarHBondContact CB-OG1 3.43Å; H140-Q359 PolarHBondContact CD2-NE2 3.46Å
141	E	82.6	Confident	92.8	Very high	36 Å²	36	8.6 Å²	8.6	17%	0.168	4%	0.044	C	C	.	.	G	3₁₀ helix	trans	-70.8	-13.3	168.6	-67.9	-157.4	-164.3	0	0	112.3	P70 R71 E138 V139 S143 T317 S318	P70-E141 HydrophobicContact CB-CB 4.36Å; P70-E141 HydrophobicContact CG-CB 4.07Å; P70-E141 HydrophobicContact CG-CG 4.04Å; R71-E141 IonicContact CZ-OE1 2.8Å; R71-E141 IonicContact CZ-OE2 2.89Å; R71-E141 VanDerWaalsContact CZ-OE2 3.26Å; R71-E141 IonicContact NE-OE1 3.94Å; R71-E141 PolarHBondContact NE-OE1 3.24Å; R71-E141 IonicContact NE-OE2 2.65Å; R71-E141 PolarHBondContact NE-OE2 3.17Å; R71-E141 IonicContact NH2-OE1 3.46Å; R71-E141 IonicContact NH2-OE2 3.16Å; R71-E141 PolarHBondContact NH2-OE2 3.28Å; E138-E141 HydrophobicContact CB-CG 4.36Å; E138-E141 WeakPolarHBondContact O-CB 3.36Å; E138-E141 PolarHBondContact O-N 3.25Å; V139-E141 PolarHBondContact O-N 2.87Å; E141-S143 VanDerWaalsContact C-N 3.27Å; E141-S143 PolarHBondContact O-N 3.37Å; E141-T317 HydrophobicContact CG-CG2 4.35Å; E141-T317 WeakPolarHBondContact OE1-CB 3.41Å; E141-T317 PolarHBondContact OE1-OG1 3.49Å; E141-S318 PolarHBondContact OE1-OG 2.91Å
142	R	87.8	Confident	92.7	Very high	16 Å²	16	9 Å²	9	6%	0.06	5%	0.045	C	C	.	.			trans	50.3	43.4	173	-59.8	-56.2	-54.1	-82.6	-1.3	113.8	V139 H140 D147 P391 E392 D420	V139-R142 WeakPolarHBondContact O-CD 3.39Å; V139-R142 PolarHBondContact O-N 3.38Å; H140-R142 PolarHBondContact O-N 3.05Å; R142-D147 IonicContact CZ-OD2 2.69Å; R142-D147 IonicContact NE-OD1 3.63Å; R142-D147 PolarHBondContact NE-OD1 3.42Å; R142-D147 IonicContact NE-OD2 3.79Å; R142-D147 IonicContact NH2-OD1 2.8Å; R142-D147 IonicContact NH2-OD2 2.61Å; R142-D147 PolarHBondContact NH2-OD2 3.18Å; R142-P391 HydrophobicContact CB-CB 3.9Å; R142-P391 HydrophobicContact CG-CB 4.46Å; R142-P391 VanDerWaalsContact NH2-CB 3.28Å; R142-E392 PolarHBondContact O-N 3.12Å; R142-E392 VanDerWaalsContact O-N 3.1Å; R142-D420 IonicContact CZ-OD2 2.93Å; R142-D420 IonicContact NH1-OD2 3.04Å; R142-D420 PolarHBondContact NH1-OD2 3.15Å; R142-D420 IonicContact NH2-OD2 3.8Å; R142-D420 PolarHBondContact NH2-OD2 3.3Å
143	S	90.1	Very high	92.6	Very high	13 Å²	13	9 Å²	9	9%	0.091	5%	0.046	C	C	.	.			trans	-69	149.9	177.9	85.3	0	0	0	0	111.1	D115 E141 N145 T146 D147 E392	D115-S143 PolarHBondContact OD2-OG 2.88Å; E141-S143 VanDerWaalsContact C-N 3.27Å; E141-S143 PolarHBondContact O-N 3.37Å; S143-N145 VanDerWaalsContact C-N 3.3Å; S143-N145 PolarHBondContact O-N 3.03Å; S143-T146 PolarHBondContact O-N 3.31Å; S143-T146 VanDerWaalsContact OG-CB 3.29Å; S143-T146 WeakPolarHBondContact OG-CB 3.44Å; S143-T146 PolarHBondContact OG-N 3.33Å; S143-T146 VanDerWaalsContact OG-N 3.13Å; S143-T146 PolarHBondContact OG-OG1 3.08Å; S143-D147 PolarHBondContact O-N 3.05Å; S143-D147 VanDerWaalsContact O-N 3.08Å; S143-E392 WeakPolarHBondContact CA-OE2 3.46Å
144	L	91.6	Very high	92.4	Very high	21 Å²	21	11.1 Å²	11.1	11%	0.11	6%	0.055	C	C	.	.	H	α-helix	trans	-57	-44.7	-179.9	-179.8	64.7	0	0	0	111.9	D147 I148 E392 I393 L398 V401	L144-D147 PolarHBondContact O-N 2.77Å; L144-I148 VanDerWaalsContact O-CG1 3.31Å; L144-I148 WeakPolarHBondContact O-CG1 3.48Å; L144-I148 PolarHBondContact O-N 3.27Å; L144-E392 HydrophobicContact CB-CB 4.02Å; L144-E392 PolarHBondContact N-OE2 3.45Å; L144-I393 HydrophobicContact CD1-CB 3.84Å; L144-I393 HydrophobicContact CD1-CD1 4.47Å; L144-I393 HydrophobicContact CD1-CG1 3.77Å; L144-L398 HydrophobicContact CD1-CD2 3.69Å; L144-V401 HydrophobicContact CD1-CG1 4.44Å; L144-V401 HydrophobicContact CD1-CG2 4.09Å; L144-V401 HydrophobicContact CD2-CG1 3.67Å; L144-V401 HydrophobicContact CD2-CG2 4.05Å; L144-V401 HydrophobicContact CG-CG1 3.76Å; L144-V401 HydrophobicContact CG-CG2 4.24Å
145	N	93.3	Very high	92	Very high	59 Å²	59	16.5 Å²	16.5	32%	0.316	8%	0.078	S	C	.	.	H	α-helix	trans	-67.9	-37.7	-179.5	-68.4	-50.9	0	0	0	112.4	D115 S143 I148 L149	D115-N145 HydrophobicContact CB-CB 3.6Å; S143-N145 VanDerWaalsContact C-N 3.3Å; S143-N145 PolarHBondContact O-N 3.03Å; N145-I148 PolarHBondContact O-N 3.05Å; N145-L149 WeakPolarHBondContact O-CB 3.38Å; N145-L149 VanDerWaalsContact O-CG 3.3Å; N145-L149 WeakPolarHBondContact O-CG 3.45Å; N145-L149 PolarHBondContact O-N 3.16Å
146	T	93.7	Very high	91.4	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	9%	0.088	C	C	.	.	H	α-helix	trans	-61.2	-48.6	175.4	-80.4	0	0	0	0	110.7	D115 V139 S143 I148 L149 L150	D115-T146 PolarHBondContact OD1-OG1 3.12Å; D115-T146 PolarHBondContact OD2-OG1 2.89Å; V139-T146 HydrophobicContact CB-CG2 4.2Å; V139-T146 HydrophobicContact CG1-CG2 3.88Å; V139-T146 HydrophobicContact CG2-CG2 3.86Å; S143-T146 PolarHBondContact O-N 3.31Å; S143-T146 VanDerWaalsContact OG-CB 3.29Å; S143-T146 WeakPolarHBondContact OG-CB 3.44Å; S143-T146 PolarHBondContact OG-N 3.33Å; S143-T146 VanDerWaalsContact OG-N 3.13Å; S143-T146 PolarHBondContact OG-OG1 3.08Å; T146-I148 VanDerWaalsContact C-N 3.3Å; T146-I148 PolarHBondContact O-N 3.4Å; T146-L149 WeakPolarHBondContact O-CB 3.4Å; T146-L149 PolarHBondContact O-N 3.35Å; T146-L149 VanDerWaalsContact O-N 3.14Å; T146-L150 HydrophobicContact CG2-CD1 4.12Å; T146-L150 HydrophobicContact CG2-CG 4.33Å; T146-L150 WeakPolarHBondContact O-CG 3.5Å; T146-L150 PolarHBondContact O-N 3.35Å
147	D	93.5	Very high	91	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-62.9	-37.5	-177.8	-82.4	18.1	0	0	0	111.9	R142 S143 L144 L150 G151 I393	R142-D147 IonicContact CZ-OD2 2.69Å; R142-D147 IonicContact NE-OD1 3.63Å; R142-D147 PolarHBondContact NE-OD1 3.42Å; R142-D147 IonicContact NE-OD2 3.79Å; R142-D147 IonicContact NH2-OD1 2.8Å; R142-D147 IonicContact NH2-OD2 2.61Å; R142-D147 PolarHBondContact NH2-OD2 3.18Å; S143-D147 PolarHBondContact O-N 3.05Å; S143-D147 VanDerWaalsContact O-N 3.08Å; L144-D147 PolarHBondContact O-N 2.77Å; D147-L150 PolarHBondContact O-N 3.5Å; D147-G151 PolarHBondContact O-N 3.41Å; D147-I393 HydrophobicContact CB-CD1 4.4Å
148	I	94.4	Very high	90.5	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-67.3	-42.8	173.7	-63.9	-63.5	0	0	0	111.7	L119 L144 N145 T146 L150 G151 L152 I393 V401 L405 F416 Y418	L119-I148 HydrophobicContact CD1-CG2 4.03Å; L119-I148 HydrophobicContact CD2-CG2 4.37Å; L144-I148 VanDerWaalsContact O-CG1 3.31Å; L144-I148 WeakPolarHBondContact O-CG1 3.48Å; L144-I148 PolarHBondContact O-N 3.27Å; N145-I148 PolarHBondContact O-N 3.05Å; T146-I148 VanDerWaalsContact C-N 3.3Å; T146-I148 PolarHBondContact O-N 3.4Å; I148-L150 VanDerWaalsContact C-N 3.34Å; I148-L150 PolarHBondContact O-N 2.79Å; I148-G151 PolarHBondContact O-N 3.22Å; I148-L152 HydrophobicContact CG2-CD1 3.86Å; I148-L152 HydrophobicContact CG2-CG 4.35Å; I148-L152 WeakPolarHBondContact O-CG 3.42Å; I148-L152 PolarHBondContact O-N 2.98Å; I148-I393 HydrophobicContact CD1-CD1 4.11Å; I148-V401 HydrophobicContact CD1-CB 4.29Å; I148-V401 HydrophobicContact CD1-CG2 4.32Å; I148-V401 HydrophobicContact CG1-CB 3.98Å; I148-V401 HydrophobicContact CG1-CG1 4.08Å; I148-V401 HydrophobicContact CG1-CG2 4.34Å; I148-L405 HydrophobicContact CD1-CD1 4.13Å; I148-L405 HydrophobicContact CG2-CD2 3.97Å; I148-L405 HydrophobicContact CG2-CG 4.44Å; I148-F416 HydrophobicContact CD1-CE1 4.46Å; I148-Y418 HydrophobicContact CD1-CD1 4.42Å; I148-Y418 HydrophobicContact CD1-CE1 3.89Å
149	L	94.4	Very high	90.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.2	-43	174.8	-78.2	172	0	0	0	111.6	D115 L118 L119 V122 L136 N145 T146 G151 L152 L153	D115-L149 HydrophobicContact CB-CD1 3.87Å; D115-L149 WeakPolarHBondContact O-CD1 3.47Å; L118-L149 HydrophobicContact CB-CD1 4.3Å; L118-L149 HydrophobicContact CB-CD2 4.45Å; L118-L149 HydrophobicContact CD2-CD1 4.15Å; L118-L149 HydrophobicContact CD2-CD2 4.13Å; L118-L149 HydrophobicContact CG-CD2 4.09Å; L119-L149 HydrophobicContact CB-CD2 4.11Å; L119-L149 HydrophobicContact CB-CG 4.45Å; L119-L149 HydrophobicContact CD1-CD2 4.05Å; V122-L149 HydrophobicContact CG2-CD2 4.32Å; L136-L149 HydrophobicContact CD2-CD1 4.18Å; N145-L149 WeakPolarHBondContact O-CB 3.38Å; N145-L149 VanDerWaalsContact O-CG 3.3Å; N145-L149 WeakPolarHBondContact O-CG 3.45Å; N145-L149 PolarHBondContact O-N 3.16Å; T146-L149 WeakPolarHBondContact O-CB 3.4Å; T146-L149 PolarHBondContact O-N 3.35Å; T146-L149 VanDerWaalsContact O-N 3.14Å; L149-G151 VanDerWaalsContact C-N 3.32Å; L149-G151 PolarHBondContact O-N 2.98Å; L149-L152 PolarHBondContact O-N 3.42Å; L149-L153 WeakPolarHBondContact O-CB 3.35Å; L149-L153 VanDerWaalsContact O-CG 3.23Å; L149-L153 WeakPolarHBondContact O-CG 3.47Å; L149-L153 PolarHBondContact O-N 3.34Å
150	L	94.9	Very high	89.7	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.3	-47.2	176.6	-69.4	171.3	0	0	0	111.2	L136 V139 T146 D147 I148 K154 V175 L185 F188 F189 L419	L136-L150 HydrophobicContact CD1-CD2 3.44Å; L136-L150 VanDerWaalsContact CD1-CD2 3.44Å; L136-L150 HydrophobicContact CD1-CG 4.07Å; V139-L150 HydrophobicContact CG1-CD1 3.88Å; T146-L150 HydrophobicContact CG2-CD1 4.12Å; T146-L150 HydrophobicContact CG2-CG 4.33Å; T146-L150 WeakPolarHBondContact O-CG 3.5Å; T146-L150 PolarHBondContact O-N 3.35Å; D147-L150 PolarHBondContact O-N 3.5Å; I148-L150 VanDerWaalsContact C-N 3.34Å; I148-L150 PolarHBondContact O-N 2.79Å; L150-K154 VanDerWaalsContact O-CB 3.3Å; L150-K154 WeakPolarHBondContact O-CB 3.34Å; L150-K154 PolarHBondContact O-N 2.96Å; L150-V175 HydrophobicContact CD2-CG1 4.48Å; L150-V175 HydrophobicContact CD2-CG2 4.07Å; L150-L185 HydrophobicContact CD1-CD2 4.43Å; L150-F188 HydrophobicContact CB-CE1 4.05Å; L150-F189 HydrophobicContact CB-CZ 4.25Å; L150-F189 HydrophobicContact CD2-CE2 3.75Å; L150-F189 HydrophobicContact CD2-CZ 3.58Å; L150-L419 HydrophobicContact CD1-CD2 4Å
151	G	93.9	Very high	89.4	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-41.5	177	0	0	0	0	0	113.7	D147 I148 L149 K155 F416 P417	D147-G151 PolarHBondContact O-N 3.41Å; I148-G151 PolarHBondContact O-N 3.22Å; L149-G151 VanDerWaalsContact C-N 3.32Å; L149-G151 PolarHBondContact O-N 2.98Å; G151-K155 WeakPolarHBondContact O-CB 3.26Å; G151-K155 PolarHBondContact O-N 3.29Å; G151-F416 VanDerWaalsContact C-CZ 3.44Å; G151-P417 VanDerWaalsContact CA-O 3.26Å; G151-P417 WeakPolarHBondContact CA-O 3.49Å
152	L	92.9	Very high	89.2	Confident	7 Å²	7	39.1 Å²	39.1	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-48.3	178.1	-75.1	171.1	0	0	0	111.6	L119 V122 I148 L149 K154 K155 V156 L405 L408 V410 F416	L119-L152 HydrophobicContact CD1-CD1 3.38Å; V122-L152 HydrophobicContact CG1-CD1 4.37Å; I148-L152 HydrophobicContact CG2-CD1 3.86Å; I148-L152 HydrophobicContact CG2-CG 4.35Å; I148-L152 WeakPolarHBondContact O-CG 3.42Å; I148-L152 PolarHBondContact O-N 2.98Å; L149-L152 PolarHBondContact O-N 3.42Å; L152-K154 VanDerWaalsContact C-N 3.31Å; L152-K154 PolarHBondContact O-N 3.09Å; L152-K155 PolarHBondContact O-N 2.9Å; L152-K155 VanDerWaalsContact O-N 3.15Å; L152-V156 WeakPolarHBondContact O-CG2 3.37Å; L152-V156 PolarHBondContact O-N 3.35Å; L152-L405 HydrophobicContact CD1-CD2 4.42Å; L152-L405 HydrophobicContact CD2-CD2 3.9Å; L152-L405 HydrophobicContact CG-CD2 4.18Å; L152-L408 HydrophobicContact CD1-CD1 3.49Å; L152-L408 VanDerWaalsContact CD1-CD1 3.49Å; L152-L408 HydrophobicContact CD2-CD1 3.66Å; L152-L408 HydrophobicContact CG-CD1 4.24Å; L152-V410 HydrophobicContact CD2-CG2 4.37Å; L152-F416 HydrophobicContact CD2-CE2 3.96Å; L152-F416 HydrophobicContact CD2-CZ 4.29Å; L152-F416 HydrophobicContact CG-CE2 4.23Å; L152-F416 HydrophobicContact CG-CZ 4.05Å
153	L	92.9	Very high	88.9	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-40.3	178.5	-65.9	-179.4	0	0	0	110.9	L128 V134 L136 L149 F157 V173	L128-L153 HydrophobicContact CD1-CD2 3.83Å; V134-L153 HydrophobicContact CG1-CD1 4.19Å; L136-L153 HydrophobicContact CD1-CD1 3.75Å; L136-L153 HydrophobicContact CD2-CD1 4.3Å; L136-L153 HydrophobicContact CG-CD1 4.16Å; L149-L153 WeakPolarHBondContact O-CB 3.35Å; L149-L153 VanDerWaalsContact O-CG 3.23Å; L149-L153 WeakPolarHBondContact O-CG 3.47Å; L149-L153 PolarHBondContact O-N 3.34Å; L153-F157 HydrophobicContact CB-CD2 4.24Å; L153-F157 HydrophobicContact CD2-CD2 3.7Å; L153-F157 HydrophobicContact CD2-CE2 3.51Å; L153-F157 VanDerWaalsContact O-CB 3.31Å; L153-F157 WeakPolarHBondContact O-CB 3.35Å; L153-F157 WeakPolarHBondContact O-CD2 3.36Å; L153-F157 PolarHBondContact O-N 2.86Å; L153-V173 HydrophobicContact CD1-CG1 3.79Å; L153-V173 HydrophobicContact CD1-CG2 4.33Å
154	K	92.1	Very high	88.6	Confident	43 Å²	43	40.3 Å²	40.3	19%	0.187	20%	0.202	C	C	.	.	H	α-helix	trans	-58.8	-51	171.8	-178.8	177.8	173.3	177.3	0	110.7	L150 L152 V156 S158 F188 F189 P417	L150-K154 VanDerWaalsContact O-CB 3.3Å; L150-K154 WeakPolarHBondContact O-CB 3.34Å; L150-K154 PolarHBondContact O-N 2.96Å; L152-K154 VanDerWaalsContact C-N 3.31Å; L152-K154 PolarHBondContact O-N 3.09Å; K154-V156 PolarHBondContact O-N 2.83Å; K154-S158 WeakPolarHBondContact O-CB 3.28Å; K154-S158 PolarHBondContact O-N 3.15Å; K154-S158 PolarHBondContact O-OG 3.02Å; K154-F188 HydrophobicContact CB-CE1 4.05Å; K154-F188 HydrophobicContact CB-CZ 4.27Å; K154-F188 HydrophobicContact CD-CD1 4.11Å; K154-F188 HydrophobicContact CD-CD2 4.35Å; K154-F188 HydrophobicContact CD-CE1 3.68Å; K154-F188 HydrophobicContact CD-CE2 3.95Å; K154-F188 HydrophobicContact CD-CG 4.43Å; K154-F188 HydrophobicContact CD-CZ 3.61Å; K154-F188 VanDerWaalsContact CD-O 3.26Å; K154-F188 WeakPolarHBondContact CD-O 3.34Å; K154-F188 WeakPolarHBondContact CE-O 3.33Å; K154-F188 HydrophobicContact CG-CE1 4.47Å; K154-F188 PolarHBondContact NZ-O 3.28Å; K154-F189 HydrophobicContact CB-CD1 4.2Å; K154-F189 HydrophobicContact CB-CE1 3.85Å; K154-F189 HydrophobicContact CG-CD1 4.43Å; K154-P417 HydrophobicContact CD-CB 4.31Å
155	K	88.7	Confident	88	Confident	113 Å²	113	44.9 Å²	44.9	49%	0.491	22%	0.221	S	C	.	.	H	α-helix	trans	-61.8	-45.6	-176.7	-173.8	176.3	-179.4	178	0	112.5	G151 L152 P417	G151-K155 WeakPolarHBondContact O-CB 3.26Å; G151-K155 PolarHBondContact O-N 3.29Å; L152-K155 PolarHBondContact O-N 2.9Å; L152-K155 VanDerWaalsContact O-N 3.15Å; K155-P417 HydrophobicContact CB-CG 4.38Å
156	V	86.4	Confident	87.2	Confident	35 Å²	35	46 Å²	46	21%	0.212	25%	0.246	C	C	.	.	H	α-helix	trans	-75.6	-49	-176.9	177.8	0	0	0	0	111.2	L152 K154 E162	L152-V156 WeakPolarHBondContact O-CG2 3.37Å; L152-V156 PolarHBondContact O-N 3.35Å; K154-V156 PolarHBondContact O-N 2.83Å; V156-E162 HydrophobicContact CG1-CB 4.45Å; V156-E162 WeakPolarHBondContact O-CB 3.3Å
157	F	86.6	Confident	86.7	Confident	5 Å²	5	46.9 Å²	46.9	2%	0.022	25%	0.249	C	C	.	.	H	α-helix	trans	-97.4	2	-167.7	-57.9	-63.4	0	0	0	114.7	F35 L128 L153 N159 A163 L171	F35-F157 HydrophobicContact CZ-CB 3.96Å; L128-F157 HydrophobicContact CB-CZ 4.23Å; L128-F157 HydrophobicContact CD1-CE2 4.01Å; L128-F157 HydrophobicContact CD1-CZ 4.23Å; L128-F157 HydrophobicContact CG-CZ 4.42Å; L153-F157 HydrophobicContact CB-CD2 4.24Å; L153-F157 HydrophobicContact CD2-CD2 3.7Å; L153-F157 HydrophobicContact CD2-CE2 3.51Å; L153-F157 VanDerWaalsContact O-CB 3.31Å; L153-F157 WeakPolarHBondContact O-CB 3.35Å; L153-F157 WeakPolarHBondContact O-CD2 3.36Å; L153-F157 PolarHBondContact O-N 2.86Å; F157-N159 PolarHBondContact O-N 2.82Å; F157-A163 HydrophobicContact CB-CB 4.4Å; F157-A163 HydrophobicContact CD1-CB 4.03Å; F157-L171 HydrophobicContact CD1-CB 4.2Å; F157-L171 HydrophobicContact CD1-CD2 3.97Å; F157-L171 HydrophobicContact CD2-CD2 3.71Å; F157-L171 HydrophobicContact CE1-CB 4.18Å; F157-L171 HydrophobicContact CE1-CD2 3.65Å; F157-L171 HydrophobicContact CE2-CD2 3.4Å; F157-L171 VanDerWaalsContact CE2-CD2 3.4Å; F157-L171 HydrophobicContact CG-CD2 4Å; F157-L171 HydrophobicContact CZ-CD2 3.37Å
158	S	84.4	Confident	86.2	Confident	53 Å²	53	51.4 Å²	51.4	37%	0.371	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21	163.1	-65.5	0	0	0	0	112.3	K154 P160	K154-S158 WeakPolarHBondContact O-CB 3.28Å; K154-S158 PolarHBondContact O-N 3.15Å; K154-S158 PolarHBondContact O-OG 3.02Å; S158-P160 WeakPolarHBondContact O-CD 3.47Å
159	N	83.3	Confident	85.7	Confident	75 Å²	75	53.5 Å²	53.5	40%	0.401	29%	0.29	S	S	.	.	S	Bend	trans	-86.9	115.2	172.9	-173.9	-18.5	0	0	0	110.2	F157 R161 E162 A163	F157-N159 PolarHBondContact O-N 2.82Å; N159-R161 PolarHBondContact O-N 2.92Å; N159-R161 VanDerWaalsContact O-N 3.13Å; N159-R161 PolarHBondContact OD1-N 3.04Å; N159-R161 VanDerWaalsContact OD1-N 3.12Å; N159-E162 HydrophobicContact CB-CB 4.38Å; N159-E162 HydrophobicContact CB-CG 4.33Å; N159-E162 PolarHBondContact O-N 3.36Å; N159-A163 PolarHBondContact O-N 2.98Å; N159-A163 VanDerWaalsContact O-N 3.08Å
160	P	79.1	Confident	85.3	Confident	94 Å²	94	55.4 Å²	55.4	61%	0.61	30%	0.303	S	S	*	.	H	α-helix	trans	-58.5	-29.4	-177.2	-25.7	35.2	0	0	0	114.5	S158 T164	S158-P160 WeakPolarHBondContact O-CD 3.47Å; P160-T164 PolarHBondContact O-N 3.48Å; P160-T164 PolarHBondContact O-OG1 3.2Å
161	R	80.7	Confident	85.3	Confident	210 Å²	210	55.4 Å²	55.4	79%	0.792	30%	0.303	S	S	*	.	H	α-helix	trans	-67.3	-47.8	178.3	-68.1	-175.4	178.2	-179.2	0.3	111.5	N159 A163 T164 K165	N159-R161 PolarHBondContact O-N 2.92Å; N159-R161 VanDerWaalsContact O-N 3.13Å; N159-R161 PolarHBondContact OD1-N 3.04Å; N159-R161 VanDerWaalsContact OD1-N 3.12Å; R161-A163 VanDerWaalsContact C-N 3.33Å; R161-T164 PolarHBondContact O-N 3.16Å; R161-K165 PolarHBondContact O-N 3.34Å
162	E	79.6	Confident	85.3	Confident	73 Å²	73	56 Å²	56	34%	0.341	31%	0.305	S	S	.	.	H	α-helix	trans	-66.8	-37.8	178	-67.1	-57.8	148.6	0	0	111.1	V156 N159 T164 K165	V156-E162 HydrophobicContact CG1-CB 4.45Å; V156-E162 WeakPolarHBondContact O-CB 3.3Å; N159-E162 HydrophobicContact CB-CB 4.38Å; N159-E162 HydrophobicContact CB-CG 4.33Å; N159-E162 PolarHBondContact O-N 3.36Å; E162-T164 VanDerWaalsContact C-N 3.29Å; E162-T164 PolarHBondContact O-N 3.31Å; E162-K165 WeakPolarHBondContact O-CB 3.49Å; E162-K165 PolarHBondContact O-N 2.98Å; E162-K165 IonicContact OE2-NZ 4Å
163	A	80	Confident	85.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-62	-33.5	176.5	0	0	0	0	0	113.9	F157 N159 R161 R167 P170 L171	F157-A163 HydrophobicContact CB-CB 4.4Å; F157-A163 HydrophobicContact CD1-CB 4.03Å; N159-A163 PolarHBondContact O-N 2.98Å; N159-A163 VanDerWaalsContact O-N 3.08Å; R161-A163 VanDerWaalsContact C-N 3.33Å; A163-R167 PolarHBondContact O-NH1 3.38Å; A163-P170 HydrophobicContact CB-CB 3.83Å; A163-P170 CarbonylContact O-C 3.6Å; A163-P170 WeakPolarHBondContact O-CA 3.39Å; A163-L171 PolarHBondContact O-N 2.67Å
164	T	83.3	Confident	85.6	Confident	52 Å²	52	55.6 Å²	55.6	32%	0.319	30%	0.303	S	S	.	.	H	α-helix	trans	-94.9	-2.8	-177.2	-41.5	0	0	0	0	112.6	P160 R161 E162 G166 R167	P160-T164 PolarHBondContact O-N 3.48Å; P160-T164 PolarHBondContact O-OG1 3.2Å; R161-T164 PolarHBondContact O-N 3.16Å; E162-T164 VanDerWaalsContact C-N 3.29Å; E162-T164 PolarHBondContact O-N 3.31Å; T164-G166 PolarHBondContact O-N 3.47Å; T164-R167 PolarHBondContact O-N 3.32Å
165	K	79.4	Confident	85.8	Confident	118 Å²	118	53.6 Å²	53.6	51%	0.513	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	112.8	-175.2	-168.5	177.3	-175.3	176.3	0	111.1	A127 R161 E162 R167	A127-K165 HydrophobicContact CB-CD 4.37Å; R161-K165 PolarHBondContact O-N 3.34Å; E162-K165 WeakPolarHBondContact O-CB 3.49Å; E162-K165 PolarHBondContact O-N 2.98Å; E162-K165 IonicContact OE2-NZ 4Å; K165-R167 PolarHBondContact O-NH1 2.89Å; K165-R167 VanDerWaalsContact O-NH1 3.07Å
166	G	76.1	Confident	86.1	Confident	81 Å²	81	48.2 Å²	48.2	84%	0.835	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	14.2	-179.7	0	0	0	0	0	115.5	T164	T164-G166 PolarHBondContact O-N 3.47Å
167	R	83.2	Confident	86.2	Confident	20 Å²	20	46.6 Å²	46.6	8%	0.075	26%	0.262	C	S	.	.	S	Bend	trans	-134.4	156.4	-175.7	-58.4	176.4	-169	86.3	1.7	111.9	A127 L128 Y131 A163 T164 K165 F169	A127-R167 PolarHBondContact O-NH2 3.44Å; L128-R167 PolarHBondContact O-NH2 3.4Å; Y131-R167 PolarHBondContact O-NE 3.02Å; Y131-R167 PolarHBondContact O-NH2 2.77Å; Y131-R167 VanDerWaalsContact O-NH2 3.15Å; A163-R167 PolarHBondContact O-NH1 3.38Å; T164-R167 PolarHBondContact O-N 3.32Å; K165-R167 PolarHBondContact O-NH1 2.89Å; K165-R167 VanDerWaalsContact O-NH1 3.07Å; R167-F169 VanDerWaalsContact C-N 3.32Å; R167-F169 WeakPolarHBondContact CB-O 3.44Å
168	S	83	Confident	85.9	Confident	96 Å²	96	47.6 Å²	47.6	67%	0.671	27%	0.271	S	S	*	.	S	Bend	trans	-78.6	-19.7	173.8	77.3	0	0	0	0	112.7	D62	D62-S168 WeakPolarHBondContact OD2-CA 3.32Å; D62-S168 WeakPolarHBondContact OD2-CB 3.17Å; D62-S168 PolarHBondContact OD2-N 2.72Å; D62-S168 PolarHBondContact OD2-OG 3.19Å
169	F	84.2	Confident	85.2	Confident	45 Å²	45	46.2 Å²	46.2	20%	0.197	26%	0.26	C	S	.	.	S	Bend	trans	-135.3	157.1	173.1	57.2	-90.7	0	0	0	111.6	F59 D62 R167 L171 K172	F59-F169 AromaticContact CD1-CE2 3.73Å; F59-F169 HydrophobicContact CD1-CE2 3.73Å; F59-F169 AromaticContact CD1-CZ 3.61Å; F59-F169 HydrophobicContact CD1-CZ 3.61Å; F59-F169 HydrophobicContact CE1-CE2 4.04Å; F59-F169 HydrophobicContact CE1-CZ 4.24Å; F59-F169 HydrophobicContact CG-CZ 4.47Å; D62-F169 HydrophobicContact CB-CE1 3.87Å; D62-F169 HydrophobicContact CB-CZ 4.12Å; D62-F169 VanDerWaalsContact OD2-CD1 3.23Å; D62-F169 WeakPolarHBondContact OD2-CD1 3.18Å; D62-F169 WeakPolarHBondContact OD2-CE1 3.38Å; R167-F169 VanDerWaalsContact C-N 3.32Å; R167-F169 WeakPolarHBondContact CB-O 3.44Å; F169-L171 PolarHBondContact O-N 2.87Å; F169-K172 HydrophobicContact CD2-CD 4.45Å; F169-K172 HydrophobicContact CD2-CG 4.13Å; F169-K172 HydrophobicContact CE2-CG 4Å
170	P	87.8	Confident	84.1	Confident	40 Å²	40	49.2 Å²	49.2	26%	0.26	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-57.3	137.6	175.7	-22.5	31.5	0	0	0	111.7	A163 K172	A163-P170 HydrophobicContact CB-CB 3.83Å; A163-P170 CarbonylContact O-C 3.6Å; A163-P170 WeakPolarHBondContact O-CA 3.39Å; P170-K172 WeakPolarHBondContact O-CD 3.13Å; P170-K172 WeakPolarHBondContact O-CE 3.3Å; P170-K172 PolarHBondContact O-N 3.44Å
171	L	93.3	Very high	84	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-46.5	129.1	173.3	-176.8	83.7	0	0	0	110	T34 L128 Y131 V134 F157 A163 F169 V173	T34-L171 WeakPolarHBondContact CG2-O 3.36Å; L128-L171 HydrophobicContact CD1-CD2 4.43Å; Y131-L171 WeakPolarHBondContact O-CD1 3.26Å; V134-L171 HydrophobicContact CG2-CD1 4.42Å; V134-L171 HydrophobicContact CG2-CD2 4.27Å; F157-L171 HydrophobicContact CD1-CB 4.2Å; F157-L171 HydrophobicContact CD1-CD2 3.97Å; F157-L171 HydrophobicContact CD2-CD2 3.71Å; F157-L171 HydrophobicContact CE1-CB 4.18Å; F157-L171 HydrophobicContact CE1-CD2 3.65Å; F157-L171 HydrophobicContact CE2-CD2 3.4Å; F157-L171 VanDerWaalsContact CE2-CD2 3.4Å; F157-L171 HydrophobicContact CG-CD2 4Å; F157-L171 HydrophobicContact CZ-CD2 3.37Å; A163-L171 PolarHBondContact O-N 2.67Å; F169-L171 PolarHBondContact O-N 2.87Å; L171-V173 HydrophobicContact CD2-CG2 4.29Å
172	K	94.6	Very high	84.1	Confident	13 Å²	13	37.6 Å²	37.6	6%	0.057	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.3	179.1	-54.3	-57.1	-170.9	169.6	0	110.3	V30 R31 S33 F59 S132 V133 V134 F169 P170	V30-K172 HydrophobicContact CG1-CB 4.17Å; V30-K172 HydrophobicContact CG1-CG 4.27Å; V30-K172 WeakPolarHBondContact O-CD 3.49Å; V30-K172 WeakPolarHBondContact O-CE 3.44Å; V30-K172 PolarHBondContact O-NZ 3Å; R31-K172 PolarHBondContact O-NZ 2.95Å; S33-K172 WeakPolarHBondContact O-CD 3.44Å; S33-K172 PolarHBondContact O-NZ 3.41Å; F59-K172 HydrophobicContact CD1-CG 4.48Å; F59-K172 HydrophobicContact CE1-CG 3.97Å; S132-K172 PolarHBondContact O-N 3.17Å; V133-K172 CarbonylContact C-O 3.34Å; V133-K172 WeakPolarHBondContact CA-O 3.02Å; V133-K172 HydrophobicContact CB-CB 4.39Å; V133-K172 HydrophobicContact CG1-CB 4.12Å; V133-K172 HydrophobicContact CG2-CB 4.07Å; V133-K172 HydrophobicContact CG2-CG 4.42Å; V134-K172 PolarHBondContact N-O 2.77Å; F169-K172 HydrophobicContact CD2-CD 4.45Å; F169-K172 HydrophobicContact CD2-CG 4.13Å; F169-K172 HydrophobicContact CE2-CG 4Å; P170-K172 WeakPolarHBondContact O-CD 3.13Å; P170-K172 WeakPolarHBondContact O-CE 3.3Å; P170-K172 PolarHBondContact O-N 3.44Å
173	V	96	Very high	84.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	113.7	175.4	-177.9	0	0	0	0	108.6	T34 F35 L36 V134 L153 L171 V175	T34-V173 PolarHBondContact O-N 2.94Å; F35-V173 WeakPolarHBondContact CA-O 3.25Å; F35-V173 HydrophobicContact CD1-CB 3.63Å; F35-V173 HydrophobicContact CD1-CG1 3.89Å; F35-V173 HydrophobicContact CD1-CG2 4.21Å; F35-V173 HydrophobicContact CE1-CB 3.84Å; F35-V173 HydrophobicContact CE1-CG1 4.08Å; F35-V173 HydrophobicContact CE1-CG2 3.9Å; L36-V173 PolarHBondContact N-O 3.47Å; V134-V173 CarbonylContact O-C 3.59Å; V134-V173 VanDerWaalsContact O-CA 3.31Å; V134-V173 WeakPolarHBondContact O-CA 3.15Å; L153-V173 HydrophobicContact CD1-CG1 3.79Å; L153-V173 HydrophobicContact CD1-CG2 4.33Å; L171-V173 HydrophobicContact CD2-CG2 4.29Å; V173-V175 HydrophobicContact CG1-CG2 4.4Å
174	V	97	Very high	85	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.6	177.2	-175.3	0	0	0	0	109.1	V30 L36 V38 L50 V133 V134 I135 L136 M176	V30-V174 HydrophobicContact CG1-CG2 4.2Å; V30-V174 HydrophobicContact CG2-CG2 3.97Å; L36-V174 CarbonylContact O-C 3.59Å; L36-V174 WeakPolarHBondContact O-CA 3.5Å; V38-V174 HydrophobicContact CB-CG1 4.33Å; V38-V174 HydrophobicContact CG2-CG1 3.59Å; L50-V174 HydrophobicContact CD2-CG1 3.93Å; V133-V174 HydrophobicContact CG1-CG2 4.39Å; V134-V174 PolarHBondContact O-N 3.24Å; I135-V174 CarbonylContact C-O 3.41Å; I135-V174 VanDerWaalsContact CA-O 3.28Å; I135-V174 WeakPolarHBondContact CA-O 3.42Å; I135-V174 HydrophobicContact CG1-CB 4.14Å; I135-V174 HydrophobicContact CG2-CB 4.43Å; L136-V174 PolarHBondContact N-O 3.34Å; V174-M176 HydrophobicContact CG1-CG 4.37Å
175	V	96	Very high	85.4	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	112.1	179.1	178.3	0	0	0	0	108.4	L36 I37 V38 V139 L150 V173 L185 F189	L36-V175 PolarHBondContact O-N 3.03Å; I37-V175 CarbonylContact C-O 3.57Å; I37-V175 WeakPolarHBondContact CA-O 3.4Å; I37-V175 HydrophobicContact CG1-CB 4.25Å; V38-V175 PolarHBondContact N-O 3Å; V139-V175 HydrophobicContact CB-CG1 4.16Å; V139-V175 HydrophobicContact CG1-CG1 4.25Å; V139-V175 HydrophobicContact CG2-CG1 3.87Å; L150-V175 HydrophobicContact CD2-CG1 4.48Å; L150-V175 HydrophobicContact CD2-CG2 4.07Å; V173-V175 HydrophobicContact CG1-CG2 4.4Å; V175-L185 HydrophobicContact CG1-CD1 4.27Å; V175-L185 HydrophobicContact CG1-CD2 4.48Å; V175-F189 HydrophobicContact CG2-CE2 3.86Å; V175-F189 HydrophobicContact CG2-CZ 4.31Å
176	M	94.1	Very high	86.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.4	178.3	-58.9	175.7	177.6	0	0	111.3	V38 K46 L50 I135 L136 D137 E138 V139 V174	V38-M176 HydrophobicContact CB-CG 4.32Å; V38-M176 VanDerWaalsContact O-CA 3.3Å; V38-M176 WeakPolarHBondContact O-CA 3.47Å; K46-M176 HydrophobicContact CB-CE 4.39Å; K46-M176 HydrophobicContact CB-SD 3.77Å; L50-M176 HydrophobicContact CB-CE 3.59Å; L50-M176 HydrophobicContact CD2-CE 3.2Å; L50-M176 HydrophobicContact CG-CE 3.78Å; I135-M176 HydrophobicContact CD1-CE 4.14Å; I135-M176 HydrophobicContact CG2-CE 3.44Å; I135-M176 VanDerWaalsContact CG2-CE 3.44Å; I135-M176 HydrophobicContact CG2-CG 4.01Å; I135-M176 HydrophobicContact CG2-SD 3.73Å; L136-M176 PolarHBondContact O-N 3.45Å; D137-M176 HydrophobicContact CB-CB 4.46Å; D137-M176 HydrophobicContact CB-SD 4.19Å; D137-M176 VanDerWaalsContact OD1-CB 3.23Å; D137-M176 WeakPolarHBondContact OD1-CB 3.49Å; E138-M176 PolarHBondContact N-O 2.82Å; V139-M176 PolarHBondContact N-O 3.07Å; V174-M176 HydrophobicContact CG1-CG 4.37Å
177	S	88.9	Confident	86.9	Confident	1 Å²	1	36 Å²	36	1%	0.007	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	150.3	175.2	-175.8	0	0	0	0	111.6	V38 T39 G40 T179	V38-S177 PolarHBondContact O-N 2.98Å; T39-S177 WeakPolarHBondContact CA-O 2.97Å; G40-S177 PolarHBondContact N-O 3.47Å; S177-T179 PolarHBondContact OG-N 3.44Å; S177-T179 VanDerWaalsContact OG-N 3.12Å; S177-T179 PolarHBondContact OG-OG1 3.33Å
178	A	80.1	Confident	87.4	Confident	26 Å²	26	36 Å²	36	22%	0.215	21%	0.205	C	C	.	.	S	Bend	trans	-92.8	-12.4	170	0	0	0	0	0	112.8	G40 T42 H140	G40-A178 WeakPolarHBondContact O-CA 3.39Å; T42-A178 HydrophobicContact CG2-CB 4.08Å; H140-A178 PolarHBondContact ND1-N 2.95Å
179	T	70.8	Confident	87.9	Confident	24 Å²	24	31.7 Å²	31.7	15%	0.147	17%	0.174	C	C	.	.	S	Bend	trans	-108.4	162.7	-172.6	62.5	0	0	0	0	113.1	H140 S177 E181	H140-T179 HydrophobicContact CB-CG2 3.77Å; H140-T179 WeakPolarHBondContact CB-OG1 3.43Å; S177-T179 PolarHBondContact OG-N 3.44Å; S177-T179 VanDerWaalsContact OG-N 3.12Å; S177-T179 PolarHBondContact OG-OG1 3.33Å; T179-E181 PolarHBondContact O-N 3.48Å
180	L	59.8	Low	88.2	Confident	137 Å²	137	34.7 Å²	34.7	72%	0.717	19%	0.193	S	C	*	.	S	Bend	trans	-83.5	6.4	-172.2	-73.1	164.5	0	0	0	115.2	T182	L180-T182 PolarHBondContact O-N 2.82Å; L180-T182 PolarHBondContact O-OG1 2.6Å
181	E	75.6	Confident	88.4	Confident	42 Å²	42	38.7 Å²	38.7	20%	0.196	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	33.2	173.3	-70.2	-167.5	83.5	0	0	113	T179 N183 K184 L185 Y388	T179-E181 PolarHBondContact O-N 3.48Å; E181-N183 VanDerWaalsContact C-N 3.33Å; E181-N183 PolarHBondContact O-N 2.72Å; E181-K184 PolarHBondContact O-N 2.95Å; E181-L185 PolarHBondContact O-N 3.37Å; E181-Y388 HydrophobicContact CG-CD1 3.93Å; E181-Y388 HydrophobicContact CG-CE1 3.68Å; E181-Y388 HydrophobicContact CG-CE2 4.38Å; E181-Y388 HydrophobicContact CG-CG 4.39Å; E181-Y388 WeakPolarHBondContact OE2-CD1 3.03Å
182	T	84.6	Confident	88.4	Confident	18 Å²	18	39.2 Å²	39.2	11%	0.11	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-37.5	-178.6	51.6	0	0	0	0	112.5	I37 T39 L180 K184 L185 S186 V194	I37-T182 HydrophobicContact CG2-CG2 4.43Å; T39-T182 HydrophobicContact CG2-CG2 3.11Å; L180-T182 PolarHBondContact O-N 2.82Å; L180-T182 PolarHBondContact O-OG1 2.6Å; T182-K184 VanDerWaalsContact C-N 3.31Å; T182-K184 PolarHBondContact O-N 2.86Å; T182-L185 PolarHBondContact O-N 3.34Å; T182-S186 VanDerWaalsContact O-CB 3.23Å; T182-S186 WeakPolarHBondContact O-CB 3.21Å; T182-S186 PolarHBondContact O-N 3.1Å; T182-V194 HydrophobicContact CG2-CG1 4.01Å
183	N	87.9	Confident	88.4	Confident	126 Å²	126	41.5 Å²	41.5	67%	0.674	23%	0.231	S	C	*	.	H	α-helix	trans	-61.8	-41.5	179.3	-66.9	-22.4	0	0	0	111.2	E181 S186 S187	E181-N183 VanDerWaalsContact C-N 3.33Å; E181-N183 PolarHBondContact O-N 2.72Å; N183-S186 PolarHBondContact O-N 3.46Å; N183-S187 WeakPolarHBondContact O-CB 3.49Å; N183-S187 PolarHBondContact O-N 3.37Å; N183-S187 PolarHBondContact O-OG 2.75Å
184	K	90.3	Very high	88.4	Confident	71 Å²	71	44.3 Å²	44.3	31%	0.309	25%	0.249	S	C	.	.	H	α-helix	trans	-65	-47	178.3	-170.9	-177.1	-170.4	173.4	0	111.4	E181 T182 S186 F188 L419 D420	E181-K184 PolarHBondContact O-N 2.95Å; T182-K184 VanDerWaalsContact C-N 3.31Å; T182-K184 PolarHBondContact O-N 2.86Å; K184-S186 VanDerWaalsContact C-N 3.34Å; K184-F188 WeakPolarHBondContact O-CB 3.3Å; K184-F188 PolarHBondContact O-N 3.29Å; K184-L419 HydrophobicContact CD-CD1 4.46Å; K184-L419 HydrophobicContact CG-CD1 4.11Å; K184-D420 WeakPolarHBondContact CE-OD1 3.28Å; K184-D420 WeakPolarHBondContact CE-OD2 3.47Å; K184-D420 IonicContact NZ-OD1 3.8Å; K184-D420 PolarHBondContact NZ-OD1 2.91Å; K184-D420 IonicContact NZ-OD2 2.92Å; K184-D420 PolarHBondContact NZ-OD2 2.95Å
185	L	91.8	Very high	88.2	Confident	9 Å²	9	45.8 Å²	45.8	5%	0.047	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-41.4	175.9	-72.4	169.2	0	0	0	111.7	I37 V139 L150 V175 E181 T182 F188 F189 L419	I37-L185 VanDerWaalsContact CD1-C 3.42Å; I37-L185 HydrophobicContact CD1-CB 3.51Å; I37-L185 HydrophobicContact CG1-CB 4.25Å; V139-L185 HydrophobicContact CG1-CD2 4.27Å; L150-L185 HydrophobicContact CD1-CD2 4.43Å; V175-L185 HydrophobicContact CG1-CD1 4.27Å; V175-L185 HydrophobicContact CG1-CD2 4.48Å; E181-L185 PolarHBondContact O-N 3.37Å; T182-L185 PolarHBondContact O-N 3.34Å; L185-F188 WeakPolarHBondContact O-CB 3.48Å; L185-F188 PolarHBondContact O-N 3.13Å; L185-F189 WeakPolarHBondContact O-CD2 3.46Å; L185-F189 PolarHBondContact O-N 3.23Å; L185-L419 HydrophobicContact CD2-CD1 4.2Å; L185-L419 HydrophobicContact CD2-CD2 3.65Å
186	S	93.6	Very high	88	Confident	16 Å²	16	52.1 Å²	52.1	11%	0.112	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-50.9	-179.7	178.3	0	0	0	0	110.2	T182 N183 K184 F188 F189 N190 N191 C192	T182-S186 VanDerWaalsContact O-CB 3.23Å; T182-S186 WeakPolarHBondContact O-CB 3.21Å; T182-S186 PolarHBondContact O-N 3.1Å; N183-S186 PolarHBondContact O-N 3.46Å; K184-S186 VanDerWaalsContact C-N 3.34Å; S186-F188 VanDerWaalsContact C-N 3.26Å; S186-F188 PolarHBondContact O-N 2.97Å; S186-F189 CarbonylContact O-C 3.58Å; S186-F189 VanDerWaalsContact O-C 3.32Å; S186-F189 PolarHBondContact O-N 3.22Å; S186-N190 PolarHBondContact O-N 3.48Å; S186-N191 WeakPolarHBondContact O-CA 3.46Å; S186-N191 PolarHBondContact O-N 2.9Å; S186-N191 WeakPolarHBondContact OG-CA 3.44Å; S186-C192 PolarHBondContact O-N 3.17Å; S186-C192 PolarHBondContact OG-N 2.93Å; S186-C192 PolarHBondContact OG-O 3.09Å
187	S	93.6	Very high	87.7	Confident	71 Å²	71	52.2 Å²	52.2	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-55.9	-41.1	173.8	-64.7	0	0	0	0	112	N183 F189 N190	N183-S187 WeakPolarHBondContact O-CB 3.49Å; N183-S187 PolarHBondContact O-N 3.37Å; N183-S187 PolarHBondContact O-OG 2.75Å; S187-F189 VanDerWaalsContact C-N 3.31Å; S187-F189 PolarHBondContact O-N 3.47Å; S187-N190 PolarHBondContact O-N 3.07Å
188	F	93.4	Very high	87.2	Confident	19 Å²	19	55.3 Å²	55.3	8%	0.083	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-39.6	176.5	179	-98.4	0	0	0	112.1	L150 K154 K184 L185 S186 N190 P417 Y418 L419	L150-F188 HydrophobicContact CB-CE1 4.05Å; K154-F188 HydrophobicContact CB-CE1 4.05Å; K154-F188 HydrophobicContact CB-CZ 4.27Å; K154-F188 HydrophobicContact CD-CD1 4.11Å; K154-F188 HydrophobicContact CD-CD2 4.35Å; K154-F188 HydrophobicContact CD-CE1 3.68Å; K154-F188 HydrophobicContact CD-CE2 3.95Å; K154-F188 HydrophobicContact CD-CG 4.43Å; K154-F188 HydrophobicContact CD-CZ 3.61Å; K154-F188 VanDerWaalsContact CD-O 3.26Å; K154-F188 WeakPolarHBondContact CD-O 3.34Å; K154-F188 WeakPolarHBondContact CE-O 3.33Å; K154-F188 HydrophobicContact CG-CE1 4.47Å; K154-F188 PolarHBondContact NZ-O 3.28Å; K184-F188 WeakPolarHBondContact O-CB 3.3Å; K184-F188 PolarHBondContact O-N 3.29Å; L185-F188 WeakPolarHBondContact O-CB 3.48Å; L185-F188 PolarHBondContact O-N 3.13Å; S186-F188 VanDerWaalsContact C-N 3.26Å; S186-F188 PolarHBondContact O-N 2.97Å; F188-N190 VanDerWaalsContact C-N 3.33Å; F188-N190 PolarHBondContact O-N 3.47Å; F188-P417 HydrophobicContact CE2-CB 4.46Å; F188-P417 WeakPolarHBondContact CE2-O 3.31Å; F188-P417 VanDerWaalsContact CZ-O 3.25Å; F188-P417 WeakPolarHBondContact CZ-O 3.48Å; F188-Y418 WeakPolarHBondContact CE2-O 3.43Å; F188-L419 HydrophobicContact CB-CD1 3.62Å; F188-L419 HydrophobicContact CD1-CD1 4.34Å; F188-L419 HydrophobicContact CD2-CB 4.32Å; F188-L419 HydrophobicContact CD2-CD1 3.95Å; F188-L419 HydrophobicContact CE2-CB 4.32Å; F188-L419 HydrophobicContact CG-CD1 3.71Å
189	F	92.9	Very high	86.6	Confident	5 Å²	5	55.9 Å²	55.9	2%	0.022	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	39.9	175.9	-69.9	-70.1	0	0	0	113.6	F35 L150 K154 V175 L185 S186 S187 N191 C192	F35-F189 HydrophobicContact CB-CB 4.1Å; F35-F189 HydrophobicContact CB-CD1 4.37Å; F35-F189 HydrophobicContact CB-CG 4.28Å; F35-F189 AromaticContact CD1-CD1 3.32Å; F35-F189 HydrophobicContact CD1-CD1 3.32Å; F35-F189 AromaticContact CD1-CE1 3.52Å; F35-F189 HydrophobicContact CD1-CE1 3.52Å; F35-F189 AromaticContact CD1-CG 4Å; F35-F189 HydrophobicContact CD1-CG 4Å; F35-F189 HydrophobicContact CD1-CZ 4.34Å; F35-F189 HydrophobicContact CD2-CD1 4.29Å; F35-F189 AromaticContact CE1-CD1 3.55Å; F35-F189 HydrophobicContact CE1-CD1 3.55Å; F35-F189 AromaticContact CE1-CE1 3.48Å; F35-F189 HydrophobicContact CE1-CE1 3.48Å; F35-F189 VanDerWaalsContact CE1-CE1 3.48Å; F35-F189 HydrophobicContact CE2-CD1 4.47Å; F35-F189 HydrophobicContact CG-CB 4.23Å; F35-F189 AromaticContact CG-CD1 3.74Å; F35-F189 HydrophobicContact CG-CD1 3.74Å; F35-F189 HydrophobicContact CG-CE1 4.39Å; F35-F189 HydrophobicContact CG-CG 4.14Å; F35-F189 HydrophobicContact CZ-CD1 4.13Å; F35-F189 HydrophobicContact CZ-CE1 4.31Å; L150-F189 HydrophobicContact CB-CZ 4.25Å; L150-F189 HydrophobicContact CD2-CE2 3.75Å; L150-F189 HydrophobicContact CD2-CZ 3.58Å; K154-F189 HydrophobicContact CB-CD1 4.2Å; K154-F189 HydrophobicContact CB-CE1 3.85Å; K154-F189 HydrophobicContact CG-CD1 4.43Å; V175-F189 HydrophobicContact CG2-CE2 3.86Å; V175-F189 HydrophobicContact CG2-CZ 4.31Å; L185-F189 WeakPolarHBondContact O-CD2 3.46Å; L185-F189 PolarHBondContact O-N 3.23Å; S186-F189 CarbonylContact O-C 3.58Å; S186-F189 VanDerWaalsContact O-C 3.32Å; S186-F189 PolarHBondContact O-N 3.22Å; S187-F189 VanDerWaalsContact C-N 3.31Å; S187-F189 PolarHBondContact O-N 3.47Å; F189-N191 PolarHBondContact O-N 3.1Å; F189-C192 HydrophobicContact CB-CB 3.92Å; F189-C192 WeakPolarHBondContact O-CB 3.24Å; F189-C192 PolarHBondContact O-N 3.1Å
190	N	90.3	Very high	86.3	Confident	109 Å²	109	61.7 Å²	61.7	58%	0.583	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	46.2	176.5	-54.1	-35	0	0	0	113.3	S186 S187 F188	S186-N190 PolarHBondContact O-N 3.48Å; S187-N190 PolarHBondContact O-N 3.07Å; F188-N190 VanDerWaalsContact C-N 3.33Å; F188-N190 PolarHBondContact O-N 3.47Å
191	N	92.6	Very high	86.6	Confident	123 Å²	123	58.4 Å²	58.4	66%	0.658	32%	0.319	S	S	*	.	S	Bend	trans	57.8	45.5	-177.6	-55.3	-46.2	0	0	0	112.8	S186 F189	S186-N191 WeakPolarHBondContact O-CA 3.46Å; S186-N191 PolarHBondContact O-N 2.9Å; S186-N191 WeakPolarHBondContact OG-CA 3.44Å; F189-N191 PolarHBondContact O-N 3.1Å
192	C	92.7	Very high	86.9	Confident	11 Å²	11	61 Å²	61	7%	0.074	33%	0.329	C	S	.	.			trans	-65.3	152.8	177.6	77.9	0	0	0	0	111.6	F35 I37 S186 F189	F35-C192 HydrophobicContact CB-CB 3.86Å; I37-C192 WeakPolarHBondContact CD1-SG 3.35Å; S186-C192 PolarHBondContact O-N 3.17Å; S186-C192 PolarHBondContact OG-N 2.93Å; S186-C192 PolarHBondContact OG-O 3.09Å; F189-C192 HydrophobicContact CB-CB 3.92Å; F189-C192 WeakPolarHBondContact O-CB 3.24Å; F189-C192 PolarHBondContact O-N 3.1Å
193	P	95.4	Very high	87	Confident	61 Å²	61	65 Å²	65	40%	0.396	36%	0.356	S	S	.	.			trans	-64.3	146.9	-177	21.9	-29.4	0	0	0	112.4	S33 L36 I37	S33-P193 WeakPolarHBondContact OG-CG 3.34Å; L36-P193 HydrophobicContact CD1-CB 4.13Å; L36-P193 HydrophobicContact CD1-CG 3.89Å; I37-P193 PolarHBondContact N-O 3.12Å
194	V	94.6	Very high	87	Confident	60 Å²	60	61 Å²	61	36%	0.364	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.6	174.9	-176.1	0	0	0	0	108.5	I37 T39 T182	I37-V194 HydrophobicContact CB-CG2 4.21Å; I37-V194 HydrophobicContact CD1-CG2 4.25Å; I37-V194 HydrophobicContact CG2-CG1 4.21Å; I37-V194 HydrophobicContact CG2-CG2 4.48Å; I37-V194 CarbonylContact O-C 3.51Å; I37-V194 WeakPolarHBondContact O-CA 3.39Å; T39-V194 HydrophobicContact CG2-CG1 4.5Å; T182-V194 HydrophobicContact CG2-CG1 4.01Å
195	F	94.1	Very high	87.2	Confident	31 Å²	31	60.5 Å²	60.5	14%	0.136	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	109.9	175.4	-167.4	-77.7	0	0	0	109.6	H22 K25 L26 A29 L36 I37 V38 T39 I197	H22-F195 HydrophobicContact CB-CE1 3.92Å; H22-F195 HydrophobicContact CB-CZ 3.91Å; K25-F195 HydrophobicContact CB-CE2 3.9Å; K25-F195 HydrophobicContact CB-CZ 3.98Å; L26-F195 HydrophobicContact CB-CE1 4.19Å; L26-F195 HydrophobicContact CB-CE2 4.46Å; L26-F195 HydrophobicContact CB-CZ 4.07Å; L26-F195 HydrophobicContact CD1-CB 4.42Å; L26-F195 HydrophobicContact CD1-CD1 3.77Å; L26-F195 HydrophobicContact CD1-CD2 4.39Å; L26-F195 HydrophobicContact CD1-CE1 4.11Å; L26-F195 HydrophobicContact CD1-CG 3.93Å; A29-F195 HydrophobicContact CB-CD2 3.97Å; L36-F195 HydrophobicContact CD1-CB 4.3Å; I37-F195 PolarHBondContact O-N 3.3Å; V38-F195 WeakPolarHBondContact CA-O 3.11Å; V38-F195 HydrophobicContact CG2-CB 4.44Å; T39-F195 PolarHBondContact N-O 2.88Å; F195-I197 HydrophobicContact CD1-CG1 4.04Å; F195-I197 HydrophobicContact CE1-CG1 4Å
196	E	91.5	Very high	87.2	Confident	134 Å²	134	62.7 Å²	62.7	63%	0.626	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.6	-179.7	-170.7	173.9	-180	0	0	111.4
197	I	87.9	Confident	87.3	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.01	37%	0.37	C	S	.	.			trans	-102.3	113.4	173.4	-59.5	160.8	0	0	0	107.4	P18 I19 L26 V38 T39 G40 K46 F195 G199	P18-I197 HydrophobicContact CB-CG2 4.19Å; I19-I197 HydrophobicContact CB-CD1 4.29Å; I19-I197 HydrophobicContact CB-CG2 4.33Å; I19-I197 HydrophobicContact CD1-CD1 3.65Å; I19-I197 HydrophobicContact CG1-CD1 3.67Å; I19-I197 HydrophobicContact CG1-CG1 4.48Å; L26-I197 HydrophobicContact CD2-CD1 4.48Å; V38-I197 HydrophobicContact CG1-CD1 3.64Å; V38-I197 HydrophobicContact CG1-CG1 4.41Å; T39-I197 WeakPolarHBondContact O-CB 3.35Å; T39-I197 PolarHBondContact O-N 3.13Å; G40-I197 WeakPolarHBondContact CA-O 3.31Å; K46-I197 HydrophobicContact CD-CD1 4.4Å; K46-I197 HydrophobicContact CG-CD1 3.94Å; F195-I197 HydrophobicContact CD1-CG1 4.04Å; F195-I197 HydrophobicContact CE1-CG1 4Å; I197-G199 PolarHBondContact O-N 3.4Å
198	P	78.6	Confident	87.4	Confident	67 Å²	67	66 Å²	66	44%	0.435	36%	0.363	S	S	.	.			trans	-62.7	134.8	179.6	25	-32.3	0	0	0	110.7	P18 H22	P18-P198 WeakPolarHBondContact CB-O 3.31Å; H22-P198 WeakPolarHBondContact NE2-CD 3.11Å
199	G	67.6	Low	87.3	Confident	38 Å²	38	66.4 Å²	66.4	39%	0.392	37%	0.372	S	S	.	.			trans	-77.2	163.6	177.3	0	0	0	0	0	113.7	E41 I197	E41-G199 WeakPolarHBondContact OE2-CA 3.44Å; I197-G199 PolarHBondContact O-N 3.4Å
200	R	63.7	Low	87.1	Confident	145 Å²	145	72.3 Å²	72.3	55%	0.547	41%	0.409	S	S	.	.			trans	-114.9	82.1	163.9	-73.8	-178.2	-174.1	177.8	6.2	107.5	Q16 P18	Q16-R200 VanDerWaalsContact O-CZ 3.3Å; Q16-R200 PolarHBondContact O-NH1 3Å; P18-R200 HydrophobicContact CG-CB 4.44Å; P18-R200 HydrophobicContact CG-CG 4.05Å
201	V	66.3	Low	86.9	Confident	69 Å²	69	69.2 Å²	69.2	42%	0.418	40%	0.398	S	S	.	.			trans	-106.9	133.4	175.5	-151.7	0	0	0	0	109.6	E41 G365	E41-V201 VanDerWaalsContact OE1-CG2 3.24Å; E41-V201 WeakPolarHBondContact OE1-CG2 3.38Å; E41-V201 WeakPolarHBondContact OE2-CG2 3.23Å; V201-G365 WeakPolarHBondContact CG1-O 3.49Å
202	F	81.1	Confident	86.8	Confident	96 Å²	96	63.5 Å²	63.5	42%	0.421	37%	0.368	S	S	.	.			trans	-78.6	147.1	164.2	-63.3	-86.1	0	0	0	109.6	V204 G365 T367 S368 A369	F202-V204 PolarHBondContact O-N 3.26Å; F202-G365 PolarHBondContact N-O 3.03Å; F202-T367 VanDerWaalsContact CE2-C 3.49Å; F202-T367 WeakPolarHBondContact CE2-O 3.44Å; F202-S368 WeakPolarHBondContact CB-O 3.37Å; F202-A369 HydrophobicContact CB-CB 4.43Å
203	P	86.5	Confident	86.6	Confident	103 Å²	103	63.6 Å²	63.6	67%	0.669	37%	0.37	S	S	*	.			trans	-60	140.1	-177.7	25	-34.3	0	0	0	111.8	A369 G370	P203-A369 HydrophobicContact CG-CB 4.27Å; P203-A369 WeakPolarHBondContact O-CA 3.3Å; P203-G370 PolarHBondContact O-N 3.2Å
204	V	88.9	Confident	86.1	Confident	42 Å²	42	62.8 Å²	62.8	26%	0.255	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.3	175.1	-178.6	0	0	0	0	109.6	F202 A361 A364 G365 G370 C372	F202-V204 PolarHBondContact O-N 3.26Å; V204-A361 HydrophobicContact CG1-CB 4.48Å; V204-A364 HydrophobicContact CG1-CB 4.47Å; V204-A364 HydrophobicContact CG2-CB 4.4Å; V204-G365 VanDerWaalsContact CG2-CA 3.48Å; V204-G370 WeakPolarHBondContact CA-O 3.42Å; V204-C372 HydrophobicContact CG1-CB 4.05Å
205	S	93.2	Very high	85.7	Confident	60 Å²	60	69.7 Å²	69.7	42%	0.42	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.4	173.9	63.2	0	0	0	0	110.3	G370 K371 C372	S205-G370 PolarHBondContact N-O 3.46Å; S205-G370 VanDerWaalsContact N-O 3.12Å; S205-K371 WeakPolarHBondContact O-CA 2.91Å; S205-K371 WeakPolarHBondContact OG-CG 3.5Å; S205-C372 PolarHBondContact O-N 3.06Å
206	S	93.4	Very high	85.2	Confident	55 Å²	55	70.9 Å²	70.9	39%	0.385	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.7	179.1	-60.7	0	0	0	0	111.4	C372	S206-C372 CarbonylContact C-O 3.57Å; S206-C372 WeakPolarHBondContact CA-O 3.06Å
207	M	95.3	Very high	84.6	Confident	77 Å²	77	66.8 Å²	66.8	38%	0.379	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140.5	178.4	-68.9	170.4	-79.4	0	0	110.1	K371 C372 F373 R374	M207-K371 HydrophobicContact CE-CB 4.16Å; M207-K371 HydrophobicContact CE-CD 4.05Å; M207-C372 PolarHBondContact N-O 3.27Å; M207-F373 HydrophobicContact CE-CD1 3.57Å; M207-F373 HydrophobicContact CE-CD2 4.5Å; M207-F373 HydrophobicContact CE-CE1 3.12Å; M207-F373 HydrophobicContact CE-CE2 4.13Å; M207-F373 HydrophobicContact CE-CG 4.25Å; M207-F373 HydrophobicContact CE-CZ 3.44Å; M207-F373 VanDerWaalsContact CE-CZ 3.44Å; M207-F373 HydrophobicContact SD-CD1 4.42Å; M207-F373 HydrophobicContact SD-CE1 4.05Å; M207-R374 WeakPolarHBondContact O-CB 3.36Å; M207-R374 PolarHBondContact O-N 3.23Å
208	F	95.2	Very high	84	Confident	79 Å²	79	75.7 Å²	75.7	35%	0.346	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.2	176.5	-67.5	-85.1	0	0	0	110.4	R374 Y376 K378 W381	F208-R374 CarbonylContact C-O 3.43Å; F208-R374 HydrophobicContact CD1-CB 4.3Å; F208-R374 VanDerWaalsContact CE1-NH1 3.31Å; F208-Y376 HydrophobicContact CD1-CD2 4.15Å; F208-Y376 HydrophobicContact CD1-CE2 4.09Å; F208-Y376 HydrophobicContact CE1-CD2 4.33Å; F208-Y376 AromaticContact CE1-CE2 3.92Å; F208-Y376 HydrophobicContact CE1-CE2 3.92Å; F208-K378 HydrophobicContact CD2-CB 4.38Å; F208-K378 HydrophobicContact CE2-CG 4.44Å; F208-K378 HydrophobicContact CG-CB 4.3Å; F208-W381 HydrophobicContact CE1-CB 3.67Å; F208-W381 AromaticContact CE1-CD2 3.92Å; F208-W381 HydrophobicContact CE1-CD2 3.92Å; F208-W381 HydrophobicContact CE1-CE3 4.02Å; F208-W381 AromaticContact CE1-CG 3.79Å; F208-W381 HydrophobicContact CE1-CG 3.79Å; F208-W381 HydrophobicContact CZ-CB 4.23Å; F208-W381 AromaticContact CZ-CD2 3.99Å; F208-W381 HydrophobicContact CZ-CD2 3.99Å; F208-W381 HydrophobicContact CZ-CE3 4.38Å; F208-W381 AromaticContact CZ-CG 3.92Å; F208-W381 HydrophobicContact CZ-CG 3.92Å
209	G	91.3	Very high	83.6	Confident	27 Å²	27	74 Å²	74	28%	0.278	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-170.1	174.3	0	0	0	0	0	112.1	R374 Y376 T377	G209-R374 WeakPolarHBondContact CA-O 3.33Å; G209-R374 PolarHBondContact N-O 3.44Å; G209-Y376 PolarHBondContact N-O 3.49Å; G209-Y376 CarbonylContact O-C 3.59Å; G209-T377 VanDerWaalsContact O-CA 3.3Å; G209-T377 WeakPolarHBondContact O-CA 3.14Å; G209-T377 PolarHBondContact O-N 3.39Å
210	T	89.8	Confident	83.5	Confident	130 Å²	130	75.5 Å²	75.5	80%	0.798	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	4.9	-175	57	0	0	0	0	113.8
211	A	85.8	Confident	84	Confident	43 Å²	43	77 Å²	77	36%	0.355	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-26.3	-168.8	0	0	0	0	0	114.2	E225 I375	A211-E225 HydrophobicContact CB-CB 4Å; A211-E225 HydrophobicContact CB-CG 3.45Å; A211-E225 VanDerWaalsContact CB-CG 3.45Å; A211-I375 PolarHBondContact N-O 3.41Å; A211-I375 VanDerWaalsContact N-O 3.08Å
212	V	89.1	Confident	85	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.024	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	118.1	177.8	175.3	0	0	0	0	108.6	D216 F332 I375 Y376 T377 F380	V212-D216 HydrophobicContact CG1-CB 3.98Å; V212-F332 HydrophobicContact CG1-CE2 3.92Å; V212-F332 HydrophobicContact CG1-CZ 3.88Å; V212-F332 HydrophobicContact CG2-CE2 4.43Å; V212-I375 HydrophobicContact CG2-CD1 3.85Å; V212-I375 HydrophobicContact CG2-CG1 4.03Å; V212-I375 PolarHBondContact N-O 3.4Å; V212-Y376 CarbonylContact O-C 3.55Å; V212-Y376 VanDerWaalsContact O-CA 3.29Å; V212-Y376 WeakPolarHBondContact O-CA 3.36Å; V212-T377 PolarHBondContact O-N 3.05Å; V212-F380 HydrophobicContact CG1-CD2 4.16Å; V212-F380 HydrophobicContact CG1-CE2 4Å; V212-F380 HydrophobicContact CG1-CG 4.47Å; V212-F380 HydrophobicContact CG1-CZ 4.21Å
213	G	89.1	Confident	85.4	Confident	12 Å²	12	69.9 Å²	69.9	12%	0.124	39%	0.389	C	S	.	.			trans	-114.5	-178	174.3	0	0	0	0	0	112.6	K215 D216 F380	G213-K215 PolarHBondContact O-N 3.35Å; G213-D216 PolarHBondContact N-OD2 3.22Å; G213-D216 WeakPolarHBondContact O-CB 3.19Å; G213-D216 PolarHBondContact O-N 2.92Å; G213-F380 WeakPolarHBondContact O-CD2 3.47Å
214	P	85.7	Confident	85.6	Confident	45 Å²	45	72.5 Å²	72.5	29%	0.292	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-57.3	-20.7	-179.5	-28.2	36	0	0	0	115.7	D216 V217 E379	P214-D216 VanDerWaalsContact C-N 3.29Å; P214-V217 WeakPolarHBondContact O-CG2 3.15Å; P214-E379 HydrophobicContact CG-CB 4.39Å; P214-E379 HydrophobicContact CG-CG 3.77Å
215	K	85.5	Confident	85.8	Confident	204 Å²	204	73.2 Å²	73.2	89%	0.887	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-78.8	-15.3	177.3	-62.8	-178.2	-178.3	177.9	0	113.1	G213	G213-K215 PolarHBondContact O-N 3.35Å
216	D	83.2	Confident	85.8	Confident	56 Å²	56	70.5 Å²	70.5	30%	0.299	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-100.2	12.4	-171.9	-56.3	-61.1	0	0	0	112.7	V212 G213 P214 E218 S219	V212-D216 HydrophobicContact CG1-CB 3.98Å; G213-D216 PolarHBondContact N-OD2 3.22Å; G213-D216 WeakPolarHBondContact O-CB 3.19Å; G213-D216 PolarHBondContact O-N 2.92Å; P214-D216 VanDerWaalsContact C-N 3.29Å; D216-E218 PolarHBondContact O-N 3.37Å; D216-S219 VanDerWaalsContact O-CB 3.25Å; D216-S219 WeakPolarHBondContact O-CB 3.22Å; D216-S219 PolarHBondContact O-N 3.47Å
217	V	78.9	Confident	85.9	Confident	48 Å²	48	68 Å²	68	29%	0.291	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-37.6	-179.3	171.9	0	0	0	0	112.2	P214 F332 P351 F380 C384	P214-V217 WeakPolarHBondContact O-CG2 3.15Å; V217-F332 WeakPolarHBondContact O-CE1 3.28Å; V217-P351 HydrophobicContact CG1-CG 3.86Å; V217-F380 HydrophobicContact CG2-CD2 4.36Å; V217-F380 HydrophobicContact CG2-CE2 3.64Å; V217-F380 HydrophobicContact CG2-CZ 4.48Å; V217-C384 HydrophobicContact CG2-CB 4.02Å
218	E	75.3	Confident	85.9	Confident	190 Å²	190	68.8 Å²	68.8	89%	0.888	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	1.9	178.3	-60.5	-177.8	173.6	0	0	112.8	D216	D216-E218 PolarHBondContact O-N 3.37Å
219	S	70.7	Confident	85.9	Confident	30 Å²	30	66.1 Å²	66.1	21%	0.21	35%	0.346	C	S	.	.			trans	-80.6	138.7	-176.4	-174.5	0	0	0	0	111.5	D216 F221 Y222	D216-S219 VanDerWaalsContact O-CB 3.25Å; D216-S219 WeakPolarHBondContact O-CB 3.22Å; D216-S219 PolarHBondContact O-N 3.47Å; S219-F221 PolarHBondContact OG-N 3.43Å; S219-Y222 WeakPolarHBondContact O-CE1 3.48Å
220	T	66.2	Low	86.2	Confident	70 Å²	70	65 Å²	65	43%	0.429	33%	0.334	S	S	.	.			trans	-105.5	6.2	174.7	53.7	0	0	0	0	112.6	Y222	T220-Y222 VanDerWaalsContact C-N 3.34Å; T220-Y222 PolarHBondContact O-N 3.46Å
221	F	73.6	Confident	86.5	Confident	176 Å²	176	59.6 Å²	59.6	77%	0.772	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	9.6	-168.9	-65.9	-69.5	0	0	0	115.5	S219 V223	S219-F221 PolarHBondContact OG-N 3.43Å; F221-V223 PolarHBondContact O-N 3.31Å
222	Y	87.3	Confident	86.9	Confident	10 Å²	10	61.2 Å²	61.2	4%	0.039	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-9.7	-175.2	55.5	-99	0	0	0	115.3	S219 T220 K224 E225 V226 L246 T247 F332 I375	S219-Y222 WeakPolarHBondContact O-CE1 3.48Å; T220-Y222 VanDerWaalsContact C-N 3.34Å; T220-Y222 PolarHBondContact O-N 3.46Å; Y222-K224 VanDerWaalsContact C-N 3.29Å; Y222-K224 PolarHBondContact O-N 3.28Å; Y222-E225 PolarHBondContact O-N 3.22Å; Y222-E225 VanDerWaalsContact O-N 3.11Å; Y222-V226 HydrophobicContact CD2-CG2 4.17Å; Y222-V226 WeakPolarHBondContact O-CG2 3.3Å; Y222-V226 PolarHBondContact O-N 3.18Å; Y222-L246 HydrophobicContact CD2-CD2 4.28Å; Y222-L246 HydrophobicContact CE2-CD2 3.89Å; Y222-T247 WeakPolarHBondContact OH-CG2 3.38Å; Y222-F332 AromaticContact CD1-CD2 3.77Å; Y222-F332 HydrophobicContact CD1-CD2 3.77Å; Y222-F332 AromaticContact CD1-CE2 3.62Å; Y222-F332 HydrophobicContact CD1-CE2 3.62Å; Y222-F332 HydrophobicContact CD1-CZ 4.39Å; Y222-F332 HydrophobicContact CE1-CB 4.43Å; Y222-F332 AromaticContact CE1-CD2 3.38Å; Y222-F332 HydrophobicContact CE1-CD2 3.38Å; Y222-F332 AromaticContact CE1-CE2 3.65Å; Y222-F332 HydrophobicContact CE1-CE2 3.65Å; Y222-F332 AromaticContact CE1-CG 3.87Å; Y222-F332 HydrophobicContact CE1-CG 3.87Å; Y222-F332 HydrophobicContact CE1-CZ 4.32Å; Y222-F332 HydrophobicContact CE2-CD2 4.18Å; Y222-F332 HydrophobicContact CG-CD2 4.33Å; Y222-F332 HydrophobicContact CG-CE2 4.28Å; Y222-F332 AromaticContact CZ-CD2 3.61Å; Y222-F332 AromaticContact CZ-CG 3.98Å; Y222-I375 HydrophobicContact CD2-CD1 4.11Å; Y222-I375 HydrophobicContact CG-CD1 4.12Å
223	V	90.1	Very high	87.2	Confident	6 Å²	6	61.1 Å²	61.1	4%	0.036	30%	0.302	C	S	.	.	H	α-helix	trans	-56.9	-40.4	-176.2	-179.5	0	0	0	0	112.4	F221 E225 V226 V227 L246 E251 A255	F221-V223 PolarHBondContact O-N 3.31Å; V223-E225 VanDerWaalsContact C-N 3.32Å; V223-E225 PolarHBondContact O-N 3.01Å; V223-V226 PolarHBondContact O-N 3.49Å; V223-V227 WeakPolarHBondContact O-CG2 3.39Å; V223-V227 PolarHBondContact O-N 3.41Å; V223-V227 VanDerWaalsContact O-N 3.08Å; V223-L246 HydrophobicContact CG2-CD2 4.49Å; V223-E251 HydrophobicContact CG2-CB 4.08Å; V223-E251 HydrophobicContact CG2-CG 4Å; V223-A255 HydrophobicContact CG1-CB 3.9Å
224	K	90.4	Very high	87.5	Confident	159 Å²	159	60.5 Å²	60.5	69%	0.691	30%	0.296	S	S	*	.	H	α-helix	trans	-64.6	-37.2	179.8	-71	-174.6	178.8	-177.3	0	112.4	Y222 K228	Y222-K224 VanDerWaalsContact C-N 3.29Å; Y222-K224 PolarHBondContact O-N 3.28Å; K224-K228 PolarHBondContact O-N 3.46Å; K224-K228 VanDerWaalsContact O-N 3.07Å
225	E	92.1	Very high	87.9	Confident	57 Å²	57	59.8 Å²	59.8	27%	0.266	29%	0.291	S	S	.	.	H	α-helix	trans	-72.1	-40.4	177.7	-166.8	70.8	-169.2	0	0	111.1	A211 Y222 V223 V227 K228 V229	A211-E225 HydrophobicContact CB-CB 4Å; A211-E225 HydrophobicContact CB-CG 3.45Å; A211-E225 VanDerWaalsContact CB-CG 3.45Å; Y222-E225 PolarHBondContact O-N 3.22Å; Y222-E225 VanDerWaalsContact O-N 3.11Å; V223-E225 VanDerWaalsContact C-N 3.32Å; V223-E225 PolarHBondContact O-N 3.01Å; E225-V227 VanDerWaalsContact C-N 3.26Å; E225-V227 PolarHBondContact O-N 3.5Å; E225-K228 WeakPolarHBondContact O-CB 3.37Å; E225-K228 PolarHBondContact O-N 2.88Å; E225-K228 VanDerWaalsContact O-N 3.07Å; E225-K228 IonicContact OE1-NZ 2.79Å; E225-K228 PolarHBondContact OE1-NZ 2.78Å; E225-K228 IonicContact OE2-NZ 3.19Å; E225-V229 HydrophobicContact CG-CG2 4.25Å; E225-V229 WeakPolarHBondContact O-CG2 3.34Å; E225-V229 PolarHBondContact O-N 3.48Å
226	V	94.6	Very high	88.3	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-55	-45.4	174.2	172.2	0	0	0	0	111.1	Y222 V223 V229 A230 V244 L246 V328 I375	Y222-V226 HydrophobicContact CD2-CG2 4.17Å; Y222-V226 WeakPolarHBondContact O-CG2 3.3Å; Y222-V226 PolarHBondContact O-N 3.18Å; V223-V226 PolarHBondContact O-N 3.49Å; V226-V229 PolarHBondContact O-N 2.87Å; V226-A230 WeakPolarHBondContact O-CB 3.34Å; V226-A230 PolarHBondContact O-N 2.75Å; V226-V244 HydrophobicContact CG1-CG1 3.15Å; V226-L246 HydrophobicContact CB-CD2 4.28Å; V226-L246 HydrophobicContact CG1-CD2 4.07Å; V226-L246 HydrophobicContact CG1-CG 4.42Å; V226-L246 HydrophobicContact CG2-CD2 4Å; V226-V328 HydrophobicContact CG1-CG1 4.05Å; V226-I375 HydrophobicContact CG2-CD1 3.64Å; V226-I375 HydrophobicContact CG2-CG2 4.06Å
227	V	94.9	Very high	88.8	Confident	3 Å²	3	51 Å²	51	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-45.6	175.7	169.3	0	0	0	0	111.1	V223 E225 A230 L231 A255 L258 L259 K262	V223-V227 WeakPolarHBondContact O-CG2 3.39Å; V223-V227 PolarHBondContact O-N 3.41Å; V223-V227 VanDerWaalsContact O-N 3.08Å; E225-V227 VanDerWaalsContact C-N 3.26Å; E225-V227 PolarHBondContact O-N 3.5Å; V227-A230 PolarHBondContact O-N 2.79Å; V227-L231 HydrophobicContact CG1-CD1 4.07Å; V227-L231 WeakPolarHBondContact O-CG 3.28Å; V227-L231 PolarHBondContact O-N 2.82Å; V227-A255 HydrophobicContact CG2-CB 3.9Å; V227-L258 HydrophobicContact CG1-CB 4.11Å; V227-L258 HydrophobicContact CG2-CB 4.17Å; V227-L259 HydrophobicContact CB-CD2 4.43Å; V227-L259 HydrophobicContact CB-CG 4.46Å; V227-L259 HydrophobicContact CG1-CD2 3.84Å; V227-L259 HydrophobicContact CG1-CG 3.97Å; V227-L259 HydrophobicContact CG2-CG 4.17Å; V227-K262 HydrophobicContact CG1-CD 4.17Å
228	K	94.6	Very high	89.4	Confident	94 Å²	94	55.8 Å²	55.8	41%	0.409	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-50.9	178.2	-178.8	-172	161.8	-153.8	0	111.6	K224 E225 A230 L231 D232	K224-K228 PolarHBondContact O-N 3.46Å; K224-K228 VanDerWaalsContact O-N 3.07Å; E225-K228 WeakPolarHBondContact O-CB 3.37Å; E225-K228 PolarHBondContact O-N 2.88Å; E225-K228 VanDerWaalsContact O-N 3.07Å; E225-K228 IonicContact OE1-NZ 2.79Å; E225-K228 PolarHBondContact OE1-NZ 2.78Å; E225-K228 IonicContact OE2-NZ 3.19Å; K228-A230 VanDerWaalsContact C-N 3.31Å; K228-A230 PolarHBondContact O-N 2.89Å; K228-L231 PolarHBondContact O-N 3.49Å; K228-L231 VanDerWaalsContact O-N 3.12Å; K228-D232 VanDerWaalsContact O-CG 3.26Å; K228-D232 PolarHBondContact O-N 2.92Å
229	V	96	Very high	90.1	Very high	23 Å²	23	49 Å²	49	14%	0.139	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-40	178.6	174.5	0	0	0	0	111.3	E225 V226 L231 D232 V233 V328 F373 I375	E225-V229 HydrophobicContact CG-CG2 4.25Å; E225-V229 WeakPolarHBondContact O-CG2 3.34Å; E225-V229 PolarHBondContact O-N 3.48Å; V226-V229 PolarHBondContact O-N 2.87Å; V229-L231 VanDerWaalsContact C-N 3.32Å; V229-L231 PolarHBondContact O-N 2.88Å; V229-D232 PolarHBondContact O-N 3.03Å; V229-V233 VanDerWaalsContact O-CG2 3.27Å; V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 3.42Å; V229-V328 HydrophobicContact CB-CG1 4.17Å; V229-V328 HydrophobicContact CG1-CG1 3.9Å; V229-V328 HydrophobicContact CG1-CG2 4.18Å; V229-F373 HydrophobicContact CG1-CB 3.8Å; V229-F373 HydrophobicContact CG1-CG 4.31Å; V229-I375 HydrophobicContact CG2-CG2 4.32Å
230	A	96.8	Very high	91.1	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-37	176.3	0	0	0	0	0	112.7	V226 V227 K228 H234 V244 L259 V328	V226-A230 WeakPolarHBondContact O-CB 3.34Å; V226-A230 PolarHBondContact O-N 2.75Å; V227-A230 PolarHBondContact O-N 2.79Å; K228-A230 VanDerWaalsContact C-N 3.31Å; K228-A230 PolarHBondContact O-N 2.89Å; A230-H234 PolarHBondContact O-N 3.43Å; A230-V244 HydrophobicContact CB-CG2 4.1Å; A230-L259 HydrophobicContact CB-CD2 4.09Å; A230-V328 HydrophobicContact CB-CG2 4.28Å
231	L	95.7	Very high	92.5	Very high	17 Å²	17	45.7 Å²	45.7	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-71.7	-41.1	174.1	-67.2	169	0	0	0	112	V227 K228 V229 V233 H234 T235 L259 K262 I266 L280	V227-L231 HydrophobicContact CG1-CD1 4.07Å; V227-L231 WeakPolarHBondContact O-CG 3.28Å; V227-L231 PolarHBondContact O-N 2.82Å; K228-L231 PolarHBondContact O-N 3.49Å; K228-L231 VanDerWaalsContact O-N 3.12Å; V229-L231 VanDerWaalsContact C-N 3.32Å; V229-L231 PolarHBondContact O-N 2.88Å; L231-V233 PolarHBondContact O-N 2.95Å; L231-H234 WeakPolarHBondContact O-CA 3.39Å; L231-H234 WeakPolarHBondContact O-CB 3.44Å; L231-H234 PolarHBondContact O-N 2.96Å; L231-T235 PolarHBondContact O-N 3.34Å; L231-T235 PolarHBondContact O-OG1 3.1Å; L231-T235 VanDerWaalsContact O-OG1 3.12Å; L231-L259 HydrophobicContact CD1-CD2 4.44Å; L231-L259 HydrophobicContact CD2-CD2 3.86Å; L231-L259 HydrophobicContact CG-CD2 3.8Å; L231-K262 HydrophobicContact CD1-CB 3.47Å; L231-K262 VanDerWaalsContact CD1-CB 3.47Å; L231-K262 HydrophobicContact CD1-CD 3.42Å; L231-K262 VanDerWaalsContact CD1-CD 3.42Å; L231-K262 HydrophobicContact CD1-CG 4.11Å; L231-I266 HydrophobicContact CD2-CD1 4.16Å; L231-L280 HydrophobicContact CD2-CD2 4.44Å
232	D	94.9	Very high	93.6	Very high	76 Å²	76	37.4 Å²	37.4	41%	0.406	20%	0.195	S	C	.	.	H	α-helix	trans	-59.2	-39.7	175	-66.3	-20.1	0	0	0	110.6	K228 V229 T235 S236	K228-D232 VanDerWaalsContact O-CG 3.26Å; K228-D232 PolarHBondContact O-N 2.92Å; V229-D232 PolarHBondContact O-N 3.03Å; D232-T235 PolarHBondContact O-OG1 2.81Å; D232-T235 VanDerWaalsContact O-OG1 3.12Å; D232-S236 VanDerWaalsContact O-CB 3.27Å; D232-S236 WeakPolarHBondContact O-CB 3.49Å; D232-S236 PolarHBondContact O-N 2.91Å; D232-S236 PolarHBondContact O-OG 3.42Å
233	V	95.2	Very high	94	Very high	2 Å²	2	37 Å²	37	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-41.7	172.7	170.4	0	0	0	0	111.4	V229 L231 T235 E237 I242 R306 Y326 F373	V229-V233 VanDerWaalsContact O-CG2 3.27Å; V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 3.42Å; L231-V233 PolarHBondContact O-N 2.95Å; V233-T235 VanDerWaalsContact C-N 3.33Å; V233-T235 PolarHBondContact O-N 3.36Å; V233-E237 HydrophobicContact CG1-CB 4.29Å; V233-E237 HydrophobicContact CG1-CG 4.12Å; V233-E237 VanDerWaalsContact O-CB 3.26Å; V233-E237 WeakPolarHBondContact O-CB 3.31Å; V233-E237 PolarHBondContact O-N 3.23Å; V233-E237 VanDerWaalsContact O-N 3.09Å; V233-I242 HydrophobicContact CB-CD1 4.31Å; V233-I242 HydrophobicContact CG1-CD1 3.8Å; V233-I242 HydrophobicContact CG1-CG1 3.96Å; V233-R306 PolarHBondContact O-NH1 3.23Å; V233-Y326 HydrophobicContact CG1-CD1 4.11Å; V233-Y326 HydrophobicContact CG1-CD2 4.16Å; V233-Y326 HydrophobicContact CG1-CG 3.72Å; V233-F373 HydrophobicContact CG1-CE2 4.34Å; V233-F373 HydrophobicContact CG2-CD1 4.26Å; V233-F373 HydrophobicContact CG2-CD2 3.56Å; V233-F373 HydrophobicContact CG2-CE1 4.08Å; V233-F373 HydrophobicContact CG2-CE2 3.37Å; V233-F373 HydrophobicContact CG2-CG 4.01Å; V233-F373 HydrophobicContact CG2-CZ 3.65Å
234	H	95.2	Very high	94.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.8	-42.8	177.3	-177.5	58.6	0	0	0	112.4	A230 L231 I242 Y268	A230-H234 PolarHBondContact O-N 3.43Å; L231-H234 WeakPolarHBondContact O-CA 3.39Å; L231-H234 WeakPolarHBondContact O-CB 3.44Å; L231-H234 PolarHBondContact O-N 2.96Å; H234-I242 HydrophobicContact CB-CD1 4.21Å; H234-Y268 AromaticContact CE1-CE1 3.93Å; H234-Y268 AromaticContact NE2-CE1 3.37Å; H234-Y268 WeakPolarHBondContact NE2-CE1 3.44Å; H234-Y268 AromaticContact NE2-CZ 3.61Å; H234-Y268 PolarHBondContact NE2-OH 3.08Å; H234-Y268 VanDerWaalsContact NE2-OH 3.13Å
235	T	94.3	Very high	94.6	Very high	30 Å²	30	29.3 Å²	29.3	18%	0.184	16%	0.159	C	C	.	.	H	α-helix	trans	-81	-37.5	-176.7	54.9	0	0	0	0	113.6	L231 D232 V233 I266 D271 V272 Q273	L231-T235 PolarHBondContact O-N 3.34Å; L231-T235 PolarHBondContact O-OG1 3.1Å; L231-T235 VanDerWaalsContact O-OG1 3.12Å; D232-T235 PolarHBondContact O-OG1 2.81Å; D232-T235 VanDerWaalsContact O-OG1 3.12Å; V233-T235 VanDerWaalsContact C-N 3.33Å; V233-T235 PolarHBondContact O-N 3.36Å; T235-I266 HydrophobicContact CG2-CD1 4.31Å; T235-D271 VanDerWaalsContact CB-O 3.31Å; T235-D271 WeakPolarHBondContact CB-O 3.23Å; T235-V272 HydrophobicContact CG2-CG2 4.46Å; T235-Q273 PolarHBondContact O-N 3.18Å
236	S	93.3	Very high	94.7	Very high	47 Å²	47	26.6 Å²	26.6	33%	0.329	15%	0.147	S	C	.	.	H	α-helix	trans	-97.7	-26.5	-171.5	67.3	0	0	0	0	115.5	D232 Q273	D232-S236 VanDerWaalsContact O-CB 3.27Å; D232-S236 WeakPolarHBondContact O-CB 3.49Å; D232-S236 PolarHBondContact O-N 2.91Å; D232-S236 PolarHBondContact O-OG 3.42Å; S236-Q273 PolarHBondContact O-OE1 2.71Å
237	E	94.4	Very high	94.6	Very high	27 Å²	27	26.9 Å²	26.9	13%	0.126	15%	0.149	C	C	.	.	S	Bend	trans	-93.6	154.5	-174.4	-66.5	-70.8	166.2	0	0	112.7	V233 R306 Y326 K371 F373	V233-E237 HydrophobicContact CG1-CB 4.29Å; V233-E237 HydrophobicContact CG1-CG 4.12Å; V233-E237 VanDerWaalsContact O-CB 3.26Å; V233-E237 WeakPolarHBondContact O-CB 3.31Å; V233-E237 PolarHBondContact O-N 3.23Å; V233-E237 VanDerWaalsContact O-N 3.09Å; E237-R306 PolarHBondContact O-NH2 3.4Å; E237-Y326 HydrophobicContact CB-CD1 4.31Å; E237-Y326 HydrophobicContact CB-CE1 3.64Å; E237-Y326 HydrophobicContact CB-CE2 4.12Å; E237-Y326 HydrophobicContact CG-CD1 4.19Å; E237-Y326 HydrophobicContact CG-CE1 3.74Å; E237-K371 WeakPolarHBondContact OE1-CD 3.03Å; E237-K371 IonicContact OE1-NZ 3.94Å; E237-K371 PolarHBondContact OE1-NZ 3.47Å; E237-K371 WeakPolarHBondContact OE2-CE 3.26Å; E237-K371 IonicContact OE2-NZ 3.75Å; E237-K371 PolarHBondContact OE2-NZ 3.45Å; E237-F373 HydrophobicContact CG-CZ 4.21Å
238	K	92.1	Very high	94.2	Very high	150 Å²	150	27.1 Å²	27.1	65%	0.652	15%	0.152	S	C	*	.	P	Polyproline II helix	trans	-64.7	171.1	175	-63.2	-174.8	179.1	-176.7	0	112.8	G240 D274 R306 Y326	K238-G240 PolarHBondContact O-N 3.47Å; K238-D274 VanDerWaalsContact CA-OD2 3.26Å; K238-D274 WeakPolarHBondContact CA-OD2 3.37Å; K238-R306 VanDerWaalsContact C-NH2 3.31Å; K238-R306 PolarHBondContact O-NH2 3.19Å; K238-Y326 PolarHBondContact N-OH 3.29Å; K238-Y326 WeakPolarHBondContact O-CE2 3.48Å; K238-Y326 PolarHBondContact O-OH 3.38Å
239	A	89.9	Confident	93.7	Very high	46 Å²	46	25.8 Å²	25.8	38%	0.38	15%	0.147	S	C	.	.	S	Bend	trans	-48.2	137.5	175.8	0	0	0	0	0	113.6	D274 V277 K325	A239-D274 PolarHBondContact N-OD2 3.13Å; A239-V277 HydrophobicContact CB-CG2 4.5Å; A239-K325 PolarHBondContact O-NZ 2.88Å
240	G	92.1	Very high	93.1	Very high	19 Å²	19	28.5 Å²	28.5	20%	0.196	17%	0.167	C	C	.	.			trans	149.6	146.6	-177.6	0	0	0	0	0	111.2	K238 R306	K238-G240 PolarHBondContact O-N 3.47Å; G240-R306 VanDerWaalsContact O-CD 3.23Å; G240-R306 WeakPolarHBondContact O-CD 3.11Å; G240-R306 WeakPolarHBondContact O-CG 3.28Å; G240-R306 PolarHBondContact O-NE 3.45Å
241	D	95	Very high	92.7	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.07	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	153.8	-175.7	-65.4	-25.7	0	0	0	111.9	K307 G323 I324 K325 Y326	D241-K307 WeakPolarHBondContact CA-O 3.26Å; D241-K307 HydrophobicContact CB-CB 4.2Å; D241-K307 WeakPolarHBondContact CB-O 3.49Å; D241-K307 WeakPolarHBondContact OD1-CB 3.13Å; D241-K307 PolarHBondContact OD1-N 3.13Å; D241-K307 VanDerWaalsContact OD2-CE 3.25Å; D241-K307 WeakPolarHBondContact OD2-CE 3.47Å; D241-K307 IonicContact OD2-NZ 3.44Å; D241-G323 WeakPolarHBondContact CB-O 3.4Å; D241-G323 PolarHBondContact N-O 3.16Å; D241-I324 HydrophobicContact CB-CD1 3.75Å; D241-K325 PolarHBondContact O-N 2.92Å; D241-Y326 PolarHBondContact O-N 3.36Å; D241-Y326 VanDerWaalsContact O-N 3.09Å
242	I	96.6	Very high	92.5	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.3	-178.2	-53.4	171.1	0	0	0	109.1	V233 H234 V244 K307 C308 V309 Y326 V328	V233-I242 HydrophobicContact CB-CD1 4.31Å; V233-I242 HydrophobicContact CG1-CD1 3.8Å; V233-I242 HydrophobicContact CG1-CG1 3.96Å; H234-I242 HydrophobicContact CB-CD1 4.21Å; I242-V244 HydrophobicContact CG2-CG2 3.89Å; I242-K307 PolarHBondContact N-O 3.46Å; I242-C308 HydrophobicContact CB-CB 4.3Å; I242-C308 WeakPolarHBondContact O-CA 3.48Å; I242-V309 PolarHBondContact O-N 3.25Å; I242-Y326 CarbonylContact C-O 3.59Å; I242-Y326 WeakPolarHBondContact CA-O 3.41Å; I242-Y326 HydrophobicContact CG1-CD2 4.44Å; I242-V328 HydrophobicContact CG2-CG2 4.09Å
243	L	96.3	Very high	92.2	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	120.5	168.7	176.9	62.2	0	0	0	109.6	F245 V309 A311 A315 I321 I324 Y326 I327 V328 R363	L243-F245 HydrophobicContact CD2-CE1 4.46Å; L243-F245 HydrophobicContact CD2-CE2 3.96Å; L243-F245 HydrophobicContact CD2-CZ 3.66Å; L243-F245 HydrophobicContact CG-CE2 4.07Å; L243-F245 HydrophobicContact CG-CZ 4.09Å; L243-V309 WeakPolarHBondContact CA-O 3.18Å; L243-V309 HydrophobicContact CD1-CB 3.98Å; L243-V309 HydrophobicContact CD1-CG1 4.1Å; L243-A311 HydrophobicContact CD1-CB 3.86Å; L243-A315 HydrophobicContact CD1-CB 3.97Å; L243-A315 HydrophobicContact CD2-CB 4.05Å; L243-I321 HydrophobicContact CD1-CD1 4.26Å; L243-I324 HydrophobicContact CB-CD1 3.95Å; L243-I324 HydrophobicContact CB-CG1 4.28Å; L243-I324 HydrophobicContact CB-CG2 3.77Å; L243-Y326 PolarHBondContact N-O 3.48Å; L243-I327 HydrophobicContact CB-CD1 3.82Å; L243-I327 HydrophobicContact CD2-CD1 4.07Å; L243-I327 HydrophobicContact CG-CD1 4.31Å; L243-I327 CarbonylContact O-C 3.57Å; L243-I327 WeakPolarHBondContact O-CA 3.45Å; L243-V328 PolarHBondContact O-N 2.96Å; L243-R363 HydrophobicContact CD2-CB 4.31Å
244	V	97.1	Very high	91.8	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.9	-178	-177.6	0	0	0	0	109.4	V226 A230 I242 L246 V309 V310 A311 V328	V226-V244 HydrophobicContact CG1-CG1 3.15Å; A230-V244 HydrophobicContact CB-CG2 4.1Å; I242-V244 HydrophobicContact CG2-CG2 3.89Å; V244-L246 HydrophobicContact CG1-CG 4.42Å; V244-V309 PolarHBondContact N-O 2.95Å; V244-V310 HydrophobicContact CB-CB 4.48Å; V244-V310 HydrophobicContact CB-CG1 4.28Å; V244-V310 HydrophobicContact CB-CG2 4.3Å; V244-V310 HydrophobicContact CG1-CG1 4.25Å; V244-V310 HydrophobicContact CG2-CG2 4.46Å; V244-A311 PolarHBondContact O-N 3.2Å; V244-V328 WeakPolarHBondContact CA-O 3.34Å; V244-V328 HydrophobicContact CB-CB 4.48Å; V244-V328 HydrophobicContact CG1-CB 4.32Å; V244-V328 HydrophobicContact CG2-CB 4.11Å; V244-V328 HydrophobicContact CG2-CG2 4.36Å
245	F	96.1	Very high	91.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.7	175.8	-70.6	-78.3	0	0	0	112.2	L243 A311 A315 A316 I327 V328 S330 R360	L243-F245 HydrophobicContact CD2-CE1 4.46Å; L243-F245 HydrophobicContact CD2-CE2 3.96Å; L243-F245 HydrophobicContact CD2-CZ 3.66Å; L243-F245 HydrophobicContact CG-CE2 4.07Å; L243-F245 HydrophobicContact CG-CZ 4.09Å; F245-A311 WeakPolarHBondContact CA-O 3.28Å; F245-A315 HydrophobicContact CE1-CB 4.03Å; F245-A315 HydrophobicContact CZ-CB 4.44Å; F245-A316 HydrophobicContact CE1-CB 3.89Å; F245-A316 HydrophobicContact CZ-CB 4.28Å; F245-I327 HydrophobicContact CD2-CG2 3.88Å; F245-I327 HydrophobicContact CE2-CG2 3.8Å; F245-V328 PolarHBondContact N-O 2.79Å; F245-S330 WeakPolarHBondContact O-CB 3.29Å; F245-S330 PolarHBondContact O-OG 2.84Å; F245-R360 HydrophobicContact CD1-CG 4.28Å; F245-R360 HydrophobicContact CD2-CB 3.99Å; F245-R360 HydrophobicContact CD2-CG 3.92Å; F245-R360 HydrophobicContact CE1-CG 4.06Å; F245-R360 HydrophobicContact CE2-CB 3.58Å; F245-R360 HydrophobicContact CE2-CG 3.68Å; F245-R360 HydrophobicContact CG-CG 4.21Å; F245-R360 HydrophobicContact CZ-CB 4.02Å; F245-R360 HydrophobicContact CZ-CG 3.75Å
246	L	94.6	Very high	91.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.179	C	C	.	.			trans	-130.2	172.6	172.3	-70.9	178.2	0	0	0	110.4	Y222 V223 V226 V244 E251 I252 A255 V310 A311 T312	Y222-L246 HydrophobicContact CD2-CD2 4.28Å; Y222-L246 HydrophobicContact CE2-CD2 3.89Å; V223-L246 HydrophobicContact CG2-CD2 4.49Å; V226-L246 HydrophobicContact CB-CD2 4.28Å; V226-L246 HydrophobicContact CG1-CD2 4.07Å; V226-L246 HydrophobicContact CG1-CG 4.42Å; V226-L246 HydrophobicContact CG2-CD2 4Å; V244-L246 HydrophobicContact CG1-CG 4.42Å; L246-E251 HydrophobicContact CD1-CB 4.46Å; L246-I252 HydrophobicContact CB-CG1 3.89Å; L246-I252 HydrophobicContact CD1-CG1 4.37Å; L246-A255 HydrophobicContact CD1-CB 3.5Å; L246-V310 HydrophobicContact CD1-CG1 3.65Å; L246-V310 HydrophobicContact CG-CG1 4.27Å; L246-A311 PolarHBondContact N-O 3.01Å; L246-T312 WeakPolarHBondContact O-CA 3.43Å
247	T	90.7	Very high	91.5	Very high	8 Å²	8	36.2 Å²	36.2	5%	0.049	19%	0.191	C	C	.	.	S	Bend	trans	-95.2	-23.3	-165	74.7	0	0	0	0	114.9	Y222 E251 F332 K334 V349	Y222-T247 WeakPolarHBondContact OH-CG2 3.38Å; T247-E251 PolarHBondContact N-OE2 3.46Å; T247-E251 PolarHBondContact OG1-OE1 3.08Å; T247-E251 PolarHBondContact OG1-OE2 3.24Å; T247-F332 HydrophobicContact CG2-CB 3.51Å; T247-K334 WeakPolarHBondContact O-CD 3.03Å; T247-K334 WeakPolarHBondContact OG1-CE 3.46Å; T247-V349 HydrophobicContact CG2-CG1 4.04Å
248	G	88	Confident	91.4	Very high	8 Å²	8	36.9 Å²	36.9	8%	0.082	20%	0.196	C	C	.	.	S	Bend	trans	-169.9	175.4	178.6	0	0	0	0	0	115.5	S250 E251 I252	G248-S250 PolarHBondContact O-N 3.2Å; G248-E251 PolarHBondContact O-N 2.93Å; G248-E251 VanDerWaalsContact O-N 3.13Å; G248-I252 WeakPolarHBondContact O-CG1 3.36Å; G248-I252 PolarHBondContact O-N 3.46Å
249	Q	84.3	Confident	91.5	Very high	65 Å²	65	29.9 Å²	29.9	30%	0.304	17%	0.165	S	C	.	.	H	α-helix	trans	-49	-54.3	-171.9	174.9	174	4.3	0	0	113.8	E251 I252 E253 Y286 S288	Q249-E251 PolarHBondContact O-N 2.94Å; Q249-I252 PolarHBondContact O-N 3.44Å; Q249-I252 VanDerWaalsContact O-N 3.11Å; Q249-E253 HydrophobicContact CG-CG 4.32Å; Q249-E253 WeakPolarHBondContact CG-OE1 3.42Å; Q249-E253 PolarHBondContact NE2-OE1 3.46Å; Q249-E253 PolarHBondContact O-N 3.14Å; Q249-Y286 HydrophobicContact CB-CD1 4.33Å; Q249-Y286 HydrophobicContact CB-CD2 3.99Å; Q249-Y286 HydrophobicContact CB-CE1 4.37Å; Q249-Y286 HydrophobicContact CB-CE2 4.08Å; Q249-Y286 HydrophobicContact CB-CG 4.14Å; Q249-Y286 HydrophobicContact CG-CD1 4.35Å; Q249-Y286 HydrophobicContact CG-CD2 4.1Å; Q249-Y286 HydrophobicContact CG-CE1 3.9Å; Q249-Y286 HydrophobicContact CG-CE2 3.65Å; Q249-Y286 HydrophobicContact CG-CG 4.45Å; Q249-Y286 PolarHBondContact NE2-OH 2.94Å; Q249-S288 PolarHBondContact OE1-OG 3.2Å
250	S	81.9	Confident	91.6	Very high	81 Å²	81	33.4 Å²	33.4	57%	0.566	17%	0.172	S	C	*	.	H	α-helix	trans	-63.1	-29.8	-175.2	-50	0	0	0	0	113.6	G248 R254	G248-S250 PolarHBondContact O-N 3.2Å; S250-R254 WeakPolarHBondContact O-CB 3.24Å; S250-R254 PolarHBondContact O-N 3.12Å
251	E	88.3	Confident	91.6	Very high	18 Å²	18	38 Å²	38	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-77	-41.1	174.9	-69.7	166.9	-157.4	0	0	111	V223 L246 T247 G248 Q249 R254 A255	V223-E251 HydrophobicContact CG2-CB 4.08Å; V223-E251 HydrophobicContact CG2-CG 4Å; L246-E251 HydrophobicContact CD1-CB 4.46Å; T247-E251 PolarHBondContact N-OE2 3.46Å; T247-E251 PolarHBondContact OG1-OE1 3.08Å; T247-E251 PolarHBondContact OG1-OE2 3.24Å; G248-E251 PolarHBondContact O-N 2.93Å; G248-E251 VanDerWaalsContact O-N 3.13Å; Q249-E251 PolarHBondContact O-N 2.94Å; E251-R254 PolarHBondContact O-N 3.24Å; E251-A255 VanDerWaalsContact O-CB 3.28Å; E251-A255 WeakPolarHBondContact O-CB 3.41Å; E251-A255 PolarHBondContact O-N 3.46Å
252	I	91.4	Very high	91.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-49.3	179	-69.6	168.8	0	0	0	110.8	L246 G248 Q249 R254 A255 C256 P284 Y286 V310 T312	L246-I252 HydrophobicContact CB-CG1 3.89Å; L246-I252 HydrophobicContact CD1-CG1 4.37Å; G248-I252 WeakPolarHBondContact O-CG1 3.36Å; G248-I252 PolarHBondContact O-N 3.46Å; Q249-I252 PolarHBondContact O-N 3.44Å; Q249-I252 VanDerWaalsContact O-N 3.11Å; I252-R254 PolarHBondContact O-N 3.27Å; I252-A255 PolarHBondContact O-N 3.18Å; I252-C256 PolarHBondContact O-N 2.86Å; I252-C256 PolarHBondContact O-SG 2.98Å; I252-P284 HydrophobicContact CG2-CB 3.58Å; I252-Y286 HydrophobicContact CB-CD1 4.3Å; I252-Y286 HydrophobicContact CD1-CD1 4.11Å; I252-Y286 HydrophobicContact CD1-CG 4.48Å; I252-Y286 HydrophobicContact CG2-CD1 4Å; I252-Y286 HydrophobicContact CG2-CE1 4.37Å; I252-V310 HydrophobicContact CB-CG1 4.33Å; I252-V310 HydrophobicContact CG1-CG1 4.15Å; I252-V310 HydrophobicContact CG2-CB 4.13Å; I252-V310 HydrophobicContact CG2-CG1 3.98Å; I252-V310 WeakPolarHBondContact CG2-O 3.41Å; I252-T312 HydrophobicContact CD1-CG2 3.52Å
253	E	88.5	Confident	91.2	Very high	50 Å²	50	42.5 Å²	42.5	23%	0.234	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-46.8	179.1	-71.2	176.4	-179.8	0	0	110.8	Q249 A255 C256 D257 Y286	Q249-E253 HydrophobicContact CG-CG 4.32Å; Q249-E253 WeakPolarHBondContact CG-OE1 3.42Å; Q249-E253 PolarHBondContact NE2-OE1 3.46Å; Q249-E253 PolarHBondContact O-N 3.14Å; E253-A255 VanDerWaalsContact C-N 3.31Å; E253-A255 PolarHBondContact O-N 3.23Å; E253-C256 WeakPolarHBondContact O-CB 3.42Å; E253-C256 PolarHBondContact O-N 3.32Å; E253-C256 VanDerWaalsContact O-N 3.14Å; E253-D257 PolarHBondContact O-N 2.99Å; E253-Y286 HydrophobicContact CG-CE1 4.24Å; E253-Y286 PolarHBondContact OE1-OH 2.87Å
254	R	87.9	Confident	91	Very high	142 Å²	142	48.8 Å²	48.8	54%	0.536	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-40.8	175.3	-172.7	-172.9	-59.3	157.8	2	112.5	S250 E251 I252 L258	S250-R254 WeakPolarHBondContact O-CB 3.24Å; S250-R254 PolarHBondContact O-N 3.12Å; E251-R254 PolarHBondContact O-N 3.24Å; I252-R254 PolarHBondContact O-N 3.27Å; R254-L258 HydrophobicContact CG-CD1 4.19Å; R254-L258 WeakPolarHBondContact O-CB 3.45Å; R254-L258 VanDerWaalsContact O-CG 3.26Å; R254-L258 WeakPolarHBondContact O-CG 3.37Å; R254-L258 PolarHBondContact O-N 3.23Å
255	A	93.2	Very high	90.6	Very high	1 Å²	1	55 Å²	55	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-39.2	177.1	0	0	0	0	0	111.6	V223 V227 L246 E251 I252 E253 L258 L259 V310	V223-A255 HydrophobicContact CG1-CB 3.9Å; V227-A255 HydrophobicContact CG2-CB 3.9Å; L246-A255 HydrophobicContact CD1-CB 3.5Å; E251-A255 VanDerWaalsContact O-CB 3.28Å; E251-A255 WeakPolarHBondContact O-CB 3.41Å; E251-A255 PolarHBondContact O-N 3.46Å; I252-A255 PolarHBondContact O-N 3.18Å; E253-A255 VanDerWaalsContact C-N 3.31Å; E253-A255 PolarHBondContact O-N 3.23Å; A255-L258 PolarHBondContact O-N 3.42Å; A255-L259 VanDerWaalsContact O-CB 3.28Å; A255-L259 WeakPolarHBondContact O-CB 3.34Å; A255-L259 WeakPolarHBondContact O-CG 3.3Å; A255-L259 PolarHBondContact O-N 3.18Å; A255-V310 HydrophobicContact CB-CG1 4.28Å
256	C	93.3	Very high	90.3	Very high	16 Å²	16	56.2 Å²	56.2	11%	0.108	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-45.5	176.1	-66.1	0	0	0	0	111.3	I252 E253 L258 L259 F260 I282	I252-C256 PolarHBondContact O-N 2.86Å; I252-C256 PolarHBondContact O-SG 2.98Å; E253-C256 WeakPolarHBondContact O-CB 3.42Å; E253-C256 PolarHBondContact O-N 3.32Å; E253-C256 VanDerWaalsContact O-N 3.14Å; C256-L258 PolarHBondContact O-N 3.21Å; C256-L259 PolarHBondContact O-N 3.43Å; C256-F260 WeakPolarHBondContact O-CB 3.12Å; C256-F260 PolarHBondContact O-N 2.92Å; C256-I282 HydrophobicContact CB-CG2 3.9Å
257	D	89.9	Confident	90.1	Very high	109 Å²	109	59.7 Å²	59.7	58%	0.583	30%	0.298	S	S	*	.	H	α-helix	trans	-60.5	-46.5	177.1	-67.1	-22.1	0	0	0	111.1	E253 F260 E261	E253-D257 PolarHBondContact O-N 2.99Å; D257-F260 PolarHBondContact O-N 3.34Å; D257-E261 WeakPolarHBondContact O-CB 3.44Å; D257-E261 PolarHBondContact O-N 2.9Å
258	L	91.9	Very high	90	Very high	42 Å²	42	61.9 Å²	61.9	22%	0.22	31%	0.305	C	S	.	.	H	α-helix	trans	-66.8	-36.2	177.7	-71.9	172.3	0	0	0	113	V227 R254 A255 C256 F260 K262	V227-L258 HydrophobicContact CG1-CB 4.11Å; V227-L258 HydrophobicContact CG2-CB 4.17Å; R254-L258 HydrophobicContact CG-CD1 4.19Å; R254-L258 WeakPolarHBondContact O-CB 3.45Å; R254-L258 VanDerWaalsContact O-CG 3.26Å; R254-L258 WeakPolarHBondContact O-CG 3.37Å; R254-L258 PolarHBondContact O-N 3.23Å; A255-L258 PolarHBondContact O-N 3.42Å; C256-L258 PolarHBondContact O-N 3.21Å; L258-F260 VanDerWaalsContact C-N 3.34Å; L258-K262 WeakPolarHBondContact O-CB 3.47Å; L258-K262 VanDerWaalsContact O-CG 3.32Å; L258-K262 WeakPolarHBondContact O-CG 3.45Å; L258-K262 PolarHBondContact O-N 2.86Å; L258-K262 VanDerWaalsContact O-N 3.16Å
259	L	94.4	Very high	89.9	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-42.1	173.8	-80.5	166.7	0	0	0	110.4	V227 A230 L231 A255 C256 A263 I282 V310	V227-L259 HydrophobicContact CB-CD2 4.43Å; V227-L259 HydrophobicContact CB-CG 4.46Å; V227-L259 HydrophobicContact CG1-CD2 3.84Å; V227-L259 HydrophobicContact CG1-CG 3.97Å; V227-L259 HydrophobicContact CG2-CG 4.17Å; A230-L259 HydrophobicContact CB-CD2 4.09Å; L231-L259 HydrophobicContact CD1-CD2 4.44Å; L231-L259 HydrophobicContact CD2-CD2 3.86Å; L231-L259 HydrophobicContact CG-CD2 3.8Å; A255-L259 VanDerWaalsContact O-CB 3.28Å; A255-L259 WeakPolarHBondContact O-CB 3.34Å; A255-L259 WeakPolarHBondContact O-CG 3.3Å; A255-L259 PolarHBondContact O-N 3.18Å; C256-L259 PolarHBondContact O-N 3.43Å; L259-A263 WeakPolarHBondContact O-CB 3.41Å; L259-A263 PolarHBondContact O-N 3.14Å; L259-I282 HydrophobicContact CB-CD1 3.6Å; L259-I282 HydrophobicContact CB-CG1 4.29Å; L259-I282 HydrophobicContact CD1-CG2 4.35Å; L259-V310 HydrophobicContact CD1-CG2 3.81Å
260	F	93	Very high	90	Very high	119 Å²	119	77.2 Å²	77.2	52%	0.522	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-53.6	179.8	-174.7	-91	0	0	0	111	C256 D257 L258 K262 A263 E264 I282	C256-F260 WeakPolarHBondContact O-CB 3.12Å; C256-F260 PolarHBondContact O-N 2.92Å; D257-F260 PolarHBondContact O-N 3.34Å; L258-F260 VanDerWaalsContact C-N 3.34Å; F260-K262 VanDerWaalsContact C-N 3.28Å; F260-K262 PolarHBondContact O-N 3.45Å; F260-A263 PolarHBondContact O-N 2.73Å; F260-A263 VanDerWaalsContact O-N 3.09Å; F260-E264 HydrophobicContact CD1-CG 4.41Å; F260-E264 VanDerWaalsContact CE1-CD 3.46Å; F260-E264 HydrophobicContact CE1-CG 4.06Å; F260-E264 WeakPolarHBondContact CE1-OE1 3.5Å; F260-E264 HydrophobicContact CZ-CG 4.36Å; F260-E264 WeakPolarHBondContact CZ-OE1 3.44Å; F260-E264 PolarHBondContact O-N 2.84Å; F260-I282 HydrophobicContact CB-CD1 4.02Å
261	E	91.9	Very high	90.3	Very high	116 Å²	116	77.4 Å²	77.4	54%	0.542	35%	0.354	S	S	.	.	H	α-helix	trans	-54.7	-43.2	178	-176.9	-171.1	172.8	0	0	112	D257 N265	D257-E261 WeakPolarHBondContact O-CB 3.44Å; D257-E261 PolarHBondContact O-N 2.9Å; E261-N265 PolarHBondContact O-ND2 2.93Å
262	K	92.1	Very high	90.4	Very high	93 Å²	93	76.9 Å²	76.9	40%	0.404	35%	0.352	S	S	.	.	H	α-helix	trans	-74.8	-35.2	178.7	-71.9	-175.9	174.9	-168.6	0	112.9	V227 L231 L258 F260 E264 N265	V227-K262 HydrophobicContact CG1-CD 4.17Å; L231-K262 HydrophobicContact CD1-CB 3.47Å; L231-K262 VanDerWaalsContact CD1-CB 3.47Å; L231-K262 HydrophobicContact CD1-CD 3.42Å; L231-K262 VanDerWaalsContact CD1-CD 3.42Å; L231-K262 HydrophobicContact CD1-CG 4.11Å; L258-K262 WeakPolarHBondContact O-CB 3.47Å; L258-K262 VanDerWaalsContact O-CG 3.32Å; L258-K262 WeakPolarHBondContact O-CG 3.45Å; L258-K262 PolarHBondContact O-N 2.86Å; L258-K262 VanDerWaalsContact O-N 3.16Å; F260-K262 VanDerWaalsContact C-N 3.28Å; F260-K262 PolarHBondContact O-N 3.45Å; K262-E264 VanDerWaalsContact C-N 3.29Å; K262-E264 PolarHBondContact O-N 3.42Å; K262-N265 PolarHBondContact O-N 2.82Å
263	A	90.8	Very high	90.3	Very high	15 Å²	15	84 Å²	84	12%	0.124	39%	0.385	C	S	.	.	H	α-helix	trans	-67.7	-28.9	178.8	0	0	0	0	0	112.6	L259 F260 N265 I266 L280	L259-A263 WeakPolarHBondContact O-CB 3.41Å; L259-A263 PolarHBondContact O-N 3.14Å; F260-A263 PolarHBondContact O-N 2.73Å; F260-A263 VanDerWaalsContact O-N 3.09Å; A263-N265 PolarHBondContact O-N 3.34Å; A263-I266 HydrophobicContact CB-CD1 4.48Å; A263-I266 PolarHBondContact O-N 3.01Å; A263-L280 HydrophobicContact CB-CD2 4.16Å
264	E	91	Very high	90.3	Very high	135 Å²	135	83.1 Å²	83.1	63%	0.631	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.9	173.4	-73.6	-173.8	140.4	0	0	113.2	F260 K262	F260-E264 HydrophobicContact CD1-CG 4.41Å; F260-E264 VanDerWaalsContact CE1-CD 3.46Å; F260-E264 HydrophobicContact CE1-CG 4.06Å; F260-E264 WeakPolarHBondContact CE1-OE1 3.5Å; F260-E264 HydrophobicContact CZ-CG 4.36Å; F260-E264 WeakPolarHBondContact CZ-OE1 3.44Å; F260-E264 PolarHBondContact O-N 2.84Å; K262-E264 VanDerWaalsContact C-N 3.29Å; K262-E264 PolarHBondContact O-N 3.42Å
265	N	90.4	Very high	90.2	Very high	132 Å²	132	87 Å²	87	71%	0.706	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	1.1	-179.6	-67.2	-66.3	0	0	0	113.6	E261 K262 A263	E261-N265 PolarHBondContact O-ND2 2.93Å; K262-N265 PolarHBondContact O-N 2.82Å; A263-N265 PolarHBondContact O-N 3.34Å
266	I	89.8	Confident	89.9	Confident	27 Å²	27	91 Å²	91	14%	0.138	42%	0.421	C	S	.	.			trans	-85.7	122.2	-178.2	-62.6	179.1	0	0	0	109.7	L231 T235 A263 Y268 D271 V272	L231-I266 HydrophobicContact CD2-CD1 4.16Å; T235-I266 HydrophobicContact CG2-CD1 4.31Å; A263-I266 HydrophobicContact CB-CD1 4.48Å; A263-I266 PolarHBondContact O-N 3.01Å; I266-Y268 HydrophobicContact CB-CE2 4.4Å; I266-Y268 HydrophobicContact CG2-CD2 4.33Å; I266-Y268 HydrophobicContact CG2-CE2 4.26Å; I266-Y268 PolarHBondContact O-N 2.88Å; I266-D271 HydrophobicContact CG2-CB 3.89Å; I266-V272 HydrophobicContact CG2-CG2 3.81Å
267	D	89.4	Confident	89.7	Confident	73 Å²	73	90.6 Å²	90.6	39%	0.39	42%	0.418	S	S	.	.			trans	-87.5	102.8	166.7	-169.6	-25.1	0	0	0	109.6	R269 Y270 D271	D267-R269 PolarHBondContact O-N 3.25Å; D267-R269 VanDerWaalsContact OD1-CB 3.31Å; D267-R269 WeakPolarHBondContact OD1-CB 3.47Å; D267-R269 PolarHBondContact OD1-N 3.07Å; D267-Y270 HydrophobicContact CB-CD2 4.3Å; D267-Y270 PolarHBondContact O-N 3.19Å; D267-Y270 VanDerWaalsContact OD2-CD2 3.31Å; D267-Y270 WeakPolarHBondContact OD2-CD2 3.5Å; D267-D271 PolarHBondContact N-OD2 3.04Å; D267-D271 WeakPolarHBondContact O-CB 3.36Å; D267-D271 PolarHBondContact O-N 2.88Å
268	Y	89.4	Confident	89.8	Confident	55 Å²	55	92.3 Å²	92.3	22%	0.216	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-14.7	-179.4	-74.6	-93.8	0	0	0	114.4	H234 I266 V272 V277 E278 G279 L280	H234-Y268 AromaticContact CE1-CE1 3.93Å; H234-Y268 AromaticContact NE2-CE1 3.37Å; H234-Y268 WeakPolarHBondContact NE2-CE1 3.44Å; H234-Y268 AromaticContact NE2-CZ 3.61Å; H234-Y268 PolarHBondContact NE2-OH 3.08Å; H234-Y268 VanDerWaalsContact NE2-OH 3.13Å; I266-Y268 HydrophobicContact CB-CE2 4.4Å; I266-Y268 HydrophobicContact CG2-CD2 4.33Å; I266-Y268 HydrophobicContact CG2-CE2 4.26Å; I266-Y268 PolarHBondContact O-N 2.88Å; Y268-V272 HydrophobicContact CD1-CB 4.3Å; Y268-V272 HydrophobicContact CD1-CG2 3.64Å; Y268-V272 HydrophobicContact CE1-CG2 4.01Å; Y268-V272 HydrophobicContact CG-CG2 4.25Å; Y268-V277 WeakPolarHBondContact CD1-O 3.33Å; Y268-V277 HydrophobicContact CE1-CG1 4.41Å; Y268-E278 VanDerWaalsContact CD1-C 3.5Å; Y268-E278 VanDerWaalsContact CE1-C 3.48Å; Y268-G279 VanDerWaalsContact CE1-N 3.31Å; Y268-G279 WeakPolarHBondContact OH-CA 3.36Å; Y268-L280 PolarHBondContact OH-N 2.95Å
269	R	85.5	Confident	89.8	Confident	208 Å²	208	90.9 Å²	90.9	79%	0.785	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-28.5	175.7	-62.1	179	177.8	176.3	1.3	113.1	D267	D267-R269 PolarHBondContact O-N 3.25Å; D267-R269 VanDerWaalsContact OD1-CB 3.31Å; D267-R269 WeakPolarHBondContact OD1-CB 3.47Å; D267-R269 PolarHBondContact OD1-N 3.07Å
270	Y	86.1	Confident	89.8	Confident	187 Å²	187	92.2 Å²	92.2	73%	0.733	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-38.1	-172.2	-60.2	-72.2	0	0	0	113.1	D267	D267-Y270 HydrophobicContact CB-CD2 4.3Å; D267-Y270 PolarHBondContact O-N 3.19Å; D267-Y270 VanDerWaalsContact OD2-CD2 3.31Å; D267-Y270 WeakPolarHBondContact OD2-CD2 3.5Å
271	D	87.3	Confident	89.8	Confident	84 Å²	84	89.6 Å²	89.6	45%	0.449	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-24.4	-171.2	-62.8	-33.6	0	0	0	112.9	T235 I266 D267	T235-D271 VanDerWaalsContact CB-O 3.31Å; T235-D271 WeakPolarHBondContact CB-O 3.23Å; I266-D271 HydrophobicContact CG2-CB 3.89Å; D267-D271 PolarHBondContact N-OD2 3.04Å; D267-D271 WeakPolarHBondContact O-CB 3.36Å; D267-D271 PolarHBondContact O-N 2.88Å
272	V	90.1	Very high	90	Very high	7 Å²	7	85.4 Å²	85.4	4%	0.042	40%	0.397	C	S	.	.			trans	-101.2	120.3	-178.4	-177.2	0	0	0	0	110.4	T235 I266 Y268 V277	T235-V272 HydrophobicContact CG2-CG2 4.46Å; I266-V272 HydrophobicContact CG2-CG2 3.81Å; Y268-V272 HydrophobicContact CD1-CB 4.3Å; Y268-V272 HydrophobicContact CD1-CG2 3.64Å; Y268-V272 HydrophobicContact CE1-CG2 4.01Å; Y268-V272 HydrophobicContact CG-CG2 4.25Å; V272-V277 HydrophobicContact CG1-CB 4.27Å
273	Q	89.6	Confident	90.1	Very high	150 Å²	150	81.9 Å²	81.9	70%	0.701	38%	0.383	S	S	*	.	S	Bend	trans	-69.8	-35.1	-177	-66.3	-173.8	6.6	0	0	112.8	T235 S236	T235-Q273 PolarHBondContact O-N 3.18Å; S236-Q273 PolarHBondContact O-OE1 2.71Å
274	D	88.4	Confident	90.1	Very high	31 Å²	31	83 Å²	83	17%	0.166	39%	0.389	C	S	.	.			trans	-91.8	104	178.1	-168.2	-17.6	0	0	0	111.2	K238 A239 T276 V277	K238-D274 VanDerWaalsContact CA-OD2 3.26Å; K238-D274 WeakPolarHBondContact CA-OD2 3.37Å; A239-D274 PolarHBondContact N-OD2 3.13Å; D274-T276 PolarHBondContact O-N 3.17Å; D274-T276 VanDerWaalsContact O-N 3.09Å; D274-T276 WeakPolarHBondContact OD1-CB 3.49Å; D274-T276 WeakPolarHBondContact OD1-CG2 3.48Å; D274-T276 PolarHBondContact OD1-N 3.46Å; D274-T276 PolarHBondContact OD1-OG1 2.84Å; D274-T276 PolarHBondContact OD2-OG1 3.27Å; D274-V277 HydrophobicContact CB-CG2 4.39Å; D274-V277 PolarHBondContact O-N 3.13Å
275	R	86.8	Confident	90	Very high	225 Å²	225	76.7 Å²	76.7	85%	0.849	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-9.1	179.8	-62.7	-175.9	179.8	175.5	-0.3	114.6
276	T	87.7	Confident	89.8	Confident	85 Å²	85	71.4 Å²	71.4	52%	0.521	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-10.6	171.9	66.1	0	0	0	0	112.4	D274 G304	D274-T276 PolarHBondContact O-N 3.17Å; D274-T276 VanDerWaalsContact O-N 3.09Å; D274-T276 WeakPolarHBondContact OD1-CB 3.49Å; D274-T276 WeakPolarHBondContact OD1-CG2 3.48Å; D274-T276 PolarHBondContact OD1-N 3.46Å; D274-T276 PolarHBondContact OD1-OG1 2.84Å; D274-T276 PolarHBondContact OD2-OG1 3.27Å; T276-G304 VanDerWaalsContact O-CA 3.27Å; T276-G304 WeakPolarHBondContact O-CA 3.4Å
277	V	88.8	Confident	89.1	Confident	7 Å²	7	72 Å²	72	4%	0.042	34%	0.342	C	S	.	.			trans	-104.1	119.3	178.9	-177.4	0	0	0	0	109.6	A239 Y268 V272 D274 G304 R306	A239-V277 HydrophobicContact CB-CG2 4.5Å; Y268-V277 WeakPolarHBondContact CD1-O 3.33Å; Y268-V277 HydrophobicContact CE1-CG1 4.41Å; V272-V277 HydrophobicContact CG1-CB 4.27Å; D274-V277 HydrophobicContact CB-CG2 4.39Å; D274-V277 PolarHBondContact O-N 3.13Å; V277-G304 CarbonylContact C-O 3.54Å; V277-G304 WeakPolarHBondContact CA-O 3.23Å; V277-R306 HydrophobicContact CG1-CB 4.01Å
278	E	90.4	Very high	88.1	Confident	145 Å²	145	70.2 Å²	70.2	68%	0.678	34%	0.335	S	S	*	.			trans	-117.1	-4	-175.3	-60.1	-179.1	175.4	0	0	112.3	Y268 G304	Y268-E278 VanDerWaalsContact CD1-C 3.5Å; Y268-E278 VanDerWaalsContact CE1-C 3.48Å; E278-G304 PolarHBondContact N-O 3.09Å
279	G	92	Very high	87.2	Confident	12 Å²	12	67.9 Å²	67.9	12%	0.124	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	166.9	-177.7	0	0	0	0	0	114.3	Y268 R306	Y268-G279 VanDerWaalsContact CE1-N 3.31Å; Y268-G279 WeakPolarHBondContact OH-CA 3.36Å; G279-R306 PolarHBondContact O-N 3.47Å
280	L	94.4	Very high	86.3	Confident	30 Å²	30	60.7 Å²	60.7	16%	0.157	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.2	175.7	-173.7	61.5	0	0	0	110.1	L231 A263 Y268 I282 R306 C308	L231-L280 HydrophobicContact CD2-CD2 4.44Å; A263-L280 HydrophobicContact CB-CD2 4.16Å; Y268-L280 PolarHBondContact OH-N 2.95Å; L280-I282 HydrophobicContact CD2-CD1 4.34Å; L280-I282 HydrophobicContact CD2-CG1 4.13Å; L280-I282 HydrophobicContact CG-CG1 4.04Å; L280-R306 CarbonylContact C-O 3.58Å; L280-R306 WeakPolarHBondContact CA-O 3.3Å; L280-R306 HydrophobicContact CD1-CB 4.25Å; L280-R306 HydrophobicContact CD1-CG 4.38Å; L280-C308 HydrophobicContact CD1-CB 3.73Å; L280-C308 HydrophobicContact CG-CB 4.42Å
281	L	94.8	Very high	85.3	Confident	64 Å²	64	54.1 Å²	54.1	34%	0.335	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	111.6	173.3	176.5	63.1	0	0	0	109.6	L283 I305 R306 K307 C308	L281-L283 HydrophobicContact CD1-CD2 4.23Å; L281-L283 HydrophobicContact CD2-CD1 4.17Å; L281-L283 HydrophobicContact CD2-CG 4.48Å; L281-L283 HydrophobicContact CG-CD1 4.31Å; L281-L283 HydrophobicContact CG-CD2 4.32Å; L281-L283 HydrophobicContact CG-CG 4.1Å; L281-I305 HydrophobicContact CB-CG2 3.7Å; L281-R306 PolarHBondContact N-O 3.34Å; L281-K307 CarbonylContact O-C 3.58Å; L281-C308 PolarHBondContact O-N 2.68Å
282	I	95.5	Very high	84.4	Confident	29 Å²	29	55.4 Å²	55.4	15%	0.149	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.3	-177.4	-57.8	159.4	0	0	0	109.5	C256 L259 F260 L280 C308	C256-I282 HydrophobicContact CB-CG2 3.9Å; L259-I282 HydrophobicContact CB-CD1 3.6Å; L259-I282 HydrophobicContact CB-CG1 4.29Å; L259-I282 HydrophobicContact CD1-CG2 4.35Å; F260-I282 HydrophobicContact CB-CD1 4.02Å; L280-I282 HydrophobicContact CD2-CD1 4.34Å; L280-I282 HydrophobicContact CD2-CG1 4.13Å; L280-I282 HydrophobicContact CG-CG1 4.04Å; I282-C308 WeakPolarHBondContact CA-O 3.34Å
283	L	93.4	Very high	83.5	Confident	19 Å²	19	59.4 Å²	59.4	10%	0.099	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	123.4	-178.4	-62.2	174.8	0	0	0	111.3	L281 I297 K307 C308 V309 V310	L281-L283 HydrophobicContact CD1-CD2 4.23Å; L281-L283 HydrophobicContact CD2-CD1 4.17Å; L281-L283 HydrophobicContact CD2-CG 4.48Å; L281-L283 HydrophobicContact CG-CD1 4.31Å; L281-L283 HydrophobicContact CG-CD2 4.32Å; L281-L283 HydrophobicContact CG-CG 4.1Å; L283-I297 HydrophobicContact CB-CG1 4.25Å; L283-I297 HydrophobicContact CD1-CG1 4.26Å; L283-K307 HydrophobicContact CD1-CD 3.89Å; L283-K307 HydrophobicContact CD1-CG 4.05Å; L283-C308 PolarHBondContact N-O 2.92Å; L283-V309 CarbonylContact O-C 3.59Å; L283-V309 WeakPolarHBondContact O-CA 3.3Å; L283-V310 PolarHBondContact O-N 3.19Å
284	P	92.3	Very high	82.9	Confident	38 Å²	38	53.3 Å²	53.3	25%	0.247	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	152.4	172.4	30.2	-31.9	0	0	0	111.5	I252 Y286 M289 V310	I252-P284 HydrophobicContact CG2-CB 3.58Å; P284-Y286 HydrophobicContact CB-CD1 4.37Å; P284-Y286 HydrophobicContact CB-CE1 4.09Å; P284-M289 VanDerWaalsContact C-SD 3.52Å; P284-M289 HydrophobicContact CB-CE 4.38Å; P284-M289 HydrophobicContact CB-SD 4.18Å; P284-M289 HydrophobicContact CG-CE 3.83Å; P284-M289 HydrophobicContact CG-SD 4.27Å; P284-M289 VanDerWaalsContact O-CE 3.27Å; P284-M289 WeakPolarHBondContact O-CE 3.25Å; P284-V310 CarbonylContact C-O 3.53Å; P284-V310 WeakPolarHBondContact CA-O 3.29Å
285	L	88.9	Confident	82.3	Confident	3 Å²	3	59 Å²	59	2%	0.016	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	105.6	173.6	178	53.6	0	0	0	111.9	M289 Q294 I297 V309 V310 A311 T312 I314 A315 I321	L285-M289 VanDerWaalsContact CA-SD 3.53Å; L285-Q294 HydrophobicContact CD1-CG 4.29Å; L285-I297 HydrophobicContact CB-CD1 3.68Å; L285-I297 HydrophobicContact CD1-CD1 3.57Å; L285-I297 HydrophobicContact CD2-CD1 4.07Å; L285-I297 HydrophobicContact CG-CD1 3.91Å; L285-V309 HydrophobicContact CB-CG1 3.99Å; L285-V309 HydrophobicContact CD2-CG1 4.29Å; L285-V310 PolarHBondContact N-O 2.97Å; L285-A311 HydrophobicContact CB-CB 3.81Å; L285-A311 HydrophobicContact CD2-CB 4Å; L285-A311 HydrophobicContact CG-CB 4.12Å; L285-A311 CarbonylContact O-C 3.54Å; L285-A311 VanDerWaalsContact O-CA 3.23Å; L285-A311 WeakPolarHBondContact O-CA 3.45Å; L285-T312 PolarHBondContact O-N 3.23Å; L285-T312 VanDerWaalsContact O-N 3.08Å; L285-I314 HydrophobicContact CD1-CG2 4.09Å; L285-I314 HydrophobicContact CD2-CG2 3.92Å; L285-I314 HydrophobicContact CG-CG2 3.61Å; L285-A315 HydrophobicContact CD2-CB 4.19Å; L285-I321 HydrophobicContact CD2-CD1 4.23Å
286	Y	84.8	Confident	82.1	Confident	21 Å²	21	52.9 Å²	52.9	8%	0.082	28%	0.283	C	S	.	.			trans	-145.7	165	173.8	54.1	-98.3	0	0	0	111.9	Q249 I252 E253 P284 S288 M289 Q294	Q249-Y286 HydrophobicContact CB-CD1 4.33Å; Q249-Y286 HydrophobicContact CB-CD2 3.99Å; Q249-Y286 HydrophobicContact CB-CE1 4.37Å; Q249-Y286 HydrophobicContact CB-CE2 4.08Å; Q249-Y286 HydrophobicContact CB-CG 4.14Å; Q249-Y286 HydrophobicContact CG-CD1 4.35Å; Q249-Y286 HydrophobicContact CG-CD2 4.1Å; Q249-Y286 HydrophobicContact CG-CE1 3.9Å; Q249-Y286 HydrophobicContact CG-CE2 3.65Å; Q249-Y286 HydrophobicContact CG-CG 4.45Å; Q249-Y286 PolarHBondContact NE2-OH 2.94Å; I252-Y286 HydrophobicContact CB-CD1 4.3Å; I252-Y286 HydrophobicContact CD1-CD1 4.11Å; I252-Y286 HydrophobicContact CD1-CG 4.48Å; I252-Y286 HydrophobicContact CG2-CD1 4Å; I252-Y286 HydrophobicContact CG2-CE1 4.37Å; E253-Y286 HydrophobicContact CG-CE1 4.24Å; E253-Y286 PolarHBondContact OE1-OH 2.87Å; P284-Y286 HydrophobicContact CB-CD1 4.37Å; P284-Y286 HydrophobicContact CB-CE1 4.09Å; Y286-S288 WeakPolarHBondContact CD2-OG 3.44Å; Y286-S288 VanDerWaalsContact CE2-OG 3.25Å; Y286-S288 WeakPolarHBondContact CE2-OG 3.2Å; Y286-S288 PolarHBondContact O-N 2.64Å; Y286-M289 HydrophobicContact CD1-CG 3.93Å; Y286-M289 HydrophobicContact CD1-SD 3.81Å; Y286-M289 HydrophobicContact CD2-CG 3.49Å; Y286-M289 VanDerWaalsContact CD2-CG 3.49Å; Y286-M289 HydrophobicContact CD2-SD 4.41Å; Y286-M289 HydrophobicContact CE1-CG 3.76Å; Y286-M289 HydrophobicContact CE1-SD 3.81Å; Y286-M289 HydrophobicContact CE2-CB 4.36Å; Y286-M289 HydrophobicContact CE2-CG 3.26Å; Y286-M289 HydrophobicContact CE2-SD 4.37Å; Y286-M289 HydrophobicContact CG-CG 3.8Å; Y286-M289 HydrophobicContact CG-SD 4.12Å; Y286-M289 VanDerWaalsContact CZ-CG 3.4Å; Y286-M289 PolarHBondContact N-SD 3.04Å; Y286-M289 VanDerWaalsContact N-SD 3.37Å; Y286-M289 WeakPolarHBondContact O-CB 3.5Å; Y286-M289 WeakPolarHBondContact O-CG 3.46Å; Y286-M289 PolarHBondContact O-N 3.43Å; Y286-Q294 PolarHBondContact O-NE2 3.4Å
287	G	75.1	Confident	82	Confident	39 Å²	39	49 Å²	49	40%	0.402	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-44.7	-168.6	0	0	0	0	0	114.8	M289 Q294	G287-M289 PolarHBondContact O-N 3.44Å; G287-Q294 PolarHBondContact O-NE2 3.18Å
288	S	69.4	Low	81.7	Confident	36 Å²	36	53.1 Å²	53.1	25%	0.252	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	1	-176.8	52.5	0	0	0	0	115.4	Q249 Y286 E488	Q249-S288 PolarHBondContact OE1-OG 3.2Å; Y286-S288 WeakPolarHBondContact CD2-OG 3.44Å; Y286-S288 VanDerWaalsContact CE2-OG 3.25Å; Y286-S288 WeakPolarHBondContact CE2-OG 3.2Å; Y286-S288 PolarHBondContact O-N 2.64Å; S288-E488 VanDerWaalsContact CA-OE2 3.26Å; S288-E488 WeakPolarHBondContact CA-OE2 3.23Å; S288-E488 WeakPolarHBondContact CB-OE2 3.39Å
289	M	70.5	Confident	81.5	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.025	27%	0.273	C	S	.	.	S	Bend	trans	-68.3	145.7	179.2	-69.8	-176.2	67.3	0	0	112.9	P284 L285 Y286 G287 Q293 Q294 R548	P284-M289 VanDerWaalsContact C-SD 3.52Å; P284-M289 HydrophobicContact CB-CE 4.38Å; P284-M289 HydrophobicContact CB-SD 4.18Å; P284-M289 HydrophobicContact CG-CE 3.83Å; P284-M289 HydrophobicContact CG-SD 4.27Å; P284-M289 VanDerWaalsContact O-CE 3.27Å; P284-M289 WeakPolarHBondContact O-CE 3.25Å; L285-M289 VanDerWaalsContact CA-SD 3.53Å; Y286-M289 HydrophobicContact CD1-CG 3.93Å; Y286-M289 HydrophobicContact CD1-SD 3.81Å; Y286-M289 HydrophobicContact CD2-CG 3.49Å; Y286-M289 VanDerWaalsContact CD2-CG 3.49Å; Y286-M289 HydrophobicContact CD2-SD 4.41Å; Y286-M289 HydrophobicContact CE1-CG 3.76Å; Y286-M289 HydrophobicContact CE1-SD 3.81Å; Y286-M289 HydrophobicContact CE2-CB 4.36Å; Y286-M289 HydrophobicContact CE2-CG 3.26Å; Y286-M289 HydrophobicContact CE2-SD 4.37Å; Y286-M289 HydrophobicContact CG-CG 3.8Å; Y286-M289 HydrophobicContact CG-SD 4.12Å; Y286-M289 VanDerWaalsContact CZ-CG 3.4Å; Y286-M289 PolarHBondContact N-SD 3.04Å; Y286-M289 VanDerWaalsContact N-SD 3.37Å; Y286-M289 WeakPolarHBondContact O-CB 3.5Å; Y286-M289 WeakPolarHBondContact O-CG 3.46Å; Y286-M289 PolarHBondContact O-N 3.43Å; G287-M289 PolarHBondContact O-N 3.44Å; M289-Q293 HydrophobicContact CE-CB 3.8Å; M289-Q294 HydrophobicContact CB-CG 3.87Å; M289-Q294 PolarHBondContact O-NE2 3.49Å; M289-R548 PolarHBondContact O-NH1 2.96Å
290	P	65.3	Low	81.3	Confident	57 Å²	57	56 Å²	56	37%	0.37	30%	0.302	S	S	.	.			trans	-57.1	143.1	168.9	-23.8	33.6	0	0	0	113.2	D292 Q293 Q294	P290-D292 VanDerWaalsContact C-N 3.28Å; P290-D292 PolarHBondContact O-N 3.26Å; P290-Q293 PolarHBondContact O-N 3.02Å; P290-Q293 VanDerWaalsContact O-N 3.14Å; P290-Q294 PolarHBondContact O-N 3.48Å
291	T	65.6	Low	81.1	Confident	50 Å²	50	56.1 Å²	56.1	31%	0.307	30%	0.304	S	S	.	.	H	α-helix	trans	-57.2	-38.3	-177.4	-50.4	0	0	0	0	113	Q293 Q294 R295 R548	T291-Q293 VanDerWaalsContact C-N 3.33Å; T291-Q293 PolarHBondContact O-N 3.09Å; T291-Q294 PolarHBondContact O-N 2.83Å; T291-R295 WeakPolarHBondContact O-CG 3.33Å; T291-R295 PolarHBondContact O-N 3.37Å; T291-R548 PolarHBondContact OG1-NH1 2.91Å; T291-R548 PolarHBondContact OG1-NH2 3.17Å
292	D	67.8	Low	80.9	Confident	111 Å²	111	56.3 Å²	56.3	59%	0.594	31%	0.31	S	S	*	.	H	α-helix	trans	-66.9	-36.1	-178.7	-61.1	-38.3	0	0	0	112	P290 R295 Q296	P290-D292 VanDerWaalsContact C-N 3.28Å; P290-D292 PolarHBondContact O-N 3.26Å; D292-R295 PolarHBondContact O-N 3.42Å; D292-R295 IonicContact OD1-NH1 2.73Å; D292-Q296 PolarHBondContact O-N 2.76Å
293	Q	71.9	Confident	80.6	Confident	91 Å²	91	61.1 Å²	61.1	43%	0.425	34%	0.343	S	S	.	.	H	α-helix	trans	-70.3	-41	173.1	-67.4	-177.7	-11.1	0	0	111.4	M289 P290 T291 R295 Q296	M289-Q293 HydrophobicContact CE-CB 3.8Å; P290-Q293 PolarHBondContact O-N 3.02Å; P290-Q293 VanDerWaalsContact O-N 3.14Å; T291-Q293 VanDerWaalsContact C-N 3.33Å; T291-Q293 PolarHBondContact O-N 3.09Å; Q293-R295 PolarHBondContact O-N 2.97Å; Q293-Q296 WeakPolarHBondContact O-CB 3.37Å; Q293-Q296 PolarHBondContact O-N 3.39Å
294	Q	76.1	Confident	80.4	Confident	22 Å²	22	61.5 Å²	61.5	10%	0.103	35%	0.351	C	S	.	.	H	α-helix	trans	-60.2	-34.4	174.7	-69.2	-178.1	0.6	0	0	112	L285 Y286 G287 M289 P290 T291 Q296 I297	L285-Q294 HydrophobicContact CD1-CG 4.29Å; Y286-Q294 PolarHBondContact O-NE2 3.4Å; G287-Q294 PolarHBondContact O-NE2 3.18Å; M289-Q294 HydrophobicContact CB-CG 3.87Å; M289-Q294 PolarHBondContact O-NE2 3.49Å; P290-Q294 PolarHBondContact O-N 3.48Å; T291-Q294 PolarHBondContact O-N 2.83Å; Q294-Q296 VanDerWaalsContact C-N 3.33Å; Q294-Q296 PolarHBondContact O-N 3.36Å; Q294-I297 PolarHBondContact O-N 3.4Å
295	R	77.3	Confident	80.5	Confident	149 Å²	149	62.4 Å²	62.4	56%	0.562	35%	0.353	S	S	*	.	H	α-helix	trans	-66.1	-31.5	177.9	-77.6	173.3	178.4	173.9	-3.7	113.5	T291 D292 Q293 I297 F298	T291-R295 WeakPolarHBondContact O-CG 3.33Å; T291-R295 PolarHBondContact O-N 3.37Å; D292-R295 PolarHBondContact O-N 3.42Å; D292-R295 IonicContact OD1-NH1 2.73Å; Q293-R295 PolarHBondContact O-N 2.97Å; R295-I297 PolarHBondContact O-N 3.43Å; R295-F298 PolarHBondContact O-N 3.16Å
296	Q	81.5	Confident	80.8	Confident	97 Å²	97	62.5 Å²	62.5	45%	0.453	35%	0.354	S	S	.	.	H	α-helix	trans	-60.6	-29.3	179.9	-69.1	177.2	-8.8	0	0	112.3	D292 Q293 Q294 F298 Q299	D292-Q296 PolarHBondContact O-N 2.76Å; Q293-Q296 WeakPolarHBondContact O-CB 3.37Å; Q293-Q296 PolarHBondContact O-N 3.39Å; Q294-Q296 VanDerWaalsContact C-N 3.33Å; Q294-Q296 PolarHBondContact O-N 3.36Å; Q296-F298 PolarHBondContact O-N 3.1Å; Q296-Q299 WeakPolarHBondContact O-CB 3.35Å; Q296-Q299 PolarHBondContact O-N 2.83Å; Q296-Q299 VanDerWaalsContact O-N 3.1Å
297	I	85.4	Confident	81.3	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.015	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-28.8	-179	-63.3	155.4	0	0	0	112.4	L283 L285 Q294 R295 Q299 K307 V309 I321	L283-I297 HydrophobicContact CB-CG1 4.25Å; L283-I297 HydrophobicContact CD1-CG1 4.26Å; L285-I297 HydrophobicContact CB-CD1 3.68Å; L285-I297 HydrophobicContact CD1-CD1 3.57Å; L285-I297 HydrophobicContact CD2-CD1 4.07Å; L285-I297 HydrophobicContact CG-CD1 3.91Å; Q294-I297 PolarHBondContact O-N 3.4Å; R295-I297 PolarHBondContact O-N 3.43Å; I297-Q299 VanDerWaalsContact C-N 3.32Å; I297-K307 PolarHBondContact O-NZ 3.23Å; I297-V309 HydrophobicContact CG2-CG1 3.94Å; I297-V309 HydrophobicContact CG2-CG2 3.94Å; I297-I321 HydrophobicContact CG2-CD1 3.62Å; I297-I321 HydrophobicContact CG2-CG1 3.95Å; I297-I321 HydrophobicContact CG2-CG2 4.2Å
298	F	83.9	Confident	82.3	Confident	95 Å²	95	59.9 Å²	59.9	42%	0.417	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-12.9	177.8	-58.5	-72.3	0	0	0	113.2	R295 Q296 L319	R295-F298 PolarHBondContact O-N 3.16Å; Q296-F298 PolarHBondContact O-N 3.1Å; F298-L319 HydrophobicContact CE1-CD2 4.46Å; F298-L319 HydrophobicContact CZ-CD1 4.17Å; F298-L319 HydrophobicContact CZ-CD2 3.91Å; F298-L319 HydrophobicContact CZ-CG 4.44Å
299	Q	86.3	Confident	83.5	Confident	128 Å²	128	58.2 Å²	58.2	60%	0.598	32%	0.32	S	S	*	.	S	Bend	trans	-73.3	146.1	176.6	-61.1	-179.2	-7.5	0	0	109.9	Q296 I297 K307	Q296-Q299 WeakPolarHBondContact O-CB 3.35Å; Q296-Q299 PolarHBondContact O-N 2.83Å; Q296-Q299 VanDerWaalsContact O-N 3.1Å; I297-Q299 VanDerWaalsContact C-N 3.32Å; Q299-K307 PolarHBondContact O-NZ 3.45Å
300	A	87.2	Confident	84.8	Confident	89 Å²	89	58 Å²	58	74%	0.736	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-68.1	139.5	172	0	0	0	0	0	109
301	P	89.6	Confident	86.1	Confident	32 Å²	32	55.2 Å²	55.2	21%	0.208	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-65.2	156.2	171.3	29.9	-33.8	0	0	0	110.2	I305 K307	P301-I305 HydrophobicContact CB-CB 4.47Å; P301-I305 VanDerWaalsContact CB-O 3.31Å; P301-I305 WeakPolarHBondContact CB-O 3.44Å; P301-I305 WeakPolarHBondContact CG-O 3.34Å; P301-K307 HydrophobicContact CB-CB 4.2Å; P301-K307 HydrophobicContact CG-CB 4.18Å
302	P	91.5	Very high	87.3	Confident	69 Å²	69	53.6 Å²	53.6	45%	0.448	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-55.3	152.7	170	-24.2	34.8	0	0	0	111.8	G304 I305	P302-G304 PolarHBondContact O-N 3.23Å; P302-I305 HydrophobicContact CB-CD1 3.86Å; P302-I305 HydrophobicContact CB-CG1 4.24Å; P302-I305 HydrophobicContact CG-CD1 3.94Å; P302-I305 WeakPolarHBondContact O-CB 3.43Å; P302-I305 PolarHBondContact O-N 3.2Å
303	P	89.5	Confident	88.3	Confident	130 Å²	130	50.9 Å²	50.9	84%	0.844	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	135.7	176.4	-24.8	34	0	0	0	111.5	I305	P303-I305 PolarHBondContact O-N 3.42Å
304	G	89.4	Confident	88.7	Confident	26 Å²	26	47.5 Å²	47.5	27%	0.268	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-7.1	-177.7	0	0	0	0	0	115.4	T276 V277 E278 P302	T276-G304 VanDerWaalsContact O-CA 3.27Å; T276-G304 WeakPolarHBondContact O-CA 3.4Å; V277-G304 CarbonylContact C-O 3.54Å; V277-G304 WeakPolarHBondContact CA-O 3.23Å; E278-G304 PolarHBondContact N-O 3.09Å; P302-G304 PolarHBondContact O-N 3.23Å
305	I	93.3	Very high	89.1	Confident	58 Å²	58	46.6 Å²	46.6	30%	0.297	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	128.1	179.5	-57.6	-173.7	0	0	0	110.2	L281 P301 P302 P303	L281-I305 HydrophobicContact CB-CG2 3.7Å; P301-I305 HydrophobicContact CB-CB 4.47Å; P301-I305 VanDerWaalsContact CB-O 3.31Å; P301-I305 WeakPolarHBondContact CB-O 3.44Å; P301-I305 WeakPolarHBondContact CG-O 3.34Å; P302-I305 HydrophobicContact CB-CD1 3.86Å; P302-I305 HydrophobicContact CB-CG1 4.24Å; P302-I305 HydrophobicContact CG-CD1 3.94Å; P302-I305 WeakPolarHBondContact O-CB 3.43Å; P302-I305 PolarHBondContact O-N 3.2Å; P303-I305 PolarHBondContact O-N 3.42Å
306	R	94.6	Very high	89.2	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.019	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	133.4	171.7	-174.6	172.5	-60.1	-170.9	5.1	110.1	V233 E237 K238 G240 V277 G279 L280 L281	V233-R306 PolarHBondContact O-NH1 3.23Å; E237-R306 PolarHBondContact O-NH2 3.4Å; K238-R306 VanDerWaalsContact C-NH2 3.31Å; K238-R306 PolarHBondContact O-NH2 3.19Å; G240-R306 VanDerWaalsContact O-CD 3.23Å; G240-R306 WeakPolarHBondContact O-CD 3.11Å; G240-R306 WeakPolarHBondContact O-CG 3.28Å; G240-R306 PolarHBondContact O-NE 3.45Å; V277-R306 HydrophobicContact CG1-CB 4.01Å; G279-R306 PolarHBondContact O-N 3.47Å; L280-R306 CarbonylContact C-O 3.58Å; L280-R306 WeakPolarHBondContact CA-O 3.3Å; L280-R306 HydrophobicContact CD1-CB 4.25Å; L280-R306 HydrophobicContact CD1-CG 4.38Å; L281-R306 PolarHBondContact N-O 3.34Å
307	K	95.4	Very high	88.4	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.017	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	131.1	173	-171.4	172.6	53.1	-178.1	0	110.4	D241 I242 L281 L283 I297 Q299 P301 V309	D241-K307 WeakPolarHBondContact CA-O 3.26Å; D241-K307 HydrophobicContact CB-CB 4.2Å; D241-K307 WeakPolarHBondContact CB-O 3.49Å; D241-K307 WeakPolarHBondContact OD1-CB 3.13Å; D241-K307 PolarHBondContact OD1-N 3.13Å; D241-K307 VanDerWaalsContact OD2-CE 3.25Å; D241-K307 WeakPolarHBondContact OD2-CE 3.47Å; D241-K307 IonicContact OD2-NZ 3.44Å; I242-K307 PolarHBondContact N-O 3.46Å; L281-K307 CarbonylContact O-C 3.58Å; L283-K307 HydrophobicContact CD1-CD 3.89Å; L283-K307 HydrophobicContact CD1-CG 4.05Å; I297-K307 PolarHBondContact O-NZ 3.23Å; Q299-K307 PolarHBondContact O-NZ 3.45Å; P301-K307 HydrophobicContact CB-CB 4.2Å; P301-K307 HydrophobicContact CG-CB 4.18Å; K307-V309 HydrophobicContact CD-CG2 4.17Å; K307-V309 HydrophobicContact CG-CG2 3.96Å
308	C	96.4	Very high	87.2	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	109.4	172.2	-177.5	0	0	0	0	109.2	I242 L280 L281 I282 L283	I242-C308 HydrophobicContact CB-CB 4.3Å; I242-C308 WeakPolarHBondContact O-CA 3.48Å; L280-C308 HydrophobicContact CD1-CB 3.73Å; L280-C308 HydrophobicContact CG-CB 4.42Å; L281-C308 PolarHBondContact O-N 2.68Å; I282-C308 WeakPolarHBondContact CA-O 3.34Å; L283-C308 PolarHBondContact N-O 2.92Å
309	V	95.8	Very high	86.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.1	179.6	-173.6	0	0	0	0	108.9	I242 L243 V244 L283 L285 I297 K307 A311 I321	I242-V309 PolarHBondContact O-N 3.25Å; L243-V309 WeakPolarHBondContact CA-O 3.18Å; L243-V309 HydrophobicContact CD1-CB 3.98Å; L243-V309 HydrophobicContact CD1-CG1 4.1Å; V244-V309 PolarHBondContact N-O 2.95Å; L283-V309 CarbonylContact O-C 3.59Å; L283-V309 WeakPolarHBondContact O-CA 3.3Å; L285-V309 HydrophobicContact CB-CG1 3.99Å; L285-V309 HydrophobicContact CD2-CG1 4.29Å; I297-V309 HydrophobicContact CG2-CG1 3.94Å; I297-V309 HydrophobicContact CG2-CG2 3.94Å; K307-V309 HydrophobicContact CD-CG2 4.17Å; K307-V309 HydrophobicContact CG-CG2 3.96Å; V309-A311 HydrophobicContact CG1-CB 4.41Å; V309-I321 HydrophobicContact CB-CD1 4.48Å; V309-I321 HydrophobicContact CG1-CD1 4.07Å; V309-I321 HydrophobicContact CG2-CD1 4.43Å
310	V	96.1	Very high	85.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	107.7	177.7	-170.3	0	0	0	0	109	V244 L246 I252 A255 L259 L283 P284 L285	V244-V310 HydrophobicContact CB-CB 4.48Å; V244-V310 HydrophobicContact CB-CG1 4.28Å; V244-V310 HydrophobicContact CB-CG2 4.3Å; V244-V310 HydrophobicContact CG1-CG1 4.25Å; V244-V310 HydrophobicContact CG2-CG2 4.46Å; L246-V310 HydrophobicContact CD1-CG1 3.65Å; L246-V310 HydrophobicContact CG-CG1 4.27Å; I252-V310 HydrophobicContact CB-CG1 4.33Å; I252-V310 HydrophobicContact CG1-CG1 4.15Å; I252-V310 HydrophobicContact CG2-CB 4.13Å; I252-V310 HydrophobicContact CG2-CG1 3.98Å; I252-V310 WeakPolarHBondContact CG2-O 3.41Å; A255-V310 HydrophobicContact CB-CG1 4.28Å; L259-V310 HydrophobicContact CD1-CG2 3.81Å; L283-V310 PolarHBondContact O-N 3.19Å; P284-V310 CarbonylContact C-O 3.53Å; P284-V310 WeakPolarHBondContact CA-O 3.29Å; L285-V310 PolarHBondContact N-O 2.97Å
311	A	93.7	Very high	85.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	156.5	-163.1	0	0	0	0	0	114.6	L243 V244 F245 L246 L285 V309 A315	L243-A311 HydrophobicContact CD1-CB 3.86Å; V244-A311 PolarHBondContact O-N 3.2Å; F245-A311 WeakPolarHBondContact CA-O 3.28Å; L246-A311 PolarHBondContact N-O 3.01Å; L285-A311 HydrophobicContact CB-CB 3.81Å; L285-A311 HydrophobicContact CD2-CB 4Å; L285-A311 HydrophobicContact CG-CB 4.12Å; L285-A311 CarbonylContact O-C 3.54Å; L285-A311 VanDerWaalsContact O-CA 3.23Å; L285-A311 WeakPolarHBondContact O-CA 3.45Å; V309-A311 HydrophobicContact CG1-CB 4.41Å; A311-A315 HydrophobicContact CB-CB 3.77Å
312	T	91.6	Very high	85.3	Confident	16 Å²	16	31 Å²	31	10%	0.098	19%	0.188	C	C	.	.			trans	-80.1	-173.7	160.7	68.6	0	0	0	0	111.7	L246 I252 L285 I314 A315	L246-T312 WeakPolarHBondContact O-CA 3.43Å; I252-T312 HydrophobicContact CD1-CG2 3.52Å; L285-T312 PolarHBondContact O-N 3.23Å; L285-T312 VanDerWaalsContact O-N 3.08Å; T312-I314 PolarHBondContact O-N 3.4Å; T312-I314 WeakPolarHBondContact OG1-CG2 3.36Å; T312-I314 PolarHBondContact OG1-N 3.3Å; T312-A315 PolarHBondContact O-N 3.46Å
313	N	87.4	Confident	85.1	Confident	53 Å²	53	29.2 Å²	29.2	28%	0.283	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-56.9	-8.2	171.6	65.8	-16.3	0	0	0	114.6	A315 A316 V333	N313-A315 PolarHBondContact O-N 3.11Å; N313-A316 HydrophobicContact CB-CB 4.5Å; N313-A316 VanDerWaalsContact O-CB 3.28Å; N313-A316 WeakPolarHBondContact O-CB 3.26Å; N313-A316 PolarHBondContact O-N 3.37Å; N313-V333 HydrophobicContact CB-CG2 4.13Å
314	I	81.5	Confident	85.3	Confident	21 Å²	21	23.2 Å²	23.2	11%	0.108	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-56.7	-29.4	172.1	-164	172.1	0	0	0	112.9	L285 T312 L319	L285-I314 HydrophobicContact CD1-CG2 4.09Å; L285-I314 HydrophobicContact CD2-CG2 3.92Å; L285-I314 HydrophobicContact CG-CG2 3.61Å; T312-I314 PolarHBondContact O-N 3.4Å; T312-I314 WeakPolarHBondContact OG1-CG2 3.36Å; T312-I314 PolarHBondContact OG1-N 3.3Å; I314-L319 HydrophobicContact CD1-CD1 4.37Å; I314-L319 HydrophobicContact CG1-CD1 4Å
315	A	83.9	Confident	85.5	Confident	2 Å²	2	24.1 Å²	24.1	2%	0.017	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-84.2	-9.3	176.2	0	0	0	0	0	113.5	L243 F245 L285 A311 T312 N313 I321 R363	L243-A315 HydrophobicContact CD1-CB 3.97Å; L243-A315 HydrophobicContact CD2-CB 4.05Å; F245-A315 HydrophobicContact CE1-CB 4.03Å; F245-A315 HydrophobicContact CZ-CB 4.44Å; L285-A315 HydrophobicContact CD2-CB 4.19Å; A311-A315 HydrophobicContact CB-CB 3.77Å; T312-A315 PolarHBondContact O-N 3.46Å; N313-A315 PolarHBondContact O-N 3.11Å; A315-I321 HydrophobicContact CB-CD1 4.46Å; A315-R363 WeakPolarHBondContact O-CD 3.28Å
316	A	78.3	Confident	85.6	Confident	7 Å²	7	21.5 Å²	21.5	6%	0.058	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-29.4	-170.1	0	0	0	0	0	114.4	F245 N313 R360 R363	F245-A316 HydrophobicContact CE1-CB 3.89Å; F245-A316 HydrophobicContact CZ-CB 4.28Å; N313-A316 HydrophobicContact CB-CB 4.5Å; N313-A316 VanDerWaalsContact O-CB 3.28Å; N313-A316 WeakPolarHBondContact O-CB 3.26Å; N313-A316 PolarHBondContact O-N 3.37Å; A316-R360 HydrophobicContact CB-CG 4.14Å; A316-R363 VanDerWaalsContact C-CZ 3.41Å; A316-R363 VanDerWaalsContact C-NH2 3.33Å; A316-R363 PolarHBondContact O-NE 3.5Å; A316-R363 PolarHBondContact O-NH2 3.41Å
317	T	65.9	Low	85.7	Confident	15 Å²	15	21.3 Å²	21.3	9%	0.092	13%	0.126	C	C	.	.	S	Bend	trans	-121.2	-65.7	-177.1	56.6	0	0	0	0	111.5	E141 R363	E141-T317 HydrophobicContact CG-CG2 4.35Å; E141-T317 WeakPolarHBondContact OE1-CB 3.41Å; E141-T317 PolarHBondContact OE1-OG1 3.49Å; T317-R363 PolarHBondContact O-NH1 3.2Å; T317-R363 PolarHBondContact O-NH2 3.18Å
318	S	60.8	Low	85.8	Confident	33 Å²	33	21.1 Å²	21.1	23%	0.231	13%	0.125	C	C	.	.	S	Bend	trans	-89.9	-7.8	-160.6	-34.6	0	0	0	0	116.7	R71 E141	R71-S318 VanDerWaalsContact CD-OG 3.26Å; R71-S318 WeakPolarHBondContact CD-OG 3.31Å; R71-S318 PolarHBondContact NE-OG 3.5Å; E141-S318 PolarHBondContact OE1-OG 2.91Å
319	L	69.3	Low	85.8	Confident	22 Å²	22	21 Å²	21	12%	0.115	13%	0.125	C	C	.	.			trans	-121.5	140.4	-178.2	-64.9	178.4	0	0	0	112.6	F298 I314 R363	F298-L319 HydrophobicContact CE1-CD2 4.46Å; F298-L319 HydrophobicContact CZ-CD1 4.17Å; F298-L319 HydrophobicContact CZ-CD2 3.91Å; F298-L319 HydrophobicContact CZ-CG 4.44Å; I314-L319 HydrophobicContact CD1-CD1 4.37Å; I314-L319 HydrophobicContact CG1-CD1 4Å; L319-R363 PolarHBondContact O-NH1 3.05Å
320	T	72.8	Confident	85.8	Confident	66 Å²	66	21 Å²	21	41%	0.405	13%	0.125	S	C	.	.			trans	-112.1	108.1	175.7	-55.9	0	0	0	0	109.3	R366	T320-R366 VanDerWaalsContact CB-NH1 3.27Å; T320-R366 PolarHBondContact OG1-NH1 3.03Å
321	I	82.6	Confident	85.7	Confident	15 Å²	15	21 Å²	21	8%	0.077	13%	0.125	C	C	.	.			trans	-92.7	119.6	172.7	-54.6	170.8	0	0	0	107	L243 L285 I297 V309 A315 I324	L243-I321 HydrophobicContact CD1-CD1 4.26Å; L285-I321 HydrophobicContact CD2-CD1 4.23Å; I297-I321 HydrophobicContact CG2-CD1 3.62Å; I297-I321 HydrophobicContact CG2-CG1 3.95Å; I297-I321 HydrophobicContact CG2-CG2 4.2Å; V309-I321 HydrophobicContact CB-CD1 4.48Å; V309-I321 HydrophobicContact CG1-CD1 4.07Å; V309-I321 HydrophobicContact CG2-CD1 4.43Å; A315-I321 HydrophobicContact CB-CD1 4.46Å; I321-I324 HydrophobicContact CB-CD1 4.3Å; I321-I324 HydrophobicContact CB-CG1 3.84Å; I321-I324 HydrophobicContact CG2-CD1 3.85Å; I321-I324 HydrophobicContact CG2-CG1 3.86Å
322	N	82.3	Confident	85.7	Confident	107 Å²	107	21 Å²	21	57%	0.572	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	147.7	177.3	-65	-29.5	0	0	0	110.3
323	G	87.3	Confident	85.7	Confident	32 Å²	32	20.8 Å²	20.8	33%	0.33	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-10.6	176.3	0	0	0	0	0	115.5	D241 K325	D241-G323 WeakPolarHBondContact CB-O 3.4Å; D241-G323 PolarHBondContact N-O 3.16Å; G323-K325 PolarHBondContact O-N 3.32Å
324	I	92.4	Very high	85.7	Confident	4 Å²	4	22.2 Å²	22.2	2%	0.021	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	124.4	179.1	-57	-54.6	0	0	0	110.6	D241 L243 I321 I327	D241-I324 HydrophobicContact CB-CD1 3.75Å; L243-I324 HydrophobicContact CB-CD1 3.95Å; L243-I324 HydrophobicContact CB-CG1 4.28Å; L243-I324 HydrophobicContact CB-CG2 3.77Å; I321-I324 HydrophobicContact CB-CD1 4.3Å; I321-I324 HydrophobicContact CB-CG1 3.84Å; I321-I324 HydrophobicContact CG2-CD1 3.85Å; I321-I324 HydrophobicContact CG2-CG1 3.86Å; I324-I327 HydrophobicContact CG2-CD1 3.61Å
325	K	94	Very high	86	Confident	45 Å²	45	23 Å²	23	20%	0.196	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	-22.9	177.5	-172	177.2	175.9	-171.1	0	112.6	A239 D241 G323 A364 A369 G370 K371	A239-K325 PolarHBondContact O-NZ 2.88Å; D241-K325 PolarHBondContact O-N 2.92Å; G323-K325 PolarHBondContact O-N 3.32Å; K325-A364 VanDerWaalsContact O-CB 3.29Å; K325-A364 WeakPolarHBondContact O-CB 3.47Å; K325-A369 WeakPolarHBondContact CE-O 3.46Å; K325-G370 CarbonylContact O-C 3.5Å; K325-G370 WeakPolarHBondContact O-CA 3.37Å; K325-K371 PolarHBondContact O-N 3.25Å
326	Y	96.5	Very high	86.1	Confident	4 Å²	4	25.9 Å²	25.9	2%	0.016	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.3	-177.7	-55	-71.6	0	0	0	110.4	V233 E237 K238 D241 I242 L243 K371 F373	V233-Y326 HydrophobicContact CG1-CD1 4.11Å; V233-Y326 HydrophobicContact CG1-CD2 4.16Å; V233-Y326 HydrophobicContact CG1-CG 3.72Å; E237-Y326 HydrophobicContact CB-CD1 4.31Å; E237-Y326 HydrophobicContact CB-CE1 3.64Å; E237-Y326 HydrophobicContact CB-CE2 4.12Å; E237-Y326 HydrophobicContact CG-CD1 4.19Å; E237-Y326 HydrophobicContact CG-CE1 3.74Å; K238-Y326 PolarHBondContact N-OH 3.29Å; K238-Y326 WeakPolarHBondContact O-CE2 3.48Å; K238-Y326 PolarHBondContact O-OH 3.38Å; D241-Y326 PolarHBondContact O-N 3.36Å; D241-Y326 VanDerWaalsContact O-N 3.09Å; I242-Y326 CarbonylContact C-O 3.59Å; I242-Y326 WeakPolarHBondContact CA-O 3.41Å; I242-Y326 HydrophobicContact CG1-CD2 4.44Å; L243-Y326 PolarHBondContact N-O 3.48Å; Y326-K371 WeakPolarHBondContact CA-O 3.44Å; Y326-K371 HydrophobicContact CD1-CB 4.09Å; Y326-K371 HydrophobicContact CD1-CG 4.44Å; Y326-K371 HydrophobicContact CE1-CB 4.43Å; Y326-K371 HydrophobicContact CE1-CD 4.23Å; Y326-K371 HydrophobicContact CE1-CG 4.28Å; Y326-F373 HydrophobicContact CD1-CE2 4.12Å
327	I	96.8	Very high	86.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.9	173.8	-55.4	-56.6	0	0	0	109.2	L243 F245 I324 D329 R363 A364 K371 C372 F373	L243-I327 HydrophobicContact CB-CD1 3.82Å; L243-I327 HydrophobicContact CD2-CD1 4.07Å; L243-I327 HydrophobicContact CG-CD1 4.31Å; L243-I327 CarbonylContact O-C 3.57Å; L243-I327 WeakPolarHBondContact O-CA 3.45Å; F245-I327 HydrophobicContact CD2-CG2 3.88Å; F245-I327 HydrophobicContact CE2-CG2 3.8Å; I324-I327 HydrophobicContact CG2-CD1 3.61Å; I327-D329 HydrophobicContact CG2-CB 4.37Å; I327-R363 HydrophobicContact CD1-CB 3.94Å; I327-A364 HydrophobicContact CD1-CB 4.19Å; I327-A364 HydrophobicContact CG1-CB 3.74Å; I327-K371 PolarHBondContact N-O 2.92Å; I327-C372 HydrophobicContact CB-CB 4.18Å; I327-F373 PolarHBondContact O-N 3.49Å
328	V	97.3	Very high	87.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	111.4	165.2	-175.7	0	0	0	0	108	V226 V229 A230 I242 L243 V244 F245 F373 I375	V226-V328 HydrophobicContact CG1-CG1 4.05Å; V229-V328 HydrophobicContact CB-CG1 4.17Å; V229-V328 HydrophobicContact CG1-CG1 3.9Å; V229-V328 HydrophobicContact CG1-CG2 4.18Å; A230-V328 HydrophobicContact CB-CG2 4.28Å; I242-V328 HydrophobicContact CG2-CG2 4.09Å; L243-V328 PolarHBondContact O-N 2.96Å; V244-V328 WeakPolarHBondContact CA-O 3.34Å; V244-V328 HydrophobicContact CB-CB 4.48Å; V244-V328 HydrophobicContact CG1-CB 4.32Å; V244-V328 HydrophobicContact CG2-CB 4.11Å; V244-V328 HydrophobicContact CG2-CG2 4.36Å; F245-V328 PolarHBondContact N-O 2.79Å; V328-F373 WeakPolarHBondContact CA-O 3.25Å; V328-I375 HydrophobicContact CG1-CG2 4.36Å
329	D	96.3	Very high	88.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.8	-174.4	-170.4	8.7	0	0	0	111.4	I327 G331 I352 R360 F373 I375 Y376	I327-D329 HydrophobicContact CG2-CB 4.37Å; D329-G331 VanDerWaalsContact C-N 3.3Å; D329-G331 PolarHBondContact OD1-N 3.17Å; D329-I352 WeakPolarHBondContact OD2-CD1 3.41Å; D329-R360 WeakPolarHBondContact OD1-CD 3.34Å; D329-R360 IonicContact OD1-CZ 3.03Å; D329-R360 IonicContact OD1-NH1 2.89Å; D329-R360 PolarHBondContact OD1-NH1 3.22Å; D329-F373 PolarHBondContact N-O 2.94Å; D329-I375 PolarHBondContact O-N 3.02Å; D329-I375 VanDerWaalsContact O-N 3.14Å; D329-Y376 PolarHBondContact OD2-OH 3.24Å
330	S	94.6	Very high	88.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.			trans	-70.4	-25.6	173.9	56.5	0	0	0	0	113.4	F245 F332	F245-S330 WeakPolarHBondContact O-CB 3.29Å; F245-S330 PolarHBondContact O-OG 2.84Å; S330-F332 WeakPolarHBondContact O-CD2 3.43Å; S330-F332 WeakPolarHBondContact O-CE2 3.26Å
331	G	93.8	Very high	88.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	S	Bend	trans	81.7	9.3	-175.6	0	0	0	0	0	115	D329 P351 I352	D329-G331 VanDerWaalsContact C-N 3.3Å; D329-G331 PolarHBondContact OD1-N 3.17Å; G331-P351 WeakPolarHBondContact O-CA 3.39Å; G331-I352 WeakPolarHBondContact O-CG1 3.28Å; G331-I352 PolarHBondContact O-N 3.1Å
332	F	93.7	Very high	87.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	160.5	-179.5	-63	-87	0	0	0	113	V212 V217 Y222 T247 S330 V349 V350 P351 R360 F380	V212-F332 HydrophobicContact CG1-CE2 3.92Å; V212-F332 HydrophobicContact CG1-CZ 3.88Å; V212-F332 HydrophobicContact CG2-CE2 4.43Å; V217-F332 WeakPolarHBondContact O-CE1 3.28Å; Y222-F332 AromaticContact CD1-CD2 3.77Å; Y222-F332 HydrophobicContact CD1-CD2 3.77Å; Y222-F332 AromaticContact CD1-CE2 3.62Å; Y222-F332 HydrophobicContact CD1-CE2 3.62Å; Y222-F332 HydrophobicContact CD1-CZ 4.39Å; Y222-F332 HydrophobicContact CE1-CB 4.43Å; Y222-F332 AromaticContact CE1-CD2 3.38Å; Y222-F332 HydrophobicContact CE1-CD2 3.38Å; Y222-F332 AromaticContact CE1-CE2 3.65Å; Y222-F332 HydrophobicContact CE1-CE2 3.65Å; Y222-F332 AromaticContact CE1-CG 3.87Å; Y222-F332 HydrophobicContact CE1-CG 3.87Å; Y222-F332 HydrophobicContact CE1-CZ 4.32Å; Y222-F332 HydrophobicContact CE2-CD2 4.18Å; Y222-F332 HydrophobicContact CG-CD2 4.33Å; Y222-F332 HydrophobicContact CG-CE2 4.28Å; Y222-F332 AromaticContact CZ-CD2 3.61Å; Y222-F332 AromaticContact CZ-CG 3.98Å; T247-F332 HydrophobicContact CG2-CB 3.51Å; S330-F332 WeakPolarHBondContact O-CD2 3.43Å; S330-F332 WeakPolarHBondContact O-CE2 3.26Å; F332-V349 HydrophobicContact CB-CG1 4.03Å; F332-V349 HydrophobicContact CD1-CG1 4.08Å; F332-V349 HydrophobicContact CG-CG1 4.33Å; F332-V350 CarbonylContact C-O 3.46Å; F332-V350 VanDerWaalsContact CA-O 3.28Å; F332-V350 WeakPolarHBondContact CA-O 3.44Å; F332-P351 HydrophobicContact CE1-CG 4.23Å; F332-R360 PolarHBondContact O-NH1 3.42Å; F332-R360 PolarHBondContact O-NH2 3.29Å; F332-F380 HydrophobicContact CE1-CZ 4.12Å; F332-F380 HydrophobicContact CZ-CE2 4.44Å; F332-F380 AromaticContact CZ-CZ 3.87Å; F332-F380 HydrophobicContact CZ-CZ 3.87Å
333	V	91.6	Very high	86.9	Confident	10 Å²	10	29 Å²	29	6%	0.061	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150.8	172.5	68.2	0	0	0	0	110	N313 V349 V350 I352	N313-V333 HydrophobicContact CB-CG2 4.13Å; V333-V349 WeakPolarHBondContact O-CA 3.37Å; V333-V350 HydrophobicContact CG1-CG2 3.85Å; V333-V350 PolarHBondContact N-O 3.16Å; V333-V350 PolarHBondContact O-N 3.03Å; V333-I352 HydrophobicContact CB-CG2 3.8Å; V333-I352 HydrophobicContact CG1-CG2 3.87Å
334	K	88.3	Confident	86.5	Confident	84 Å²	84	28.5 Å²	28.5	37%	0.365	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	122.1	164.1	-82.4	177.1	-169.7	-177	0	109.3	T247 E348 V349	T247-K334 WeakPolarHBondContact O-CD 3.03Å; T247-K334 WeakPolarHBondContact OG1-CE 3.46Å; K334-E348 CarbonylContact C-O 3.58Å; K334-E348 WeakPolarHBondContact CA-O 3.27Å; K334-V349 HydrophobicContact CD-CG2 4.29Å; K334-V349 HydrophobicContact CG-CG2 3.64Å
335	Q	87.1	Confident	86.1	Confident	37 Å²	37	30.4 Å²	30.4	17%	0.173	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153.1	177.5	73.9	178.6	1.7	0	0	111.1	N337 L347 E348 V350	Q335-N337 PolarHBondContact NE2-ND2 2.91Å; Q335-N337 PolarHBondContact NE2-OD1 3.35Å; Q335-L347 WeakPolarHBondContact O-CA 3.34Å; Q335-E348 PolarHBondContact N-O 2.89Å; Q335-E348 PolarHBondContact O-N 3.15Å; Q335-V350 HydrophobicContact CB-CG2 4.45Å; Q335-V350 HydrophobicContact CG-CG1 4.12Å; Q335-V350 HydrophobicContact CG-CG2 3.62Å
336	L	85.4	Confident	85.7	Confident	63 Å²	63	28.4 Å²	28.4	33%	0.33	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	122.7	176.4	-168.9	69.4	0	0	0	109.7	D345 L347 R395 T396	L336-D345 HydrophobicContact CD1-CB 3.74Å; L336-D345 HydrophobicContact CD2-CB 4.01Å; L336-D345 HydrophobicContact CG-CB 3.82Å; L336-L347 HydrophobicContact CB-CD2 4.16Å; L336-L347 HydrophobicContact CD1-CD2 4.06Å; L336-L347 HydrophobicContact CD1-CG 4.02Å; L336-R395 PolarHBondContact O-NH1 3.46Å; L336-T396 HydrophobicContact CB-CG2 4.28Å; L336-T396 HydrophobicContact CD2-CG2 4.08Å; L336-T396 HydrophobicContact CG-CG2 4.24Å
337	N	87.8	Confident	85.1	Confident	26 Å²	26	33.5 Å²	33.5	14%	0.139	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.7	-179.4	-78.5	-7.1	0	0	0	110.3	Q335 N339 D345 V346 E348 R395	Q335-N337 PolarHBondContact NE2-ND2 2.91Å; Q335-N337 PolarHBondContact NE2-OD1 3.35Å; N337-N339 PolarHBondContact O-N 3.24Å; N337-D345 CarbonylContact O-C 3.59Å; N337-D345 WeakPolarHBondContact O-CA 3.46Å; N337-V346 PolarHBondContact N-O 3.2Å; N337-V346 PolarHBondContact O-N 2.81Å; N337-E348 PolarHBondContact ND2-OE2 3.01Å; N337-R395 CarbonylContact C-O 3.57Å; N337-R395 VanDerWaalsContact CA-O 3.32Å; N337-R395 WeakPolarHBondContact CA-O 3.25Å
338	H	83.5	Confident	84.5	Confident	26 Å²	26	36.6 Å²	36.6	12%	0.12	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	115.7	176	-171.4	72.8	0	0	0	109.4	S340 G343 D345 R395 F426	H338-S340 PolarHBondContact O-N 2.97Å; H338-G343 PolarHBondContact CE1-O 3.42Å; H338-D345 WeakPolarHBondContact CA-OD1 3.37Å; H338-D345 WeakPolarHBondContact CB-OD1 3.42Å; H338-D345 IonicContact CE1-OD1 3.86Å; H338-D345 IonicContact CG-OD1 2.89Å; H338-D345 IonicContact ND1-OD1 3.35Å; H338-D345 PolarHBondContact ND1-OD1 2.97Å; H338-R395 WeakPolarHBondContact CB-O 3.47Å; H338-R395 PolarHBondContact N-O 2.9Å; H338-F426 AromaticContact CD2-CE1 3.92Å
339	N	79.3	Confident	84	Confident	28 Å²	28	38.7 Å²	38.7	15%	0.15	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	102.2	177	-167.1	-39.5	0	0	0	109.9	N337 R341 V342 G343 M344 V346	N337-N339 PolarHBondContact O-N 3.24Å; N339-R341 PolarHBondContact O-N 2.84Å; N339-R341 WeakPolarHBondContact OD1-CB 3.03Å; N339-R341 PolarHBondContact OD1-N 2.81Å; N339-V342 PolarHBondContact O-N 3.25Å; N339-G343 PolarHBondContact O-N 2.57Å; N339-M344 PolarHBondContact N-O 3.32Å; N339-V346 HydrophobicContact CB-CG2 4.08Å
340	S	70.2	Confident	83.7	Confident	49 Å²	49	39.8 Å²	39.8	34%	0.343	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.9	-179.8	-52.6	0	0	0	0	114.7	H338 H613	H338-S340 PolarHBondContact O-N 2.97Å; S340-H613 PolarHBondContact O-NE2 2.81Å
341	R	69.4	Low	83.7	Confident	179 Å²	179	40.9 Å²	40.9	68%	0.675	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-24.1	176.6	-61.8	-178.3	177.9	173.5	0.3	113	N339 H613 S615	N339-R341 PolarHBondContact O-N 2.84Å; N339-R341 WeakPolarHBondContact OD1-CB 3.03Å; N339-R341 PolarHBondContact OD1-N 2.81Å; R341-H613 VanDerWaalsContact O-CB 3.24Å; R341-H613 WeakPolarHBondContact O-CB 3.34Å; R341-S615 PolarHBondContact O-OG 2.59Å
342	V	68.3	Low	83.7	Confident	3 Å²	3	41 Å²	41	2%	0.018	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-8.9	-176.4	-168.2	0	0	0	0	111.1	N339 M344 V640 M646	N339-V342 PolarHBondContact O-N 3.25Å; V342-M344 PolarHBondContact O-N 3.19Å; V342-V640 HydrophobicContact CG1-CG1 4.32Å; V342-V640 HydrophobicContact CG1-CG2 4.01Å; V342-M646 HydrophobicContact CG2-CE 3.97Å; V342-M646 HydrophobicContact CG2-SD 3.8Å
343	G	72.3	Confident	83.6	Confident	19 Å²	19	41.1 Å²	41.1	20%	0.196	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	19.8	-178.1	0	0	0	0	0	113.9	H338 N339	H338-G343 PolarHBondContact CE1-O 3.42Å; N339-G343 PolarHBondContact O-N 2.57Å
344	M	78.2	Confident	83.7	Confident	22 Å²	22	42.2 Å²	42.2	11%	0.108	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	154.4	-174.8	-66	-167.4	-167.1	0	0	112.9	N339 V342 N597 F637 V640	N339-M344 PolarHBondContact N-O 3.32Å; V342-M344 PolarHBondContact O-N 3.19Å; M344-N597 HydrophobicContact CE-CB 3.71Å; M344-N597 VanDerWaalsContact CE-ND2 3.26Å; M344-N597 WeakPolarHBondContact CE-ND2 3.37Å; M344-N597 WeakPolarHBondContact CE-OD1 3.5Å; M344-F637 HydrophobicContact CE-CD2 4.12Å; M344-F637 HydrophobicContact CE-CE2 3.21Å; M344-F637 HydrophobicContact CE-CZ 3.63Å; M344-F637 HydrophobicContact SD-CD2 4.36Å; M344-F637 HydrophobicContact SD-CE2 3.65Å; M344-V640 HydrophobicContact SD-CB 4.42Å; M344-V640 HydrophobicContact SD-CG2 3.58Å; M344-V640 VanDerWaalsContact SD-CG2 3.58Å
345	D	84	Confident	83.7	Confident	44 Å²	44	39.1 Å²	39.1	24%	0.235	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	129.8	173.9	-64.5	-14.2	0	0	0	110.3	L336 N337 H338 S397	L336-D345 HydrophobicContact CD1-CB 3.74Å; L336-D345 HydrophobicContact CD2-CB 4.01Å; L336-D345 HydrophobicContact CG-CB 3.82Å; N337-D345 CarbonylContact O-C 3.59Å; N337-D345 WeakPolarHBondContact O-CA 3.46Å; H338-D345 WeakPolarHBondContact CA-OD1 3.37Å; H338-D345 WeakPolarHBondContact CB-OD1 3.42Å; H338-D345 IonicContact CE1-OD1 3.86Å; H338-D345 IonicContact CG-OD1 2.89Å; H338-D345 IonicContact ND1-OD1 3.35Å; H338-D345 PolarHBondContact ND1-OD1 2.97Å; D345-S397 WeakPolarHBondContact OD1-CB 3.32Å; D345-S397 PolarHBondContact OD1-N 3.43Å; D345-S397 WeakPolarHBondContact OD2-CB 3.47Å; D345-S397 PolarHBondContact OD2-N 2.92Å
346	V	84.4	Confident	83.8	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.4	-176.3	-179.3	0	0	0	0	109.3	N337 N339 E348 V642	N337-V346 PolarHBondContact N-O 3.2Å; N337-V346 PolarHBondContact O-N 2.81Å; N339-V346 HydrophobicContact CB-CG2 4.08Å; V346-E348 HydrophobicContact CG1-CG 4.11Å; V346-E348 PolarHBondContact O-N 2.9Å; V346-V642 HydrophobicContact CB-CG2 4.38Å; V346-V642 HydrophobicContact CG1-CB 3.83Å; V346-V642 HydrophobicContact CG1-CG2 3.7Å; V346-V642 HydrophobicContact CG2-CG2 3.84Å
347	L	83.7	Confident	84.1	Confident	112 Å²	112	36.5 Å²	36.5	59%	0.586	19%	0.188	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	112.3	172.6	-77	168.6	0	0	0	110.7	Q335 L336	Q335-L347 WeakPolarHBondContact O-CA 3.34Å; L336-L347 HydrophobicContact CB-CD2 4.16Å; L336-L347 HydrophobicContact CD1-CD2 4.06Å; L336-L347 HydrophobicContact CD1-CG 4.02Å
348	E	84.8	Confident	84.2	Confident	65 Å²	65	40.6 Å²	40.6	30%	0.304	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	147.4	-178.8	-66.3	-179.2	157.3	0	0	111.2	K334 Q335 N337 V346 V350	K334-E348 CarbonylContact C-O 3.58Å; K334-E348 WeakPolarHBondContact CA-O 3.27Å; Q335-E348 PolarHBondContact N-O 2.89Å; Q335-E348 PolarHBondContact O-N 3.15Å; N337-E348 PolarHBondContact ND2-OE2 3.01Å; V346-E348 HydrophobicContact CG1-CG 4.11Å; V346-E348 PolarHBondContact O-N 2.9Å; E348-V350 HydrophobicContact CB-CG1 4.48Å
349	V	88.1	Confident	84.4	Confident	43 Å²	43	41.2 Å²	41.2	26%	0.261	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	122.9	171.3	178.1	0	0	0	0	107.9	T247 F332 V333 K334	T247-V349 HydrophobicContact CG2-CG1 4.04Å; F332-V349 HydrophobicContact CB-CG1 4.03Å; F332-V349 HydrophobicContact CD1-CG1 4.08Å; F332-V349 HydrophobicContact CG-CG1 4.33Å; V333-V349 WeakPolarHBondContact O-CA 3.37Å; K334-V349 HydrophobicContact CD-CG2 4.29Å; K334-V349 HydrophobicContact CG-CG2 3.64Å
350	V	90.2	Very high	84.9	Confident	24 Å²	24	40 Å²	40	15%	0.145	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	160.3	179.1	-58.4	0	0	0	0	111.6	F332 V333 Q335 E348	F332-V350 CarbonylContact C-O 3.46Å; F332-V350 VanDerWaalsContact CA-O 3.28Å; F332-V350 WeakPolarHBondContact CA-O 3.44Å; V333-V350 HydrophobicContact CG1-CG2 3.85Å; V333-V350 PolarHBondContact N-O 3.16Å; V333-V350 PolarHBondContact O-N 3.03Å; Q335-V350 HydrophobicContact CB-CG2 4.45Å; Q335-V350 HydrophobicContact CG-CG1 4.12Å; Q335-V350 HydrophobicContact CG-CG2 3.62Å; E348-V350 HydrophobicContact CB-CG1 4.48Å
351	P	93.4	Very high	85.9	Confident	23 Å²	23	38 Å²	38	15%	0.149	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	143	165.5	-20.7	32.9	0	0	0	111.6	V217 G331 F332 F380 M385	V217-P351 HydrophobicContact CG1-CG 3.86Å; G331-P351 WeakPolarHBondContact O-CA 3.39Å; F332-P351 HydrophobicContact CE1-CG 4.23Å; P351-F380 HydrophobicContact CB-CE1 4.19Å; P351-F380 HydrophobicContact CB-CZ 3.9Å; P351-F380 HydrophobicContact CG-CZ 3.85Å; P351-M385 HydrophobicContact CB-CG 4.49Å
352	I	93.7	Very high	86.8	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-74.2	163.1	172.2	64.2	-176	0	0	0	112.2	D329 G331 V333 E356 A357 R360 M385	D329-I352 WeakPolarHBondContact OD2-CD1 3.41Å; G331-I352 WeakPolarHBondContact O-CG1 3.28Å; G331-I352 PolarHBondContact O-N 3.1Å; V333-I352 HydrophobicContact CB-CG2 3.8Å; V333-I352 HydrophobicContact CG1-CG2 3.87Å; I352-E356 HydrophobicContact CB-CB 4.19Å; I352-E356 WeakPolarHBondContact CB-OE2 3.25Å; I352-A357 HydrophobicContact CD1-CB 3.6Å; I352-A357 HydrophobicContact CG1-CB 4.18Å; I352-R360 VanDerWaalsContact CG2-NH2 3.33Å; I352-M385 HydrophobicContact CG1-CE 3.9Å; I352-M385 HydrophobicContact CG1-SD 4.35Å; I352-M385 WeakPolarHBondContact O-CB 3.37Å; I352-M385 WeakPolarHBondContact O-CG 3.35Å
353	S	92.8	Very high	87.7	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.021	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-75.3	158.2	168.2	72.5	0	0	0	0	111.9	S355 E356 A357 P386 T389	S353-S355 VanDerWaalsContact C-N 3.26Å; S353-S355 PolarHBondContact O-N 2.66Å; S353-S355 PolarHBondContact OG-OG 3.46Å; S353-E356 PolarHBondContact O-N 3.24Å; S353-E356 WeakPolarHBondContact OG-CG 3.43Å; S353-E356 PolarHBondContact OG-N 3.39Å; S353-A357 PolarHBondContact O-N 3.14Å; S353-P386 CarbonylContact C-O 3.41Å; S353-P386 WeakPolarHBondContact CA-O 3.45Å; S353-P386 WeakPolarHBondContact CB-O 3.14Å; S353-T389 PolarHBondContact OG-N 2.9Å; S353-T389 PolarHBondContact OG-OG1 2.88Å
354	K	92.9	Very high	88.5	Confident	34 Å²	34	30.2 Å²	30.2	15%	0.148	16%	0.162	C	C	.	.	H	α-helix	trans	-60.8	-38.9	174.7	-63.9	-176.4	-159.8	155	0	111.4	A357 Q358 W381 M385 P386 E387	K354-A357 WeakPolarHBondContact O-CB 3.34Å; K354-A357 PolarHBondContact O-N 3.21Å; K354-Q358 PolarHBondContact O-N 2.95Å; K354-Q358 PolarHBondContact O-OE1 3.29Å; K354-W381 HydrophobicContact CB-CH2 3.71Å; K354-W381 HydrophobicContact CB-CZ2 3.67Å; K354-W381 HydrophobicContact CB-CZ3 4.35Å; K354-W381 HydrophobicContact CD-CD2 4.39Å; K354-W381 HydrophobicContact CD-CZ2 3.87Å; K354-W381 WeakPolarHBondContact CE-O 3.33Å; K354-W381 HydrophobicContact CG-CD2 4.1Å; K354-W381 HydrophobicContact CG-CE3 4.36Å; K354-W381 HydrophobicContact CG-CH2 3.99Å; K354-W381 HydrophobicContact CG-CZ2 3.7Å; K354-W381 HydrophobicContact CG-CZ3 4.32Å; K354-M385 WeakPolarHBondContact CE-O 3.47Å; K354-M385 HydrophobicContact CG-CB 4.02Å; K354-P386 PolarHBondContact N-O 3.47Å; K354-E387 VanDerWaalsContact CD-OE2 3.31Å; K354-E387 WeakPolarHBondContact CD-OE2 3.26Å; K354-E387 IonicContact NZ-OE2 2.68Å; K354-E387 PolarHBondContact NZ-OE2 3.41Å
355	S	88.5	Confident	88.7	Confident	18 Å²	18	29.1 Å²	29.1	13%	0.126	16%	0.157	C	C	.	.	H	α-helix	trans	-60.6	-43.6	174.9	69.7	0	0	0	0	112.5	S353 Q358 Q359 E387	S353-S355 VanDerWaalsContact C-N 3.26Å; S353-S355 PolarHBondContact O-N 2.66Å; S353-S355 PolarHBondContact OG-OG 3.46Å; S355-Q358 PolarHBondContact O-N 3.35Å; S355-Q359 WeakPolarHBondContact O-CG 3.49Å; S355-Q359 PolarHBondContact O-N 3.24Å; S355-E387 WeakPolarHBondContact CB-O 3.15Å; S355-E387 PolarHBondContact N-O 2.88Å; S355-E387 PolarHBondContact OG-O 3.47Å
356	E	89.2	Confident	88.5	Confident	45 Å²	45	29.5 Å²	29.5	21%	0.21	16%	0.155	C	C	.	.	H	α-helix	trans	-63.8	-42.1	174.3	-79.2	178.1	173.2	0	0	112.1	I352 S353 Q358 Q359 R360 T389	I352-E356 HydrophobicContact CB-CB 4.19Å; I352-E356 WeakPolarHBondContact CB-OE2 3.25Å; S353-E356 PolarHBondContact O-N 3.24Å; S353-E356 WeakPolarHBondContact OG-CG 3.43Å; S353-E356 PolarHBondContact OG-N 3.39Å; E356-Q358 VanDerWaalsContact C-N 3.29Å; E356-Q358 PolarHBondContact O-N 2.93Å; E356-Q359 WeakPolarHBondContact O-CB 3.48Å; E356-Q359 PolarHBondContact O-N 3.28Å; E356-Q359 VanDerWaalsContact O-N 3.13Å; E356-R360 WeakPolarHBondContact O-CG 3.37Å; E356-R360 PolarHBondContact O-N 3.46Å; E356-T389 WeakPolarHBondContact CG-OG1 3.42Å; E356-T389 WeakPolarHBondContact OE1-CG2 3.44Å; E356-T389 PolarHBondContact OE1-OG1 3.35Å
357	A	92.5	Very high	88.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-35.5	177.1	0	0	0	0	0	112.4	I352 S353 K354 A361 W381	I352-A357 HydrophobicContact CD1-CB 3.6Å; I352-A357 HydrophobicContact CG1-CB 4.18Å; S353-A357 PolarHBondContact O-N 3.14Å; K354-A357 WeakPolarHBondContact O-CB 3.34Å; K354-A357 PolarHBondContact O-N 3.21Å; A357-A361 WeakPolarHBondContact O-CB 3.49Å; A357-A361 PolarHBondContact O-N 3.41Å; A357-W381 HydrophobicContact CB-CH2 3.92Å; A357-W381 HydrophobicContact CB-CZ3 3.42Å; A357-W381 VanDerWaalsContact CB-CZ3 3.42Å
358	Q	89.4	Confident	88.1	Confident	113 Å²	113	29.5 Å²	29.5	53%	0.528	16%	0.162	S	C	.	.	H	α-helix	trans	-67.6	-39.3	171.2	-92.5	154.9	-26.6	0	0	112.2	K354 S355 E356 A361 G362	K354-Q358 PolarHBondContact O-N 2.95Å; K354-Q358 PolarHBondContact O-OE1 3.29Å; S355-Q358 PolarHBondContact O-N 3.35Å; E356-Q358 VanDerWaalsContact C-N 3.29Å; E356-Q358 PolarHBondContact O-N 2.93Å; Q358-A361 PolarHBondContact O-N 2.93Å; Q358-G362 PolarHBondContact O-N 3.13Å
359	Q	86.6	Confident	88.4	Confident	38 Å²	38	28.8 Å²	28.8	18%	0.178	17%	0.167	C	C	.	.	H	α-helix	trans	-63.1	-41.9	173.2	-70.2	178.9	17	0	0	112.3	H140 S355 E356 G362 R363	H140-Q359 PolarHBondContact CD2-NE2 3.46Å; S355-Q359 WeakPolarHBondContact O-CG 3.49Å; S355-Q359 PolarHBondContact O-N 3.24Å; E356-Q359 WeakPolarHBondContact O-CB 3.48Å; E356-Q359 PolarHBondContact O-N 3.28Å; E356-Q359 VanDerWaalsContact O-N 3.13Å; Q359-G362 PolarHBondContact O-N 3.17Å; Q359-R363 PolarHBondContact O-N 3.21Å
360	R	91.3	Very high	88.6	Confident	3 Å²	3	27 Å²	27	1%	0.011	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-49	173.5	-71.6	180	-176.2	-163.2	-1.3	110.7	F245 A316 D329 F332 I352 E356 G362 R363	F245-R360 HydrophobicContact CD1-CG 4.28Å; F245-R360 HydrophobicContact CD2-CB 3.99Å; F245-R360 HydrophobicContact CD2-CG 3.92Å; F245-R360 HydrophobicContact CE1-CG 4.06Å; F245-R360 HydrophobicContact CE2-CB 3.58Å; F245-R360 HydrophobicContact CE2-CG 3.68Å; F245-R360 HydrophobicContact CG-CG 4.21Å; F245-R360 HydrophobicContact CZ-CB 4.02Å; F245-R360 HydrophobicContact CZ-CG 3.75Å; A316-R360 HydrophobicContact CB-CG 4.14Å; D329-R360 WeakPolarHBondContact OD1-CD 3.34Å; D329-R360 IonicContact OD1-CZ 3.03Å; D329-R360 IonicContact OD1-NH1 2.89Å; D329-R360 PolarHBondContact OD1-NH1 3.22Å; F332-R360 PolarHBondContact O-NH1 3.42Å; F332-R360 PolarHBondContact O-NH2 3.29Å; I352-R360 VanDerWaalsContact CG2-NH2 3.33Å; E356-R360 WeakPolarHBondContact O-CG 3.37Å; E356-R360 PolarHBondContact O-N 3.46Å; R360-G362 VanDerWaalsContact C-N 3.34Å; R360-G362 PolarHBondContact O-N 3.19Å; R360-R363 WeakPolarHBondContact O-CB 3.46Å; R360-R363 PolarHBondContact O-N 3.33Å
361	A	91.1	Very high	88.9	Confident	6 Å²	6	29 Å²	29	5%	0.05	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-41.2	176.9	0	0	0	0	0	112.5	V204 A357 Q358 R363 A364 C372	V204-A361 HydrophobicContact CG1-CB 4.48Å; A357-A361 WeakPolarHBondContact O-CB 3.49Å; A357-A361 PolarHBondContact O-N 3.41Å; Q358-A361 PolarHBondContact O-N 2.93Å; A361-R363 PolarHBondContact O-N 2.93Å; A361-R363 VanDerWaalsContact O-N 3.09Å; A361-A364 PolarHBondContact O-N 3.39Å; A361-A364 VanDerWaalsContact O-N 3.14Å; A361-C372 HydrophobicContact CB-CB 3.82Å
362	G	87.3	Confident	89	Confident	28 Å²	28	27.9 Å²	27.9	29%	0.289	16%	0.156	S	C	.	.	H	α-helix	trans	-60.3	-18.8	179.1	0	0	0	0	0	114.2	Q358 Q359 R360 A364 G365	Q358-G362 PolarHBondContact O-N 3.13Å; Q359-G362 PolarHBondContact O-N 3.17Å; R360-G362 VanDerWaalsContact C-N 3.34Å; R360-G362 PolarHBondContact O-N 3.19Å; G362-A364 PolarHBondContact O-N 3.18Å; G362-G365 PolarHBondContact O-N 2.87Å; G362-G365 VanDerWaalsContact O-N 3.1Å
363	R	87.4	Confident	89.2	Confident	10 Å²	10	29.4 Å²	29.4	4%	0.038	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-62.7	-29.2	175.5	-62.8	-70.9	152	167.4	-12.7	112.8	T42 L243 A315 A316 T317 L319 I327 Q359 R360 A361 R366	T42-R363 PolarHBondContact OG1-NH2 3.14Å; L243-R363 HydrophobicContact CD2-CB 4.31Å; A315-R363 WeakPolarHBondContact O-CD 3.28Å; A316-R363 VanDerWaalsContact C-CZ 3.41Å; A316-R363 VanDerWaalsContact C-NH2 3.33Å; A316-R363 PolarHBondContact O-NE 3.5Å; A316-R363 PolarHBondContact O-NH2 3.41Å; T317-R363 PolarHBondContact O-NH1 3.2Å; T317-R363 PolarHBondContact O-NH2 3.18Å; L319-R363 PolarHBondContact O-NH1 3.05Å; I327-R363 HydrophobicContact CD1-CB 3.94Å; Q359-R363 PolarHBondContact O-N 3.21Å; R360-R363 WeakPolarHBondContact O-CB 3.46Å; R360-R363 PolarHBondContact O-N 3.33Å; A361-R363 PolarHBondContact O-N 2.93Å; A361-R363 VanDerWaalsContact O-N 3.09Å; R363-R366 VanDerWaalsContact NH1-CZ 3.27Å; R363-R366 VanDerWaalsContact NH1-NH1 3.19Å
364	A	88.8	Confident	89.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-76.7	-22.9	174.7	0	0	0	0	0	113.9	V204 K325 I327 A361 G362 R366 S368	V204-A364 HydrophobicContact CG1-CB 4.47Å; V204-A364 HydrophobicContact CG2-CB 4.4Å; K325-A364 VanDerWaalsContact O-CB 3.29Å; K325-A364 WeakPolarHBondContact O-CB 3.47Å; I327-A364 HydrophobicContact CD1-CB 4.19Å; I327-A364 HydrophobicContact CG1-CB 3.74Å; A361-A364 PolarHBondContact O-N 3.39Å; A361-A364 VanDerWaalsContact O-N 3.14Å; G362-A364 PolarHBondContact O-N 3.18Å; A364-R366 VanDerWaalsContact C-N 3.32Å; A364-R366 PolarHBondContact O-N 3.2Å; A364-S368 VanDerWaalsContact O-O 3.05Å
365	G	83.1	Confident	89.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-87.2	8.7	-174.9	0	0	0	0	0	115.1	V201 F202 V204 G362	V201-G365 WeakPolarHBondContact CG1-O 3.49Å; F202-G365 PolarHBondContact N-O 3.03Å; V204-G365 VanDerWaalsContact CG2-CA 3.48Å; G362-G365 PolarHBondContact O-N 2.87Å; G362-G365 VanDerWaalsContact O-N 3.1Å
366	R	78.6	Confident	89.8	Confident	52 Å²	52	27.6 Å²	27.6	20%	0.196	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-36.6	-170.6	-72.5	179.2	164.4	-165.1	-11	114.6	T42 T320 R363 A364	T42-R366 PolarHBondContact OG1-NH2 2.82Å; T320-R366 VanDerWaalsContact CB-NH1 3.27Å; T320-R366 PolarHBondContact OG1-NH1 3.03Å; R363-R366 VanDerWaalsContact NH1-CZ 3.27Å; R363-R366 VanDerWaalsContact NH1-NH1 3.19Å; A364-R366 VanDerWaalsContact C-N 3.32Å; A364-R366 PolarHBondContact O-N 3.2Å
367	T	77.1	Confident	90.1	Very high	72 Å²	72	26.9 Å²	26.9	44%	0.442	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-33.4	-175	56.2	0	0	0	0	112.2	F202	F202-T367 VanDerWaalsContact CE2-C 3.49Å; F202-T367 WeakPolarHBondContact CE2-O 3.44Å
368	S	84	Confident	90.2	Very high	42 Å²	42	32.8 Å²	32.8	29%	0.294	18%	0.177	S	C	.	.	S	Bend	trans	-159.3	174.7	-179.3	62.8	0	0	0	0	109.8	F202 A364 G370	F202-S368 WeakPolarHBondContact CB-O 3.37Å; A364-S368 VanDerWaalsContact O-O 3.05Å; S368-G370 PolarHBondContact O-N 3.08Å
369	A	90	Very high	90.4	Very high	50 Å²	50	31.8 Å²	31.8	41%	0.413	17%	0.172	S	C	.	.			trans	-62.9	135.1	173.7	0	0	0	0	0	110.4	F202 P203 K325	F202-A369 HydrophobicContact CB-CB 4.43Å; P203-A369 HydrophobicContact CG-CB 4.27Å; P203-A369 WeakPolarHBondContact O-CA 3.3Å; K325-A369 WeakPolarHBondContact CE-O 3.46Å
370	G	93.1	Very high	90.8	Very high	5 Å²	5	30 Å²	30	5%	0.052	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	178.2	-171.4	0	0	0	0	0	113.7	P203 V204 S205 K325 S368	P203-G370 PolarHBondContact O-N 3.2Å; V204-G370 WeakPolarHBondContact CA-O 3.42Å; S205-G370 PolarHBondContact N-O 3.46Å; S205-G370 VanDerWaalsContact N-O 3.12Å; K325-G370 CarbonylContact O-C 3.5Å; K325-G370 WeakPolarHBondContact O-CA 3.37Å; S368-G370 PolarHBondContact O-N 3.08Å
371	K	95.9	Very high	91	Very high	66 Å²	66	31.3 Å²	31.3	29%	0.287	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.7	179.3	-54.4	-174.9	170.6	166.9	0	111.2	S205 M207 E237 K325 Y326 I327 F373	S205-K371 WeakPolarHBondContact O-CA 2.91Å; S205-K371 WeakPolarHBondContact OG-CG 3.5Å; M207-K371 HydrophobicContact CE-CB 4.16Å; M207-K371 HydrophobicContact CE-CD 4.05Å; E237-K371 WeakPolarHBondContact OE1-CD 3.03Å; E237-K371 IonicContact OE1-NZ 3.94Å; E237-K371 PolarHBondContact OE1-NZ 3.47Å; E237-K371 WeakPolarHBondContact OE2-CE 3.26Å; E237-K371 IonicContact OE2-NZ 3.75Å; E237-K371 PolarHBondContact OE2-NZ 3.45Å; K325-K371 PolarHBondContact O-N 3.25Å; Y326-K371 WeakPolarHBondContact CA-O 3.44Å; Y326-K371 HydrophobicContact CD1-CB 4.09Å; Y326-K371 HydrophobicContact CD1-CG 4.44Å; Y326-K371 HydrophobicContact CE1-CB 4.43Å; Y326-K371 HydrophobicContact CE1-CD 4.23Å; Y326-K371 HydrophobicContact CE1-CG 4.28Å; I327-K371 PolarHBondContact N-O 2.92Å; K371-F373 HydrophobicContact CB-CD2 4.48Å; K371-F373 HydrophobicContact CB-CE2 3.79Å; K371-F373 HydrophobicContact CB-CZ 4.21Å; K371-F373 HydrophobicContact CD-CE2 4.45Å; K371-F373 HydrophobicContact CD-CZ 4.12Å
372	C	96.9	Very high	91.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.4	173.9	-177.6	0	0	0	0	109.9	V204 S205 S206 M207 I327 A361	V204-C372 HydrophobicContact CG1-CB 4.05Å; S205-C372 PolarHBondContact O-N 3.06Å; S206-C372 CarbonylContact C-O 3.57Å; S206-C372 WeakPolarHBondContact CA-O 3.06Å; M207-C372 PolarHBondContact N-O 3.27Å; I327-C372 HydrophobicContact CB-CB 4.18Å; A361-C372 HydrophobicContact CB-CB 3.82Å
373	F	97.3	Very high	91.4	Very high	32 Å²	32	42 Å²	42	14%	0.14	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.7	178.4	-60.8	-93.9	0	0	0	108.7	M207 V229 V233 E237 Y326 I327 V328 D329 K371	M207-F373 HydrophobicContact CE-CD1 3.57Å; M207-F373 HydrophobicContact CE-CD2 4.5Å; M207-F373 HydrophobicContact CE-CE1 3.12Å; M207-F373 HydrophobicContact CE-CE2 4.13Å; M207-F373 HydrophobicContact CE-CG 4.25Å; M207-F373 HydrophobicContact CE-CZ 3.44Å; M207-F373 VanDerWaalsContact CE-CZ 3.44Å; M207-F373 HydrophobicContact SD-CD1 4.42Å; M207-F373 HydrophobicContact SD-CE1 4.05Å; V229-F373 HydrophobicContact CG1-CB 3.8Å; V229-F373 HydrophobicContact CG1-CG 4.31Å; V233-F373 HydrophobicContact CG1-CE2 4.34Å; V233-F373 HydrophobicContact CG2-CD1 4.26Å; V233-F373 HydrophobicContact CG2-CD2 3.56Å; V233-F373 HydrophobicContact CG2-CE1 4.08Å; V233-F373 HydrophobicContact CG2-CE2 3.37Å; V233-F373 HydrophobicContact CG2-CG 4.01Å; V233-F373 HydrophobicContact CG2-CZ 3.65Å; E237-F373 HydrophobicContact CG-CZ 4.21Å; Y326-F373 HydrophobicContact CD1-CE2 4.12Å; I327-F373 PolarHBondContact O-N 3.49Å; V328-F373 WeakPolarHBondContact CA-O 3.25Å; D329-F373 PolarHBondContact N-O 2.94Å; K371-F373 HydrophobicContact CB-CD2 4.48Å; K371-F373 HydrophobicContact CB-CE2 3.79Å; K371-F373 HydrophobicContact CB-CZ 4.21Å; K371-F373 HydrophobicContact CD-CE2 4.45Å; K371-F373 HydrophobicContact CD-CZ 4.12Å
374	R	96.1	Very high	91.7	Very high	14 Å²	14	43.1 Å²	43.1	5%	0.053	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.6	177.3	-61.9	169.5	173.8	-171.7	-7.2	108.1	M207 F208 G209 Y376 W381	M207-R374 WeakPolarHBondContact O-CB 3.36Å; M207-R374 PolarHBondContact O-N 3.23Å; F208-R374 CarbonylContact C-O 3.43Å; F208-R374 HydrophobicContact CD1-CB 4.3Å; F208-R374 VanDerWaalsContact CE1-NH1 3.31Å; G209-R374 WeakPolarHBondContact CA-O 3.33Å; G209-R374 PolarHBondContact N-O 3.44Å; R374-Y376 HydrophobicContact CB-CD1 4.23Å; R374-Y376 HydrophobicContact CB-CD2 4.21Å; R374-Y376 HydrophobicContact CB-CE1 3.8Å; R374-Y376 HydrophobicContact CB-CE2 3.78Å; R374-Y376 HydrophobicContact CB-CG 4.42Å; R374-Y376 VanDerWaalsContact CD-OH 3.28Å; R374-Y376 WeakPolarHBondContact CD-OH 3.3Å; R374-Y376 HydrophobicContact CG-CE1 4.15Å; R374-Y376 HydrophobicContact CG-CE2 4.05Å; R374-Y376 WeakPolarHBondContact CG-OH 3.44Å; R374-Y376 PolarHBondContact NE-OH 2.93Å; R374-Y376 PolarHBondContact O-N 3.26Å; R374-W381 VanDerWaalsContact NH1-CH2 3.26Å; R374-W381 VanDerWaalsContact NH2-CZ3 3.33Å
375	I	94.8	Very high	91.9	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.015	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-13.7	-178.8	68.7	173.4	0	0	0	113.4	A211 V212 Y222 V226 V229 V328 D329	A211-I375 PolarHBondContact N-O 3.41Å; A211-I375 VanDerWaalsContact N-O 3.08Å; V212-I375 HydrophobicContact CG2-CD1 3.85Å; V212-I375 HydrophobicContact CG2-CG1 4.03Å; V212-I375 PolarHBondContact N-O 3.4Å; Y222-I375 HydrophobicContact CD2-CD1 4.11Å; Y222-I375 HydrophobicContact CG-CD1 4.12Å; V226-I375 HydrophobicContact CG2-CD1 3.64Å; V226-I375 HydrophobicContact CG2-CG2 4.06Å; V229-I375 HydrophobicContact CG2-CG2 4.32Å; V328-I375 HydrophobicContact CG1-CG2 4.36Å; D329-I375 PolarHBondContact O-N 3.02Å; D329-I375 VanDerWaalsContact O-N 3.14Å
376	Y	94.9	Very high	92.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	156	-175.3	49.6	-95.6	0	0	0	112.7	F208 G209 V212 D329 R374 F380 W381 M385	F208-Y376 HydrophobicContact CD1-CD2 4.15Å; F208-Y376 HydrophobicContact CD1-CE2 4.09Å; F208-Y376 HydrophobicContact CE1-CD2 4.33Å; F208-Y376 AromaticContact CE1-CE2 3.92Å; F208-Y376 HydrophobicContact CE1-CE2 3.92Å; G209-Y376 PolarHBondContact N-O 3.49Å; G209-Y376 CarbonylContact O-C 3.59Å; V212-Y376 CarbonylContact O-C 3.55Å; V212-Y376 VanDerWaalsContact O-CA 3.29Å; V212-Y376 WeakPolarHBondContact O-CA 3.36Å; D329-Y376 PolarHBondContact OD2-OH 3.24Å; R374-Y376 HydrophobicContact CB-CD1 4.23Å; R374-Y376 HydrophobicContact CB-CD2 4.21Å; R374-Y376 HydrophobicContact CB-CE1 3.8Å; R374-Y376 HydrophobicContact CB-CE2 3.78Å; R374-Y376 HydrophobicContact CB-CG 4.42Å; R374-Y376 VanDerWaalsContact CD-OH 3.28Å; R374-Y376 WeakPolarHBondContact CD-OH 3.3Å; R374-Y376 HydrophobicContact CG-CE1 4.15Å; R374-Y376 HydrophobicContact CG-CE2 4.05Å; R374-Y376 WeakPolarHBondContact CG-OH 3.44Å; R374-Y376 PolarHBondContact NE-OH 2.93Å; R374-Y376 PolarHBondContact O-N 3.26Å; Y376-F380 HydrophobicContact CD2-CD1 4.04Å; Y376-F380 AromaticContact CG-CD1 3.91Å; Y376-F380 HydrophobicContact CG-CD1 3.91Å; Y376-F380 HydrophobicContact CG-CE1 4.45Å; Y376-W381 HydrophobicContact CE2-CB 4.4Å; Y376-W381 AromaticContact CE2-CE3 3.78Å; Y376-W381 HydrophobicContact CE2-CE3 3.78Å; Y376-W381 HydrophobicContact CE2-CZ3 4.49Å; Y376-M385 HydrophobicContact CD1-CE 3.89Å; Y376-M385 HydrophobicContact CD2-CE 3.9Å; Y376-M385 HydrophobicContact CE1-CE 3.55Å; Y376-M385 HydrophobicContact CE2-CE 3.55Å; Y376-M385 HydrophobicContact CE2-SD 3.97Å; Y376-M385 HydrophobicContact CG-CE 4.05Å
377	T	95.2	Very high	92.9	Very high	30 Å²	30	48 Å²	48	18%	0.184	25%	0.247	C	C	.	.			trans	-71.6	159.6	179.9	64.2	0	0	0	0	112.3	G209 V212 E379 F380 W381	G209-T377 VanDerWaalsContact O-CA 3.3Å; G209-T377 WeakPolarHBondContact O-CA 3.14Å; G209-T377 PolarHBondContact O-N 3.39Å; V212-T377 PolarHBondContact O-N 3.05Å; T377-E379 PolarHBondContact O-N 3.41Å; T377-F380 WeakPolarHBondContact O-CB 3.46Å; T377-F380 PolarHBondContact O-N 2.86Å; T377-F380 PolarHBondContact OG1-N 3.16Å; T377-F380 VanDerWaalsContact OG1-N 3.1Å; T377-W381 PolarHBondContact O-N 2.77Å; T377-W381 VanDerWaalsContact O-N 3.14Å
378	K	95.1	Very high	93.5	Very high	125 Å²	125	49.3 Å²	49.3	54%	0.543	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-32	169.5	-170.3	175.9	176.8	-173.4	0	112.1	F208 W381 E382	F208-K378 HydrophobicContact CD2-CB 4.38Å; F208-K378 HydrophobicContact CE2-CG 4.44Å; F208-K378 HydrophobicContact CG-CB 4.3Å; K378-W381 WeakPolarHBondContact O-CB 3.46Å; K378-W381 PolarHBondContact O-N 3.16Å; K378-E382 WeakPolarHBondContact CE-OE1 3.21Å; K378-E382 WeakPolarHBondContact O-CG 3.23Å; K378-E382 PolarHBondContact O-N 3.4Å
379	E	95.1	Very high	93.6	Very high	91 Å²	91	48.5 Å²	48.5	43%	0.425	24%	0.238	S	C	.	.	H	α-helix	trans	-65	-42.1	174.9	-172.6	-178.5	-168.1	0	0	112	P214 T377 W381 E382 K383	P214-E379 HydrophobicContact CG-CB 4.39Å; P214-E379 HydrophobicContact CG-CG 3.77Å; T377-E379 PolarHBondContact O-N 3.41Å; E379-W381 VanDerWaalsContact C-N 3.32Å; E379-W381 PolarHBondContact O-N 2.98Å; E379-E382 PolarHBondContact O-N 3.04Å; E379-K383 HydrophobicContact CG-CD 3.79Å; E379-K383 HydrophobicContact CG-CG 4.32Å; E379-K383 WeakPolarHBondContact O-CB 3.45Å; E379-K383 PolarHBondContact O-N 2.91Å; E379-K383 WeakPolarHBondContact OE1-CE 3.44Å; E379-K383 IonicContact OE1-NZ 3.62Å; E379-K383 PolarHBondContact OE1-NZ 3.05Å
380	F	94.6	Very high	93.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-42.6	174.4	-176.1	-93.3	0	0	0	111.5	V212 G213 V217 F332 P351 Y376 T377 E382 C384 M385	V212-F380 HydrophobicContact CG1-CD2 4.16Å; V212-F380 HydrophobicContact CG1-CE2 4Å; V212-F380 HydrophobicContact CG1-CG 4.47Å; V212-F380 HydrophobicContact CG1-CZ 4.21Å; G213-F380 WeakPolarHBondContact O-CD2 3.47Å; V217-F380 HydrophobicContact CG2-CD2 4.36Å; V217-F380 HydrophobicContact CG2-CE2 3.64Å; V217-F380 HydrophobicContact CG2-CZ 4.48Å; F332-F380 HydrophobicContact CE1-CZ 4.12Å; F332-F380 HydrophobicContact CZ-CE2 4.44Å; F332-F380 AromaticContact CZ-CZ 3.87Å; F332-F380 HydrophobicContact CZ-CZ 3.87Å; P351-F380 HydrophobicContact CB-CE1 4.19Å; P351-F380 HydrophobicContact CB-CZ 3.9Å; P351-F380 HydrophobicContact CG-CZ 3.85Å; Y376-F380 HydrophobicContact CD2-CD1 4.04Å; Y376-F380 AromaticContact CG-CD1 3.91Å; Y376-F380 HydrophobicContact CG-CD1 3.91Å; Y376-F380 HydrophobicContact CG-CE1 4.45Å; T377-F380 WeakPolarHBondContact O-CB 3.46Å; T377-F380 PolarHBondContact O-N 2.86Å; T377-F380 PolarHBondContact OG1-N 3.16Å; T377-F380 VanDerWaalsContact OG1-N 3.1Å; F380-E382 VanDerWaalsContact C-N 3.32Å; F380-E382 PolarHBondContact O-N 3.45Å; F380-C384 HydrophobicContact CD1-CB 4.46Å; F380-C384 HydrophobicContact CD2-CB 3.73Å; F380-C384 HydrophobicContact CE1-CB 4.48Å; F380-C384 HydrophobicContact CE2-CB 3.79Å; F380-C384 HydrophobicContact CG-CB 4.11Å; F380-C384 HydrophobicContact CZ-CB 4.18Å; F380-C384 WeakPolarHBondContact O-CA 3.38Å; F380-C384 VanDerWaalsContact O-CB 3.29Å; F380-C384 WeakPolarHBondContact O-CB 3.43Å; F380-C384 PolarHBondContact O-N 3.48Å; F380-M385 HydrophobicContact CD1-CE 3.78Å; F380-M385 HydrophobicContact CD1-CG 4.14Å; F380-M385 HydrophobicContact CD1-SD 4.48Å; F380-M385 HydrophobicContact CE1-CE 3.5Å; F380-M385 HydrophobicContact CE1-CG 4Å; F380-M385 PolarHBondContact O-N 2.84Å
381	W	94.9	Very high	93.5	Very high	32 Å²	32	50.3 Å²	50.3	12%	0.121	24%	0.239	C	C	.	.	H	α-helix	trans	-57.8	-42.1	174.4	172.6	-86.8	0	0	0	113.1	F208 K354 A357 R374 Y376 T377 K378 E379 M385	F208-W381 HydrophobicContact CE1-CB 3.67Å; F208-W381 AromaticContact CE1-CD2 3.92Å; F208-W381 HydrophobicContact CE1-CD2 3.92Å; F208-W381 HydrophobicContact CE1-CE3 4.02Å; F208-W381 AromaticContact CE1-CG 3.79Å; F208-W381 HydrophobicContact CE1-CG 3.79Å; F208-W381 HydrophobicContact CZ-CB 4.23Å; F208-W381 AromaticContact CZ-CD2 3.99Å; F208-W381 HydrophobicContact CZ-CD2 3.99Å; F208-W381 HydrophobicContact CZ-CE3 4.38Å; F208-W381 AromaticContact CZ-CG 3.92Å; F208-W381 HydrophobicContact CZ-CG 3.92Å; K354-W381 HydrophobicContact CB-CH2 3.71Å; K354-W381 HydrophobicContact CB-CZ2 3.67Å; K354-W381 HydrophobicContact CB-CZ3 4.35Å; K354-W381 HydrophobicContact CD-CD2 4.39Å; K354-W381 HydrophobicContact CD-CZ2 3.87Å; K354-W381 WeakPolarHBondContact CE-O 3.33Å; K354-W381 HydrophobicContact CG-CD2 4.1Å; K354-W381 HydrophobicContact CG-CE3 4.36Å; K354-W381 HydrophobicContact CG-CH2 3.99Å; K354-W381 HydrophobicContact CG-CZ2 3.7Å; K354-W381 HydrophobicContact CG-CZ3 4.32Å; A357-W381 HydrophobicContact CB-CH2 3.92Å; A357-W381 HydrophobicContact CB-CZ3 3.42Å; A357-W381 VanDerWaalsContact CB-CZ3 3.42Å; R374-W381 VanDerWaalsContact NH1-CH2 3.26Å; R374-W381 VanDerWaalsContact NH2-CZ3 3.33Å; Y376-W381 HydrophobicContact CE2-CB 4.4Å; Y376-W381 AromaticContact CE2-CE3 3.78Å; Y376-W381 HydrophobicContact CE2-CE3 3.78Å; Y376-W381 HydrophobicContact CE2-CZ3 4.49Å; T377-W381 PolarHBondContact O-N 2.77Å; T377-W381 VanDerWaalsContact O-N 3.14Å; K378-W381 WeakPolarHBondContact O-CB 3.46Å; K378-W381 PolarHBondContact O-N 3.16Å; E379-W381 VanDerWaalsContact C-N 3.32Å; E379-W381 PolarHBondContact O-N 2.98Å; W381-M385 HydrophobicContact CD2-SD 4.37Å; W381-M385 HydrophobicContact CE3-SD 3.53Å; W381-M385 VanDerWaalsContact CE3-SD 3.53Å; W381-M385 HydrophobicContact CZ3-SD 4.06Å
382	E	94.4	Very high	93.3	Very high	114 Å²	114	50.1 Å²	50.1	53%	0.533	24%	0.239	S	C	.	.	H	α-helix	trans	-79.5	-39	-176.6	-70.8	173.5	179.5	0	0	112.9	K378 E379 F380	K378-E382 WeakPolarHBondContact CE-OE1 3.21Å; K378-E382 WeakPolarHBondContact O-CG 3.23Å; K378-E382 PolarHBondContact O-N 3.4Å; E379-E382 PolarHBondContact O-N 3.04Å; F380-E382 VanDerWaalsContact C-N 3.32Å; F380-E382 PolarHBondContact O-N 3.45Å
383	K	93.3	Very high	93	Very high	143 Å²	143	50.1 Å²	50.1	62%	0.622	24%	0.239	S	C	*	.	H	α-helix	trans	-98	-29.6	-171.5	-64.6	-174.5	-178.6	174.4	0	114.8	E379	E379-K383 HydrophobicContact CG-CD 3.79Å; E379-K383 HydrophobicContact CG-CG 4.32Å; E379-K383 WeakPolarHBondContact O-CB 3.45Å; E379-K383 PolarHBondContact O-N 2.91Å; E379-K383 WeakPolarHBondContact OE1-CE 3.44Å; E379-K383 IonicContact OE1-NZ 3.62Å; E379-K383 PolarHBondContact OE1-NZ 3.05Å
384	C	92.5	Very high	92.8	Very high	35 Å²	35	51.6 Å²	51.6	24%	0.236	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-24.4	-169.4	-57.1	0	0	0	0	113.6	V217 F380	V217-C384 HydrophobicContact CG2-CB 4.02Å; F380-C384 HydrophobicContact CD1-CB 4.46Å; F380-C384 HydrophobicContact CD2-CB 3.73Å; F380-C384 HydrophobicContact CE1-CB 4.48Å; F380-C384 HydrophobicContact CE2-CB 3.79Å; F380-C384 HydrophobicContact CG-CB 4.11Å; F380-C384 HydrophobicContact CZ-CB 4.18Å; F380-C384 WeakPolarHBondContact O-CA 3.38Å; F380-C384 VanDerWaalsContact O-CB 3.29Å; F380-C384 WeakPolarHBondContact O-CB 3.43Å; F380-C384 PolarHBondContact O-N 3.48Å
385	M	93.9	Very high	92.5	Very high	7 Å²	7	52.4 Å²	52.4	3%	0.034	25%	0.249	C	C	.	.	S	Bend	trans	-92.8	121.6	179.5	-65.4	-172.5	166.3	0	0	111.2	P351 I352 K354 Y376 F380 W381	P351-M385 HydrophobicContact CB-CG 4.49Å; I352-M385 HydrophobicContact CG1-CE 3.9Å; I352-M385 HydrophobicContact CG1-SD 4.35Å; I352-M385 WeakPolarHBondContact O-CB 3.37Å; I352-M385 WeakPolarHBondContact O-CG 3.35Å; K354-M385 WeakPolarHBondContact CE-O 3.47Å; K354-M385 HydrophobicContact CG-CB 4.02Å; Y376-M385 HydrophobicContact CD1-CE 3.89Å; Y376-M385 HydrophobicContact CD2-CE 3.9Å; Y376-M385 HydrophobicContact CE1-CE 3.55Å; Y376-M385 HydrophobicContact CE2-CE 3.55Å; Y376-M385 HydrophobicContact CE2-SD 3.97Å; Y376-M385 HydrophobicContact CG-CE 4.05Å; F380-M385 HydrophobicContact CD1-CE 3.78Å; F380-M385 HydrophobicContact CD1-CG 4.14Å; F380-M385 HydrophobicContact CD1-SD 4.48Å; F380-M385 HydrophobicContact CE1-CE 3.5Å; F380-M385 HydrophobicContact CE1-CG 4Å; F380-M385 PolarHBondContact O-N 2.84Å; W381-M385 HydrophobicContact CD2-SD 4.37Å; W381-M385 HydrophobicContact CE3-SD 3.53Å; W381-M385 VanDerWaalsContact CE3-SD 3.53Å; W381-M385 HydrophobicContact CZ3-SD 4.06Å
386	P	92.6	Very high	92.3	Very high	56 Å²	56	52.6 Å²	52.6	36%	0.364	25%	0.251	S	S	.	.			trans	-67.2	156.9	173.7	29.6	-34.2	0	0	0	110.6	S353 K354	S353-P386 CarbonylContact C-O 3.41Å; S353-P386 WeakPolarHBondContact CA-O 3.45Å; S353-P386 WeakPolarHBondContact CB-O 3.14Å; K354-P386 PolarHBondContact N-O 3.47Å
387	E	89.9	Confident	92	Very high	92 Å²	92	53.8 Å²	53.8	43%	0.43	26%	0.259	S	S	.	.	S	Bend	trans	-63.9	-46.5	179.6	-161.9	63.6	-147	0	0	111.4	K354 S355	K354-E387 VanDerWaalsContact CD-OE2 3.31Å; K354-E387 WeakPolarHBondContact CD-OE2 3.26Å; K354-E387 IonicContact NZ-OE2 2.68Å; K354-E387 PolarHBondContact NZ-OE2 3.41Å; S355-E387 WeakPolarHBondContact CB-O 3.15Å; S355-E387 PolarHBondContact N-O 2.88Å; S355-E387 PolarHBondContact OG-O 3.47Å
388	Y	88	Confident	91.9	Very high	98 Å²	98	52.5 Å²	52.5	38%	0.384	25%	0.251	S	S	.	.	S	Bend	trans	-123.8	157.1	-179	-58.1	-75.1	0	0	0	111	E181	E181-Y388 HydrophobicContact CG-CD1 3.93Å; E181-Y388 HydrophobicContact CG-CE1 3.68Å; E181-Y388 HydrophobicContact CG-CE2 4.38Å; E181-Y388 HydrophobicContact CG-CG 4.39Å; E181-Y388 WeakPolarHBondContact OE2-CD1 3.03Å
389	T	87	Confident	91.7	Very high	26 Å²	26	46.6 Å²	46.6	16%	0.16	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-70.3	132.4	176.4	-59.4	0	0	0	0	110	S353 E356	S353-T389 PolarHBondContact OG-N 2.9Å; S353-T389 PolarHBondContact OG-OG1 2.88Å; E356-T389 WeakPolarHBondContact CG-OG1 3.42Å; E356-T389 WeakPolarHBondContact OE1-CG2 3.44Å; E356-T389 PolarHBondContact OE1-OG1 3.35Å
390	I	89.5	Confident	91.5	Very high	87 Å²	87	44.4 Å²	44.4	45%	0.446	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-67.8	124.5	174.7	-59.3	173.2	0	0	0	108.1	Q394 R395	I390-Q394 HydrophobicContact CG2-CB 4.03Å; I390-R395 PolarHBondContact O-NE 3.09Å
391	P	91.1	Very high	91.4	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.039	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-64.9	149.1	-175.2	28.3	-36.6	0	0	0	112	R142 I393 Q394 D420	R142-P391 HydrophobicContact CB-CB 3.9Å; R142-P391 HydrophobicContact CG-CB 4.46Å; R142-P391 VanDerWaalsContact NH2-CB 3.28Å; P391-I393 HydrophobicContact CB-CG2 4.11Å; P391-I393 HydrophobicContact CG-CG2 4.12Å; P391-I393 PolarHBondContact O-N 3.18Å; P391-I393 VanDerWaalsContact O-N 3.15Å; P391-Q394 HydrophobicContact CG-CB 4.31Å; P391-Q394 HydrophobicContact CG-CG 4.04Å; P391-Q394 PolarHBondContact O-N 3.29Å; P391-D420 HydrophobicContact CG-CB 3.89Å
392	E	91.2	Very high	91.4	Very high	61 Å²	61	43.1 Å²	43.1	29%	0.285	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-54.9	-36.8	-178.8	-77.2	-176.2	174.8	0	0	112.6	R142 S143 L144 Q394 R395 T396	R142-E392 PolarHBondContact O-N 3.12Å; R142-E392 VanDerWaalsContact O-N 3.1Å; S143-E392 WeakPolarHBondContact CA-OE2 3.46Å; L144-E392 HydrophobicContact CB-CB 4.02Å; L144-E392 PolarHBondContact N-OE2 3.45Å; E392-Q394 PolarHBondContact O-N 3.43Å; E392-Q394 VanDerWaalsContact O-N 3.09Å; E392-R395 CarbonylContact O-C 3.58Å; E392-R395 PolarHBondContact O-N 3.18Å; E392-R395 IonicContact OE1-NH2 3.79Å; E392-T396 HydrophobicContact CB-CG2 4.32Å; E392-T396 PolarHBondContact O-N 3.28Å; E392-T396 PolarHBondContact O-OG1 3.19Å
393	I	92	Very high	91.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-56.1	-29.6	178.9	-159.2	168.6	0	0	0	113.7	L144 D147 I148 P391 L398 Y418 D420 P422	L144-I393 HydrophobicContact CD1-CB 3.84Å; L144-I393 HydrophobicContact CD1-CD1 4.47Å; L144-I393 HydrophobicContact CD1-CG1 3.77Å; D147-I393 HydrophobicContact CB-CD1 4.4Å; I148-I393 HydrophobicContact CD1-CD1 4.11Å; P391-I393 HydrophobicContact CB-CG2 4.11Å; P391-I393 HydrophobicContact CG-CG2 4.12Å; P391-I393 PolarHBondContact O-N 3.18Å; P391-I393 VanDerWaalsContact O-N 3.15Å; I393-L398 HydrophobicContact CG1-CD2 3.83Å; I393-Y418 HydrophobicContact CD1-CD1 3.32Å; I393-Y418 HydrophobicContact CD1-CE1 3.67Å; I393-Y418 HydrophobicContact CD1-CG 4.28Å; I393-D420 WeakPolarHBondContact CG2-O 3.2Å; I393-P422 HydrophobicContact CD1-CG 4.36Å; I393-P422 HydrophobicContact CG1-CB 4.21Å; I393-P422 HydrophobicContact CG1-CG 4.09Å; I393-P422 WeakPolarHBondContact O-CB 3.34Å
394	Q	92	Very high	91.3	Very high	62 Å²	62	31.9 Å²	31.9	29%	0.29	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-89.8	-6.8	179.2	-71.8	-178.9	-25.6	0	0	113.7	I390 P391 E392 C421 F426	I390-Q394 HydrophobicContact CG2-CB 4.03Å; P391-Q394 HydrophobicContact CG-CB 4.31Å; P391-Q394 HydrophobicContact CG-CG 4.04Å; P391-Q394 PolarHBondContact O-N 3.29Å; E392-Q394 PolarHBondContact O-N 3.43Å; E392-Q394 VanDerWaalsContact O-N 3.09Å; Q394-C421 PolarHBondContact NE2-O 3.2Å; Q394-F426 WeakPolarHBondContact O-CE2 3.44Å
395	R	90.1	Very high	91.4	Very high	32 Å²	32	30.2 Å²	30.2	12%	0.121	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.7	-2.8	-171.3	65	178.7	172.1	82.3	-1.7	115.1	L336 N337 H338 I390 E392	L336-R395 PolarHBondContact O-NH1 3.46Å; N337-R395 CarbonylContact C-O 3.57Å; N337-R395 VanDerWaalsContact CA-O 3.32Å; N337-R395 WeakPolarHBondContact CA-O 3.25Å; H338-R395 WeakPolarHBondContact CB-O 3.47Å; H338-R395 PolarHBondContact N-O 2.9Å; I390-R395 PolarHBondContact O-NE 3.09Å; E392-R395 CarbonylContact O-C 3.58Å; E392-R395 PolarHBondContact O-N 3.18Å; E392-R395 IonicContact OE1-NH2 3.79Å
396	T	90.6	Very high	91.3	Very high	7 Å²	7	30.1 Å²	30.1	4%	0.043	16%	0.157	C	C	.	.	S	Bend	trans	-122.4	165.3	178.8	63.6	0	0	0	0	112	L336 E392 L398	L336-T396 HydrophobicContact CB-CG2 4.28Å; L336-T396 HydrophobicContact CD2-CG2 4.08Å; L336-T396 HydrophobicContact CG-CG2 4.24Å; E392-T396 HydrophobicContact CB-CG2 4.32Å; E392-T396 PolarHBondContact O-N 3.28Å; E392-T396 PolarHBondContact O-OG1 3.19Å; T396-L398 PolarHBondContact O-N 3.05Å
397	S	89.1	Confident	91.2	Very high	24 Å²	24	29.3 Å²	29.3	17%	0.168	15%	0.153	C	C	.	.			trans	-58.1	134.8	172.1	178.9	0	0	0	0	112.3	D345 T399	D345-S397 WeakPolarHBondContact OD1-CB 3.32Å; D345-S397 PolarHBondContact OD1-N 3.43Å; D345-S397 WeakPolarHBondContact OD2-CB 3.47Å; D345-S397 PolarHBondContact OD2-N 2.92Å; S397-T399 PolarHBondContact OG-N 3.02Å; S397-T399 PolarHBondContact OG-OG1 3.07Å; S397-T399 VanDerWaalsContact OG-OG1 3.07Å
398	L	92	Very high	91.2	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	14%	0.142	C	C	.	.			trans	-97.3	-0.1	-179.2	-58.7	179.2	0	0	0	113.2	L144 I393 T396 A400 V401 I402 P422 F426 I427 A430	L144-L398 HydrophobicContact CD1-CD2 3.69Å; I393-L398 HydrophobicContact CG1-CD2 3.83Å; T396-L398 PolarHBondContact O-N 3.05Å; L398-A400 PolarHBondContact O-N 3.23Å; L398-V401 HydrophobicContact CB-CG2 4.15Å; L398-V401 HydrophobicContact CD2-CG2 4.16Å; L398-V401 WeakPolarHBondContact O-CG2 3.49Å; L398-V401 PolarHBondContact O-N 3.36Å; L398-I402 HydrophobicContact CB-CD1 3.87Å; L398-I402 HydrophobicContact CB-CG1 4.09Å; L398-I402 WeakPolarHBondContact O-CB 3.38Å; L398-I402 WeakPolarHBondContact O-CG1 3.31Å; L398-I402 PolarHBondContact O-N 3.03Å; L398-P422 HydrophobicContact CD1-CB 3.63Å; L398-P422 HydrophobicContact CD1-CG 3.75Å; L398-F426 HydrophobicContact CD1-CB 3.95Å; L398-F426 HydrophobicContact CG-CB 4.48Å; L398-I427 HydrophobicContact CD1-CG1 4.01Å; L398-A430 HydrophobicContact CB-CB 3.9Å
399	T	92.1	Very high	91.1	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-56.1	-47.3	-168.8	-54.5	0	0	0	0	112.9	S397 L403 Q433 L434 F437 P460	S397-T399 PolarHBondContact OG-N 3.02Å; S397-T399 PolarHBondContact OG-OG1 3.07Å; S397-T399 VanDerWaalsContact OG-OG1 3.07Å; T399-L403 PolarHBondContact O-N 2.88Å; T399-Q433 HydrophobicContact CG2-CB 3.88Å; T399-Q433 PolarHBondContact OG1-OE1 3.4Å; T399-L434 HydrophobicContact CG2-CD2 3.68Å; T399-L434 HydrophobicContact CG2-CG 3.89Å; T399-F437 HydrophobicContact CG2-CE2 4.21Å; T399-P460 HydrophobicContact CG2-CB 4.42Å; T399-P460 HydrophobicContact CG2-CG 4.11Å
400	A	91.3	Very high	91.2	Very high	45 Å²	45	22.9 Å²	22.9	37%	0.372	14%	0.136	S	C	.	.	H	α-helix	trans	-68.7	-39.3	-179.7	0	0	0	0	0	113.2	L398 T404 P460	L398-A400 PolarHBondContact O-N 3.23Å; A400-T404 PolarHBondContact O-N 3.05Å; A400-T404 PolarHBondContact O-OG1 3Å; A400-P460 HydrophobicContact CB-CG 4.45Å
401	V	92.1	Very high	91	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-76.6	-33.8	-178.7	-66.8	0	0	0	0	112.4	L144 I148 L398 L403 T404 L405	L144-V401 HydrophobicContact CD1-CG1 4.44Å; L144-V401 HydrophobicContact CD1-CG2 4.09Å; L144-V401 HydrophobicContact CD2-CG1 3.67Å; L144-V401 HydrophobicContact CD2-CG2 4.05Å; L144-V401 HydrophobicContact CG-CG1 3.76Å; L144-V401 HydrophobicContact CG-CG2 4.24Å; I148-V401 HydrophobicContact CD1-CB 4.29Å; I148-V401 HydrophobicContact CD1-CG2 4.32Å; I148-V401 HydrophobicContact CG1-CB 3.98Å; I148-V401 HydrophobicContact CG1-CG1 4.08Å; I148-V401 HydrophobicContact CG1-CG2 4.34Å; L398-V401 HydrophobicContact CB-CG2 4.15Å; L398-V401 HydrophobicContact CD2-CG2 4.16Å; L398-V401 WeakPolarHBondContact O-CG2 3.49Å; L398-V401 PolarHBondContact O-N 3.36Å; V401-L403 VanDerWaalsContact C-N 3.34Å; V401-T404 VanDerWaalsContact O-CB 3.31Å; V401-T404 WeakPolarHBondContact O-CB 3.26Å; V401-T404 PolarHBondContact O-N 2.85Å; V401-L405 WeakPolarHBondContact O-CG 3.37Å; V401-L405 PolarHBondContact O-N 2.95Å
402	I	93.9	Very high	90.7	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-66.5	-38.8	174.2	-72.2	-175.6	0	0	0	110.7	L398 T404 L405 K406 V413 I427 A430 L431 L434	L398-I402 HydrophobicContact CB-CD1 3.87Å; L398-I402 HydrophobicContact CB-CG1 4.09Å; L398-I402 WeakPolarHBondContact O-CB 3.38Å; L398-I402 WeakPolarHBondContact O-CG1 3.31Å; L398-I402 PolarHBondContact O-N 3.03Å; I402-T404 VanDerWaalsContact C-N 3.29Å; I402-T404 PolarHBondContact O-N 3.09Å; I402-L405 PolarHBondContact O-N 3.14Å; I402-K406 HydrophobicContact CG2-CG 4.3Å; I402-K406 WeakPolarHBondContact O-CB 3.45Å; I402-K406 VanDerWaalsContact O-CG 3.25Å; I402-K406 WeakPolarHBondContact O-CG 3.06Å; I402-K406 PolarHBondContact O-N 3.43Å; I402-V413 HydrophobicContact CG2-CG1 4.32Å; I402-V413 HydrophobicContact CG2-CG2 4.45Å; I402-I427 HydrophobicContact CD1-CB 4.17Å; I402-I427 HydrophobicContact CD1-CG2 3.67Å; I402-A430 HydrophobicContact CD1-CB 3.67Å; I402-L431 HydrophobicContact CG2-CD2 3.7Å; I402-L431 HydrophobicContact CG2-CG 4.29Å; I402-L434 HydrophobicContact CB-CD1 4.16Å; I402-L434 HydrophobicContact CG2-CD1 3.69Å
403	L	94.6	Very high	90.6	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-58.7	-45.1	172	-179.5	58.3	0	0	0	111.1	T399 V401 K406 C407 L434 A439 V446 M453 V454 P460	T399-L403 PolarHBondContact O-N 2.88Å; V401-L403 VanDerWaalsContact C-N 3.34Å; L403-K406 PolarHBondContact O-N 3.5Å; L403-C407 WeakPolarHBondContact O-CB 3.25Å; L403-C407 PolarHBondContact O-N 3.11Å; L403-C407 PolarHBondContact O-SG 3.37Å; L403-L434 HydrophobicContact CB-CD1 4Å; L403-L434 HydrophobicContact CB-CD2 3.76Å; L403-L434 HydrophobicContact CD1-CD2 4.34Å; L403-L434 HydrophobicContact CD2-CD2 4.25Å; L403-L434 HydrophobicContact CG-CD2 4.34Å; L403-A439 HydrophobicContact CD1-CB 4.14Å; L403-V446 HydrophobicContact CD1-CG1 4.45Å; L403-M453 HydrophobicContact CD2-CB 4.05Å; L403-V454 HydrophobicContact CD2-CB 4.33Å; L403-V454 HydrophobicContact CG-CB 4.26Å; L403-V454 HydrophobicContact CG-CG2 4.27Å; L403-P460 HydrophobicContact CD2-CG 4.43Å
404	T	92.6	Very high	90.5	Very high	16 Å²	16	24.6 Å²	24.6	10%	0.098	14%	0.144	C	C	.	.	H	α-helix	trans	-58.5	-50.4	176.4	-59.5	0	0	0	0	111.3	L119 L123 A400 V401 I402 K406 C407 L408	L119-T404 HydrophobicContact CD1-CG2 3.9Å; L119-T404 HydrophobicContact CD2-CG2 3.98Å; L119-T404 HydrophobicContact CG-CG2 3.79Å; L123-T404 HydrophobicContact CD1-CG2 3.94Å; L123-T404 HydrophobicContact CD2-CG2 3.97Å; L123-T404 HydrophobicContact CG-CG2 3.98Å; A400-T404 PolarHBondContact O-N 3.05Å; A400-T404 PolarHBondContact O-OG1 3Å; V401-T404 VanDerWaalsContact O-CB 3.31Å; V401-T404 WeakPolarHBondContact O-CB 3.26Å; V401-T404 PolarHBondContact O-N 2.85Å; I402-T404 VanDerWaalsContact C-N 3.29Å; I402-T404 PolarHBondContact O-N 3.09Å; T404-K406 VanDerWaalsContact C-N 3.35Å; T404-K406 PolarHBondContact O-N 2.94Å; T404-C407 PolarHBondContact O-N 2.93Å; T404-L408 HydrophobicContact CG2-CD1 4.16Å; T404-L408 WeakPolarHBondContact O-CG 3.3Å; T404-L408 PolarHBondContact O-N 3.45Å
405	L	92.9	Very high	90.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58	-45.9	177.5	-73.5	-179.3	0	0	0	111.9	I148 L152 V401 I402 C407 L408 G409 V410 V413 F416	I148-L405 HydrophobicContact CD1-CD1 4.13Å; I148-L405 HydrophobicContact CG2-CD2 3.97Å; I148-L405 HydrophobicContact CG2-CG 4.44Å; L152-L405 HydrophobicContact CD1-CD2 4.42Å; L152-L405 HydrophobicContact CD2-CD2 3.9Å; L152-L405 HydrophobicContact CG-CD2 4.18Å; V401-L405 WeakPolarHBondContact O-CG 3.37Å; V401-L405 PolarHBondContact O-N 2.95Å; I402-L405 PolarHBondContact O-N 3.14Å; L405-C407 VanDerWaalsContact C-N 3.34Å; L405-C407 PolarHBondContact O-N 3.13Å; L405-L408 CarbonylContact O-C 3.57Å; L405-L408 WeakPolarHBondContact O-CB 3.22Å; L405-L408 PolarHBondContact O-N 3.22Å; L405-L408 VanDerWaalsContact O-N 3.14Å; L405-G409 PolarHBondContact O-N 2.89Å; L405-V410 HydrophobicContact CB-CB 4.11Å; L405-V410 HydrophobicContact CD2-CG2 4.28Å; L405-V410 WeakPolarHBondContact O-CA 3.35Å; L405-V410 VanDerWaalsContact O-CB 3.23Å; L405-V410 WeakPolarHBondContact O-CB 3.46Å; L405-V410 PolarHBondContact O-N 3.36Å; L405-V413 HydrophobicContact CB-CG1 4.11Å; L405-V413 HydrophobicContact CD1-CG1 4.28Å; L405-F416 HydrophobicContact CD1-CD1 4.45Å; L405-F416 HydrophobicContact CD1-CD2 4.45Å; L405-F416 HydrophobicContact CD1-CG 4.33Å; L405-F416 HydrophobicContact CD2-CD2 4.06Å; L405-F416 HydrophobicContact CD2-CE1 4.44Å; L405-F416 HydrophobicContact CD2-CE2 3.61Å; L405-F416 HydrophobicContact CD2-CZ 3.79Å
406	K	92.5	Very high	90.4	Very high	5 Å²	5	27.8 Å²	27.8	2%	0.022	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-40	178.3	-71	-79.5	-171.5	170.9	0	111.8	I402 L403 T404 L408 G409 H411 V413 G444 V446	I402-K406 HydrophobicContact CG2-CG 4.3Å; I402-K406 WeakPolarHBondContact O-CB 3.45Å; I402-K406 VanDerWaalsContact O-CG 3.25Å; I402-K406 WeakPolarHBondContact O-CG 3.06Å; I402-K406 PolarHBondContact O-N 3.43Å; L403-K406 PolarHBondContact O-N 3.5Å; T404-K406 VanDerWaalsContact C-N 3.35Å; T404-K406 PolarHBondContact O-N 2.94Å; K406-L408 VanDerWaalsContact C-N 3.29Å; K406-L408 PolarHBondContact O-N 3.35Å; K406-G409 PolarHBondContact O-N 2.77Å; K406-G409 VanDerWaalsContact O-N 3.08Å; K406-H411 WeakPolarHBondContact CE-O 3.23Å; K406-H411 PolarHBondContact NZ-O 3.46Å; K406-V413 HydrophobicContact CD-CG1 4.28Å; K406-V413 HydrophobicContact CG-CG1 4.24Å; K406-G444 PolarHBondContact NZ-O 2.79Å; K406-G444 VanDerWaalsContact NZ-O 3.08Å; K406-V446 HydrophobicContact CB-CG2 3.5Å; K406-V446 VanDerWaalsContact CB-CG2 3.5Å
407	C	91.6	Very high	90.4	Very high	40 Å²	40	29.3 Å²	29.3	27%	0.27	16%	0.164	S	C	.	.	H	α-helix	trans	-66.2	-30.6	175.1	-65.9	0	0	0	0	112.4	L123 L403 T404 L405 G409 V454	L123-C407 HydrophobicContact CD2-CB 3.83Å; L403-C407 WeakPolarHBondContact O-CB 3.25Å; L403-C407 PolarHBondContact O-N 3.11Å; L403-C407 PolarHBondContact O-SG 3.37Å; T404-C407 PolarHBondContact O-N 2.93Å; L405-C407 VanDerWaalsContact C-N 3.34Å; L405-C407 PolarHBondContact O-N 3.13Å; C407-G409 PolarHBondContact O-N 2.69Å; C407-V454 HydrophobicContact CB-CG1 4.19Å; C407-V454 HydrophobicContact CB-CG2 4.3Å
408	L	89	Confident	90.6	Very high	38 Å²	38	29.2 Å²	29.2	20%	0.199	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	5.5	172.2	-70	170.9	0	0	0	113.8	V122 L123 P126 L152 T404 L405 K406 V410	V122-L408 HydrophobicContact CG1-CD1 4.15Å; V122-L408 HydrophobicContact CG1-CD2 3.97Å; V122-L408 WeakPolarHBondContact O-CD2 3.41Å; L123-L408 HydrophobicContact CB-CD2 4.47Å; L123-L408 HydrophobicContact CD2-CD1 4.34Å; L123-L408 HydrophobicContact CD2-CD2 3.77Å; L123-L408 HydrophobicContact CD2-CG 3.61Å; L123-L408 HydrophobicContact CG-CD2 4.24Å; L123-L408 HydrophobicContact CG-CG 4.35Å; P126-L408 HydrophobicContact CG-CD2 4.49Å; L152-L408 HydrophobicContact CD1-CD1 3.49Å; L152-L408 VanDerWaalsContact CD1-CD1 3.49Å; L152-L408 HydrophobicContact CD2-CD1 3.66Å; L152-L408 HydrophobicContact CG-CD1 4.24Å; T404-L408 HydrophobicContact CG2-CD1 4.16Å; T404-L408 WeakPolarHBondContact O-CG 3.3Å; T404-L408 PolarHBondContact O-N 3.45Å; L405-L408 CarbonylContact O-C 3.57Å; L405-L408 WeakPolarHBondContact O-CB 3.22Å; L405-L408 PolarHBondContact O-N 3.22Å; L405-L408 VanDerWaalsContact O-N 3.14Å; K406-L408 VanDerWaalsContact C-N 3.29Å; K406-L408 PolarHBondContact O-N 3.35Å; L408-V410 VanDerWaalsContact C-N 3.29Å; L408-V410 HydrophobicContact CB-CG2 4.45Å; L408-V410 PolarHBondContact O-N 3.32Å
409	G	86.4	Confident	90.6	Very high	39 Å²	39	30 Å²	30	40%	0.402	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	13.9	-177.3	0	0	0	0	0	113.9	L405 K406 C407 H411	L405-G409 PolarHBondContact O-N 2.89Å; K406-G409 PolarHBondContact O-N 2.77Å; K406-G409 VanDerWaalsContact O-N 3.08Å; C407-G409 PolarHBondContact O-N 2.69Å; G409-H411 PolarHBondContact O-N 3.43Å; G409-H411 VanDerWaalsContact O-N 3.12Å
410	V	88.8	Confident	90.6	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	17%	0.171	C	C	.	.			trans	-80.5	90.6	169.6	-174.8	0	0	0	0	108.4	L152 L405 L408 D412 V413 F416	L152-V410 HydrophobicContact CD2-CG2 4.37Å; L405-V410 HydrophobicContact CB-CB 4.11Å; L405-V410 HydrophobicContact CD2-CG2 4.28Å; L405-V410 WeakPolarHBondContact O-CA 3.35Å; L405-V410 VanDerWaalsContact O-CB 3.23Å; L405-V410 WeakPolarHBondContact O-CB 3.46Å; L405-V410 PolarHBondContact O-N 3.36Å; L408-V410 VanDerWaalsContact C-N 3.29Å; L408-V410 HydrophobicContact CB-CG2 4.45Å; L408-V410 PolarHBondContact O-N 3.32Å; V410-D412 WeakPolarHBondContact CG1-O 3.41Å; V410-V413 HydrophobicContact CG1-CG1 4.45Å; V410-F416 HydrophobicContact CG1-CB 4.43Å; V410-F416 HydrophobicContact CG1-CD2 3.74Å; V410-F416 HydrophobicContact CG1-CG 4.5Å; V410-F416 HydrophobicContact CG2-CD2 4.4Å; V410-F416 HydrophobicContact CG2-CE2 4.46Å
411	H	84.4	Confident	90.6	Very high	108 Å²	108	32.5 Å²	32.5	50%	0.5	18%	0.176	S	C	.	.			trans	-72.5	-47.1	179.7	-59.4	-54.5	0	0	0	112.2	K406 G409 V413 S676	K406-H411 WeakPolarHBondContact CE-O 3.23Å; K406-H411 PolarHBondContact NZ-O 3.46Å; G409-H411 PolarHBondContact O-N 3.43Å; G409-H411 VanDerWaalsContact O-N 3.12Å; H411-V413 PolarHBondContact O-N 2.8Å; H411-S676 VanDerWaalsContact C-OG 3.32Å; H411-S676 PolarHBondContact O-OG 2.89Å
412	D	84.6	Confident	90.6	Very high	45 Å²	45	32.5 Å²	32.5	24%	0.241	18%	0.175	C	C	.	.			trans	-84.7	94.2	174	-171.9	-7.3	0	0	0	110.4	V410 I414 R415 V677	V410-D412 WeakPolarHBondContact CG1-O 3.41Å; D412-I414 PolarHBondContact OD1-N 3.21Å; D412-R415 PolarHBondContact OD1-N 3.46Å; D412-R415 VanDerWaalsContact OD2-CB 3.3Å; D412-R415 WeakPolarHBondContact OD2-CB 3.27Å; D412-R415 WeakPolarHBondContact OD2-CD 3.41Å; D412-R415 WeakPolarHBondContact OD2-CG 3.41Å; D412-R415 IonicContact OD2-NE 3.66Å; D412-V677 HydrophobicContact CB-CG2 4.31Å; D412-V677 WeakPolarHBondContact OD1-CG2 3.45Å
413	V	90.7	Very high	90.3	Very high	2 Å²	2	37 Å²	37	1%	0.012	20%	0.197	C	C	.	.	S	Bend	trans	-83.9	-12.9	176.1	-64.9	0	0	0	0	112.4	I402 L405 K406 V410 H411 Y418 I427 L431	I402-V413 HydrophobicContact CG2-CG1 4.32Å; I402-V413 HydrophobicContact CG2-CG2 4.45Å; L405-V413 HydrophobicContact CB-CG1 4.11Å; L405-V413 HydrophobicContact CD1-CG1 4.28Å; K406-V413 HydrophobicContact CD-CG1 4.28Å; K406-V413 HydrophobicContact CG-CG1 4.24Å; V410-V413 HydrophobicContact CG1-CG1 4.45Å; H411-V413 PolarHBondContact O-N 2.8Å; V413-Y418 VanDerWaalsContact O-CE2 3.23Å; V413-Y418 WeakPolarHBondContact O-CE2 3.25Å; V413-Y418 PolarHBondContact O-OH 2.71Å; V413-I427 HydrophobicContact CB-CG2 4.45Å; V413-I427 HydrophobicContact CG2-CG2 3.65Å; V413-L431 HydrophobicContact CG2-CD1 4.18Å; V413-L431 HydrophobicContact CG2-CD2 4.4Å
414	I	88.8	Confident	90	Very high	36 Å²	36	42.2 Å²	42.2	19%	0.185	22%	0.221	C	C	.	.	S	Bend	trans	-78.5	-47.4	178.9	-64	172.2	0	0	0	109.1	D412 F416 I427 V677	D412-I414 PolarHBondContact OD1-N 3.21Å; I414-F416 VanDerWaalsContact C-N 3.28Å; I414-F416 PolarHBondContact O-N 3.3Å; I414-I427 HydrophobicContact CG1-CD1 4.47Å; I414-I427 HydrophobicContact CG1-CG2 4.17Å; I414-V677 HydrophobicContact CD1-CG2 4.43Å
415	R	87.7	Confident	89.7	Confident	153 Å²	153	47.6 Å²	47.6	58%	0.577	24%	0.239	S	C	*	.	S	Bend	trans	-90.1	13.8	179.6	-54.4	-176.5	-177.2	169.3	2	113.8	D412 E681	D412-R415 PolarHBondContact OD1-N 3.46Å; D412-R415 VanDerWaalsContact OD2-CB 3.3Å; D412-R415 WeakPolarHBondContact OD2-CB 3.27Å; D412-R415 WeakPolarHBondContact OD2-CD 3.41Å; D412-R415 WeakPolarHBondContact OD2-CG 3.41Å; D412-R415 IonicContact OD2-NE 3.66Å; R415-E681 IonicContact CZ-OE2 2.95Å; R415-E681 IonicContact NH1-OE2 2.74Å; R415-E681 PolarHBondContact NH1-OE2 3.14Å; R415-E681 IonicContact NH2-OE2 3Å; R415-E681 PolarHBondContact NH2-OE2 2.86Å
416	F	92	Very high	89.5	Confident	9 Å²	9	48.5 Å²	48.5	4%	0.039	24%	0.243	C	C	.	.	S	Bend	trans	-59.6	142	172.9	176	-92.6	0	0	0	109.9	I148 G151 L152 L405 V410 I414 Y418	I148-F416 HydrophobicContact CD1-CE1 4.46Å; G151-F416 VanDerWaalsContact C-CZ 3.44Å; L152-F416 HydrophobicContact CD2-CE2 3.96Å; L152-F416 HydrophobicContact CD2-CZ 4.29Å; L152-F416 HydrophobicContact CG-CE2 4.23Å; L152-F416 HydrophobicContact CG-CZ 4.05Å; L405-F416 HydrophobicContact CD1-CD1 4.45Å; L405-F416 HydrophobicContact CD1-CD2 4.45Å; L405-F416 HydrophobicContact CD1-CG 4.33Å; L405-F416 HydrophobicContact CD2-CD2 4.06Å; L405-F416 HydrophobicContact CD2-CE1 4.44Å; L405-F416 HydrophobicContact CD2-CE2 3.61Å; L405-F416 HydrophobicContact CD2-CZ 3.79Å; V410-F416 HydrophobicContact CG1-CB 4.43Å; V410-F416 HydrophobicContact CG1-CD2 3.74Å; V410-F416 HydrophobicContact CG1-CG 4.5Å; V410-F416 HydrophobicContact CG2-CD2 4.4Å; V410-F416 HydrophobicContact CG2-CE2 4.46Å; I414-F416 VanDerWaalsContact C-N 3.28Å; I414-F416 PolarHBondContact O-N 3.3Å; F416-Y418 VanDerWaalsContact C-N 3.27Å; F416-Y418 HydrophobicContact CB-CD2 4.35Å; F416-Y418 HydrophobicContact CB-CE1 4.44Å; F416-Y418 HydrophobicContact CB-CE2 3.74Å; F416-Y418 AromaticContact CD1-CD1 3.52Å; F416-Y418 HydrophobicContact CD1-CD1 3.52Å; F416-Y418 HydrophobicContact CD1-CD2 4.13Å; F416-Y418 AromaticContact CD1-CE1 3.35Å; F416-Y418 HydrophobicContact CD1-CE1 3.35Å; F416-Y418 AromaticContact CD1-CE2 3.99Å; F416-Y418 HydrophobicContact CD1-CE2 3.99Å; F416-Y418 AromaticContact CD1-CG 3.91Å; F416-Y418 HydrophobicContact CD1-CG 3.91Å; F416-Y418 AromaticContact CD1-CZ 3.59Å; F416-Y418 AromaticContact CE1-CD1 3.96Å; F416-Y418 HydrophobicContact CE1-CD1 3.96Å; F416-Y418 AromaticContact CE1-CE1 3.95Å; F416-Y418 HydrophobicContact CE1-CE1 3.95Å; F416-Y418 HydrophobicContact CG-CE1 4.26Å; F416-Y418 HydrophobicContact CG-CE2 4.37Å; F416-Y418 WeakPolarHBondContact O-CD2 3.16Å; F416-Y418 PolarHBondContact O-N 2.61Å
417	P	91.4	Very high	89.4	Confident	39 Å²	39	48.3 Å²	48.3	25%	0.253	24%	0.242	S	C	.	.			trans	-73	78.7	-177.2	30.7	-38.1	0	0	0	111.6	G151 K154 K155 F188	G151-P417 VanDerWaalsContact CA-O 3.26Å; G151-P417 WeakPolarHBondContact CA-O 3.49Å; K154-P417 HydrophobicContact CD-CB 4.31Å; K155-P417 HydrophobicContact CB-CG 4.38Å; F188-P417 HydrophobicContact CE2-CB 4.46Å; F188-P417 WeakPolarHBondContact CE2-O 3.31Å; F188-P417 VanDerWaalsContact CZ-O 3.25Å; F188-P417 WeakPolarHBondContact CZ-O 3.48Å
418	Y	93.2	Very high	89.2	Confident	22 Å²	22	47.2 Å²	47.2	9%	0.086	23%	0.234	C	C	.	.			trans	-74	143.1	170.9	-58.1	-73.5	0	0	0	110.9	I148 F188 I393 V413 F416 D420 P422 I427	I148-Y418 HydrophobicContact CD1-CD1 4.42Å; I148-Y418 HydrophobicContact CD1-CE1 3.89Å; F188-Y418 WeakPolarHBondContact CE2-O 3.43Å; I393-Y418 HydrophobicContact CD1-CD1 3.32Å; I393-Y418 HydrophobicContact CD1-CE1 3.67Å; I393-Y418 HydrophobicContact CD1-CG 4.28Å; V413-Y418 VanDerWaalsContact O-CE2 3.23Å; V413-Y418 WeakPolarHBondContact O-CE2 3.25Å; V413-Y418 PolarHBondContact O-OH 2.71Å; F416-Y418 VanDerWaalsContact C-N 3.27Å; F416-Y418 HydrophobicContact CB-CD2 4.35Å; F416-Y418 HydrophobicContact CB-CE1 4.44Å; F416-Y418 HydrophobicContact CB-CE2 3.74Å; F416-Y418 AromaticContact CD1-CD1 3.52Å; F416-Y418 HydrophobicContact CD1-CD1 3.52Å; F416-Y418 HydrophobicContact CD1-CD2 4.13Å; F416-Y418 AromaticContact CD1-CE1 3.35Å; F416-Y418 HydrophobicContact CD1-CE1 3.35Å; F416-Y418 AromaticContact CD1-CE2 3.99Å; F416-Y418 HydrophobicContact CD1-CE2 3.99Å; F416-Y418 AromaticContact CD1-CG 3.91Å; F416-Y418 HydrophobicContact CD1-CG 3.91Å; F416-Y418 AromaticContact CD1-CZ 3.59Å; F416-Y418 AromaticContact CE1-CD1 3.96Å; F416-Y418 HydrophobicContact CE1-CD1 3.96Å; F416-Y418 AromaticContact CE1-CE1 3.95Å; F416-Y418 HydrophobicContact CE1-CE1 3.95Å; F416-Y418 HydrophobicContact CG-CE1 4.26Å; F416-Y418 HydrophobicContact CG-CE2 4.37Å; F416-Y418 WeakPolarHBondContact O-CD2 3.16Å; F416-Y418 PolarHBondContact O-N 2.61Å; Y418-D420 WeakPolarHBondContact CB-O 3.42Å; Y418-P422 HydrophobicContact CE1-CG 4.48Å; Y418-P422 HydrophobicContact CE2-CG 4.4Å; Y418-I427 HydrophobicContact CE2-CD1 4.42Å
419	L	92.2	Very high	89.1	Confident	19 Å²	19	48 Å²	48	10%	0.099	24%	0.236	C	C	.	.	S	Bend	trans	-65.5	-45.1	169.5	177.1	64.1	0	0	0	110.6	L150 K184 L185 F188	L150-L419 HydrophobicContact CD1-CD2 4Å; K184-L419 HydrophobicContact CD-CD1 4.46Å; K184-L419 HydrophobicContact CG-CD1 4.11Å; L185-L419 HydrophobicContact CD2-CD1 4.2Å; L185-L419 HydrophobicContact CD2-CD2 3.65Å; F188-L419 HydrophobicContact CB-CD1 3.62Å; F188-L419 HydrophobicContact CD1-CD1 4.34Å; F188-L419 HydrophobicContact CD2-CB 4.32Å; F188-L419 HydrophobicContact CD2-CD1 3.95Å; F188-L419 HydrophobicContact CE2-CB 4.32Å; F188-L419 HydrophobicContact CG-CD1 3.71Å
420	D	91.1	Very high	89.3	Confident	28 Å²	28	46.2 Å²	46.2	15%	0.15	22%	0.218	C	C	.	.	S	Bend	trans	-125.6	119	167.7	-81.7	-62.3	0	0	0	108	R142 K184 P391 I393 Y418	R142-D420 IonicContact CZ-OD2 2.93Å; R142-D420 IonicContact NH1-OD2 3.04Å; R142-D420 PolarHBondContact NH1-OD2 3.15Å; R142-D420 IonicContact NH2-OD2 3.8Å; R142-D420 PolarHBondContact NH2-OD2 3.3Å; K184-D420 WeakPolarHBondContact CE-OD1 3.28Å; K184-D420 WeakPolarHBondContact CE-OD2 3.47Å; K184-D420 IonicContact NZ-OD1 3.8Å; K184-D420 PolarHBondContact NZ-OD1 2.91Å; K184-D420 IonicContact NZ-OD2 2.92Å; K184-D420 PolarHBondContact NZ-OD2 2.95Å; P391-D420 HydrophobicContact CG-CB 3.89Å; I393-D420 WeakPolarHBondContact CG2-O 3.2Å; Y418-D420 WeakPolarHBondContact CB-O 3.42Å
421	C	91.3	Very high	89.4	Confident	71 Å²	71	46 Å²	46	48%	0.48	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-68.8	129.5	-178.5	-160.9	0	0	0	0	109.8	Q394	Q394-C421 PolarHBondContact NE2-O 3.2Å
422	P	92.4	Very high	89.6	Confident	4 Å²	4	42.7 Å²	42.7	3%	0.026	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-65.3	157.5	165.6	27.1	-31.2	0	0	0	110.6	I393 L398 Y418 E424 I427	I393-P422 HydrophobicContact CD1-CG 4.36Å; I393-P422 HydrophobicContact CG1-CB 4.21Å; I393-P422 HydrophobicContact CG1-CG 4.09Å; I393-P422 WeakPolarHBondContact O-CB 3.34Å; L398-P422 HydrophobicContact CD1-CB 3.63Å; L398-P422 HydrophobicContact CD1-CG 3.75Å; Y418-P422 HydrophobicContact CE1-CG 4.48Å; Y418-P422 HydrophobicContact CE2-CG 4.4Å; P422-E424 PolarHBondContact O-N 3.07Å; P422-I427 HydrophobicContact CG-CD1 3.95Å; P422-I427 HydrophobicContact CG-CG1 3.88Å
423	E	89.1	Confident	89.8	Confident	96 Å²	96	41.4 Å²	41.4	45%	0.449	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-62.4	136.5	170.9	-63.5	-174.2	-135.7	0	0	110.5	R425 F426	E423-R425 HydrophobicContact CB-CG 3.95Å; E423-R425 VanDerWaalsContact CD-NH2 3.3Å; E423-R425 PolarHBondContact O-N 3.4Å; E423-R425 VanDerWaalsContact O-N 3.1Å; E423-R425 IonicContact OE1-CZ 3.98Å; E423-R425 IonicContact OE1-NE 3.22Å; E423-R425 IonicContact OE1-NH2 3.24Å; E423-R425 PolarHBondContact OE1-NH2 3.24Å; E423-R425 IonicContact OE2-CZ 2.74Å; E423-R425 IonicContact OE2-NE 2.81Å; E423-R425 PolarHBondContact OE2-NE 3.3Å; E423-R425 IonicContact OE2-NH2 2.77Å; E423-R425 PolarHBondContact OE2-NH2 3.41Å; E423-F426 HydrophobicContact CB-CD2 3.97Å; E423-F426 HydrophobicContact CB-CE2 4.25Å; E423-F426 HydrophobicContact CG-CE2 4.41Å; E423-F426 WeakPolarHBondContact O-CB 3.3Å; E423-F426 PolarHBondContact O-N 2.78Å
424	E	87.6	Confident	89.9	Confident	113 Å²	113	41.3 Å²	41.3	53%	0.528	19%	0.193	S	C	.	.	H	α-helix	trans	-54.9	-35.3	-177.1	-68	-178.9	-179.8	0	0	112.4	P422 F426 I427 L428	P422-E424 PolarHBondContact O-N 3.07Å; E424-F426 PolarHBondContact O-N 3.06Å; E424-I427 WeakPolarHBondContact O-CB 3.49Å; E424-I427 PolarHBondContact O-N 3.39Å; E424-L428 WeakPolarHBondContact O-CG 3.46Å; E424-L428 PolarHBondContact O-N 3.38Å
425	R	85.4	Confident	90	Very high	130 Å²	130	41.1 Å²	41.1	49%	0.491	19%	0.19	S	C	.	.	H	α-helix	trans	-54.8	-36.9	175.6	64.9	172.2	171.7	162.9	-3.4	113.1	E423 E429	E423-R425 HydrophobicContact CB-CG 3.95Å; E423-R425 VanDerWaalsContact CD-NH2 3.3Å; E423-R425 PolarHBondContact O-N 3.4Å; E423-R425 VanDerWaalsContact O-N 3.1Å; E423-R425 IonicContact OE1-CZ 3.98Å; E423-R425 IonicContact OE1-NE 3.22Å; E423-R425 IonicContact OE1-NH2 3.24Å; E423-R425 PolarHBondContact OE1-NH2 3.24Å; E423-R425 IonicContact OE2-CZ 2.74Å; E423-R425 IonicContact OE2-NE 2.81Å; E423-R425 PolarHBondContact OE2-NE 3.3Å; E423-R425 IonicContact OE2-NH2 2.77Å; E423-R425 PolarHBondContact OE2-NH2 3.41Å; R425-E429 WeakPolarHBondContact O-CB 3.34Å; R425-E429 PolarHBondContact O-N 2.69Å
426	F	88.4	Confident	90	Very high	19 Å²	19	34.1 Å²	34.1	8%	0.083	16%	0.164	C	C	.	.	H	α-helix	trans	-75	-33.6	179.9	-63.8	-38.4	0	0	0	111.6	H338 Q394 L398 E423 E424 A430	H338-F426 AromaticContact CD2-CE1 3.92Å; Q394-F426 WeakPolarHBondContact O-CE2 3.44Å; L398-F426 HydrophobicContact CD1-CB 3.95Å; L398-F426 HydrophobicContact CG-CB 4.48Å; E423-F426 HydrophobicContact CB-CD2 3.97Å; E423-F426 HydrophobicContact CB-CE2 4.25Å; E423-F426 HydrophobicContact CG-CE2 4.41Å; E423-F426 WeakPolarHBondContact O-CB 3.3Å; E423-F426 PolarHBondContact O-N 2.78Å; E424-F426 PolarHBondContact O-N 3.06Å; F426-A430 VanDerWaalsContact O-CB 3.3Å; F426-A430 WeakPolarHBondContact O-CB 3.38Å; F426-A430 PolarHBondContact O-N 2.75Å
427	I	90.6	Very high	90	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.9	-47.4	173.2	-55.6	-179.8	0	0	0	109.7	L398 I402 V413 I414 Y418 P422 E424 A430 L431	L398-I427 HydrophobicContact CD1-CG1 4.01Å; I402-I427 HydrophobicContact CD1-CB 4.17Å; I402-I427 HydrophobicContact CD1-CG2 3.67Å; V413-I427 HydrophobicContact CB-CG2 4.45Å; V413-I427 HydrophobicContact CG2-CG2 3.65Å; I414-I427 HydrophobicContact CG1-CD1 4.47Å; I414-I427 HydrophobicContact CG1-CG2 4.17Å; Y418-I427 HydrophobicContact CE2-CD1 4.42Å; P422-I427 HydrophobicContact CG-CD1 3.95Å; P422-I427 HydrophobicContact CG-CG1 3.88Å; E424-I427 WeakPolarHBondContact O-CB 3.49Å; E424-I427 PolarHBondContact O-N 3.39Å; I427-A430 PolarHBondContact O-N 3.32Å; I427-L431 HydrophobicContact CG2-CD1 4.42Å; I427-L431 WeakPolarHBondContact O-CG 3.29Å; I427-L431 PolarHBondContact O-N 2.8Å
428	L	87.8	Confident	90	Very high	17 Å²	17	34.3 Å²	34.3	9%	0.089	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-47.1	179.4	-69.3	180	0	0	0	111.3	E424 A430 L431 K432 V671 Y672	E424-L428 WeakPolarHBondContact O-CG 3.46Å; E424-L428 PolarHBondContact O-N 3.38Å; L428-A430 VanDerWaalsContact C-N 3.31Å; L428-A430 PolarHBondContact O-N 2.64Å; L428-L431 WeakPolarHBondContact O-CB 3.4Å; L428-L431 PolarHBondContact O-N 3.24Å; L428-L431 VanDerWaalsContact O-N 3.14Å; L428-K432 PolarHBondContact O-N 3.04Å; L428-V671 HydrophobicContact CB-CB 4.45Å; L428-V671 HydrophobicContact CB-CG1 3.57Å; L428-V671 HydrophobicContact CD2-CG1 3.98Å; L428-V671 HydrophobicContact CG-CG1 4.29Å; L428-V671 WeakPolarHBondContact O-CG1 3.45Å; L428-Y672 HydrophobicContact CD1-CE1 4.15Å; L428-Y672 HydrophobicContact CD1-CE2 4.23Å
429	E	86.7	Confident	90	Very high	55 Å²	55	33.2 Å²	33.2	26%	0.257	16%	0.159	S	C	.	.	H	α-helix	trans	-60.7	-41.2	177	-174.5	55.3	-147.2	0	0	111.9	R425 L431 K432 Q433	R425-E429 WeakPolarHBondContact O-CB 3.34Å; R425-E429 PolarHBondContact O-N 2.69Å; E429-L431 PolarHBondContact O-N 2.99Å; E429-K432 WeakPolarHBondContact O-CB 3.36Å; E429-K432 PolarHBondContact O-N 3.31Å; E429-Q433 WeakPolarHBondContact O-CG 3.38Å; E429-Q433 PolarHBondContact O-N 2.78Å
430	A	90.7	Very high	90.1	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-39	174.8	0	0	0	0	0	112.8	L398 I402 F426 I427 L428 Q433 L434	L398-A430 HydrophobicContact CB-CB 3.9Å; I402-A430 HydrophobicContact CD1-CB 3.67Å; F426-A430 VanDerWaalsContact O-CB 3.3Å; F426-A430 WeakPolarHBondContact O-CB 3.38Å; F426-A430 PolarHBondContact O-N 2.75Å; I427-A430 PolarHBondContact O-N 3.32Å; L428-A430 VanDerWaalsContact C-N 3.31Å; L428-A430 PolarHBondContact O-N 2.64Å; A430-Q433 PolarHBondContact O-N 2.81Å; A430-L434 VanDerWaalsContact O-CG 3.28Å; A430-L434 WeakPolarHBondContact O-CG 3.47Å; A430-L434 PolarHBondContact O-N 2.95Å
431	L	91.3	Very high	90	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-42.8	172.2	-71.9	170.6	0	0	0	111.6	I402 V413 I427 L428 E429 Q433 L434 Y435 I440 L674	I402-L431 HydrophobicContact CG2-CD2 3.7Å; I402-L431 HydrophobicContact CG2-CG 4.29Å; V413-L431 HydrophobicContact CG2-CD1 4.18Å; V413-L431 HydrophobicContact CG2-CD2 4.4Å; I427-L431 HydrophobicContact CG2-CD1 4.42Å; I427-L431 WeakPolarHBondContact O-CG 3.29Å; I427-L431 PolarHBondContact O-N 2.8Å; L428-L431 WeakPolarHBondContact O-CB 3.4Å; L428-L431 PolarHBondContact O-N 3.24Å; L428-L431 VanDerWaalsContact O-N 3.14Å; E429-L431 PolarHBondContact O-N 2.99Å; L431-Q433 VanDerWaalsContact C-N 3.35Å; L431-Q433 PolarHBondContact O-N 3.2Å; L431-L434 PolarHBondContact O-N 3.39Å; L431-Y435 PolarHBondContact O-N 2.71Å; L431-I440 HydrophobicContact CB-CD1 4.38Å; L431-I440 HydrophobicContact CD2-CD1 3.94Å; L431-I440 WeakPolarHBondContact O-CD1 3.33Å; L431-L674 HydrophobicContact CB-CB 4.22Å; L431-L674 HydrophobicContact CB-CD1 4.42Å
432	K	88.3	Confident	89.7	Confident	38 Å²	38	37.7 Å²	37.7	17%	0.165	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-46.8	175.1	-175.8	-171.6	177	-167.2	0	111.1	L428 E429 L434 Y435 Q436 L666 V669 V671	L428-K432 PolarHBondContact O-N 3.04Å; E429-K432 WeakPolarHBondContact O-CB 3.36Å; E429-K432 PolarHBondContact O-N 3.31Å; K432-L434 PolarHBondContact O-N 2.84Å; K432-Y435 PolarHBondContact O-N 3.19Å; K432-Q436 VanDerWaalsContact O-CG 3.29Å; K432-Q436 WeakPolarHBondContact O-CG 3.12Å; K432-Q436 PolarHBondContact O-N 3.2Å; K432-L666 WeakPolarHBondContact CE-O 3.37Å; K432-L666 PolarHBondContact NZ-O 3.42Å; K432-V669 HydrophobicContact CG-CB 4.47Å; K432-V669 HydrophobicContact CG-CG1 4.5Å; K432-V671 HydrophobicContact CB-CG1 4.18Å; K432-V671 HydrophobicContact CB-CG2 4.4Å; K432-V671 HydrophobicContact CD-CG2 4.34Å
433	Q	89.3	Confident	89.3	Confident	18 Å²	18	44.1 Å²	44.1	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-41.2	176.4	-71.9	-177	4.2	0	0	112.4	T399 E429 A430 L431 Y435 Q436 F437	T399-Q433 HydrophobicContact CG2-CB 3.88Å; T399-Q433 PolarHBondContact OG1-OE1 3.4Å; E429-Q433 WeakPolarHBondContact O-CG 3.38Å; E429-Q433 PolarHBondContact O-N 2.78Å; A430-Q433 PolarHBondContact O-N 2.81Å; L431-Q433 VanDerWaalsContact C-N 3.35Å; L431-Q433 PolarHBondContact O-N 3.2Å; Q433-Y435 VanDerWaalsContact C-N 3.32Å; Q433-Y435 PolarHBondContact O-N 2.99Å; Q433-Q436 WeakPolarHBondContact O-CB 3.26Å; Q433-Q436 PolarHBondContact O-N 3.35Å; Q433-F437 HydrophobicContact CB-CE2 4.1Å; Q433-F437 WeakPolarHBondContact O-CD2 3.11Å; Q433-F437 WeakPolarHBondContact O-CG 3.44Å; Q433-F437 PolarHBondContact O-N 3.02Å
434	L	92.5	Very high	89.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-37.5	175.9	-70.7	175.3	0	0	0	112.5	T399 I402 L403 A430 L431 K432 F437 D438 A439 I440 P460	T399-L434 HydrophobicContact CG2-CD2 3.68Å; T399-L434 HydrophobicContact CG2-CG 3.89Å; I402-L434 HydrophobicContact CB-CD1 4.16Å; I402-L434 HydrophobicContact CG2-CD1 3.69Å; L403-L434 HydrophobicContact CB-CD1 4Å; L403-L434 HydrophobicContact CB-CD2 3.76Å; L403-L434 HydrophobicContact CD1-CD2 4.34Å; L403-L434 HydrophobicContact CD2-CD2 4.25Å; L403-L434 HydrophobicContact CG-CD2 4.34Å; A430-L434 VanDerWaalsContact O-CG 3.28Å; A430-L434 WeakPolarHBondContact O-CG 3.47Å; A430-L434 PolarHBondContact O-N 2.95Å; L431-L434 PolarHBondContact O-N 3.39Å; K432-L434 PolarHBondContact O-N 2.84Å; L434-F437 PolarHBondContact O-N 3.33Å; L434-D438 PolarHBondContact O-N 3.41Å; L434-A439 HydrophobicContact CB-CB 4.35Å; L434-A439 HydrophobicContact CD2-CB 4.09Å; L434-A439 WeakPolarHBondContact O-CB 3.46Å; L434-A439 PolarHBondContact O-N 3.3Å; L434-I440 HydrophobicContact CB-CD1 3.92Å; L434-I440 HydrophobicContact CB-CG1 3.94Å; L434-I440 HydrophobicContact CB-CG2 4.27Å; L434-I440 PolarHBondContact O-N 2.79Å; L434-P460 HydrophobicContact CD2-CB 4.43Å; L434-P460 HydrophobicContact CD2-CG 4.36Å
435	Y	91.1	Very high	89.2	Confident	31 Å²	31	40.5 Å²	40.5	12%	0.122	17%	0.167	C	C	.	.	H	α-helix	trans	-65.8	-41.7	173.8	174.5	-103.4	0	0	0	111.1	L431 K432 Q433 F437 D438 R442 V669 L674	L431-Y435 PolarHBondContact O-N 2.71Å; K432-Y435 PolarHBondContact O-N 3.19Å; Q433-Y435 VanDerWaalsContact C-N 3.32Å; Q433-Y435 PolarHBondContact O-N 2.99Å; Y435-F437 VanDerWaalsContact C-N 3.31Å; Y435-F437 PolarHBondContact O-N 3.03Å; Y435-D438 WeakPolarHBondContact O-CA 3.03Å; Y435-D438 PolarHBondContact O-N 2.88Å; Y435-R442 HydrophobicContact CD2-CG 4.48Å; Y435-R442 HydrophobicContact CE2-CB 4.32Å; Y435-R442 HydrophobicContact CE2-CG 3.44Å; Y435-R442 VanDerWaalsContact CE2-CG 3.44Å; Y435-R442 WeakPolarHBondContact OH-CG 3.44Å; Y435-R442 PolarHBondContact OH-NE 3.41Å; Y435-V669 HydrophobicContact CD1-CG1 3.91Å; Y435-V669 HydrophobicContact CD1-CG2 3.82Å; Y435-V669 HydrophobicContact CE1-CG1 4.22Å; Y435-V669 HydrophobicContact CE1-CG2 3.79Å; Y435-L674 HydrophobicContact CD2-CD2 3.9Å; Y435-L674 HydrophobicContact CG-CD1 4.24Å; Y435-L674 HydrophobicContact CG-CD2 3.98Å
436	Q	88.6	Confident	89.6	Confident	7 Å²	7	35.9 Å²	35.9	3%	0.033	15%	0.153	C	C	.	.	H	α-helix	trans	-58.5	-41.3	174.2	-76	169.7	-9.5	0	0	112	K432 Q433 D438 F595 T596	K432-Q436 VanDerWaalsContact O-CG 3.29Å; K432-Q436 WeakPolarHBondContact O-CG 3.12Å; K432-Q436 PolarHBondContact O-N 3.2Å; Q433-Q436 WeakPolarHBondContact O-CB 3.26Å; Q433-Q436 PolarHBondContact O-N 3.35Å; Q436-D438 PolarHBondContact O-N 3.25Å; Q436-D438 VanDerWaalsContact O-N 3.16Å; Q436-F595 HydrophobicContact CB-CE2 4.27Å; Q436-F595 HydrophobicContact CB-CZ 3.64Å; Q436-F595 HydrophobicContact CG-CE2 4.47Å; Q436-F595 HydrophobicContact CG-CZ 4.3Å; Q436-F595 WeakPolarHBondContact O-CE1 3.45Å; Q436-F595 WeakPolarHBondContact O-CZ 3.24Å; Q436-T596 HydrophobicContact CB-CG2 4.25Å; Q436-T596 VanDerWaalsContact OE1-CG2 3.27Å
437	F	91.1	Very high	89.9	Confident	3 Å²	3	36.7 Å²	36.7	1%	0.013	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	5.3	175.7	-57.6	-44.7	0	0	0	114.4	T399 Q433 L434 Y435 A439 L449 M453 P460 R464 G593 F595 T596	T399-F437 HydrophobicContact CG2-CE2 4.21Å; Q433-F437 HydrophobicContact CB-CE2 4.1Å; Q433-F437 WeakPolarHBondContact O-CD2 3.11Å; Q433-F437 WeakPolarHBondContact O-CG 3.44Å; Q433-F437 PolarHBondContact O-N 3.02Å; L434-F437 PolarHBondContact O-N 3.33Å; Y435-F437 VanDerWaalsContact C-N 3.31Å; Y435-F437 PolarHBondContact O-N 3.03Å; F437-A439 PolarHBondContact O-N 3.45Å; F437-L449 WeakPolarHBondContact O-CD2 3.4Å; F437-M453 HydrophobicContact CB-CE 4Å; F437-P460 HydrophobicContact CD2-CB 3.7Å; F437-P460 HydrophobicContact CE2-CB 4.06Å; F437-R464 PolarHBondContact O-NE 3.41Å; F437-G593 WeakPolarHBondContact CE1-O 3.35Å; F437-F595 HydrophobicContact CD1-CE1 4.41Å; F437-T596 HydrophobicContact CE1-CG2 3.86Å; F437-T596 HydrophobicContact CZ-CG2 4.15Å
438	D	91.5	Very high	90	Very high	48 Å²	48	43 Å²	43	26%	0.257	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	21.7	-172.2	-51.5	-58.7	0	0	0	113	L434 Y435 Q436 T447 L449 R464 K665	L434-D438 PolarHBondContact O-N 3.41Å; Y435-D438 WeakPolarHBondContact O-CA 3.03Å; Y435-D438 PolarHBondContact O-N 2.88Å; Q436-D438 PolarHBondContact O-N 3.25Å; Q436-D438 VanDerWaalsContact O-N 3.16Å; D438-T447 WeakPolarHBondContact O-CG2 3.33Å; D438-T447 PolarHBondContact O-OG1 3.2Å; D438-L449 HydrophobicContact CB-CD2 3.82Å; D438-R464 IonicContact OD2-CZ 2.87Å; D438-R464 IonicContact OD2-NE 3.15Å; D438-R464 IonicContact OD2-NH2 3.38Å; D438-R464 PolarHBondContact OD2-NH2 2.96Å; D438-K665 IonicContact OD1-NZ 3.97Å; D438-K665 PolarHBondContact OD1-NZ 2.79Å; D438-K665 IonicContact OD2-NZ 3.92Å
439	A	94.1	Very high	90.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-77.8	-26.7	179.7	0	0	0	0	0	112.2	L403 L434 F437 T447 G450 M453	L403-A439 HydrophobicContact CD1-CB 4.14Å; L434-A439 HydrophobicContact CB-CB 4.35Å; L434-A439 HydrophobicContact CD2-CB 4.09Å; L434-A439 WeakPolarHBondContact O-CB 3.46Å; L434-A439 PolarHBondContact O-N 3.3Å; F437-A439 PolarHBondContact O-N 3.45Å; A439-T447 PolarHBondContact O-N 3.08Å; A439-T447 PolarHBondContact O-OG1 2.62Å; A439-G450 WeakPolarHBondContact O-CA 3.35Å; A439-M453 HydrophobicContact CB-CE 4Å; A439-M453 HydrophobicContact CB-SD 3.82Å
440	I	93.4	Very high	90.6	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-127.3	152.1	172.3	65.4	177.5	0	0	0	110.9	L431 L434 R445	L431-I440 HydrophobicContact CB-CD1 4.38Å; L431-I440 HydrophobicContact CD2-CD1 3.94Å; L431-I440 WeakPolarHBondContact O-CD1 3.33Å; L434-I440 HydrophobicContact CB-CD1 3.92Å; L434-I440 HydrophobicContact CB-CG1 3.94Å; L434-I440 HydrophobicContact CB-CG2 4.27Å; L434-I440 PolarHBondContact O-N 2.79Å; I440-R445 CarbonylContact C-O 3.32Å; I440-R445 WeakPolarHBondContact CA-O 3.41Å; I440-R445 WeakPolarHBondContact CB-O 3.5Å
441	D	89.4	Confident	90.7	Very high	40 Å²	40	45.2 Å²	45.2	21%	0.214	20%	0.197	C	C	.	.			trans	-79.8	174	173	74.9	6	0	0	0	111.7	R443 G444 R445 T447	D441-R443 PolarHBondContact O-N 3.42Å; D441-R443 VanDerWaalsContact OD1-C 3.3Å; D441-R443 VanDerWaalsContact OD1-CA 3.28Å; D441-R443 WeakPolarHBondContact OD1-CA 3.21Å; D441-R443 WeakPolarHBondContact OD1-CB 3.36Å; D441-R443 PolarHBondContact OD1-N 2.65Å; D441-G444 PolarHBondContact O-N 3.25Å; D441-G444 PolarHBondContact OD1-N 3.39Å; D441-G444 VanDerWaalsContact OD1-N 3.08Å; D441-R445 PolarHBondContact N-O 3.41Å; D441-R445 PolarHBondContact OD1-N 3.19Å; D441-R445 IonicContact OD2-CZ 3.17Å; D441-R445 IonicContact OD2-NE 2.73Å; D441-R445 PolarHBondContact OD2-NE 2.93Å; D441-R445 IonicContact OD2-NH2 3.21Å; D441-R445 PolarHBondContact OD2-NH2 2.94Å; D441-T447 HydrophobicContact CB-CG2 4.35Å
442	R	84.6	Confident	90.8	Very high	170 Å²	170	45.4 Å²	45.4	64%	0.642	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.6	175.9	-70.6	-171.1	-179.1	-177.8	-1.2	114.2	Y435	Y435-R442 HydrophobicContact CD2-CG 4.48Å; Y435-R442 HydrophobicContact CE2-CB 4.32Å; Y435-R442 HydrophobicContact CE2-CG 3.44Å; Y435-R442 VanDerWaalsContact CE2-CG 3.44Å; Y435-R442 WeakPolarHBondContact OH-CG 3.44Å; Y435-R442 PolarHBondContact OH-NE 3.41Å
443	R	82.8	Confident	91.1	Very high	138 Å²	138	43.8 Å²	43.8	52%	0.521	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	4.4	177	-54.8	-178	-178.8	-169.9	-0.7	111.8	D441 R445	D441-R443 PolarHBondContact O-N 3.42Å; D441-R443 VanDerWaalsContact OD1-C 3.3Å; D441-R443 VanDerWaalsContact OD1-CA 3.28Å; D441-R443 WeakPolarHBondContact OD1-CA 3.21Å; D441-R443 WeakPolarHBondContact OD1-CB 3.36Å; D441-R443 PolarHBondContact OD1-N 2.65Å; R443-R445 VanDerWaalsContact C-N 3.32Å; R443-R445 PolarHBondContact O-N 2.93Å
444	G	85.6	Confident	91.3	Very high	1 Å²	1	44 Å²	44	1%	0.01	19%	0.194	C	C	.	.	S	Bend	trans	73.2	19.5	-178.4	0	0	0	0	0	114.8	K406 D441 L674	K406-G444 PolarHBondContact NZ-O 2.79Å; K406-G444 VanDerWaalsContact NZ-O 3.08Å; D441-G444 PolarHBondContact O-N 3.25Å; D441-G444 PolarHBondContact OD1-N 3.39Å; D441-G444 VanDerWaalsContact OD1-N 3.08Å; G444-L674 VanDerWaalsContact CA-O 3.27Å; G444-L674 WeakPolarHBondContact CA-O 3.45Å
445	R	90	Very high	91.2	Very high	133 Å²	133	47 Å²	47	50%	0.502	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-91.9	143.6	173.8	-61.2	-178.2	-61.9	174	5.1	110.1	I440 D441 R443 T447	I440-R445 CarbonylContact C-O 3.32Å; I440-R445 WeakPolarHBondContact CA-O 3.41Å; I440-R445 WeakPolarHBondContact CB-O 3.5Å; D441-R445 PolarHBondContact N-O 3.41Å; D441-R445 PolarHBondContact OD1-N 3.19Å; D441-R445 IonicContact OD2-CZ 3.17Å; D441-R445 IonicContact OD2-NE 2.73Å; D441-R445 PolarHBondContact OD2-NE 2.93Å; D441-R445 IonicContact OD2-NH2 3.21Å; D441-R445 PolarHBondContact OD2-NH2 2.94Å; R443-R445 VanDerWaalsContact C-N 3.32Å; R443-R445 PolarHBondContact O-N 2.93Å; R445-T447 PolarHBondContact O-N 2.8Å
446	V	94.1	Very high	91.2	Very high	33 Å²	33	45.8 Å²	45.8	20%	0.2	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-63.2	132	178.2	-170.9	0	0	0	0	109.6	L403 K406 E451	L403-V446 HydrophobicContact CD1-CG1 4.45Å; K406-V446 HydrophobicContact CB-CG2 3.5Å; K406-V446 VanDerWaalsContact CB-CG2 3.5Å; V446-E451 HydrophobicContact CG1-CG 3.92Å
447	T	94.5	Very high	91.2	Very high	36 Å²	36	46.4 Å²	46.4	22%	0.221	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-84.2	165.2	172.5	68.7	0	0	0	0	109.9	D438 A439 D441 R445 L449 G450 E451	D438-T447 WeakPolarHBondContact O-CG2 3.33Å; D438-T447 PolarHBondContact O-OG1 3.2Å; A439-T447 PolarHBondContact O-N 3.08Å; A439-T447 PolarHBondContact O-OG1 2.62Å; D441-T447 HydrophobicContact CB-CG2 4.35Å; R445-T447 PolarHBondContact O-N 2.8Å; T447-L449 PolarHBondContact O-N 2.98Å; T447-L449 VanDerWaalsContact O-N 3.16Å; T447-L449 PolarHBondContact OG1-N 2.93Å; T447-G450 WeakPolarHBondContact O-CA 3.39Å; T447-G450 PolarHBondContact O-N 3.25Å; T447-G450 PolarHBondContact OG1-N 3.37Å; T447-E451 PolarHBondContact O-N 3.2Å
448	K	92.1	Very high	91.1	Very high	131 Å²	131	47 Å²	47	57%	0.57	21%	0.211	S	C	*	.	H	α-helix	trans	-54	-36.6	171.1	-64.7	-173.5	177.1	-172.5	0	112.4	E451 L452 D572	K448-E451 WeakPolarHBondContact O-CB 3.35Å; K448-E451 PolarHBondContact O-N 3.32Å; K448-L452 WeakPolarHBondContact O-CG 3.36Å; K448-L452 PolarHBondContact O-N 3.29Å; K448-D572 HydrophobicContact CD-CB 4.39Å
449	L	92.9	Very high	91	Very high	24 Å²	24	49.3 Å²	49.3	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-42.5	175.1	-178.9	75.2	0	0	0	111.3	F437 D438 T447 E451 L452 M453 L467	F437-L449 WeakPolarHBondContact O-CD2 3.4Å; D438-L449 HydrophobicContact CB-CD2 3.82Å; T447-L449 PolarHBondContact O-N 2.98Å; T447-L449 VanDerWaalsContact O-N 3.16Å; T447-L449 PolarHBondContact OG1-N 2.93Å; L449-E451 VanDerWaalsContact C-N 3.3Å; L449-E451 PolarHBondContact O-N 3.08Å; L449-L452 CarbonylContact O-C 3.58Å; L449-L452 WeakPolarHBondContact O-CB 3.2Å; L449-L452 PolarHBondContact O-N 2.82Å; L449-L452 VanDerWaalsContact O-N 3.15Å; L449-M453 HydrophobicContact CD2-SD 4.16Å; L449-M453 HydrophobicContact CG-CG 4.32Å; L449-M453 HydrophobicContact CG-SD 3.88Å; L449-M453 WeakPolarHBondContact O-CB 3.26Å; L449-M453 WeakPolarHBondContact O-CG 3.39Å; L449-M453 PolarHBondContact O-N 3.02Å; L449-L467 HydrophobicContact CD1-CB 4.36Å; L449-L467 HydrophobicContact CD1-CD1 3.78Å
450	G	94.2	Very high	90.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.8	-40.7	173.1	0	0	0	0	0	113.1	A439 T447 M453 V454	A439-G450 WeakPolarHBondContact O-CA 3.35Å; T447-G450 WeakPolarHBondContact O-CA 3.39Å; T447-G450 PolarHBondContact O-N 3.25Å; T447-G450 PolarHBondContact OG1-N 3.37Å; G450-M453 PolarHBondContact O-N 2.79Å; G450-M453 VanDerWaalsContact O-N 3.16Å; G450-V454 PolarHBondContact O-N 3Å
451	E	92.9	Very high	90.9	Very high	96 Å²	96	49.5 Å²	49.5	45%	0.449	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-38.5	174	-65.7	175.2	178.4	0	0	112.2	V446 T447 K448 L449 M453 V454	V446-E451 HydrophobicContact CG1-CG 3.92Å; T447-E451 PolarHBondContact O-N 3.2Å; K448-E451 WeakPolarHBondContact O-CB 3.35Å; K448-E451 PolarHBondContact O-N 3.32Å; L449-E451 VanDerWaalsContact C-N 3.3Å; L449-E451 PolarHBondContact O-N 3.08Å; E451-M453 VanDerWaalsContact C-N 3.35Å; E451-V454 WeakPolarHBondContact O-CG1 3.44Å
452	L	93.4	Very high	91.1	Very high	5 Å²	5	48 Å²	48	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-35.9	172.3	-64	176	0	0	0	111.5	K448 L449 F456 L467 L567 F573	K448-L452 WeakPolarHBondContact O-CG 3.36Å; K448-L452 PolarHBondContact O-N 3.29Å; L449-L452 CarbonylContact O-C 3.58Å; L449-L452 WeakPolarHBondContact O-CB 3.2Å; L449-L452 PolarHBondContact O-N 2.82Å; L449-L452 VanDerWaalsContact O-N 3.15Å; L452-F456 VanDerWaalsContact O-CD2 3.3Å; L452-F456 WeakPolarHBondContact O-CD2 3.47Å; L452-L467 HydrophobicContact CB-CD1 3.88Å; L452-L467 HydrophobicContact CB-CD2 4.35Å; L452-L567 HydrophobicContact CD2-CB 4.27Å; L452-L567 HydrophobicContact CD2-CD1 4.22Å; L452-L567 HydrophobicContact CD2-CD2 3.84Å; L452-L567 HydrophobicContact CD2-CG 4.32Å; L452-F573 HydrophobicContact CD1-CD2 4.24Å
453	M	94.6	Very high	91.6	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-69.1	-39.7	-176	-75.4	170.3	63.8	0	0	112.7	L403 F437 A439 L449 G450 E451 E455 F456 P460 T463 R464 L467	L403-M453 HydrophobicContact CD2-CB 4.05Å; F437-M453 HydrophobicContact CB-CE 4Å; A439-M453 HydrophobicContact CB-CE 4Å; A439-M453 HydrophobicContact CB-SD 3.82Å; L449-M453 HydrophobicContact CD2-SD 4.16Å; L449-M453 HydrophobicContact CG-CG 4.32Å; L449-M453 HydrophobicContact CG-SD 3.88Å; L449-M453 WeakPolarHBondContact O-CB 3.26Å; L449-M453 WeakPolarHBondContact O-CG 3.39Å; L449-M453 PolarHBondContact O-N 3.02Å; G450-M453 PolarHBondContact O-N 2.79Å; G450-M453 VanDerWaalsContact O-N 3.16Å; E451-M453 VanDerWaalsContact C-N 3.35Å; M453-E455 PolarHBondContact O-N 2.83Å; M453-F456 PolarHBondContact O-N 3.43Å; M453-P460 HydrophobicContact CE-CB 3.54Å; M453-P460 VanDerWaalsContact CE-O 3.24Å; M453-P460 WeakPolarHBondContact CE-O 2.71Å; M453-T463 HydrophobicContact CB-CG2 4.02Å; M453-T463 HydrophobicContact CG-CG2 3.91Å; M453-R464 HydrophobicContact CE-CB 4.43Å; M453-L467 HydrophobicContact CG-CD1 3.62Å
454	V	92.9	Very high	92.2	Very high	24 Å²	24	35.5 Å²	35.5	15%	0.145	17%	0.166	C	C	.	.	H	α-helix	trans	-66.2	-23	-177.1	82.5	0	0	0	0	113.1	L123 L403 C407 G450 E451 F456	L123-V454 HydrophobicContact CD1-CG2 3.66Å; L123-V454 HydrophobicContact CD2-CG2 4.26Å; L403-V454 HydrophobicContact CD2-CB 4.33Å; L403-V454 HydrophobicContact CG-CB 4.26Å; L403-V454 HydrophobicContact CG-CG2 4.27Å; C407-V454 HydrophobicContact CB-CG1 4.19Å; C407-V454 HydrophobicContact CB-CG2 4.3Å; G450-V454 PolarHBondContact O-N 3Å; E451-V454 WeakPolarHBondContact O-CG1 3.44Å; V454-F456 VanDerWaalsContact C-N 3.26Å; V454-F456 PolarHBondContact O-N 3.24Å
455	E	90.7	Very high	92.6	Very high	61 Å²	61	35.4 Å²	35.4	29%	0.285	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-26.1	177.4	-66.5	-89.7	-175.6	0	0	112.3	M453 R566 L567 R570	M453-E455 PolarHBondContact O-N 2.83Å; E455-R566 IonicContact OE1-NH1 3.84Å; E455-R566 IonicContact OE2-CZ 3.26Å; E455-R566 IonicContact OE2-NH1 2.79Å; E455-R566 PolarHBondContact OE2-NH1 3.02Å; E455-R566 VanDerWaalsContact OE2-NH1 3.09Å; E455-R566 IonicContact OE2-NH2 2.73Å; E455-R566 PolarHBondContact OE2-NH2 3.19Å; E455-L567 HydrophobicContact CB-CD1 4.27Å; E455-L567 HydrophobicContact CG-CD2 4.31Å; E455-R570 IonicContact OE1-NH2 3.53Å; E455-R570 PolarHBondContact OE1-NH2 2.94Å; E455-R570 VanDerWaalsContact OE1-NH2 3.17Å
456	F	91.1	Very high	92.8	Very high	7 Å²	7	29.1 Å²	29.1	3%	0.031	14%	0.142	C	C	.	.	S	Bend	trans	-84.9	130.8	177	-69.3	-90.2	0	0	0	110.2	L452 M453 V454 L458 T463 L466 L467 L560 I563 L564 L567	L452-F456 VanDerWaalsContact O-CD2 3.3Å; L452-F456 WeakPolarHBondContact O-CD2 3.47Å; M453-F456 PolarHBondContact O-N 3.43Å; V454-F456 VanDerWaalsContact C-N 3.26Å; V454-F456 PolarHBondContact O-N 3.24Å; F456-L458 HydrophobicContact CB-CB 4.35Å; F456-L458 HydrophobicContact CB-CG 4.32Å; F456-L458 HydrophobicContact CD1-CD1 4.5Å; F456-L458 PolarHBondContact O-N 3.27Å; F456-T463 HydrophobicContact CB-CG2 3.66Å; F456-T463 HydrophobicContact CD2-CG2 3.44Å; F456-T463 VanDerWaalsContact CD2-CG2 3.44Å; F456-T463 HydrophobicContact CE2-CG2 4.26Å; F456-T463 HydrophobicContact CG-CG2 3.69Å; F456-L466 HydrophobicContact CD1-CD2 4.06Å; F456-L466 HydrophobicContact CE1-CD2 3.74Å; F456-L466 HydrophobicContact CZ-CD2 4.39Å; F456-L467 HydrophobicContact CE2-CD2 3.77Å; F456-L467 HydrophobicContact CE2-CG 4.23Å; F456-L467 HydrophobicContact CZ-CD2 4.24Å; F456-L560 HydrophobicContact CD1-CD2 3.85Å; F456-L560 HydrophobicContact CE1-CD2 4.44Å; F456-I563 HydrophobicContact CD1-CG2 3.99Å; F456-I563 HydrophobicContact CD2-CG2 4.42Å; F456-I563 HydrophobicContact CE1-CB 4.17Å; F456-I563 HydrophobicContact CE1-CG2 3.66Å; F456-I563 HydrophobicContact CE2-CG2 4.11Å; F456-I563 HydrophobicContact CG-CG2 4.37Å; F456-I563 HydrophobicContact CZ-CG2 3.73Å; F456-L564 HydrophobicContact CZ-CB 4.33Å; F456-L564 HydrophobicContact CZ-CD1 4.09Å; F456-L567 HydrophobicContact CD2-CD1 4.3Å; F456-L567 HydrophobicContact CE2-CD1 3.4Å; F456-L567 VanDerWaalsContact CE2-CD1 3.4Å; F456-L567 HydrophobicContact CZ-CD1 3.84Å
457	P	88.7	Confident	92.9	Very high	19 Å²	19	27.8 Å²	27.8	12%	0.123	13%	0.134	C	C	.	.	S	Bend	trans	-78.5	50.4	172.1	36.4	-37.6	0	0	0	109.9	R99 F100	R99-P457 HydrophobicContact CG-CB 4.21Å; R99-P457 PolarHBondContact NE-O 2.9Å; R99-P457 PolarHBondContact NH1-O 2.95Å; R99-P457 PolarHBondContact NH2-O 3.42Å; F100-P457 HydrophobicContact CD1-CG 4.35Å; F100-P457 HydrophobicContact CE1-CG 3.42Å; F100-P457 VanDerWaalsContact CE1-CG 3.42Å; F100-P457 HydrophobicContact CZ-CG 3.68Å
458	L	90.4	Very high	92.8	Very high	16 Å²	16	27.9 Å²	27.9	8%	0.084	13%	0.131	C	C	.	.	S	Bend	trans	-127.8	162.6	-177.1	-61.6	-179.4	0	0	0	110.2	F100 F456 L462 T463 L466 A482 S486 L560	F100-L458 HydrophobicContact CZ-CD2 4.34Å; F456-L458 HydrophobicContact CB-CB 4.35Å; F456-L458 HydrophobicContact CB-CG 4.32Å; F456-L458 HydrophobicContact CD1-CD1 4.5Å; F456-L458 PolarHBondContact O-N 3.27Å; L458-L462 HydrophobicContact CD1-CD2 4.34Å; L458-L462 HydrophobicContact CD1-CG 4.38Å; L458-L462 HydrophobicContact CD2-CD2 4.4Å; L458-T463 WeakPolarHBondContact CB-OG1 3.21Å; L458-L466 HydrophobicContact CD1-CD2 4.15Å; L458-A482 HydrophobicContact CD1-CB 4.26Å; L458-S486 WeakPolarHBondContact CD2-OG 3.45Å; L458-L560 HydrophobicContact CD1-CD1 4.09Å; L458-L560 HydrophobicContact CD1-CD2 3.8Å; L458-L560 HydrophobicContact CD2-CD2 4.32Å; L458-L560 HydrophobicContact CG-CD2 4.02Å
459	H	89.3	Confident	92.9	Very high	96 Å²	96	21.6 Å²	21.6	44%	0.444	10%	0.104	S	C	.	.			trans	-61.5	135.9	172	-174.3	-93.2	0	0	0	110.2	G461 L462 T463	H459-G461 VanDerWaalsContact C-N 3.29Å; H459-G461 PolarHBondContact ND1-N 3.35Å; H459-G461 PolarHBondContact O-N 2.7Å; H459-G461 VanDerWaalsContact O-N 3.13Å; H459-L462 PolarHBondContact O-N 3.21Å; H459-T463 PolarHBondContact O-N 3.07Å; H459-T463 PolarHBondContact O-OG1 2.68Å
460	P	92.2	Very high	92.9	Very high	4 Å²	4	20.6 Å²	20.6	3%	0.026	10%	0.099	C	C	.	.	H	α-helix	trans	-47.3	-44	-177.4	-35.6	40.5	0	0	0	115	T399 A400 L403 L434 F437 M453 L462 T463 R464	T399-P460 HydrophobicContact CG2-CB 4.42Å; T399-P460 HydrophobicContact CG2-CG 4.11Å; A400-P460 HydrophobicContact CB-CG 4.45Å; L403-P460 HydrophobicContact CD2-CG 4.43Å; L434-P460 HydrophobicContact CD2-CB 4.43Å; L434-P460 HydrophobicContact CD2-CG 4.36Å; F437-P460 HydrophobicContact CD2-CB 3.7Å; F437-P460 HydrophobicContact CE2-CB 4.06Å; M453-P460 HydrophobicContact CE-CB 3.54Å; M453-P460 VanDerWaalsContact CE-O 3.24Å; M453-P460 WeakPolarHBondContact CE-O 2.71Å; P460-L462 PolarHBondContact O-N 3.45Å; P460-T463 PolarHBondContact O-N 3.07Å; P460-R464 WeakPolarHBondContact O-CB 3.24Å; P460-R464 PolarHBondContact O-N 3.38Å
461	G	92.2	Very high	92.8	Very high	2 Å²	2	20.8 Å²	20.8	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-60.9	-43.1	176.4	0	0	0	0	0	113.9	H459 R464 A465 G593	H459-G461 VanDerWaalsContact C-N 3.29Å; H459-G461 PolarHBondContact ND1-N 3.35Å; H459-G461 PolarHBondContact O-N 2.7Å; H459-G461 VanDerWaalsContact O-N 3.13Å; G461-R464 PolarHBondContact O-N 2.97Å; G461-A465 PolarHBondContact O-N 3.05Å; G461-G593 VanDerWaalsContact CA-O 3.28Å; G461-G593 WeakPolarHBondContact CA-O 3.49Å; G461-G593 WeakPolarHBondContact O-CA 3.4Å
462	L	93.7	Very high	92.7	Very high	9 Å²	9	17.6 Å²	17.6	5%	0.047	9%	0.086	C	C	.	.	H	α-helix	trans	-68.8	-38.9	176.4	178.6	61	0	0	0	111.3	L458 H459 P460 R464 A465 L466 A482 L485 Y594	L458-L462 HydrophobicContact CD1-CD2 4.34Å; L458-L462 HydrophobicContact CD1-CG 4.38Å; L458-L462 HydrophobicContact CD2-CD2 4.4Å; H459-L462 PolarHBondContact O-N 3.21Å; P460-L462 PolarHBondContact O-N 3.45Å; L462-R464 VanDerWaalsContact C-N 3.32Å; L462-R464 PolarHBondContact O-N 3.14Å; L462-A465 PolarHBondContact O-N 3.25Å; L462-L466 WeakPolarHBondContact O-CB 3.39Å; L462-L466 PolarHBondContact O-N 3.49Å; L462-A482 HydrophobicContact CD1-CB 4.03Å; L462-A482 HydrophobicContact CD2-CB 4.13Å; L462-A482 HydrophobicContact CG-CB 4.19Å; L462-L485 HydrophobicContact CD1-CD1 4.14Å; L462-L485 HydrophobicContact CD2-CB 4.35Å; L462-Y594 HydrophobicContact CD1-CE2 4.28Å
463	T	95	Very high	92.4	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.9	-40.8	174.5	-50.1	0	0	0	0	111.7	M453 F456 L458 H459 P460 L466 L467	M453-T463 HydrophobicContact CB-CG2 4.02Å; M453-T463 HydrophobicContact CG-CG2 3.91Å; F456-T463 HydrophobicContact CB-CG2 3.66Å; F456-T463 HydrophobicContact CD2-CG2 3.44Å; F456-T463 VanDerWaalsContact CD2-CG2 3.44Å; F456-T463 HydrophobicContact CE2-CG2 4.26Å; F456-T463 HydrophobicContact CG-CG2 3.69Å; L458-T463 WeakPolarHBondContact CB-OG1 3.21Å; H459-T463 PolarHBondContact O-N 3.07Å; H459-T463 PolarHBondContact O-OG1 2.68Å; P460-T463 PolarHBondContact O-N 3.07Å; T463-L466 PolarHBondContact O-N 2.87Å; T463-L467 HydrophobicContact CG2-CD1 4.06Å; T463-L467 HydrophobicContact CG2-CG 4.35Å; T463-L467 WeakPolarHBondContact O-CB 3.48Å; T463-L467 WeakPolarHBondContact O-CG 3.36Å; T463-L467 PolarHBondContact O-N 3.34Å
464	R	95	Very high	92.1	Very high	45 Å²	45	20.6 Å²	20.6	17%	0.17	12%	0.116	C	C	.	.	H	α-helix	trans	-60	-47.8	177.1	178.9	58.2	168.9	149.9	-8	111.5	F437 D438 M453 P460 G461 L462 L466 L467 K468 T592	F437-R464 PolarHBondContact O-NE 3.41Å; D438-R464 IonicContact OD2-CZ 2.87Å; D438-R464 IonicContact OD2-NE 3.15Å; D438-R464 IonicContact OD2-NH2 3.38Å; D438-R464 PolarHBondContact OD2-NH2 2.96Å; M453-R464 HydrophobicContact CE-CB 4.43Å; P460-R464 WeakPolarHBondContact O-CB 3.24Å; P460-R464 PolarHBondContact O-N 3.38Å; G461-R464 PolarHBondContact O-N 2.97Å; L462-R464 VanDerWaalsContact C-N 3.32Å; L462-R464 PolarHBondContact O-N 3.14Å; R464-L466 VanDerWaalsContact C-N 3.34Å; R464-L466 PolarHBondContact O-N 2.89Å; R464-L467 PolarHBondContact O-N 3.21Å; R464-K468 WeakPolarHBondContact O-CB 3.33Å; R464-K468 PolarHBondContact O-N 3.47Å; R464-T592 WeakPolarHBondContact CG-O 3.33Å
465	A	94.9	Very high	92	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.9	-42.8	176	0	0	0	0	0	111.8	G461 L462 K468 S469 L478 C589	G461-A465 PolarHBondContact O-N 3.05Å; L462-A465 PolarHBondContact O-N 3.25Å; A465-K468 PolarHBondContact O-N 3.35Å; A465-S469 PolarHBondContact O-N 3.23Å; A465-L478 HydrophobicContact CB-CD1 4.05Å; A465-L478 VanDerWaalsContact O-CD1 3.28Å; A465-L478 WeakPolarHBondContact O-CD1 3.27Å; A465-C589 WeakPolarHBondContact CA-O 3.18Å; A465-C589 WeakPolarHBondContact CB-O 3.41Å
466	L	95.3	Very high	92	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-63.1	-48.2	178.3	-178.6	63.1	0	0	0	111.9	F456 L458 L462 T463 R464 K468 S469 A470 L478 L479	F456-L466 HydrophobicContact CD1-CD2 4.06Å; F456-L466 HydrophobicContact CE1-CD2 3.74Å; F456-L466 HydrophobicContact CZ-CD2 4.39Å; L458-L466 HydrophobicContact CD1-CD2 4.15Å; L462-L466 WeakPolarHBondContact O-CB 3.39Å; L462-L466 PolarHBondContact O-N 3.49Å; T463-L466 PolarHBondContact O-N 2.87Å; R464-L466 VanDerWaalsContact C-N 3.34Å; R464-L466 PolarHBondContact O-N 2.89Å; L466-K468 VanDerWaalsContact C-N 3.3Å; L466-K468 PolarHBondContact O-N 3.24Å; L466-S469 PolarHBondContact O-N 3.47Å; L466-S469 PolarHBondContact O-OG 2.92Å; L466-A470 PolarHBondContact O-N 3.31Å; L466-L478 HydrophobicContact CD1-CB 4.12Å; L466-L479 HydrophobicContact CD1-CD2 3.73Å; L466-L479 HydrophobicContact CD1-CG 3.81Å; L466-L479 HydrophobicContact CD2-CD2 4.1Å; L466-L479 HydrophobicContact CG-CD2 4.48Å
467	L	94.8	Very high	92	Very high	4 Å²	4	23.8 Å²	23.8	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-61.2	-39.3	176.9	-75	173.9	0	0	0	111.8	L449 L452 M453 F456 T463 R464 A470 S471 L564 F573	L449-L467 HydrophobicContact CD1-CB 4.36Å; L449-L467 HydrophobicContact CD1-CD1 3.78Å; L452-L467 HydrophobicContact CB-CD1 3.88Å; L452-L467 HydrophobicContact CB-CD2 4.35Å; M453-L467 HydrophobicContact CG-CD1 3.62Å; F456-L467 HydrophobicContact CE2-CD2 3.77Å; F456-L467 HydrophobicContact CE2-CG 4.23Å; F456-L467 HydrophobicContact CZ-CD2 4.24Å; T463-L467 HydrophobicContact CG2-CD1 4.06Å; T463-L467 HydrophobicContact CG2-CG 4.35Å; T463-L467 WeakPolarHBondContact O-CB 3.48Å; T463-L467 WeakPolarHBondContact O-CG 3.36Å; T463-L467 PolarHBondContact O-N 3.34Å; R464-L467 PolarHBondContact O-N 3.21Å; L467-A470 PolarHBondContact O-N 2.9Å; L467-S471 PolarHBondContact O-N 3.37Å; L467-L564 HydrophobicContact CD2-CD1 4.34Å; L467-F573 HydrophobicContact CD2-CE2 4.06Å
468	K	93.6	Very high	92.2	Very high	38 Å²	38	23 Å²	23	17%	0.165	13%	0.129	C	C	.	.	H	α-helix	trans	-64.1	-40.3	174.5	-174.2	69.5	-173.5	-175.8	0	112.3	R464 A465 L466 A470 S471 L472 E576 T592	R464-K468 WeakPolarHBondContact O-CB 3.33Å; R464-K468 PolarHBondContact O-N 3.47Å; A465-K468 PolarHBondContact O-N 3.35Å; L466-K468 VanDerWaalsContact C-N 3.3Å; L466-K468 PolarHBondContact O-N 3.24Å; K468-A470 VanDerWaalsContact C-N 3.27Å; K468-A470 PolarHBondContact O-N 3.21Å; K468-S471 PolarHBondContact O-N 3.14Å; K468-S471 PolarHBondContact O-OG 3.24Å; K468-L472 HydrophobicContact CD-CD1 4.47Å; K468-L472 HydrophobicContact CG-CD1 4.23Å; K468-L472 WeakPolarHBondContact O-CG 3.44Å; K468-L472 PolarHBondContact O-N 3.15Å; K468-E576 IonicContact NZ-OE1 3.82Å; K468-E576 PolarHBondContact NZ-OE1 3.47Å; K468-E576 IonicContact NZ-OE2 3.09Å; K468-E576 PolarHBondContact NZ-OE2 2.87Å; K468-T592 WeakPolarHBondContact CB-OG1 3.43Å; K468-T592 HydrophobicContact CD-CG2 4.3Å; K468-T592 HydrophobicContact CG-CG2 3.96Å
469	S	93.4	Very high	92.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.5	-34.9	174.9	64.8	0	0	0	0	112.6	A465 L466 L472 G473 C474 Q475	A465-S469 PolarHBondContact O-N 3.23Å; L466-S469 PolarHBondContact O-N 3.47Å; L466-S469 PolarHBondContact O-OG 2.92Å; S469-L472 CarbonylContact O-C 3.58Å; S469-L472 PolarHBondContact O-N 3.16Å; S469-G473 PolarHBondContact O-N 3.19Å; S469-G473 VanDerWaalsContact O-N 3.09Å; S469-C474 VanDerWaalsContact CA-SG 3.52Å; S469-C474 VanDerWaalsContact CB-SG 3.52Å; S469-C474 PolarHBondContact O-N 2.82Å; S469-C474 PolarHBondContact O-SG 3.36Å; S469-C474 VanDerWaalsContact O-SG 3.38Å; S469-Q475 PolarHBondContact O-N 2.98Å
470	A	92.8	Very high	92.7	Very high	2 Å²	2	17.9 Å²	17.9	2%	0.017	11%	0.105	C	C	.	.	H	α-helix	trans	-71.6	-34.2	177.6	0	0	0	0	0	112.7	L466 L467 K468 L472 G473 Q475 L564 F573	L466-A470 PolarHBondContact O-N 3.31Å; L467-A470 PolarHBondContact O-N 2.9Å; K468-A470 VanDerWaalsContact C-N 3.27Å; K468-A470 PolarHBondContact O-N 3.21Å; A470-L472 PolarHBondContact O-N 2.96Å; A470-G473 PolarHBondContact O-N 3.1Å; A470-Q475 HydrophobicContact CB-CB 4.18Å; A470-L564 HydrophobicContact CB-CD1 3.53Å; A470-L564 HydrophobicContact CB-CD2 3.73Å; A470-L564 HydrophobicContact CB-CG 4.11Å; A470-F573 HydrophobicContact CB-CE1 4.36Å; A470-F573 HydrophobicContact CB-CZ 3.76Å
471	S	91.9	Very high	92.8	Very high	5 Å²	5	17.7 Å²	17.7	4%	0.035	10%	0.104	C	C	.	.	H	α-helix	trans	-66.1	-29	173.2	68.5	0	0	0	0	112.3	L467 K468 P574 E576	L467-S471 PolarHBondContact O-N 3.37Å; K468-S471 PolarHBondContact O-N 3.14Å; K468-S471 PolarHBondContact O-OG 3.24Å; S471-P574 VanDerWaalsContact CA-O 3.28Å; S471-P574 WeakPolarHBondContact CA-O 3.26Å; S471-P574 WeakPolarHBondContact CB-O 3.44Å; S471-E576 PolarHBondContact O-N 3.26Å
472	L	90.8	Very high	93	Very high	29 Å²	29	17.7 Å²	17.7	15%	0.152	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	2.4	178.3	-67.2	169.4	0	0	0	114	K468 S469 A470 C474 E576 F578 L585	K468-L472 HydrophobicContact CD-CD1 4.47Å; K468-L472 HydrophobicContact CG-CD1 4.23Å; K468-L472 WeakPolarHBondContact O-CG 3.44Å; K468-L472 PolarHBondContact O-N 3.15Å; S469-L472 CarbonylContact O-C 3.58Å; S469-L472 PolarHBondContact O-N 3.16Å; A470-L472 PolarHBondContact O-N 2.96Å; L472-C474 VanDerWaalsContact C-N 3.31Å; L472-C474 PolarHBondContact O-N 3.42Å; L472-E576 HydrophobicContact CD2-CB 3.67Å; L472-E576 HydrophobicContact CG-CB 4.45Å; L472-F578 HydrophobicContact CD2-CB 3.66Å; L472-L585 HydrophobicContact CD1-CD2 4.06Å
473	G	87.8	Confident	93	Very high	56 Å²	56	17.2 Å²	17.2	58%	0.577	10%	0.101	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	19.7	-179.6	0	0	0	0	0	115.2	S469 A470	S469-G473 PolarHBondContact O-N 3.19Å; S469-G473 VanDerWaalsContact O-N 3.09Å; A470-G473 PolarHBondContact O-N 3.1Å
474	C	88.4	Confident	93	Very high	14 Å²	14	17.6 Å²	17.6	10%	0.095	10%	0.103	C	C	.	.			trans	-113.5	23.7	179.6	67.4	0	0	0	0	113.8	S469 L472 D476 L477	S469-C474 VanDerWaalsContact CA-SG 3.52Å; S469-C474 VanDerWaalsContact CB-SG 3.52Å; S469-C474 PolarHBondContact O-N 2.82Å; S469-C474 PolarHBondContact O-SG 3.36Å; S469-C474 VanDerWaalsContact O-SG 3.38Å; L472-C474 VanDerWaalsContact C-N 3.31Å; L472-C474 PolarHBondContact O-N 3.42Å; C474-D476 PolarHBondContact O-N 3.23Å; C474-D476 VanDerWaalsContact O-N 3.13Å; C474-L477 HydrophobicContact CB-CD1 4.34Å; C474-L477 PolarHBondContact O-N 2.62Å; C474-L477 VanDerWaalsContact O-N 3.08Å
475	Q	90.9	Very high	92.8	Very high	32 Å²	32	16.9 Å²	16.9	15%	0.15	10%	0.102	C	C	.	.	H	α-helix	trans	-56.5	-28.2	179.7	63	-83.4	10.1	0	0	114	S469 A470 L477 L478 L479 L564	S469-Q475 PolarHBondContact O-N 2.98Å; A470-Q475 HydrophobicContact CB-CB 4.18Å; Q475-L477 PolarHBondContact O-N 2.88Å; Q475-L477 VanDerWaalsContact O-N 3.15Å; Q475-L478 PolarHBondContact O-N 3.44Å; Q475-L479 HydrophobicContact CB-CD1 4.04Å; Q475-L479 HydrophobicContact CB-CG 4.33Å; Q475-L479 HydrophobicContact CG-CD1 4.08Å; Q475-L479 VanDerWaalsContact O-CB 3.29Å; Q475-L479 WeakPolarHBondContact O-CB 3.38Å; Q475-L479 WeakPolarHBondContact O-CG 3.48Å; Q475-L479 PolarHBondContact O-N 3.34Å; Q475-L564 HydrophobicContact CB-CD2 3.65Å; Q475-L564 HydrophobicContact CG-CD2 3.85Å
476	D	90.6	Very high	92.6	Very high	86 Å²	86	18.4 Å²	18.4	46%	0.46	11%	0.113	S	C	.	.	H	α-helix	trans	-65.1	-17.3	179.4	-67.5	-37.2	0	0	0	113.5	C474 P480 R561	C474-D476 PolarHBondContact O-N 3.23Å; C474-D476 VanDerWaalsContact O-N 3.13Å; D476-P480 WeakPolarHBondContact O-CD 3.32Å; D476-P480 WeakPolarHBondContact O-CG 3.4Å; D476-R561 IonicContact OD1-CZ 2.95Å; D476-R561 VanDerWaalsContact OD1-CZ 3.26Å; D476-R561 IonicContact OD1-NH1 3.4Å; D476-R561 PolarHBondContact OD1-NH1 3.04Å; D476-R561 IonicContact OD1-NH2 3.4Å; D476-R561 PolarHBondContact OD1-NH2 2.95Å
477	L	90.1	Very high	92.2	Very high	42 Å²	42	19.9 Å²	19.9	22%	0.22	12%	0.121	C	C	.	.	H	α-helix	trans	-85.8	-39	175	-56.5	177.6	0	0	0	111.8	C474 Q475 V481 L524 K582 F586	C474-L477 HydrophobicContact CB-CD1 4.34Å; C474-L477 PolarHBondContact O-N 2.62Å; C474-L477 VanDerWaalsContact O-N 3.08Å; Q475-L477 PolarHBondContact O-N 2.88Å; Q475-L477 VanDerWaalsContact O-N 3.15Å; L477-V481 VanDerWaalsContact O-CG2 3.3Å; L477-V481 WeakPolarHBondContact O-CG2 3.38Å; L477-L524 HydrophobicContact CB-CD2 4.27Å; L477-L524 HydrophobicContact CD2-CD2 3.82Å; L477-K582 HydrophobicContact CD1-CB 4.3Å; L477-F586 HydrophobicContact CB-CD2 3.59Å; L477-F586 HydrophobicContact CB-CE2 4.04Å; L477-F586 HydrophobicContact CD1-CB 4.12Å; L477-F586 HydrophobicContact CD1-CD2 4.37Å
478	L	93.1	Very high	91.5	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-93.5	-26.4	-176.2	-80.6	-173	0	0	0	114.8	A465 L466 Q475 V481 A482 F586 C589 L590	A465-L478 HydrophobicContact CB-CD1 4.05Å; A465-L478 VanDerWaalsContact O-CD1 3.28Å; A465-L478 WeakPolarHBondContact O-CD1 3.27Å; L466-L478 HydrophobicContact CD1-CB 4.12Å; Q475-L478 PolarHBondContact O-N 3.44Å; L478-V481 HydrophobicContact CD2-CB 4.4Å; L478-V481 PolarHBondContact O-N 3.24Å; L478-A482 VanDerWaalsContact O-CB 3.3Å; L478-A482 WeakPolarHBondContact O-CB 3.38Å; L478-A482 PolarHBondContact O-N 3.13Å; L478-F586 HydrophobicContact CD2-CD2 3.91Å; L478-F586 HydrophobicContact CD2-CE2 3.37Å; L478-F586 HydrophobicContact CD2-CZ 4.07Å; L478-F586 HydrophobicContact CG-CD2 4.1Å; L478-F586 HydrophobicContact CG-CE2 3.97Å; L478-C589 HydrophobicContact CD1-CB 3.77Å; L478-L590 HydrophobicContact CD2-CD2 3.51Å; L478-L590 HydrophobicContact CD2-CG 3.89Å
479	L	94.8	Very high	91	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.1	-50.2	176.7	-83	169.8	0	0	0	112	L466 Q475 V481 A482 A483 E557 L560 R561 L564	L466-L479 HydrophobicContact CD1-CD2 3.73Å; L466-L479 HydrophobicContact CD1-CG 3.81Å; L466-L479 HydrophobicContact CD2-CD2 4.1Å; L466-L479 HydrophobicContact CG-CD2 4.48Å; Q475-L479 HydrophobicContact CB-CD1 4.04Å; Q475-L479 HydrophobicContact CB-CG 4.33Å; Q475-L479 HydrophobicContact CG-CD1 4.08Å; Q475-L479 VanDerWaalsContact O-CB 3.29Å; Q475-L479 WeakPolarHBondContact O-CB 3.38Å; Q475-L479 WeakPolarHBondContact O-CG 3.48Å; Q475-L479 PolarHBondContact O-N 3.34Å; L479-V481 VanDerWaalsContact C-N 3.31Å; L479-V481 PolarHBondContact O-N 2.59Å; L479-A482 PolarHBondContact O-N 3.36Å; L479-A483 WeakPolarHBondContact O-CB 3.22Å; L479-A483 PolarHBondContact O-N 2.87Å; L479-E557 HydrophobicContact CB-CG 4.21Å; L479-L560 HydrophobicContact CD2-CB 3.66Å; L479-R561 HydrophobicContact CD1-CB 4.08Å; L479-R561 HydrophobicContact CD1-CG 4.27Å; L479-L564 HydrophobicContact CD1-CD2 4.13Å; L479-L564 HydrophobicContact CD2-CD2 4.5Å; L479-L564 HydrophobicContact CG-CD2 4.5Å
480	P	95.1	Very high	90.8	Very high	4 Å²	4	28 Å²	28	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-59.6	-41.6	174.5	-26.7	37.3	0	0	0	112.7	D476 A483 M484 L524 F527 E557	D476-P480 WeakPolarHBondContact O-CD 3.32Å; D476-P480 WeakPolarHBondContact O-CG 3.4Å; P480-A483 WeakPolarHBondContact O-CB 3.43Å; P480-A483 PolarHBondContact O-N 2.93Å; P480-M484 WeakPolarHBondContact O-CB 3.42Å; P480-M484 WeakPolarHBondContact O-CG 3.28Å; P480-M484 PolarHBondContact O-N 3.22Å; P480-L524 HydrophobicContact CB-CD1 3.7Å; P480-L524 HydrophobicContact CG-CD1 3.72Å; P480-F527 HydrophobicContact CB-CB 4.23Å; P480-F527 HydrophobicContact CB-CD1 3.63Å; P480-F527 HydrophobicContact CB-CD2 4.05Å; P480-F527 HydrophobicContact CB-CE1 3.83Å; P480-F527 HydrophobicContact CB-CE2 4.21Å; P480-F527 HydrophobicContact CB-CG 3.73Å; P480-F527 HydrophobicContact CB-CZ 4.09Å; P480-F527 HydrophobicContact CG-CD1 4.08Å; P480-F527 HydrophobicContact CG-CE1 3.97Å; P480-F527 HydrophobicContact CG-CZ 4.43Å; P480-E557 HydrophobicContact CG-CG 4.45Å
481	V	94.9	Very high	90.6	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.9	-45.2	-178.1	175.9	0	0	0	0	110.9	L477 L478 L479 A483 M484 L485 F520 L524 F586	L477-V481 VanDerWaalsContact O-CG2 3.3Å; L477-V481 WeakPolarHBondContact O-CG2 3.38Å; L478-V481 HydrophobicContact CD2-CB 4.4Å; L478-V481 PolarHBondContact O-N 3.24Å; L479-V481 VanDerWaalsContact C-N 3.31Å; L479-V481 PolarHBondContact O-N 2.59Å; V481-A483 VanDerWaalsContact C-N 3.27Å; V481-A483 PolarHBondContact O-N 2.84Å; V481-M484 PolarHBondContact O-N 2.91Å; V481-M484 VanDerWaalsContact O-N 3.17Å; V481-L485 HydrophobicContact CG1-CD1 4.01Å; V481-L485 HydrophobicContact CG1-CG 4.42Å; V481-L485 VanDerWaalsContact O-CG 3.3Å; V481-L485 WeakPolarHBondContact O-CG 3.46Å; V481-L485 PolarHBondContact O-N 2.96Å; V481-F520 HydrophobicContact CG1-CB 4.14Å; V481-F520 HydrophobicContact CG1-CD1 3.73Å; V481-F520 HydrophobicContact CG1-CG 4.44Å; V481-F520 WeakPolarHBondContact CG2-O 3.2Å; V481-L524 HydrophobicContact CG2-CB 3.8Å; V481-F586 HydrophobicContact CG2-CE2 4.14Å; V481-F586 HydrophobicContact CG2-CZ 4.04Å
482	A	95.3	Very high	90.2	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-39.1	175.6	0	0	0	0	0	111.5	L458 L462 L478 L479 S486 L560	L458-A482 HydrophobicContact CD1-CB 4.26Å; L462-A482 HydrophobicContact CD1-CB 4.03Å; L462-A482 HydrophobicContact CD2-CB 4.13Å; L462-A482 HydrophobicContact CG-CB 4.19Å; L478-A482 VanDerWaalsContact O-CB 3.3Å; L478-A482 WeakPolarHBondContact O-CB 3.38Å; L478-A482 PolarHBondContact O-N 3.13Å; L479-A482 PolarHBondContact O-N 3.36Å; A482-S486 WeakPolarHBondContact O-CB 3.44Å; A482-S486 PolarHBondContact O-N 3.32Å; A482-S486 VanDerWaalsContact O-N 3.13Å; A482-S486 PolarHBondContact O-OG 2.87Å; A482-L560 HydrophobicContact CB-CD1 4.18Å
483	A	94.8	Very high	89.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-42.7	174.2	0	0	0	0	0	112.5	L479 P480 V481 S486 A553 V556 E557 L560	L479-A483 WeakPolarHBondContact O-CB 3.22Å; L479-A483 PolarHBondContact O-N 2.87Å; P480-A483 WeakPolarHBondContact O-CB 3.43Å; P480-A483 PolarHBondContact O-N 2.93Å; V481-A483 VanDerWaalsContact C-N 3.27Å; V481-A483 PolarHBondContact O-N 2.84Å; A483-S486 PolarHBondContact O-N 2.94Å; A483-A553 HydrophobicContact CB-CB 4.35Å; A483-A553 WeakPolarHBondContact CB-O 3.38Å; A483-V556 HydrophobicContact CB-CB 3.96Å; A483-V556 HydrophobicContact CB-CG1 3.84Å; A483-E557 HydrophobicContact CB-CB 3.78Å; A483-L560 HydrophobicContact CB-CD1 4.49Å
484	M	93.9	Very high	89.2	Confident	8 Å²	8	34 Å²	34	4%	0.039	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-35.1	177.5	-69.9	-68.6	-77.5	0	0	113.1	P480 V481 S486 V487 I490 L523 V526 F527 L550 A553	P480-M484 WeakPolarHBondContact O-CB 3.42Å; P480-M484 WeakPolarHBondContact O-CG 3.28Å; P480-M484 PolarHBondContact O-N 3.22Å; V481-M484 PolarHBondContact O-N 2.91Å; V481-M484 VanDerWaalsContact O-N 3.17Å; M484-S486 VanDerWaalsContact C-N 3.3Å; M484-V487 VanDerWaalsContact O-CG2 3.29Å; M484-V487 WeakPolarHBondContact O-CG2 3.33Å; M484-I490 HydrophobicContact CE-CB 4.2Å; M484-I490 HydrophobicContact CE-CD1 3.35Å; M484-I490 HydrophobicContact CE-CG1 3.67Å; M484-I490 HydrophobicContact CE-CG2 3.78Å; M484-I490 HydrophobicContact SD-CG2 4.25Å; M484-L523 HydrophobicContact CB-CB 4.21Å; M484-L523 HydrophobicContact CB-CD1 4.34Å; M484-L523 HydrophobicContact CB-CD2 4.46Å; M484-L523 HydrophobicContact CE-CD2 4.07Å; M484-L523 HydrophobicContact CG-CB 4.48Å; M484-V526 HydrophobicContact CE-CG1 4.18Å; M484-F527 HydrophobicContact CG-CB 4.34Å; M484-F527 HydrophobicContact CG-CD2 3.93Å; M484-F527 HydrophobicContact SD-CB 4.48Å; M484-F527 HydrophobicContact SD-CD2 3.94Å; M484-L550 HydrophobicContact CE-CD1 3.64Å; M484-L550 HydrophobicContact SD-CD1 3.26Å; M484-L550 WeakPolarHBondContact SD-CD1 3.4Å; M484-A553 HydrophobicContact CG-CB 4.42Å; M484-A553 HydrophobicContact SD-CB 3.68Å
485	L	92.7	Very high	88.1	Confident	30 Å²	30	35.9 Å²	35.9	16%	0.157	20%	0.195	C	C	.	.	H	α-helix	trans	-76.4	-17.4	174.6	-65.3	173.4	0	0	0	113.1	L462 V481 F520 L523 T650	L462-L485 HydrophobicContact CD1-CD1 4.14Å; L462-L485 HydrophobicContact CD2-CB 4.35Å; V481-L485 HydrophobicContact CG1-CD1 4.01Å; V481-L485 HydrophobicContact CG1-CG 4.42Å; V481-L485 VanDerWaalsContact O-CG 3.3Å; V481-L485 WeakPolarHBondContact O-CG 3.46Å; V481-L485 PolarHBondContact O-N 2.96Å; L485-F520 HydrophobicContact CD1-CD1 4.07Å; L485-F520 HydrophobicContact CD1-CE1 3.83Å; L485-L523 HydrophobicContact CD2-CD1 3.69Å; L485-L523 HydrophobicContact CG-CD1 4.17Å; L485-T650 HydrophobicContact CD2-CG2 4.19Å
486	S	90.2	Very high	87.3	Confident	32 Å²	32	39.6 Å²	39.6	22%	0.224	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.6	-179.9	-63.8	0	0	0	0	114	L458 A482 A483 M484	L458-S486 WeakPolarHBondContact CD2-OG 3.45Å; A482-S486 WeakPolarHBondContact O-CB 3.44Å; A482-S486 PolarHBondContact O-N 3.32Å; A482-S486 VanDerWaalsContact O-N 3.13Å; A482-S486 PolarHBondContact O-OG 2.87Å; A483-S486 PolarHBondContact O-N 2.94Å; M484-S486 VanDerWaalsContact C-N 3.3Å
487	V	86.9	Confident	86.7	Confident	31 Å²	31	39.6 Å²	39.6	19%	0.188	22%	0.216	C	C	.	.	S	Bend	trans	-108.3	169.6	178.3	-62.7	0	0	0	0	110.6	M484 I490 A549 A553 V556	M484-V487 VanDerWaalsContact O-CG2 3.29Å; M484-V487 WeakPolarHBondContact O-CG2 3.33Å; V487-I490 HydrophobicContact CG2-CG2 4.16Å; V487-A549 HydrophobicContact CG2-CB 4.47Å; V487-A553 HydrophobicContact CG1-CB 4.17Å; V487-A553 HydrophobicContact CG2-CB 4.07Å; V487-V556 HydrophobicContact CG1-CG2 4.28Å
488	E	79.6	Confident	86.3	Confident	100 Å²	100	43.4 Å²	43.4	47%	0.467	24%	0.237	S	C	.	.	S	Bend	trans	-57.1	154.3	172	-63.5	178.4	166.3	0	0	111.4	S288 I490	S288-E488 VanDerWaalsContact CA-OE2 3.26Å; S288-E488 WeakPolarHBondContact CA-OE2 3.23Å; S288-E488 WeakPolarHBondContact CB-OE2 3.39Å; E488-I490 PolarHBondContact O-N 2.91Å
489	N	83.9	Confident	85.8	Confident	108 Å²	108	47.7 Å²	47.7	58%	0.578	26%	0.256	S	S	*	.			trans	-53.7	118.8	-179.7	-173.4	-3.8	0	0	0	110.9	F491 H546	N489-F491 VanDerWaalsContact C-N 3.32Å; N489-F491 PolarHBondContact O-N 3.5Å; N489-F491 PolarHBondContact OD1-N 3.48Å; N489-F491 VanDerWaalsContact OD1-N 3.16Å; N489-H546 PolarHBondContact O-CD2 2.63Å
490	I	88.5	Confident	85.2	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	28%	0.277	C	S	.	.			trans	-74.7	-20	-174.4	55.9	127.7	0	0	0	113.6	M484 V487 E488 L523 V526 I545 H546 A549	M484-I490 HydrophobicContact CE-CB 4.2Å; M484-I490 HydrophobicContact CE-CD1 3.35Å; M484-I490 HydrophobicContact CE-CG1 3.67Å; M484-I490 HydrophobicContact CE-CG2 3.78Å; M484-I490 HydrophobicContact SD-CG2 4.25Å; V487-I490 HydrophobicContact CG2-CG2 4.16Å; E488-I490 PolarHBondContact O-N 2.91Å; I490-L523 HydrophobicContact CD1-CD2 4.13Å; I490-L523 HydrophobicContact CG1-CD2 4.21Å; I490-V526 HydrophobicContact CD1-CG1 3.78Å; I490-I545 HydrophobicContact CB-CG2 4.35Å; I490-I545 HydrophobicContact CD1-CG2 4.39Å; I490-I545 CarbonylContact O-C 3.39Å; I490-I545 WeakPolarHBondContact O-CA 3.48Å; I490-H546 PolarHBondContact O-N 3.25Å; I490-A549 HydrophobicContact CG2-CB 3.88Å
491	F	88.5	Confident	84.7	Confident	44 Å²	44	58.9 Å²	58.9	19%	0.193	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-83.8	118.5	-175.5	-65.2	-72.6	0	0	0	111.4	N489 H507 T522 L523	N489-F491 VanDerWaalsContact C-N 3.32Å; N489-F491 PolarHBondContact O-N 3.5Å; N489-F491 PolarHBondContact OD1-N 3.48Å; N489-F491 VanDerWaalsContact OD1-N 3.16Å; F491-H507 HydrophobicContact CD1-CB 4.48Å; F491-H507 AromaticContact CD1-CD2 3.64Å; F491-H507 AromaticContact CD1-CE1 3.86Å; F491-H507 AromaticContact CD1-CG 3.77Å; F491-H507 AromaticContact CD1-ND1 3.9Å; F491-H507 AromaticContact CD1-NE2 3.7Å; F491-T522 HydrophobicContact CZ-CG2 4.33Å; F491-L523 HydrophobicContact CE2-CD2 3.86Å; F491-L523 HydrophobicContact CZ-CD2 4.27Å
492	I	83.9	Confident	84.4	Confident	41 Å²	41	63.6 Å²	63.6	21%	0.21	33%	0.328	C	S	.	.			trans	-78.2	126.1	177.9	-56.4	174.3	0	0	0	109.3	H507 W544 H546	I492-H507 PolarHBondContact O-CE1 3.1Å; I492-H507 VanDerWaalsContact O-CE1 3.31Å; I492-W544 HydrophobicContact CB-CB 4.3Å; I492-W544 HydrophobicContact CB-CE3 4.43Å; I492-W544 WeakPolarHBondContact CB-O 3.48Å; I492-W544 WeakPolarHBondContact CG1-O 3.39Å; I492-W544 HydrophobicContact CG2-CE3 4.07Å; I492-W544 PolarHBondContact N-O 3.42Å; I492-H546 HydrophobicContact CG1-CB 4.48Å; I492-H546 VanDerWaalsContact CG1-CD2 3.46Å; I492-H546 WeakPolarHBondContact CG1-CD2 3.38Å; I492-H546 WeakPolarHBondContact CG1-NE2 3.5Å
493	R	81.3	Confident	84	Confident	110 Å²	110	63.7 Å²	63.7	42%	0.415	33%	0.328	S	S	.	.			trans	-121.3	95.5	172.5	-68.7	-178.8	174.8	-140.9	-18.8	109.4	S622	R493-S622 VanDerWaalsContact CZ-CB 3.43Å
494	P	75.1	Confident	83.6	Confident	23 Å²	23	65.3 Å²	65.3	15%	0.149	34%	0.341	C	S	.	.			trans	-67.7	147.9	-178.5	27.8	-32.6	0	0	0	110.8	Q496 K499 W544	P494-Q496 VanDerWaalsContact C-N 3.27Å; P494-Q496 PolarHBondContact O-N 3.43Å; P494-K499 HydrophobicContact CB-CB 4Å; P494-K499 VanDerWaalsContact CG-C 3.48Å; P494-K499 HydrophobicContact CG-CB 3.48Å; P494-K499 VanDerWaalsContact CG-CB 3.48Å; P494-W544 HydrophobicContact CB-CZ3 4.34Å; P494-W544 HydrophobicContact CG-CE3 4.29Å; P494-W544 HydrophobicContact CG-CH2 4.43Å; P494-W544 HydrophobicContact CG-CZ3 3.94Å
495	G	65.8	Low	83.3	Confident	55 Å²	55	71 Å²	71	57%	0.567	37%	0.366	S	S	*	.	S	Bend	trans	-68.7	-23.3	177.3	0	0	0	0	0	114.2
496	Q	74.1	Confident	83.2	Confident	109 Å²	109	72.6 Å²	72.6	51%	0.509	37%	0.372	S	S	.	.	S	Bend	trans	-72.7	124.2	178	-70.7	179.6	-14.2	0	0	111	P494 D498 K499 Q500	P494-Q496 VanDerWaalsContact C-N 3.27Å; P494-Q496 PolarHBondContact O-N 3.43Å; Q496-D498 VanDerWaalsContact C-N 3.34Å; Q496-D498 PolarHBondContact O-N 3.12Å; Q496-K499 HydrophobicContact CB-CB 4.38Å; Q496-K499 HydrophobicContact CB-CD 4.37Å; Q496-K499 HydrophobicContact CB-CG 4.48Å; Q496-K499 PolarHBondContact O-N 3.33Å; Q496-K499 VanDerWaalsContact OE1-CD 3.25Å; Q496-Q500 WeakPolarHBondContact O-CB 3.36Å; Q496-Q500 PolarHBondContact O-N 2.93Å
497	P	77.8	Confident	83.1	Confident	86 Å²	86	72.1 Å²	72.1	56%	0.558	37%	0.366	S	S	*	.	H	α-helix	trans	-56.7	-39.2	-172.1	-27.4	33.8	0	0	0	115	Q500 K501	P497-Q500 WeakPolarHBondContact O-CB 3.38Å; P497-Q500 PolarHBondContact O-N 3.43Å; P497-K501 PolarHBondContact O-N 2.9Å; P497-K501 VanDerWaalsContact O-N 3.12Å
498	D	82.3	Confident	83	Confident	123 Å²	123	77.2 Å²	77.2	66%	0.658	38%	0.382	S	S	*	.	H	α-helix	trans	-70.7	-45.3	-177.5	-63.9	-37.6	0	0	0	111.9	Q496 Q500 K501 E502	Q496-D498 VanDerWaalsContact C-N 3.34Å; Q496-D498 PolarHBondContact O-N 3.12Å; D498-Q500 PolarHBondContact O-N 3.42Å; D498-K501 PolarHBondContact O-N 2.82Å; D498-E502 PolarHBondContact O-N 3.3Å; D498-E502 VanDerWaalsContact O-N 3.14Å
499	K	81.6	Confident	83.3	Confident	92 Å²	92	76.1 Å²	76.1	40%	0.4	38%	0.376	S	S	.	.	H	α-helix	trans	-64.4	-31	173.7	-66.7	-178.6	178.1	159.5	0	111.6	P494 Q496 E502 A503 W544	P494-K499 HydrophobicContact CB-CB 4Å; P494-K499 VanDerWaalsContact CG-C 3.48Å; P494-K499 HydrophobicContact CG-CB 3.48Å; P494-K499 VanDerWaalsContact CG-CB 3.48Å; Q496-K499 HydrophobicContact CB-CB 4.38Å; Q496-K499 HydrophobicContact CB-CD 4.37Å; Q496-K499 HydrophobicContact CB-CG 4.48Å; Q496-K499 PolarHBondContact O-N 3.33Å; Q496-K499 VanDerWaalsContact OE1-CD 3.25Å; K499-E502 PolarHBondContact O-N 3.35Å; K499-A503 WeakPolarHBondContact O-CB 3.32Å; K499-A503 PolarHBondContact O-N 3.14Å; K499-W544 HydrophobicContact CB-CH2 3.97Å; K499-W544 HydrophobicContact CB-CZ2 4.4Å; K499-W544 HydrophobicContact CD-CH2 4.02Å; K499-W544 HydrophobicContact CG-CH2 4.13Å
500	Q	82.2	Confident	83.4	Confident	94 Å²	94	71 Å²	71	44%	0.439	35%	0.349	S	S	.	.	H	α-helix	trans	-66.1	-41.1	176.8	-169	-177.9	2.4	0	0	111.4	Q496 P497 D498 A504	Q496-Q500 WeakPolarHBondContact O-CB 3.36Å; Q496-Q500 PolarHBondContact O-N 2.93Å; P497-Q500 WeakPolarHBondContact O-CB 3.38Å; P497-Q500 PolarHBondContact O-N 3.43Å; D498-Q500 PolarHBondContact O-N 3.42Å; Q500-A504 VanDerWaalsContact O-CB 3.3Å; Q500-A504 WeakPolarHBondContact O-CB 3.49Å; Q500-A504 PolarHBondContact O-N 2.98Å
501	K	86.1	Confident	83.2	Confident	145 Å²	145	71 Å²	71	63%	0.63	35%	0.35	S	S	*	.	H	α-helix	trans	-63.1	-42.7	174	-71.1	172.4	-176.6	169.3	0	111.5	P497 D498 A504 K505	P497-K501 PolarHBondContact O-N 2.9Å; P497-K501 VanDerWaalsContact O-N 3.12Å; D498-K501 PolarHBondContact O-N 2.82Å; K501-A504 PolarHBondContact O-N 2.96Å; K501-K505 PolarHBondContact O-N 3.3Å
502	E	88.4	Confident	82.9	Confident	100 Å²	100	71.7 Å²	71.7	47%	0.467	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-50.3	176.9	-167.5	-168.1	155.1	0	0	111.8	D498 K499 A504 K505 K506 W544	D498-E502 PolarHBondContact O-N 3.3Å; D498-E502 VanDerWaalsContact O-N 3.14Å; K499-E502 PolarHBondContact O-N 3.35Å; E502-A504 VanDerWaalsContact C-N 3.34Å; E502-A504 PolarHBondContact O-N 2.96Å; E502-K505 WeakPolarHBondContact O-CB 3.49Å; E502-K505 PolarHBondContact O-N 3.31Å; E502-K505 VanDerWaalsContact O-N 3.15Å; E502-K506 PolarHBondContact O-N 3.45Å; E502-W544 PolarHBondContact OE1-NE1 3.07Å
503	A	87.1	Confident	82.6	Confident	2 Å²	2	76.4 Å²	76.4	2%	0.017	38%	0.383	C	S	.	.	H	α-helix	trans	-58.1	-46.2	176.6	0	0	0	0	0	111.6	K499 K505 K506 H507 W544	K499-A503 WeakPolarHBondContact O-CB 3.32Å; K499-A503 PolarHBondContact O-N 3.14Å; A503-K505 VanDerWaalsContact C-N 3.29Å; A503-K505 PolarHBondContact O-N 3.23Å; A503-K506 PolarHBondContact O-N 2.94Å; A503-H507 PolarHBondContact O-CD2 2.85Å; A503-H507 PolarHBondContact O-N 2.96Å; A503-H507 PolarHBondContact O-ND1 2.86Å; A503-W544 HydrophobicContact CB-CB 3.85Å; A503-W544 HydrophobicContact CB-CD2 3.82Å; A503-W544 HydrophobicContact CB-CE3 4.31Å; A503-W544 HydrophobicContact CB-CG 3.6Å
504	A	85.9	Confident	82	Confident	34 Å²	34	73.3 Å²	73.3	28%	0.281	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-31.6	178.3	0	0	0	0	0	113.2	Q500 K501 E502 R508	Q500-A504 VanDerWaalsContact O-CB 3.3Å; Q500-A504 WeakPolarHBondContact O-CB 3.49Å; Q500-A504 PolarHBondContact O-N 2.98Å; K501-A504 PolarHBondContact O-N 2.96Å; E502-A504 VanDerWaalsContact C-N 3.34Å; E502-A504 PolarHBondContact O-N 2.96Å; A504-R508 WeakPolarHBondContact O-CG 3.43Å; A504-R508 PolarHBondContact O-N 2.93Å; A504-R508 PolarHBondContact O-NE 3.09Å
505	K	87.8	Confident	81.5	Confident	127 Å²	127	74.5 Å²	74.5	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-68.1	-47.2	173.1	-175.3	-177.2	175.8	-175.4	0	110.6	K501 E502 A503 H507 R508 E509	K501-K505 PolarHBondContact O-N 3.3Å; E502-K505 WeakPolarHBondContact O-CB 3.49Å; E502-K505 PolarHBondContact O-N 3.31Å; E502-K505 VanDerWaalsContact O-N 3.15Å; A503-K505 VanDerWaalsContact C-N 3.29Å; A503-K505 PolarHBondContact O-N 3.23Å; K505-H507 PolarHBondContact O-N 2.92Å; K505-R508 WeakPolarHBondContact O-CB 3.43Å; K505-R508 PolarHBondContact O-N 2.8Å; K505-E509 VanDerWaalsContact CE-OE1 3.28Å; K505-E509 WeakPolarHBondContact CE-OE1 3.17Å; K505-E509 WeakPolarHBondContact O-CG 3.48Å; K505-E509 PolarHBondContact O-N 3.21Å
506	K	89.4	Confident	81.3	Confident	65 Å²	65	73 Å²	73	28%	0.283	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-41.8	177.1	-72.1	-62	-180	-167.8	0	113.1	E502 A503 R508 E509 L510	E502-K506 PolarHBondContact O-N 3.45Å; A503-K506 PolarHBondContact O-N 2.94Å; K506-R508 VanDerWaalsContact C-N 3.31Å; K506-R508 PolarHBondContact O-N 2.66Å; K506-E509 WeakPolarHBondContact CD-OE2 3.36Å; K506-E509 IonicContact NZ-OE2 2.76Å; K506-E509 PolarHBondContact NZ-OE2 2.75Å; K506-E509 PolarHBondContact O-N 3.33Å; K506-L510 WeakPolarHBondContact O-CG 3.49Å; K506-L510 PolarHBondContact O-N 3.49Å
507	H	88.9	Confident	81	Confident	22 Å²	22	73.4 Å²	73.4	10%	0.102	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-37.3	175.9	-60.1	164.4	0	0	0	112.1	F491 I492 A503 K505 L510 A511 W544	F491-H507 HydrophobicContact CD1-CB 4.48Å; F491-H507 AromaticContact CD1-CD2 3.64Å; F491-H507 AromaticContact CD1-CE1 3.86Å; F491-H507 AromaticContact CD1-CG 3.77Å; F491-H507 AromaticContact CD1-ND1 3.9Å; F491-H507 AromaticContact CD1-NE2 3.7Å; I492-H507 PolarHBondContact O-CE1 3.1Å; I492-H507 VanDerWaalsContact O-CE1 3.31Å; A503-H507 PolarHBondContact O-CD2 2.85Å; A503-H507 PolarHBondContact O-N 2.96Å; A503-H507 PolarHBondContact O-ND1 2.86Å; K505-H507 PolarHBondContact O-N 2.92Å; H507-L510 PolarHBondContact O-N 2.8Å; H507-A511 PolarHBondContact O-N 2.88Å; H507-A511 VanDerWaalsContact O-N 3.07Å; H507-W544 PolarHBondContact NE2-O 2.94Å
508	R	84.2	Confident	81.3	Confident	137 Å²	137	69.9 Å²	69.9	52%	0.517	35%	0.353	S	S	.	.	H	α-helix	trans	-66.6	-42.2	173.3	-81.8	-177.1	-85.7	177.7	-7.7	112.8	A504 K505 K506 L510 A511 A512 E627	A504-R508 WeakPolarHBondContact O-CG 3.43Å; A504-R508 PolarHBondContact O-N 2.93Å; A504-R508 PolarHBondContact O-NE 3.09Å; K505-R508 WeakPolarHBondContact O-CB 3.43Å; K505-R508 PolarHBondContact O-N 2.8Å; K506-R508 VanDerWaalsContact C-N 3.31Å; K506-R508 PolarHBondContact O-N 2.66Å; R508-L510 VanDerWaalsContact C-N 3.26Å; R508-L510 PolarHBondContact O-N 2.89Å; R508-A511 PolarHBondContact O-N 2.82Å; R508-A512 WeakPolarHBondContact O-CB 3.5Å; R508-A512 PolarHBondContact O-N 3.1Å; R508-E627 IonicContact NH1-OE1 2.76Å
509	E	86.9	Confident	81.6	Confident	77 Å²	77	64.9 Å²	64.9	36%	0.36	33%	0.326	S	S	.	.	H	α-helix	trans	-58.2	-39.4	174.4	-72.9	171.4	-167	0	0	111.5	K505 K506 K513	K505-E509 VanDerWaalsContact CE-OE1 3.28Å; K505-E509 WeakPolarHBondContact CE-OE1 3.17Å; K505-E509 WeakPolarHBondContact O-CG 3.48Å; K505-E509 PolarHBondContact O-N 3.21Å; K506-E509 WeakPolarHBondContact CD-OE2 3.36Å; K506-E509 IonicContact NZ-OE2 2.76Å; K506-E509 PolarHBondContact NZ-OE2 2.75Å; K506-E509 PolarHBondContact O-N 3.33Å; E509-K513 PolarHBondContact O-N 3.15Å
510	L	86.1	Confident	82.1	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-43.3	175.9	-70.7	168	0	0	0	112.7	K506 H507 R508 A512 K513 V526 W539 N543 I545	K506-L510 WeakPolarHBondContact O-CG 3.49Å; K506-L510 PolarHBondContact O-N 3.49Å; H507-L510 PolarHBondContact O-N 2.8Å; R508-L510 VanDerWaalsContact C-N 3.26Å; R508-L510 PolarHBondContact O-N 2.89Å; L510-A512 VanDerWaalsContact C-N 3.32Å; L510-A512 PolarHBondContact O-N 2.78Å; L510-K513 WeakPolarHBondContact O-CB 3.37Å; L510-K513 PolarHBondContact O-N 3.09Å; L510-V526 HydrophobicContact CB-CG2 4.5Å; L510-V526 HydrophobicContact CD1-CG2 4.11Å; L510-W539 HydrophobicContact CD2-CH2 4.3Å; L510-W539 HydrophobicContact CD2-CZ2 3.96Å; L510-N543 HydrophobicContact CD1-CB 4.17Å; L510-I545 HydrophobicContact CD1-CD1 3.9Å
511	A	83.6	Confident	82.5	Confident	4 Å²	4	57 Å²	57	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-37.2	177	0	0	0	0	0	112.2	H507 R508 K513 T514 S516 T522	H507-A511 PolarHBondContact O-N 2.88Å; H507-A511 VanDerWaalsContact O-N 3.07Å; R508-A511 PolarHBondContact O-N 2.82Å; A511-K513 VanDerWaalsContact C-N 3.26Å; A511-K513 PolarHBondContact O-N 3.43Å; A511-T514 PolarHBondContact O-N 3.19Å; A511-T514 PolarHBondContact O-OG1 2.89Å; A511-S516 WeakPolarHBondContact O-CA 3.06Å; A511-S516 PolarHBondContact O-N 2.99Å; A511-T522 HydrophobicContact CB-CG2 4.12Å
512	A	81.5	Confident	82.7	Confident	58 Å²	58	50.5 Å²	50.5	48%	0.479	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-32.5	178.2	0	0	0	0	0	113	R508 L510 T514 G515 S516	R508-A512 WeakPolarHBondContact O-CB 3.5Å; R508-A512 PolarHBondContact O-N 3.1Å; L510-A512 VanDerWaalsContact C-N 3.32Å; L510-A512 PolarHBondContact O-N 2.78Å; A512-T514 PolarHBondContact O-N 3.14Å; A512-T514 VanDerWaalsContact O-N 3.17Å; A512-G515 PolarHBondContact O-N 2.72Å; A512-S516 VanDerWaalsContact CA-OG 3.3Å; A512-S516 WeakPolarHBondContact CA-OG 3.46Å; A512-S516 PolarHBondContact N-OG 3.02Å
513	K	78.1	Confident	82.9	Confident	141 Å²	141	46.3 Å²	46.3	61%	0.613	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.4	175.1	-68.1	177.7	179.8	-179	0	113.3	E509 L510 A511	E509-K513 PolarHBondContact O-N 3.15Å; L510-K513 WeakPolarHBondContact O-CB 3.37Å; L510-K513 PolarHBondContact O-N 3.09Å; A511-K513 VanDerWaalsContact C-N 3.26Å; A511-K513 PolarHBondContact O-N 3.43Å
514	T	68.9	Low	83.2	Confident	45 Å²	45	47.2 Å²	47.2	28%	0.276	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	15.4	175.5	47.4	0	0	0	0	113.3	A511 A512 S516	A511-T514 PolarHBondContact O-N 3.19Å; A511-T514 PolarHBondContact O-OG1 2.89Å; A512-T514 PolarHBondContact O-N 3.14Å; A512-T514 VanDerWaalsContact O-N 3.17Å; T514-S516 VanDerWaalsContact C-N 3.31Å
515	G	65.4	Low	83.4	Confident	47 Å²	47	46.6 Å²	46.6	49%	0.485	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	9.5	-176.4	0	0	0	0	0	114.4	A512 M517	A512-G515 PolarHBondContact O-N 2.72Å; G515-M517 WeakPolarHBondContact O-CG 3.38Å; G515-M517 PolarHBondContact O-N 2.66Å
516	S	61.4	Low	83.6	Confident	25 Å²	25	40.5 Å²	40.5	18%	0.175	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	14.7	-176.4	-61.6	0	0	0	0	115.8	A511 A512 T514 L625	A511-S516 WeakPolarHBondContact O-CA 3.06Å; A511-S516 PolarHBondContact O-N 2.99Å; A512-S516 VanDerWaalsContact CA-OG 3.3Å; A512-S516 WeakPolarHBondContact CA-OG 3.46Å; A512-S516 PolarHBondContact N-OG 3.02Å; T514-S516 VanDerWaalsContact C-N 3.31Å; S516-L625 WeakPolarHBondContact O-CD2 3.43Å
517	M	67.2	Low	83.9	Confident	117 Å²	117	37.5 Å²	37.5	58%	0.576	21%	0.206	S	C	*	.			trans	-93.2	-5.9	-171.2	-50.2	-164.9	87.1	0	0	113.9	G515 P653	G515-M517 WeakPolarHBondContact O-CG 3.38Å; G515-M517 PolarHBondContact O-N 2.66Å; M517-P653 WeakPolarHBondContact O-CD 3.3Å; M517-P653 WeakPolarHBondContact O-CG 3.4Å
518	N	84.2	Confident	84.1	Confident	11 Å²	11	40 Å²	40	6%	0.059	22%	0.22	C	C	.	.			trans	-160.4	120.8	-170.6	-173.2	-13.6	0	0	0	113.1	F520 A521 T522 F586 C652	N518-F520 PolarHBondContact O-N 2.92Å; N518-F520 WeakPolarHBondContact OD1-CB 3.45Å; N518-F520 PolarHBondContact OD1-N 3.07Å; N518-A521 HydrophobicContact CB-CB 3.77Å; N518-A521 PolarHBondContact O-N 2.91Å; N518-A521 PolarHBondContact OD1-N 3.1Å; N518-T522 PolarHBondContact O-N 3.21Å; N518-T522 PolarHBondContact O-OG1 3.11Å; N518-F586 WeakPolarHBondContact ND2-CE1 3.47Å; N518-C652 PolarHBondContact ND2-SG 3.46Å; N518-C652 VanDerWaalsContact ND2-SG 3.37Å
519	D	89.6	Confident	84.4	Confident	18 Å²	18	35 Å²	35	10%	0.096	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-36.6	177.6	-70.7	-24.8	0	0	0	112	A521 T522 L523 S623 S624 T650 V651	D519-A521 VanDerWaalsContact C-N 3.32Å; D519-A521 PolarHBondContact O-N 2.92Å; D519-T522 WeakPolarHBondContact O-CB 3.39Å; D519-T522 PolarHBondContact O-N 2.88Å; D519-L523 PolarHBondContact O-N 3.23Å; D519-L523 VanDerWaalsContact O-N 3.09Å; D519-S623 VanDerWaalsContact CG-OG 3.27Å; D519-S623 PolarHBondContact OD1-OG 3.46Å; D519-S623 VanDerWaalsContact OD2-CB 3.26Å; D519-S623 WeakPolarHBondContact OD2-CB 3.5Å; D519-S623 PolarHBondContact OD2-OG 2.92Å; D519-S624 WeakPolarHBondContact OD1-CB 3.37Å; D519-S624 PolarHBondContact OD1-N 3.03Å; D519-S624 PolarHBondContact OD1-OG 2.92Å; D519-T650 HydrophobicContact CB-CG2 4.01Å; D519-T650 WeakPolarHBondContact OD2-CA 3.46Å; D519-V651 WeakPolarHBondContact CB-O 3.43Å; D519-V651 PolarHBondContact N-O 2.89Å; D519-V651 VanDerWaalsContact N-O 3.11Å; D519-V651 PolarHBondContact OD2-N 2.8Å
520	F	91.9	Very high	84.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-38.7	176	-64.4	-101.5	0	0	0	111.2	V481 L485 N518 T522 L523 L524 F586 L590 Y594 H638 T650 C652	V481-F520 HydrophobicContact CG1-CB 4.14Å; V481-F520 HydrophobicContact CG1-CD1 3.73Å; V481-F520 HydrophobicContact CG1-CG 4.44Å; V481-F520 WeakPolarHBondContact CG2-O 3.2Å; L485-F520 HydrophobicContact CD1-CD1 4.07Å; L485-F520 HydrophobicContact CD1-CE1 3.83Å; N518-F520 PolarHBondContact O-N 2.92Å; N518-F520 WeakPolarHBondContact OD1-CB 3.45Å; N518-F520 PolarHBondContact OD1-N 3.07Å; F520-T522 VanDerWaalsContact C-N 3.33Å; F520-L523 WeakPolarHBondContact O-CB 3.47Å; F520-L523 PolarHBondContact O-N 3.02Å; F520-L524 PolarHBondContact O-N 2.95Å; F520-F586 HydrophobicContact CB-CE1 3.97Å; F520-F586 HydrophobicContact CB-CZ 3.86Å; F520-L590 HydrophobicContact CB-CD1 3.97Å; F520-L590 HydrophobicContact CD1-CD1 4.06Å; F520-L590 HydrophobicContact CD1-CD2 3.88Å; F520-L590 HydrophobicContact CD2-CD1 4.18Å; F520-L590 HydrophobicContact CE1-CD2 3.97Å; F520-L590 HydrophobicContact CG-CD1 3.83Å; F520-L590 HydrophobicContact CG-CD2 4.49Å; F520-Y594 HydrophobicContact CE1-CE2 4.2Å; F520-H638 HydrophobicContact CE1-CB 4.42Å; F520-H638 HydrophobicContact CZ-CB 4.03Å; F520-T650 HydrophobicContact CD1-CG2 4.17Å; F520-T650 HydrophobicContact CD2-CG2 3.92Å; F520-T650 HydrophobicContact CE1-CG2 4.09Å; F520-T650 HydrophobicContact CE2-CG2 3.86Å; F520-T650 WeakPolarHBondContact CE2-O 3.26Å; F520-T650 HydrophobicContact CG-CG2 4.1Å; F520-T650 HydrophobicContact CZ-CG2 3.94Å; F520-C652 HydrophobicContact CD2-CB 3.64Å; F520-C652 HydrophobicContact CE2-CB 3.83Å
521	A	89.7	Confident	85	Confident	21 Å²	21	36.9 Å²	36.9	17%	0.174	21%	0.213	C	C	.	.	H	α-helix	trans	-69	-33.5	175.2	0	0	0	0	0	111.8	N518 D519 L523 L524 S525 F586	N518-A521 HydrophobicContact CB-CB 3.77Å; N518-A521 PolarHBondContact O-N 2.91Å; N518-A521 PolarHBondContact OD1-N 3.1Å; D519-A521 VanDerWaalsContact C-N 3.32Å; D519-A521 PolarHBondContact O-N 2.92Å; A521-L523 VanDerWaalsContact C-N 3.32Å; A521-L523 PolarHBondContact O-N 3.13Å; A521-L524 WeakPolarHBondContact O-CB 3.36Å; A521-L524 PolarHBondContact O-N 2.8Å; A521-S525 PolarHBondContact O-N 2.88Å; A521-F586 HydrophobicContact CB-CE1 4.47Å
522	T	91.1	Very high	85.4	Confident	8 Å²	8	41.2 Å²	41.2	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-43.7	173.3	-57.6	0	0	0	0	110.7	F491 A511 N518 D519 F520 L524 S525 V526	F491-T522 HydrophobicContact CZ-CG2 4.33Å; A511-T522 HydrophobicContact CB-CG2 4.12Å; N518-T522 PolarHBondContact O-N 3.21Å; N518-T522 PolarHBondContact O-OG1 3.11Å; D519-T522 WeakPolarHBondContact O-CB 3.39Å; D519-T522 PolarHBondContact O-N 2.88Å; F520-T522 VanDerWaalsContact C-N 3.33Å; T522-L524 VanDerWaalsContact C-N 3.35Å; T522-L524 PolarHBondContact O-N 2.82Å; T522-S525 PolarHBondContact O-N 3.44Å; T522-V526 WeakPolarHBondContact O-CG2 3.25Å; T522-V526 PolarHBondContact O-N 2.99Å
523	L	92.7	Very high	85.9	Confident	13 Å²	13	40 Å²	40	7%	0.068	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-43.2	174.9	-65.8	175.6	0	0	0	112.2	M484 L485 I490 F491 D519 F520 A521 V526 F527 T650	M484-L523 HydrophobicContact CB-CB 4.21Å; M484-L523 HydrophobicContact CB-CD1 4.34Å; M484-L523 HydrophobicContact CB-CD2 4.46Å; M484-L523 HydrophobicContact CE-CD2 4.07Å; M484-L523 HydrophobicContact CG-CB 4.48Å; L485-L523 HydrophobicContact CD2-CD1 3.69Å; L485-L523 HydrophobicContact CG-CD1 4.17Å; I490-L523 HydrophobicContact CD1-CD2 4.13Å; I490-L523 HydrophobicContact CG1-CD2 4.21Å; F491-L523 HydrophobicContact CE2-CD2 3.86Å; F491-L523 HydrophobicContact CZ-CD2 4.27Å; D519-L523 PolarHBondContact O-N 3.23Å; D519-L523 VanDerWaalsContact O-N 3.09Å; F520-L523 WeakPolarHBondContact O-CB 3.47Å; F520-L523 PolarHBondContact O-N 3.02Å; A521-L523 VanDerWaalsContact C-N 3.32Å; A521-L523 PolarHBondContact O-N 3.13Å; L523-V526 PolarHBondContact O-N 3.31Å; L523-F527 WeakPolarHBondContact O-CB 3.01Å; L523-F527 PolarHBondContact O-N 2.85Å; L523-T650 HydrophobicContact CD1-CG2 4.35Å
524	L	91.8	Very high	86.5	Confident	21 Å²	21	41.2 Å²	41.2	11%	0.11	24%	0.244	C	C	.	.	H	α-helix	trans	-61.1	-45.5	176.2	177.9	61.3	0	0	0	111.9	L477 P480 V481 F520 A521 T522 F527 N528	L477-L524 HydrophobicContact CB-CD2 4.27Å; L477-L524 HydrophobicContact CD2-CD2 3.82Å; P480-L524 HydrophobicContact CB-CD1 3.7Å; P480-L524 HydrophobicContact CG-CD1 3.72Å; V481-L524 HydrophobicContact CG2-CB 3.8Å; F520-L524 PolarHBondContact O-N 2.95Å; A521-L524 WeakPolarHBondContact O-CB 3.36Å; A521-L524 PolarHBondContact O-N 2.8Å; T522-L524 VanDerWaalsContact C-N 3.35Å; T522-L524 PolarHBondContact O-N 2.82Å; L524-F527 PolarHBondContact O-N 3.25Å; L524-N528 WeakPolarHBondContact O-CB 3.23Å; L524-N528 PolarHBondContact O-N 3.4Å; L524-N528 PolarHBondContact O-ND2 2.93Å
525	S	90.8	Very high	87.5	Confident	20 Å²	20	48.8 Å²	48.8	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-63.3	-42.6	178.6	175.6	0	0	0	0	112.2	A521 T522 N528 S529	A521-S525 PolarHBondContact O-N 2.88Å; T522-S525 PolarHBondContact O-N 3.44Å; S525-N528 PolarHBondContact O-N 3.35Å; S525-S529 WeakPolarHBondContact O-CB 3.39Å; S525-S529 PolarHBondContact O-N 3.39Å; S525-S529 PolarHBondContact O-OG 2.81Å
526	V	93.1	Very high	88.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-46.2	175.2	166	0	0	0	0	111.1	M484 I490 L510 T522 L523 C530 W539 I545 L550	M484-V526 HydrophobicContact CE-CG1 4.18Å; I490-V526 HydrophobicContact CD1-CG1 3.78Å; L510-V526 HydrophobicContact CB-CG2 4.5Å; L510-V526 HydrophobicContact CD1-CG2 4.11Å; T522-V526 WeakPolarHBondContact O-CG2 3.25Å; T522-V526 PolarHBondContact O-N 2.99Å; L523-V526 PolarHBondContact O-N 3.31Å; V526-C530 WeakPolarHBondContact O-CB 3.15Å; V526-C530 PolarHBondContact O-N 3.4Å; V526-C530 VanDerWaalsContact O-N 3.07Å; V526-W539 HydrophobicContact CG1-CH2 4.15Å; V526-W539 HydrophobicContact CG1-CZ3 4.28Å; V526-I545 HydrophobicContact CG1-CD1 3.61Å; V526-I545 HydrophobicContact CG2-CD1 4.27Å; V526-L550 HydrophobicContact CG1-CD2 4.48Å
527	F	94.1	Very high	89.9	Confident	1 Å²	1	50.2 Å²	50.2	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-50.3	178.1	-175.5	-80.9	0	0	0	111.6	P480 M484 L523 L524 C530 K531 L550 A553 F554 E557	P480-F527 HydrophobicContact CB-CB 4.23Å; P480-F527 HydrophobicContact CB-CD1 3.63Å; P480-F527 HydrophobicContact CB-CD2 4.05Å; P480-F527 HydrophobicContact CB-CE1 3.83Å; P480-F527 HydrophobicContact CB-CE2 4.21Å; P480-F527 HydrophobicContact CB-CG 3.73Å; P480-F527 HydrophobicContact CB-CZ 4.09Å; P480-F527 HydrophobicContact CG-CD1 4.08Å; P480-F527 HydrophobicContact CG-CE1 3.97Å; P480-F527 HydrophobicContact CG-CZ 4.43Å; M484-F527 HydrophobicContact CG-CB 4.34Å; M484-F527 HydrophobicContact CG-CD2 3.93Å; M484-F527 HydrophobicContact SD-CB 4.48Å; M484-F527 HydrophobicContact SD-CD2 3.94Å; L523-F527 WeakPolarHBondContact O-CB 3.01Å; L523-F527 PolarHBondContact O-N 2.85Å; L524-F527 PolarHBondContact O-N 3.25Å; F527-C530 PolarHBondContact O-N 3.31Å; F527-K531 HydrophobicContact CD1-CD 4.46Å; F527-K531 HydrophobicContact CE1-CD 3.84Å; F527-K531 WeakPolarHBondContact O-CB 3.48Å; F527-K531 PolarHBondContact O-N 3.14Å; F527-L550 HydrophobicContact CD2-CD1 4.34Å; F527-A553 HydrophobicContact CE2-CB 4.35Å; F527-F554 HydrophobicContact CD1-CD1 4.46Å; F527-F554 HydrophobicContact CD1-CE1 4.02Å; F527-F554 AromaticContact CD2-CD1 3.89Å; F527-F554 HydrophobicContact CD2-CD1 3.89Å; F527-F554 AromaticContact CD2-CE1 3.75Å; F527-F554 HydrophobicContact CD2-CE1 3.75Å; F527-F554 AromaticContact CE1-CD1 3.96Å; F527-F554 HydrophobicContact CE1-CD1 3.96Å; F527-F554 AromaticContact CE1-CE1 3.94Å; F527-F554 HydrophobicContact CE1-CE1 3.94Å; F527-F554 AromaticContact CE2-CD1 3.33Å; F527-F554 HydrophobicContact CE2-CD1 3.33Å; F527-F554 AromaticContact CE2-CE1 3.68Å; F527-F554 HydrophobicContact CE2-CE1 3.68Å; F527-F554 HydrophobicContact CE2-CG 4.5Å; F527-F554 HydrophobicContact CG-CD1 4.44Å; F527-F554 AromaticContact CG-CE1 3.95Å; F527-F554 HydrophobicContact CG-CE1 3.95Å; F527-F554 AromaticContact CZ-CD1 3.38Å; F527-F554 HydrophobicContact CZ-CD1 3.38Å; F527-F554 AromaticContact CZ-CE1 3.79Å; F527-F554 HydrophobicContact CZ-CE1 3.79Å; F527-E557 HydrophobicContact CE1-CG 4.43Å; F527-E557 HydrophobicContact CE2-CB 4.09Å; F527-E557 HydrophobicContact CE2-CG 4.39Å; F527-E557 HydrophobicContact CZ-CB 3.73Å; F527-E557 HydrophobicContact CZ-CG 3.69Å
528	N	92.7	Very high	91	Very high	76 Å²	76	46.1 Å²	46.1	41%	0.406	26%	0.257	S	S	.	.	H	α-helix	trans	-66.5	-44.3	-178.5	-72.1	-20.9	0	0	0	112.1	L524 S525 C530 K531 S532	L524-N528 WeakPolarHBondContact O-CB 3.23Å; L524-N528 PolarHBondContact O-N 3.4Å; L524-N528 PolarHBondContact O-ND2 2.93Å; S525-N528 PolarHBondContact O-N 3.35Å; N528-C530 VanDerWaalsContact C-N 3.28Å; N528-C530 PolarHBondContact O-N 3.43Å; N528-K531 PolarHBondContact O-N 3.23Å; N528-S532 WeakPolarHBondContact O-CB 3.34Å; N528-S532 PolarHBondContact O-N 3.34Å; N528-S532 PolarHBondContact O-OG 3.08Å; N528-S532 VanDerWaalsContact O-OG 3.12Å
529	S	92.5	Very high	91.4	Very high	30 Å²	30	47.3 Å²	47.3	21%	0.21	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-37.5	179.3	-61.1	0	0	0	0	112.2	S525 S532 S533 W539	S525-S529 WeakPolarHBondContact O-CB 3.39Å; S525-S529 PolarHBondContact O-N 3.39Å; S525-S529 PolarHBondContact O-OG 2.81Å; S529-S532 PolarHBondContact O-OG 2.79Å; S529-S533 PolarHBondContact O-N 3.22Å; S529-W539 VanDerWaalsContact CB-CZ2 3.45Å
530	C	93.3	Very high	91.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-73.4	-42.3	175.7	-171.9	0	0	0	0	112	V526 F527 N528 S532 S533 W539 L550 F554	V526-C530 WeakPolarHBondContact O-CB 3.15Å; V526-C530 PolarHBondContact O-N 3.4Å; V526-C530 VanDerWaalsContact O-N 3.07Å; F527-C530 PolarHBondContact O-N 3.31Å; N528-C530 VanDerWaalsContact C-N 3.28Å; N528-C530 PolarHBondContact O-N 3.43Å; C530-S532 VanDerWaalsContact C-N 3.26Å; C530-S532 PolarHBondContact O-N 3.28Å; C530-S533 WeakPolarHBondContact O-CB 3.37Å; C530-S533 PolarHBondContact O-N 3.12Å; C530-S533 VanDerWaalsContact O-N 3.13Å; C530-W539 HydrophobicContact CB-CD2 4.49Å; C530-W539 HydrophobicContact CB-CE3 3.65Å; C530-W539 HydrophobicContact CB-CH2 4.38Å; C530-W539 HydrophobicContact CB-CZ3 3.59Å; C530-L550 HydrophobicContact CB-CD2 3.43Å; C530-L550 VanDerWaalsContact CB-CD2 3.43Å; C530-L550 HydrophobicContact CB-CG 4.45Å; C530-L550 WeakPolarHBondContact SG-CD2 3.41Å; C530-F554 HydrophobicContact CB-CZ 4.14Å
531	K	91.8	Very high	91.2	Very high	119 Å²	119	54.8 Å²	54.8	52%	0.517	29%	0.292	S	S	.	.	H	α-helix	trans	-63.7	-32	179.3	-167.8	170	-176.3	174.4	0	112.1	F527 N528 F554 E557	F527-K531 HydrophobicContact CD1-CD 4.46Å; F527-K531 HydrophobicContact CE1-CD 3.84Å; F527-K531 WeakPolarHBondContact O-CB 3.48Å; F527-K531 PolarHBondContact O-N 3.14Å; N528-K531 PolarHBondContact O-N 3.23Å; K531-F554 HydrophobicContact CB-CE1 3.93Å; K531-F554 HydrophobicContact CB-CZ 3.97Å; K531-F554 HydrophobicContact CD-CE1 4.4Å; K531-F554 HydrophobicContact CG-CE1 4.38Å; K531-E557 IonicContact NZ-OE2 3.26Å; K531-E557 PolarHBondContact NZ-OE2 2.86Å
532	S	91.8	Very high	91.2	Very high	95 Å²	95	60.2 Å²	60.2	66%	0.664	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.2	176.5	70.2	0	0	0	0	114.4	N528 S529 C530	N528-S532 WeakPolarHBondContact O-CB 3.34Å; N528-S532 PolarHBondContact O-N 3.34Å; N528-S532 PolarHBondContact O-OG 3.08Å; N528-S532 VanDerWaalsContact O-OG 3.12Å; S529-S532 PolarHBondContact O-OG 2.79Å; C530-S532 VanDerWaalsContact C-N 3.26Å; C530-S532 PolarHBondContact O-N 3.28Å
533	S	92.4	Very high	91.2	Very high	33 Å²	33	60.7 Å²	60.7	23%	0.231	32%	0.316	C	S	.	.			trans	-83.9	137.1	-179.6	-177.4	0	0	0	0	111	S529 C530 R535 P536	S529-S533 PolarHBondContact O-N 3.22Å; C530-S533 WeakPolarHBondContact O-CB 3.37Å; C530-S533 PolarHBondContact O-N 3.12Å; C530-S533 VanDerWaalsContact O-N 3.13Å; S533-R535 PolarHBondContact O-N 2.96Å; S533-R535 PolarHBondContact OG-N 3.35Å; S533-P536 VanDerWaalsContact O-CD 3.29Å; S533-P536 WeakPolarHBondContact O-CD 3.21Å; S533-P536 WeakPolarHBondContact O-CG 3.26Å
534	D	89.3	Confident	91	Very high	165 Å²	165	62.2 Å²	62.2	88%	0.882	32%	0.321	S	S	*	.	S	Bend	trans	-66.2	-24.4	173.1	-61.2	-38.7	0	0	0	112.8
535	R	91.3	Very high	91	Very high	204 Å²	204	61.3 Å²	61.3	77%	0.77	32%	0.317	S	S	*	.	S	Bend	trans	-128.2	71.1	177.8	-68	-176.5	172.9	168	-1	111.1	S533 S537 G538 W539	S533-R535 PolarHBondContact O-N 2.96Å; S533-R535 PolarHBondContact OG-N 3.35Å; R535-S537 VanDerWaalsContact C-N 3.32Å; R535-S537 PolarHBondContact O-N 2.87Å; R535-G538 PolarHBondContact O-N 2.8Å; R535-W539 PolarHBondContact O-N 2.93Å
536	P	88.8	Confident	90.7	Very high	37 Å²	37	63 Å²	63	24%	0.24	32%	0.322	C	S	.	.	H	α-helix	trans	-54.7	-42.4	-173.7	-28.6	36.7	0	0	0	114.1	S533 G538 W539 C540 W547	S533-P536 VanDerWaalsContact O-CD 3.29Å; S533-P536 WeakPolarHBondContact O-CD 3.21Å; S533-P536 WeakPolarHBondContact O-CG 3.26Å; P536-G538 PolarHBondContact O-N 3.4Å; P536-W539 PolarHBondContact O-N 2.75Å; P536-C540 PolarHBondContact O-N 3.12Å; P536-C540 PolarHBondContact O-SG 2.94Å; P536-C540 VanDerWaalsContact O-SG 3.34Å; P536-W547 HydrophobicContact CB-CE3 4.15Å; P536-W547 HydrophobicContact CB-CH2 3.41Å; P536-W547 VanDerWaalsContact CB-CH2 3.41Å; P536-W547 HydrophobicContact CB-CZ2 4.3Å; P536-W547 HydrophobicContact CB-CZ3 3.32Å; P536-W547 HydrophobicContact CG-CH2 4.29Å
537	S	88	Confident	90.4	Very high	66 Å²	66	66.8 Å²	66.8	46%	0.462	34%	0.336	S	S	.	.	H	α-helix	trans	-67.4	-34.3	178.4	-175.6	0	0	0	0	113.2	R535 K541	R535-S537 VanDerWaalsContact C-N 3.32Å; R535-S537 PolarHBondContact O-N 2.87Å; S537-K541 PolarHBondContact O-N 2.94Å
538	G	89.8	Confident	89.8	Confident	30 Å²	30	72 Å²	72	31%	0.309	36%	0.356	S	S	.	.	H	α-helix	trans	-71	-46.7	176.5	0	0	0	0	0	110.8	R535 P536 C540 K541 E542	R535-G538 PolarHBondContact O-N 2.8Å; P536-G538 PolarHBondContact O-N 3.4Å; G538-C540 VanDerWaalsContact C-N 3.31Å; G538-C540 PolarHBondContact O-N 3.11Å; G538-K541 WeakPolarHBondContact O-CB 3.41Å; G538-K541 PolarHBondContact O-N 2.82Å; G538-E542 WeakPolarHBondContact O-CG 3.29Å; G538-E542 PolarHBondContact O-N 2.9Å
539	W	93	Very high	89.4	Confident	37 Å²	37	68.8 Å²	68.8	14%	0.14	34%	0.34	C	S	.	.	H	α-helix	trans	-56.4	-43.7	175.5	-176.8	89.5	0	0	0	112.3	L510 V526 S529 C530 R535 P536 K541 E542 N543 I545	L510-W539 HydrophobicContact CD2-CH2 4.3Å; L510-W539 HydrophobicContact CD2-CZ2 3.96Å; V526-W539 HydrophobicContact CG1-CH2 4.15Å; V526-W539 HydrophobicContact CG1-CZ3 4.28Å; S529-W539 VanDerWaalsContact CB-CZ2 3.45Å; C530-W539 HydrophobicContact CB-CD2 4.49Å; C530-W539 HydrophobicContact CB-CE3 3.65Å; C530-W539 HydrophobicContact CB-CH2 4.38Å; C530-W539 HydrophobicContact CB-CZ3 3.59Å; R535-W539 PolarHBondContact O-N 2.93Å; P536-W539 PolarHBondContact O-N 2.75Å; W539-K541 VanDerWaalsContact C-N 3.33Å; W539-K541 PolarHBondContact O-N 3.15Å; W539-E542 PolarHBondContact O-N 3.11Å; W539-N543 VanDerWaalsContact CE2-ND2 3.34Å; W539-N543 PolarHBondContact NE1-ND2 3.47Å; W539-N543 WeakPolarHBondContact O-CB 3.4Å; W539-N543 PolarHBondContact O-N 3.43Å; W539-N543 VanDerWaalsContact O-N 3.1Å; W539-N543 PolarHBondContact O-ND2 3.24Å; W539-I545 HydrophobicContact CE3-CD1 4.45Å; W539-I545 HydrophobicContact CH2-CD1 3.64Å; W539-I545 HydrophobicContact CZ3-CD1 3.47Å; W539-I545 VanDerWaalsContact CZ3-CD1 3.47Å
540	C	90.4	Very high	89.3	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.007	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-41.4	175.5	-77.6	0	0	0	0	112.8	P536 G538 N543 W544 I545 W547 L550	P536-C540 PolarHBondContact O-N 3.12Å; P536-C540 PolarHBondContact O-SG 2.94Å; P536-C540 VanDerWaalsContact O-SG 3.34Å; G538-C540 VanDerWaalsContact C-N 3.31Å; G538-C540 PolarHBondContact O-N 3.11Å; C540-N543 PolarHBondContact O-N 3.49Å; C540-W544 PolarHBondContact O-N 3.06Å; C540-W544 VanDerWaalsContact O-N 3.16Å; C540-I545 HydrophobicContact CB-CB 4.27Å; C540-I545 HydrophobicContact CB-CG2 4.47Å; C540-I545 WeakPolarHBondContact CB-O 3.42Å; C540-I545 PolarHBondContact O-N 3.47Å; C540-W547 HydrophobicContact CB-CB 3.98Å; C540-L550 VanDerWaalsContact SG-CD2 3.59Å
541	K	87.6	Confident	89.1	Confident	173 Å²	173	73.5 Å²	73.5	75%	0.752	36%	0.357	S	S	*	.	H	α-helix	trans	-64.6	-44.2	179.3	-172.7	178.6	178.3	-177.5	0	111.5	S537 G538 W539 N543 W544	S537-K541 PolarHBondContact O-N 2.94Å; G538-K541 WeakPolarHBondContact O-CB 3.41Å; G538-K541 PolarHBondContact O-N 2.82Å; W539-K541 VanDerWaalsContact C-N 3.33Å; W539-K541 PolarHBondContact O-N 3.15Å; K541-N543 VanDerWaalsContact C-N 3.26Å; K541-N543 PolarHBondContact O-N 2.85Å; K541-W544 PolarHBondContact O-N 3.29Å
542	E	89.9	Confident	88.8	Confident	136 Å²	136	69.7 Å²	69.7	64%	0.636	35%	0.345	S	S	*	.	H	α-helix	trans	-65.6	-29.1	178.4	-69.5	169.4	-167.5	0	0	113.2	G538 W539	G538-E542 WeakPolarHBondContact O-CG 3.29Å; G538-E542 PolarHBondContact O-N 2.9Å; W539-E542 PolarHBondContact O-N 3.11Å
543	N	90.2	Very high	88.8	Confident	17 Å²	17	65.2 Å²	65.2	9%	0.091	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	9.8	-177.2	-72.1	-76	0	0	0	113.9	L510 W539 C540 K541 I545	L510-N543 HydrophobicContact CD1-CB 4.17Å; W539-N543 VanDerWaalsContact CE2-ND2 3.34Å; W539-N543 PolarHBondContact NE1-ND2 3.47Å; W539-N543 WeakPolarHBondContact O-CB 3.4Å; W539-N543 PolarHBondContact O-N 3.43Å; W539-N543 VanDerWaalsContact O-N 3.1Å; W539-N543 PolarHBondContact O-ND2 3.24Å; C540-N543 PolarHBondContact O-N 3.49Å; K541-N543 VanDerWaalsContact C-N 3.26Å; K541-N543 PolarHBondContact O-N 2.85Å; N543-I545 VanDerWaalsContact C-N 3.33Å; N543-I545 HydrophobicContact CB-CD1 3.82Å; N543-I545 HydrophobicContact CB-CG1 4.33Å; N543-I545 PolarHBondContact O-N 3.19Å
544	W	89.3	Confident	88.9	Confident	45 Å²	45	65.3 Å²	65.3	17%	0.17	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	47.3	-178.5	-62.5	90.9	0	0	0	112.7	I492 P494 K499 E502 A503 H507 C540 K541	I492-W544 HydrophobicContact CB-CB 4.3Å; I492-W544 HydrophobicContact CB-CE3 4.43Å; I492-W544 WeakPolarHBondContact CB-O 3.48Å; I492-W544 WeakPolarHBondContact CG1-O 3.39Å; I492-W544 HydrophobicContact CG2-CE3 4.07Å; I492-W544 PolarHBondContact N-O 3.42Å; P494-W544 HydrophobicContact CB-CZ3 4.34Å; P494-W544 HydrophobicContact CG-CE3 4.29Å; P494-W544 HydrophobicContact CG-CH2 4.43Å; P494-W544 HydrophobicContact CG-CZ3 3.94Å; K499-W544 HydrophobicContact CB-CH2 3.97Å; K499-W544 HydrophobicContact CB-CZ2 4.4Å; K499-W544 HydrophobicContact CD-CH2 4.02Å; K499-W544 HydrophobicContact CG-CH2 4.13Å; E502-W544 PolarHBondContact OE1-NE1 3.07Å; A503-W544 HydrophobicContact CB-CB 3.85Å; A503-W544 HydrophobicContact CB-CD2 3.82Å; A503-W544 HydrophobicContact CB-CE3 4.31Å; A503-W544 HydrophobicContact CB-CG 3.6Å; H507-W544 PolarHBondContact NE2-O 2.94Å; C540-W544 PolarHBondContact O-N 3.06Å; C540-W544 VanDerWaalsContact O-N 3.16Å; K541-W544 PolarHBondContact O-N 3.29Å
545	I	90	Very high	88.9	Confident	3 Å²	3	60 Å²	60	2%	0.015	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-117.7	137.2	178.9	-67.4	162	0	0	0	110.2	I490 L510 V526 W539 C540 N543 W547 L550	I490-I545 HydrophobicContact CB-CG2 4.35Å; I490-I545 HydrophobicContact CD1-CG2 4.39Å; I490-I545 CarbonylContact O-C 3.39Å; I490-I545 WeakPolarHBondContact O-CA 3.48Å; L510-I545 HydrophobicContact CD1-CD1 3.9Å; V526-I545 HydrophobicContact CG1-CD1 3.61Å; V526-I545 HydrophobicContact CG2-CD1 4.27Å; W539-I545 HydrophobicContact CE3-CD1 4.45Å; W539-I545 HydrophobicContact CH2-CD1 3.64Å; W539-I545 HydrophobicContact CZ3-CD1 3.47Å; W539-I545 VanDerWaalsContact CZ3-CD1 3.47Å; C540-I545 HydrophobicContact CB-CB 4.27Å; C540-I545 HydrophobicContact CB-CG2 4.47Å; C540-I545 WeakPolarHBondContact CB-O 3.42Å; C540-I545 PolarHBondContact O-N 3.47Å; N543-I545 VanDerWaalsContact C-N 3.33Å; N543-I545 HydrophobicContact CB-CD1 3.82Å; N543-I545 HydrophobicContact CB-CG1 4.33Å; N543-I545 PolarHBondContact O-N 3.19Å; I545-W547 PolarHBondContact O-N 2.95Å; I545-W547 VanDerWaalsContact O-N 3.09Å; I545-L550 HydrophobicContact CG2-CD2 4.07Å
546	H	84.6	Confident	88.9	Confident	55 Å²	55	50.5 Å²	50.5	26%	0.255	25%	0.25	S	S	.	.			trans	-71.4	100.9	175.6	-75.3	-70.9	0	0	0	111.3	N489 I490 I492 R548 A549 L550	N489-H546 PolarHBondContact O-CD2 2.63Å; I490-H546 PolarHBondContact O-N 3.25Å; I492-H546 HydrophobicContact CG1-CB 4.48Å; I492-H546 VanDerWaalsContact CG1-CD2 3.46Å; I492-H546 WeakPolarHBondContact CG1-CD2 3.38Å; I492-H546 WeakPolarHBondContact CG1-NE2 3.5Å; H546-R548 VanDerWaalsContact C-N 3.28Å; H546-R548 PolarHBondContact O-N 2.96Å; H546-A549 HydrophobicContact CB-CB 3.96Å; H546-A549 PolarHBondContact O-N 3Å; H546-L550 PolarHBondContact O-N 3.3Å
547	W	86.9	Confident	89.2	Confident	80 Å²	80	48.9 Å²	48.9	30%	0.303	24%	0.24	S	C	.	.	H	α-helix	trans	-54.3	-40.2	177.4	171	-123.3	0	0	0	113.2	P536 C540 I545 A549 L550 K551 F554	P536-W547 HydrophobicContact CB-CE3 4.15Å; P536-W547 HydrophobicContact CB-CH2 3.41Å; P536-W547 VanDerWaalsContact CB-CH2 3.41Å; P536-W547 HydrophobicContact CB-CZ2 4.3Å; P536-W547 HydrophobicContact CB-CZ3 3.32Å; P536-W547 HydrophobicContact CG-CH2 4.29Å; C540-W547 HydrophobicContact CB-CB 3.98Å; I545-W547 PolarHBondContact O-N 2.95Å; I545-W547 VanDerWaalsContact O-N 3.09Å; W547-A549 PolarHBondContact O-N 3.09Å; W547-L550 PolarHBondContact O-N 2.75Å; W547-K551 HydrophobicContact CD2-CB 4.41Å; W547-K551 HydrophobicContact CH2-CB 4.37Å; W547-K551 HydrophobicContact CZ2-CB 4.17Å; W547-K551 HydrophobicContact CZ2-CD 4.14Å; W547-K551 HydrophobicContact CZ2-CG 4.29Å; W547-K551 VanDerWaalsContact O-CB 3.26Å; W547-K551 WeakPolarHBondContact O-CB 3.41Å; W547-K551 PolarHBondContact O-N 3.48Å; W547-F554 HydrophobicContact CH2-CE2 4.12Å; W547-F554 AromaticContact CZ3-CE2 3.87Å; W547-F554 HydrophobicContact CZ3-CE2 3.87Å
548	R	81.7	Confident	89.5	Confident	110 Å²	110	49 Å²	49	42%	0.415	24%	0.238	S	C	.	.	H	α-helix	trans	-62	-45.3	179.3	-178.8	-175.6	177	178.2	4.5	112.3	M289 T291 H546 S552	M289-R548 PolarHBondContact O-NH1 2.96Å; T291-R548 PolarHBondContact OG1-NH1 2.91Å; T291-R548 PolarHBondContact OG1-NH2 3.17Å; H546-R548 VanDerWaalsContact C-N 3.28Å; H546-R548 PolarHBondContact O-N 2.96Å; R548-S552 WeakPolarHBondContact O-CB 3.35Å; R548-S552 PolarHBondContact O-N 3.43Å; R548-S552 PolarHBondContact O-OG 2.96Å
549	A	84.9	Confident	89.5	Confident	8 Å²	8	50 Å²	50	7%	0.066	23%	0.234	C	C	.	.	H	α-helix	trans	-64.9	-43.6	178.6	0	0	0	0	0	110	V487 I490 H546 W547 S552 A553	V487-A549 HydrophobicContact CG2-CB 4.47Å; I490-A549 HydrophobicContact CG2-CB 3.88Å; H546-A549 HydrophobicContact CB-CB 3.96Å; H546-A549 PolarHBondContact O-N 3Å; W547-A549 PolarHBondContact O-N 3.09Å; A549-S552 WeakPolarHBondContact O-CB 3.45Å; A549-S552 PolarHBondContact O-N 2.84Å; A549-A553 PolarHBondContact O-N 3.13Å
550	L	90.6	Very high	89.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-41.4	178.8	-166.2	58.3	0	0	0	113.5	M484 V526 F527 C530 C540 I545 H546 W547 S552 A553 F554	M484-L550 HydrophobicContact CE-CD1 3.64Å; M484-L550 HydrophobicContact SD-CD1 3.26Å; M484-L550 WeakPolarHBondContact SD-CD1 3.4Å; V526-L550 HydrophobicContact CG1-CD2 4.48Å; F527-L550 HydrophobicContact CD2-CD1 4.34Å; C530-L550 HydrophobicContact CB-CD2 3.43Å; C530-L550 VanDerWaalsContact CB-CD2 3.43Å; C530-L550 HydrophobicContact CB-CG 4.45Å; C530-L550 WeakPolarHBondContact SG-CD2 3.41Å; C540-L550 VanDerWaalsContact SG-CD2 3.59Å; I545-L550 HydrophobicContact CG2-CD2 4.07Å; H546-L550 PolarHBondContact O-N 3.3Å; W547-L550 PolarHBondContact O-N 2.75Å; L550-S552 VanDerWaalsContact C-N 3.27Å; L550-S552 PolarHBondContact O-N 3.33Å; L550-A553 WeakPolarHBondContact O-CA 3.23Å; L550-A553 WeakPolarHBondContact O-CB 3.33Å; L550-A553 PolarHBondContact O-N 3.45Å; L550-A553 VanDerWaalsContact O-N 3.09Å; L550-F554 HydrophobicContact CG-CE1 4.45Å; L550-F554 HydrophobicContact CG-CE2 4.43Å; L550-F554 HydrophobicContact CG-CZ 4.06Å; L550-F554 PolarHBondContact O-N 3.09Å
551	K	88.8	Confident	89.8	Confident	130 Å²	130	51.7 Å²	51.7	57%	0.565	24%	0.24	S	C	*	.	H	α-helix	trans	-60.4	-39.8	172	-176.5	-179.2	179.5	-178.3	0	111.1	W547 A553 F554 S555	W547-K551 HydrophobicContact CD2-CB 4.41Å; W547-K551 HydrophobicContact CH2-CB 4.37Å; W547-K551 HydrophobicContact CZ2-CB 4.17Å; W547-K551 HydrophobicContact CZ2-CD 4.14Å; W547-K551 HydrophobicContact CZ2-CG 4.29Å; W547-K551 VanDerWaalsContact O-CB 3.26Å; W547-K551 WeakPolarHBondContact O-CB 3.41Å; W547-K551 PolarHBondContact O-N 3.48Å; K551-A553 VanDerWaalsContact C-N 3.34Å; K551-F554 PolarHBondContact O-N 2.93Å; K551-S555 PolarHBondContact O-N 3.43Å
552	S	85.7	Confident	90.1	Very high	39 Å²	39	49.1 Å²	49.1	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-63.5	-42.9	173.5	-55.9	0	0	0	0	110.4	R548 A549 L550 F554 S555 V556	R548-S552 WeakPolarHBondContact O-CB 3.35Å; R548-S552 PolarHBondContact O-N 3.43Å; R548-S552 PolarHBondContact O-OG 2.96Å; A549-S552 WeakPolarHBondContact O-CB 3.45Å; A549-S552 PolarHBondContact O-N 2.84Å; L550-S552 VanDerWaalsContact C-N 3.27Å; L550-S552 PolarHBondContact O-N 3.33Å; S552-F554 VanDerWaalsContact C-N 3.3Å; S552-F554 PolarHBondContact O-N 2.93Å; S552-S555 WeakPolarHBondContact O-CB 3.41Å; S552-S555 PolarHBondContact O-N 2.91Å; S552-V556 WeakPolarHBondContact O-CG2 3.4Å; S552-V556 PolarHBondContact O-N 3.32Å
553	A	92.4	Very high	90.2	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-36.4	175.9	0	0	0	0	0	112.5	A483 M484 V487 F527 A549 L550 K551 S555 V556 E557	A483-A553 HydrophobicContact CB-CB 4.35Å; A483-A553 WeakPolarHBondContact CB-O 3.38Å; M484-A553 HydrophobicContact CG-CB 4.42Å; M484-A553 HydrophobicContact SD-CB 3.68Å; V487-A553 HydrophobicContact CG1-CB 4.17Å; V487-A553 HydrophobicContact CG2-CB 4.07Å; F527-A553 HydrophobicContact CE2-CB 4.35Å; A549-A553 PolarHBondContact O-N 3.13Å; L550-A553 WeakPolarHBondContact O-CA 3.23Å; L550-A553 WeakPolarHBondContact O-CB 3.33Å; L550-A553 PolarHBondContact O-N 3.45Å; L550-A553 VanDerWaalsContact O-N 3.09Å; K551-A553 VanDerWaalsContact C-N 3.34Å; A553-S555 VanDerWaalsContact C-N 3.34Å; A553-S555 PolarHBondContact O-N 2.61Å; A553-V556 PolarHBondContact O-N 2.89Å; A553-E557 WeakPolarHBondContact O-CB 3.32Å; A553-E557 PolarHBondContact O-N 2.98Å
554	F	92.9	Very high	90.4	Very high	36 Å²	36	43.3 Å²	43.3	16%	0.158	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-42.2	172	-63	-33.3	0	0	0	112.8	F527 C530 K531 W547 L550 K551 S552 E557 T558	F527-F554 HydrophobicContact CD1-CD1 4.46Å; F527-F554 HydrophobicContact CD1-CE1 4.02Å; F527-F554 AromaticContact CD2-CD1 3.89Å; F527-F554 HydrophobicContact CD2-CD1 3.89Å; F527-F554 AromaticContact CD2-CE1 3.75Å; F527-F554 HydrophobicContact CD2-CE1 3.75Å; F527-F554 AromaticContact CE1-CD1 3.96Å; F527-F554 HydrophobicContact CE1-CD1 3.96Å; F527-F554 AromaticContact CE1-CE1 3.94Å; F527-F554 HydrophobicContact CE1-CE1 3.94Å; F527-F554 AromaticContact CE2-CD1 3.33Å; F527-F554 HydrophobicContact CE2-CD1 3.33Å; F527-F554 AromaticContact CE2-CE1 3.68Å; F527-F554 HydrophobicContact CE2-CE1 3.68Å; F527-F554 HydrophobicContact CE2-CG 4.5Å; F527-F554 HydrophobicContact CG-CD1 4.44Å; F527-F554 AromaticContact CG-CE1 3.95Å; F527-F554 HydrophobicContact CG-CE1 3.95Å; F527-F554 AromaticContact CZ-CD1 3.38Å; F527-F554 HydrophobicContact CZ-CD1 3.38Å; F527-F554 AromaticContact CZ-CE1 3.79Å; F527-F554 HydrophobicContact CZ-CE1 3.79Å; C530-F554 HydrophobicContact CB-CZ 4.14Å; K531-F554 HydrophobicContact CB-CE1 3.93Å; K531-F554 HydrophobicContact CB-CZ 3.97Å; K531-F554 HydrophobicContact CD-CE1 4.4Å; K531-F554 HydrophobicContact CG-CE1 4.38Å; W547-F554 HydrophobicContact CH2-CE2 4.12Å; W547-F554 AromaticContact CZ3-CE2 3.87Å; W547-F554 HydrophobicContact CZ3-CE2 3.87Å; L550-F554 HydrophobicContact CG-CE1 4.45Å; L550-F554 HydrophobicContact CG-CE2 4.43Å; L550-F554 HydrophobicContact CG-CZ 4.06Å; L550-F554 PolarHBondContact O-N 3.09Å; K551-F554 PolarHBondContact O-N 2.93Å; S552-F554 VanDerWaalsContact C-N 3.3Å; S552-F554 PolarHBondContact O-N 2.93Å; F554-E557 PolarHBondContact O-N 3.4Å; F554-T558 PolarHBondContact O-N 3.31Å; F554-T558 VanDerWaalsContact O-N 3.1Å; F554-T558 PolarHBondContact O-OG1 3.18Å
555	S	89.6	Confident	90.6	Very high	54 Å²	54	45.4 Å²	45.4	38%	0.378	22%	0.218	S	C	.	.	H	α-helix	trans	-64.9	-42.9	175.2	-169.3	0	0	0	0	111.6	K551 S552 A553 T558 Q559	K551-S555 PolarHBondContact O-N 3.43Å; S552-S555 WeakPolarHBondContact O-CB 3.41Å; S552-S555 PolarHBondContact O-N 2.91Å; A553-S555 VanDerWaalsContact C-N 3.34Å; A553-S555 PolarHBondContact O-N 2.61Å; S555-T558 PolarHBondContact O-N 2.69Å; S555-Q559 WeakPolarHBondContact O-CG 3.34Å; S555-Q559 PolarHBondContact O-N 2.9Å
556	V	91.4	Very high	90.8	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-46.8	176.4	176.5	0	0	0	0	110.9	F100 A483 V487 S552 A553 T558 Q559 L560	F100-V556 HydrophobicContact CB-CG2 3.93Å; F100-V556 HydrophobicContact CD1-CB 4.45Å; F100-V556 HydrophobicContact CD1-CG1 4.1Å; F100-V556 HydrophobicContact CD1-CG2 4.25Å; F100-V556 HydrophobicContact CD2-CB 4.22Å; F100-V556 HydrophobicContact CD2-CG1 4.04Å; F100-V556 HydrophobicContact CD2-CG2 3.3Å; F100-V556 HydrophobicContact CE1-CG1 3.76Å; F100-V556 HydrophobicContact CE2-CB 4.33Å; F100-V556 HydrophobicContact CE2-CG1 3.67Å; F100-V556 HydrophobicContact CE2-CG2 3.71Å; F100-V556 HydrophobicContact CG-CB 4.27Å; F100-V556 HydrophobicContact CG-CG1 4.24Å; F100-V556 HydrophobicContact CG-CG2 3.6Å; F100-V556 HydrophobicContact CZ-CG1 3.53Å; F100-V556 HydrophobicContact CZ-CG2 4.36Å; A483-V556 HydrophobicContact CB-CB 3.96Å; A483-V556 HydrophobicContact CB-CG1 3.84Å; V487-V556 HydrophobicContact CG1-CG2 4.28Å; S552-V556 WeakPolarHBondContact O-CG2 3.4Å; S552-V556 PolarHBondContact O-N 3.32Å; A553-V556 PolarHBondContact O-N 2.89Å; V556-T558 VanDerWaalsContact C-N 3.33Å; V556-T558 PolarHBondContact O-N 2.99Å; V556-Q559 PolarHBondContact O-N 2.91Å; V556-L560 HydrophobicContact CG1-CD1 3.7Å; V556-L560 HydrophobicContact CG1-CG 3.98Å; V556-L560 WeakPolarHBondContact O-CB 3.36Å; V556-L560 VanDerWaalsContact O-CG 3.28Å; V556-L560 WeakPolarHBondContact O-CG 3.37Å; V556-L560 PolarHBondContact O-N 3.13Å
557	E	95.4	Very high	91.1	Very high	3 Å²	3	47.5 Å²	47.5	1%	0.014	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-44.1	179.7	-172.6	-93	142.6	0	0	111.8	L479 P480 A483 F527 K531 A553 F554 Q559 L560 R561	L479-E557 HydrophobicContact CB-CG 4.21Å; P480-E557 HydrophobicContact CG-CG 4.45Å; A483-E557 HydrophobicContact CB-CB 3.78Å; F527-E557 HydrophobicContact CE1-CG 4.43Å; F527-E557 HydrophobicContact CE2-CB 4.09Å; F527-E557 HydrophobicContact CE2-CG 4.39Å; F527-E557 HydrophobicContact CZ-CB 3.73Å; F527-E557 HydrophobicContact CZ-CG 3.69Å; K531-E557 IonicContact NZ-OE2 3.26Å; K531-E557 PolarHBondContact NZ-OE2 2.86Å; A553-E557 WeakPolarHBondContact O-CB 3.32Å; A553-E557 PolarHBondContact O-N 2.98Å; F554-E557 PolarHBondContact O-N 3.4Å; E557-Q559 VanDerWaalsContact C-N 3.33Å; E557-Q559 PolarHBondContact O-N 2.73Å; E557-L560 PolarHBondContact O-N 2.9Å; E557-R561 VanDerWaalsContact O-CB 3.26Å; E557-R561 WeakPolarHBondContact O-CB 3.19Å; E557-R561 PolarHBondContact O-N 2.87Å; E557-R561 IonicContact OE1-CZ 3.56Å; E557-R561 IonicContact OE1-NE 3.02Å; E557-R561 PolarHBondContact OE1-NE 2.8Å; E557-R561 IonicContact OE1-NH2 2.58Å; E557-R561 PolarHBondContact OE1-NH2 3.42Å
558	T	93.6	Very high	91.2	Very high	68 Å²	68	45.5 Å²	45.5	42%	0.417	22%	0.218	S	C	.	.	H	α-helix	trans	-58.5	-45.9	177.1	-55.1	0	0	0	0	111.1	F554 S555 V556 R561 E562	F554-T558 PolarHBondContact O-N 3.31Å; F554-T558 VanDerWaalsContact O-N 3.1Å; F554-T558 PolarHBondContact O-OG1 3.18Å; S555-T558 PolarHBondContact O-N 2.69Å; V556-T558 VanDerWaalsContact C-N 3.33Å; V556-T558 PolarHBondContact O-N 2.99Å; T558-R561 WeakPolarHBondContact O-CB 3.39Å; T558-R561 PolarHBondContact O-N 3.22Å; T558-E562 WeakPolarHBondContact O-CG 3.21Å; T558-E562 PolarHBondContact O-N 2.83Å
559	Q	91.5	Very high	91.6	Very high	52 Å²	52	47.8 Å²	47.8	24%	0.243	23%	0.233	C	C	.	.	H	α-helix	trans	-74	-37.7	-178.7	-68	175.4	23.7	0	0	113.4	F100 S555 V556 E557 R561 E562 I563	F100-Q559 VanDerWaalsContact C-NE2 3.3Å; F100-Q559 HydrophobicContact CD1-CB 4.44Å; F100-Q559 PolarHBondContact O-NE2 3.41Å; S555-Q559 WeakPolarHBondContact O-CG 3.34Å; S555-Q559 PolarHBondContact O-N 2.9Å; V556-Q559 PolarHBondContact O-N 2.91Å; E557-Q559 VanDerWaalsContact C-N 3.33Å; E557-Q559 PolarHBondContact O-N 2.73Å; Q559-R561 PolarHBondContact O-N 2.79Å; Q559-E562 PolarHBondContact O-N 3.46Å; Q559-I563 WeakPolarHBondContact O-CG1 3.28Å; Q559-I563 PolarHBondContact O-N 2.84Å
560	L	94.6	Very high	91.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-38.1	172.3	-69.3	177.4	0	0	0	110.6	F100 F456 L458 L479 A482 A483 V556 E557 L564	F100-L560 HydrophobicContact CE1-CD2 4.14Å; F100-L560 HydrophobicContact CE1-CG 4.42Å; F456-L560 HydrophobicContact CD1-CD2 3.85Å; F456-L560 HydrophobicContact CE1-CD2 4.44Å; L458-L560 HydrophobicContact CD1-CD1 4.09Å; L458-L560 HydrophobicContact CD1-CD2 3.8Å; L458-L560 HydrophobicContact CD2-CD2 4.32Å; L458-L560 HydrophobicContact CG-CD2 4.02Å; L479-L560 HydrophobicContact CD2-CB 3.66Å; A482-L560 HydrophobicContact CB-CD1 4.18Å; A483-L560 HydrophobicContact CB-CD1 4.49Å; V556-L560 HydrophobicContact CG1-CD1 3.7Å; V556-L560 HydrophobicContact CG1-CG 3.98Å; V556-L560 WeakPolarHBondContact O-CB 3.36Å; V556-L560 VanDerWaalsContact O-CG 3.28Å; V556-L560 WeakPolarHBondContact O-CG 3.37Å; V556-L560 PolarHBondContact O-N 3.13Å; E557-L560 PolarHBondContact O-N 2.9Å; L560-L564 VanDerWaalsContact O-CB 3.3Å; L560-L564 WeakPolarHBondContact O-CB 3.45Å; L560-L564 PolarHBondContact O-N 2.65Å
561	R	95.3	Very high	91.2	Very high	72 Å²	72	63.7 Å²	63.7	27%	0.272	29%	0.291	S	S	.	.	H	α-helix	trans	-64.9	-44.2	174.3	-176.6	177.4	-64.5	-85.5	-1.9	111.8	D476 L479 E557 T558 Q559 L564 L565	D476-R561 IonicContact OD1-CZ 2.95Å; D476-R561 VanDerWaalsContact OD1-CZ 3.26Å; D476-R561 IonicContact OD1-NH1 3.4Å; D476-R561 PolarHBondContact OD1-NH1 3.04Å; D476-R561 IonicContact OD1-NH2 3.4Å; D476-R561 PolarHBondContact OD1-NH2 2.95Å; L479-R561 HydrophobicContact CD1-CB 4.08Å; L479-R561 HydrophobicContact CD1-CG 4.27Å; E557-R561 VanDerWaalsContact O-CB 3.26Å; E557-R561 WeakPolarHBondContact O-CB 3.19Å; E557-R561 PolarHBondContact O-N 2.87Å; E557-R561 IonicContact OE1-CZ 3.56Å; E557-R561 IonicContact OE1-NE 3.02Å; E557-R561 PolarHBondContact OE1-NE 2.8Å; E557-R561 IonicContact OE1-NH2 2.58Å; E557-R561 PolarHBondContact OE1-NH2 3.42Å; T558-R561 WeakPolarHBondContact O-CB 3.39Å; T558-R561 PolarHBondContact O-N 3.22Å; Q559-R561 PolarHBondContact O-N 2.79Å; R561-L564 PolarHBondContact O-N 2.96Å; R561-L565 HydrophobicContact CG-CD1 4.02Å; R561-L565 HydrophobicContact CG-CG 4.33Å; R561-L565 WeakPolarHBondContact O-CB 3.43Å; R561-L565 VanDerWaalsContact O-CG 3.26Å; R561-L565 WeakPolarHBondContact O-CG 3.07Å; R561-L565 PolarHBondContact O-N 3.2Å
562	E	93.4	Very high	90.9	Very high	120 Å²	120	60.6 Å²	60.6	56%	0.561	28%	0.281	S	S	*	.	H	α-helix	trans	-59.8	-46.4	175.2	-73.8	169.3	-175.8	0	0	112.2	T558 Q559 L564 L565 R566	T558-E562 WeakPolarHBondContact O-CG 3.21Å; T558-E562 PolarHBondContact O-N 2.83Å; Q559-E562 PolarHBondContact O-N 3.46Å; E562-L564 VanDerWaalsContact C-N 3.32Å; E562-L564 PolarHBondContact O-N 3.04Å; E562-L565 PolarHBondContact O-N 3.26Å; E562-R566 WeakPolarHBondContact O-CB 3.35Å; E562-R566 PolarHBondContact O-N 3.3Å
563	I	92.3	Very high	91	Very high	28 Å²	28	59.1 Å²	59.1	14%	0.144	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-49.1	174.6	-67.8	167.3	0	0	0	109.5	F456 Q559 R566 L567	F456-I563 HydrophobicContact CD1-CG2 3.99Å; F456-I563 HydrophobicContact CD2-CG2 4.42Å; F456-I563 HydrophobicContact CE1-CB 4.17Å; F456-I563 HydrophobicContact CE1-CG2 3.66Å; F456-I563 HydrophobicContact CE2-CG2 4.11Å; F456-I563 HydrophobicContact CG-CG2 4.37Å; F456-I563 HydrophobicContact CZ-CG2 3.73Å; Q559-I563 WeakPolarHBondContact O-CG1 3.28Å; Q559-I563 PolarHBondContact O-N 2.84Å; I563-R566 PolarHBondContact O-N 2.93Å; I563-L567 HydrophobicContact CG2-CD1 3.94Å; I563-L567 HydrophobicContact CG2-CG 4.4Å; I563-L567 VanDerWaalsContact O-CG 3.3Å; I563-L567 WeakPolarHBondContact O-CG 3.39Å; I563-L567 PolarHBondContact O-N 3.49Å
564	L	94.1	Very high	90.7	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-45.4	-177.5	-175.7	66.7	0	0	0	112.4	F456 L467 A470 Q475 L479 L560 R561 E562 R566 L567 Q568 F573	F456-L564 HydrophobicContact CZ-CB 4.33Å; F456-L564 HydrophobicContact CZ-CD1 4.09Å; L467-L564 HydrophobicContact CD2-CD1 4.34Å; A470-L564 HydrophobicContact CB-CD1 3.53Å; A470-L564 HydrophobicContact CB-CD2 3.73Å; A470-L564 HydrophobicContact CB-CG 4.11Å; Q475-L564 HydrophobicContact CB-CD2 3.65Å; Q475-L564 HydrophobicContact CG-CD2 3.85Å; L479-L564 HydrophobicContact CD1-CD2 4.13Å; L479-L564 HydrophobicContact CD2-CD2 4.5Å; L479-L564 HydrophobicContact CG-CD2 4.5Å; L560-L564 VanDerWaalsContact O-CB 3.3Å; L560-L564 WeakPolarHBondContact O-CB 3.45Å; L560-L564 PolarHBondContact O-N 2.65Å; R561-L564 PolarHBondContact O-N 2.96Å; E562-L564 VanDerWaalsContact C-N 3.32Å; E562-L564 PolarHBondContact O-N 3.04Å; L564-R566 VanDerWaalsContact C-N 3.33Å; L564-R566 PolarHBondContact O-N 3.48Å; L564-L567 PolarHBondContact O-N 2.86Å; L564-L567 VanDerWaalsContact O-N 3.12Å; L564-Q568 HydrophobicContact CG-CG 4.41Å; L564-Q568 WeakPolarHBondContact O-CB 3.01Å; L564-Q568 WeakPolarHBondContact O-CG 3.33Å; L564-Q568 PolarHBondContact O-N 3.2Å; L564-F573 HydrophobicContact CD1-CE2 4.29Å; L564-F573 HydrophobicContact CD1-CZ 4.25Å
565	L	93.3	Very high	90.4	Very high	89 Å²	89	66.7 Å²	66.7	47%	0.466	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-42.3	178.2	-72.6	172.3	0	0	0	111.5	R561 E562 L567 Q568 Q569	R561-L565 HydrophobicContact CG-CD1 4.02Å; R561-L565 HydrophobicContact CG-CG 4.33Å; R561-L565 WeakPolarHBondContact O-CB 3.43Å; R561-L565 VanDerWaalsContact O-CG 3.26Å; R561-L565 WeakPolarHBondContact O-CG 3.07Å; R561-L565 PolarHBondContact O-N 3.2Å; E562-L565 PolarHBondContact O-N 3.26Å; L565-L567 VanDerWaalsContact C-N 3.32Å; L565-L567 PolarHBondContact O-N 3.32Å; L565-Q568 PolarHBondContact O-N 2.9Å; L565-Q569 WeakPolarHBondContact O-CG 3.45Å; L565-Q569 PolarHBondContact O-N 2.92Å
566	R	93.1	Very high	90.3	Very high	102 Å²	102	68.2 Å²	68.2	39%	0.385	31%	0.309	S	S	.	.	H	α-helix	trans	-60.8	-41.3	173.7	177.5	-174.1	58.3	114.1	2.5	111.6	E455 E562 I563 L564 Q569	E455-R566 IonicContact OE1-NH1 3.84Å; E455-R566 IonicContact OE2-CZ 3.26Å; E455-R566 IonicContact OE2-NH1 2.79Å; E455-R566 PolarHBondContact OE2-NH1 3.02Å; E455-R566 VanDerWaalsContact OE2-NH1 3.09Å; E455-R566 IonicContact OE2-NH2 2.73Å; E455-R566 PolarHBondContact OE2-NH2 3.19Å; E562-R566 WeakPolarHBondContact O-CB 3.35Å; E562-R566 PolarHBondContact O-N 3.3Å; I563-R566 PolarHBondContact O-N 2.93Å; L564-R566 VanDerWaalsContact C-N 3.33Å; L564-R566 PolarHBondContact O-N 3.48Å; R566-Q569 PolarHBondContact O-N 3.21Å
567	L	91.3	Very high	89.7	Confident	0 Å²	0	75 Å²	75	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-71.7	-36.1	179.3	-66.7	178.7	0	0	0	112.4	L452 E455 F456 I563 L564 L565 Q569 R570 F573	L452-L567 HydrophobicContact CD2-CB 4.27Å; L452-L567 HydrophobicContact CD2-CD1 4.22Å; L452-L567 HydrophobicContact CD2-CD2 3.84Å; L452-L567 HydrophobicContact CD2-CG 4.32Å; E455-L567 HydrophobicContact CB-CD1 4.27Å; E455-L567 HydrophobicContact CG-CD2 4.31Å; F456-L567 HydrophobicContact CD2-CD1 4.3Å; F456-L567 HydrophobicContact CE2-CD1 3.4Å; F456-L567 VanDerWaalsContact CE2-CD1 3.4Å; F456-L567 HydrophobicContact CZ-CD1 3.84Å; I563-L567 HydrophobicContact CG2-CD1 3.94Å; I563-L567 HydrophobicContact CG2-CG 4.4Å; I563-L567 VanDerWaalsContact O-CG 3.3Å; I563-L567 WeakPolarHBondContact O-CG 3.39Å; I563-L567 PolarHBondContact O-N 3.49Å; L564-L567 PolarHBondContact O-N 2.86Å; L564-L567 VanDerWaalsContact O-N 3.12Å; L565-L567 VanDerWaalsContact C-N 3.32Å; L565-L567 PolarHBondContact O-N 3.32Å; L567-Q569 PolarHBondContact O-N 3.42Å; L567-R570 VanDerWaalsContact O-CB 3.31Å; L567-R570 WeakPolarHBondContact O-CB 3.46Å; L567-R570 WeakPolarHBondContact O-CG 3.49Å; L567-R570 PolarHBondContact O-N 2.93Å; L567-F573 HydrophobicContact CB-CD2 4.37Å; L567-F573 HydrophobicContact CB-CE2 4.48Å
568	Q	90.4	Very high	88.8	Confident	38 Å²	38	79.6 Å²	79.6	18%	0.178	37%	0.371	C	S	.	.	H	α-helix	trans	-64	-22.9	175.7	-78.3	179.7	-33.9	0	0	113.4	L564 L565 R570 F573	L564-Q568 HydrophobicContact CG-CG 4.41Å; L564-Q568 WeakPolarHBondContact O-CB 3.01Å; L564-Q568 WeakPolarHBondContact O-CG 3.33Å; L564-Q568 PolarHBondContact O-N 3.2Å; L565-Q568 PolarHBondContact O-N 2.9Å; Q568-R570 VanDerWaalsContact C-N 3.25Å; Q568-R570 PolarHBondContact O-N 3.45Å; Q568-F573 HydrophobicContact CG-CD1 4Å; Q568-F573 HydrophobicContact CG-CD2 4.26Å; Q568-F573 HydrophobicContact CG-CE1 3.75Å; Q568-F573 HydrophobicContact CG-CE2 4.02Å; Q568-F573 HydrophobicContact CG-CG 4.26Å; Q568-F573 HydrophobicContact CG-CZ 3.77Å
569	Q	89.3	Confident	87.6	Confident	159 Å²	159	84.3 Å²	84.3	74%	0.743	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-14.5	173.7	-68.7	170.7	7.5	0	0	113.1	L565 R566 L567	L565-Q569 WeakPolarHBondContact O-CG 3.45Å; L565-Q569 PolarHBondContact O-N 2.92Å; R566-Q569 PolarHBondContact O-N 3.21Å; L567-Q569 PolarHBondContact O-N 3.42Å
570	R	88.5	Confident	86.6	Confident	82 Å²	82	83.7 Å²	83.7	31%	0.309	40%	0.401	S	S	.	.	S	Bend	trans	-72.5	139	176.4	-59.5	-173.6	175.6	178.1	4.6	109.7	E455 L567 Q568 D572 F573	E455-R570 IonicContact OE1-NH2 3.53Å; E455-R570 PolarHBondContact OE1-NH2 2.94Å; E455-R570 VanDerWaalsContact OE1-NH2 3.17Å; L567-R570 VanDerWaalsContact O-CB 3.31Å; L567-R570 WeakPolarHBondContact O-CB 3.46Å; L567-R570 WeakPolarHBondContact O-CG 3.49Å; L567-R570 PolarHBondContact O-N 2.93Å; Q568-R570 VanDerWaalsContact C-N 3.25Å; Q568-R570 PolarHBondContact O-N 3.45Å; R570-D572 WeakPolarHBondContact CB-OD1 3.34Å; R570-D572 PolarHBondContact O-N 3.26Å; R570-D572 VanDerWaalsContact O-N 3.12Å; R570-F573 WeakPolarHBondContact O-CB 3.35Å; R570-F573 PolarHBondContact O-N 2.94Å
571	R	79.4	Confident	86.1	Confident	260 Å²	260	89 Å²	89	98%	0.981	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-22.4	-175.7	-69.7	-174.9	176.8	-173.4	-1	114
572	D	80.7	Confident	85.5	Confident	64 Å²	64	92.8 Å²	92.8	34%	0.342	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	6.6	-175.2	61.8	-35.2	0	0	0	113.4	K448 R570	K448-D572 HydrophobicContact CD-CB 4.39Å; R570-D572 WeakPolarHBondContact CB-OD1 3.34Å; R570-D572 PolarHBondContact O-N 3.26Å; R570-D572 VanDerWaalsContact O-N 3.12Å
573	F	88	Confident	84.9	Confident	9 Å²	9	90.1 Å²	90.1	4%	0.039	44%	0.443	C	S	.	.			trans	-64.3	130.1	173.1	-167.7	-89.6	0	0	0	110.4	L452 L467 A470 L564 L567 Q568 R570 F575	L452-F573 HydrophobicContact CD1-CD2 4.24Å; L467-F573 HydrophobicContact CD2-CE2 4.06Å; A470-F573 HydrophobicContact CB-CE1 4.36Å; A470-F573 HydrophobicContact CB-CZ 3.76Å; L564-F573 HydrophobicContact CD1-CE2 4.29Å; L564-F573 HydrophobicContact CD1-CZ 4.25Å; L567-F573 HydrophobicContact CB-CD2 4.37Å; L567-F573 HydrophobicContact CB-CE2 4.48Å; Q568-F573 HydrophobicContact CG-CD1 4Å; Q568-F573 HydrophobicContact CG-CD2 4.26Å; Q568-F573 HydrophobicContact CG-CE1 3.75Å; Q568-F573 HydrophobicContact CG-CE2 4.02Å; Q568-F573 HydrophobicContact CG-CG 4.26Å; Q568-F573 HydrophobicContact CG-CZ 3.77Å; R570-F573 WeakPolarHBondContact O-CB 3.35Å; R570-F573 PolarHBondContact O-N 2.94Å; F573-F575 HydrophobicContact CB-CE2 4.2Å; F573-F575 HydrophobicContact CD1-CD1 4.5Å; F573-F575 HydrophobicContact CD1-CD2 4.42Å; F573-F575 HydrophobicContact CD1-CE1 4.06Å; F573-F575 AromaticContact CD1-CE2 3.97Å; F573-F575 HydrophobicContact CD1-CE2 3.97Å; F573-F575 AromaticContact CD1-CZ 3.78Å; F573-F575 HydrophobicContact CD1-CZ 3.78Å; F573-F575 HydrophobicContact CE1-CE1 4.46Å; F573-F575 VanDerWaalsContact O-CD2 3.27Å; F573-F575 WeakPolarHBondContact O-CD2 3.28Å
574	P	87.1	Confident	84.7	Confident	50 Å²	50	91 Å²	91	33%	0.325	45%	0.446	S	S	.	.			trans	-72.5	131.4	-178	28.4	-33.3	0	0	0	111.1	S471	S471-P574 VanDerWaalsContact CA-O 3.28Å; S471-P574 WeakPolarHBondContact CA-O 3.26Å; S471-P574 WeakPolarHBondContact CB-O 3.44Å
575	F	87.3	Confident	84.3	Confident	144 Å²	144	91.6 Å²	91.6	63%	0.632	45%	0.449	S	S	*	.			trans	-119.2	131.9	170.5	-67.1	-81.5	0	0	0	109.5	F573	F573-F575 HydrophobicContact CB-CE2 4.2Å; F573-F575 HydrophobicContact CD1-CD1 4.5Å; F573-F575 HydrophobicContact CD1-CD2 4.42Å; F573-F575 HydrophobicContact CD1-CE1 4.06Å; F573-F575 AromaticContact CD1-CE2 3.97Å; F573-F575 HydrophobicContact CD1-CE2 3.97Å; F573-F575 AromaticContact CD1-CZ 3.78Å; F573-F575 HydrophobicContact CD1-CZ 3.78Å; F573-F575 HydrophobicContact CE1-CE1 4.46Å; F573-F575 VanDerWaalsContact O-CD2 3.27Å; F573-F575 WeakPolarHBondContact O-CD2 3.28Å
576	E	86.4	Confident	84.1	Confident	86 Å²	86	87.7 Å²	87.7	40%	0.402	43%	0.428	S	S	.	.			trans	-131	143.1	-178.6	-67.9	-178.8	-139.3	0	0	109.8	K468 S471 L472	K468-E576 IonicContact NZ-OE1 3.82Å; K468-E576 PolarHBondContact NZ-OE1 3.47Å; K468-E576 IonicContact NZ-OE2 3.09Å; K468-E576 PolarHBondContact NZ-OE2 2.87Å; S471-E576 PolarHBondContact O-N 3.26Å; L472-E576 HydrophobicContact CD2-CB 3.67Å; L472-E576 HydrophobicContact CG-CB 4.45Å
577	T	79.4	Confident	84	Confident	146 Å²	146	85.1 Å²	85.1	90%	0.896	42%	0.418	S	S	*	.			trans	-102.9	128.2	173.2	52.4	0	0	0	0	109.3
578	F	76	Confident	83.9	Confident	100 Å²	100	87 Å²	87	44%	0.439	43%	0.427	S	S	.	.			trans	-135.8	131.3	173.6	-173	-86.9	0	0	0	110.1	L472 L585	L472-F578 HydrophobicContact CD2-CB 3.66Å; F578-L585 HydrophobicContact CB-CD2 3.95Å; F578-L585 HydrophobicContact CD1-CD1 4.01Å; F578-L585 HydrophobicContact CD1-CD2 3.11Å; F578-L585 HydrophobicContact CD1-CG 3.61Å; F578-L585 HydrophobicContact CD2-CD2 4.47Å; F578-L585 HydrophobicContact CE1-CD2 3.59Å; F578-L585 HydrophobicContact CE1-CG 3.89Å; F578-L585 HydrophobicContact CG-CD2 3.6Å; F578-L585 HydrophobicContact CZ-CD2 4.46Å
579	D	69.3	Low	84	Confident	168 Å²	168	85.2 Å²	85.2	90%	0.898	42%	0.419	S	S	*	.			trans	-100.5	111.8	175.2	-166.3	11.5	0	0	0	109
580	G	70.7	Confident	84.2	Confident	39 Å²	39	77.6 Å²	77.6	40%	0.402	38%	0.384	S	S	.	.	S	Bend	trans	175	171.3	179.8	0	0	0	0	0	113.8	K582	G580-K582 PolarHBondContact O-N 3.31Å
581	N	83.4	Confident	84.4	Confident	111 Å²	111	73.8 Å²	73.8	59%	0.594	37%	0.369	S	S	*	.			trans	-65.6	133.7	-178.5	-174.6	-9.6	0	0	0	110.9	S583 E584 L585	N581-S583 PolarHBondContact O-N 2.85Å; N581-S583 VanDerWaalsContact O-N 3.1Å; N581-S583 PolarHBondContact OD1-N 3.5Å; N581-E584 HydrophobicContact CB-CB 4.46Å; N581-E584 PolarHBondContact O-N 2.88Å; N581-L585 PolarHBondContact O-N 3.48Å
582	K	81.4	Confident	84.9	Confident	152 Å²	152	62.7 Å²	62.7	66%	0.661	33%	0.331	S	S	*	.	H	α-helix	trans	-50.4	-35.6	176.8	-69.5	-172.8	179.2	-177.1	0	113.5	L477 G580 F586	L477-K582 HydrophobicContact CD1-CB 4.3Å; G580-K582 PolarHBondContact O-N 3.31Å; K582-F586 WeakPolarHBondContact O-CB 3.34Å; K582-F586 PolarHBondContact O-N 3.05Å
583	S	82.3	Confident	85.4	Confident	64 Å²	64	59.7 Å²	59.7	45%	0.448	32%	0.315	S	S	.	.	H	α-helix	trans	-71.6	-31.9	177.9	178.3	0	0	0	0	113.4	N581 R587	N581-S583 PolarHBondContact O-N 2.85Å; N581-S583 VanDerWaalsContact O-N 3.1Å; N581-S583 PolarHBondContact OD1-N 3.5Å; S583-R587 WeakPolarHBondContact O-CG 3.34Å; S583-R587 PolarHBondContact O-NE 3.5Å; S583-R587 VanDerWaalsContact O-NE 3.16Å
584	E	86.7	Confident	85.6	Confident	47 Å²	47	59.8 Å²	59.8	22%	0.22	32%	0.315	C	S	.	.	H	α-helix	trans	-75.3	-45.7	174.1	178.7	152.2	-173.9	0	0	110.4	N581 F586 R587 Q588 R655 W658	N581-E584 HydrophobicContact CB-CB 4.46Å; N581-E584 PolarHBondContact O-N 2.88Å; E584-F586 VanDerWaalsContact C-N 3.31Å; E584-F586 PolarHBondContact O-N 2.93Å; E584-R587 PolarHBondContact O-N 2.87Å; E584-R587 VanDerWaalsContact O-N 3.11Å; E584-Q588 HydrophobicContact CG-CG 4.45Å; E584-Q588 WeakPolarHBondContact O-CG 3.24Å; E584-Q588 PolarHBondContact O-N 3.5Å; E584-R655 VanDerWaalsContact CD-NH1 3.27Å; E584-R655 IonicContact OE1-NH1 2.89Å; E584-R655 PolarHBondContact OE1-NH1 2.96Å; E584-R655 IonicContact OE2-CZ 3.72Å; E584-R655 IonicContact OE2-NH1 3.66Å; E584-R655 PolarHBondContact OE2-NH1 3.49Å; E584-W658 HydrophobicContact CG-CH2 4.25Å; E584-W658 HydrophobicContact CG-CZ2 3.58Å; E584-W658 VanDerWaalsContact OE1-CZ2 3.26Å; E584-W658 WeakPolarHBondContact OE1-CZ2 3.43Å; E584-W658 PolarHBondContact OE1-NE1 2.83Å; E584-W658 VanDerWaalsContact OE1-NE1 3.14Å
585	L	87	Confident	85.7	Confident	13 Å²	13	57.5 Å²	57.5	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-52.1	-47.3	172.4	-85.5	174.9	0	0	0	112.8	L472 F578 N581 R587 Q588 C589	L472-L585 HydrophobicContact CD1-CD2 4.06Å; F578-L585 HydrophobicContact CB-CD2 3.95Å; F578-L585 HydrophobicContact CD1-CD1 4.01Å; F578-L585 HydrophobicContact CD1-CD2 3.11Å; F578-L585 HydrophobicContact CD1-CG 3.61Å; F578-L585 HydrophobicContact CD2-CD2 4.47Å; F578-L585 HydrophobicContact CE1-CD2 3.59Å; F578-L585 HydrophobicContact CE1-CG 3.89Å; F578-L585 HydrophobicContact CG-CD2 3.6Å; F578-L585 HydrophobicContact CZ-CD2 4.46Å; N581-L585 PolarHBondContact O-N 3.48Å; L585-R587 VanDerWaalsContact C-N 3.32Å; L585-R587 PolarHBondContact O-N 3.35Å; L585-Q588 PolarHBondContact O-N 3.39Å; L585-C589 PolarHBondContact O-N 2.98Å; L585-C589 PolarHBondContact O-SG 2.76Å
586	F	88.8	Confident	85.7	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.035	28%	0.276	C	S	.	.	H	α-helix	trans	-55.4	-46.3	177.3	176.4	-107.4	0	0	0	112.4	L477 L478 V481 N518 F520 A521 K582 E584 C589 L590	L477-F586 HydrophobicContact CB-CD2 3.59Å; L477-F586 HydrophobicContact CB-CE2 4.04Å; L477-F586 HydrophobicContact CD1-CB 4.12Å; L477-F586 HydrophobicContact CD1-CD2 4.37Å; L478-F586 HydrophobicContact CD2-CD2 3.91Å; L478-F586 HydrophobicContact CD2-CE2 3.37Å; L478-F586 HydrophobicContact CD2-CZ 4.07Å; L478-F586 HydrophobicContact CG-CD2 4.1Å; L478-F586 HydrophobicContact CG-CE2 3.97Å; V481-F586 HydrophobicContact CG2-CE2 4.14Å; V481-F586 HydrophobicContact CG2-CZ 4.04Å; N518-F586 WeakPolarHBondContact ND2-CE1 3.47Å; F520-F586 HydrophobicContact CB-CE1 3.97Å; F520-F586 HydrophobicContact CB-CZ 3.86Å; A521-F586 HydrophobicContact CB-CE1 4.47Å; K582-F586 WeakPolarHBondContact O-CB 3.34Å; K582-F586 PolarHBondContact O-N 3.05Å; E584-F586 VanDerWaalsContact C-N 3.31Å; E584-F586 PolarHBondContact O-N 2.93Å; F586-C589 PolarHBondContact O-N 3.14Å; F586-L590 HydrophobicContact CD1-CD1 4.1Å; F586-L590 HydrophobicContact CE1-CD1 3.65Å; F586-L590 HydrophobicContact CZ-CD1 3.9Å; F586-L590 WeakPolarHBondContact O-CG 3.34Å; F586-L590 PolarHBondContact O-N 3.44Å; F586-L590 VanDerWaalsContact O-N 3.13Å
587	R	90.8	Very high	85.9	Confident	47 Å²	47	48.7 Å²	48.7	18%	0.177	26%	0.263	C	S	.	.	H	α-helix	trans	-71.7	-39.2	-179.4	-67.4	-176.7	-81.5	173.8	-4.3	112.2	S583 E584 L585 C589 L590 C591 C652 W658	S583-R587 WeakPolarHBondContact O-CG 3.34Å; S583-R587 PolarHBondContact O-NE 3.5Å; S583-R587 VanDerWaalsContact O-NE 3.16Å; E584-R587 PolarHBondContact O-N 2.87Å; E584-R587 VanDerWaalsContact O-N 3.11Å; L585-R587 VanDerWaalsContact C-N 3.32Å; L585-R587 PolarHBondContact O-N 3.35Å; R587-C589 VanDerWaalsContact C-N 3.34Å; R587-C589 PolarHBondContact O-N 3.45Å; R587-L590 WeakPolarHBondContact O-CB 3.48Å; R587-L590 PolarHBondContact O-N 3.38Å; R587-C591 PolarHBondContact O-N 3.22Å; R587-C591 PolarHBondContact O-SG 2.86Å; R587-C652 VanDerWaalsContact CG-SG 3.59Å; R587-W658 HydrophobicContact CB-CE3 4.33Å; R587-W658 HydrophobicContact CB-CH2 4.13Å; R587-W658 HydrophobicContact CB-CZ3 3.58Å
588	Q	89.9	Confident	86.5	Confident	39 Å²	39	41.8 Å²	41.8	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-41.4	174.3	-72	179	-3.5	0	0	111.8	E584 L585 L590 C591 T592 W658	E584-Q588 HydrophobicContact CG-CG 4.45Å; E584-Q588 WeakPolarHBondContact O-CG 3.24Å; E584-Q588 PolarHBondContact O-N 3.5Å; L585-Q588 PolarHBondContact O-N 3.39Å; Q588-L590 VanDerWaalsContact C-N 3.33Å; Q588-L590 PolarHBondContact O-N 2.88Å; Q588-C591 WeakPolarHBondContact O-CB 3.36Å; Q588-C591 PolarHBondContact O-N 2.65Å; Q588-C591 VanDerWaalsContact O-N 3.16Å; Q588-T592 PolarHBondContact O-N 3.04Å; Q588-T592 VanDerWaalsContact O-N 3.12Å; Q588-W658 HydrophobicContact CG-CB 4.44Å; Q588-W658 HydrophobicContact CG-CD2 3.82Å; Q588-W658 HydrophobicContact CG-CE3 4.31Å; Q588-W658 HydrophobicContact CG-CG 3.87Å
589	C	91.9	Very high	87.3	Confident	1 Å²	1	37 Å²	37	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-45	173.9	-65.9	0	0	0	0	111.1	A465 L478 L585 F586 R587 C591 T592	A465-C589 WeakPolarHBondContact CA-O 3.18Å; A465-C589 WeakPolarHBondContact CB-O 3.41Å; L478-C589 HydrophobicContact CD1-CB 3.77Å; L585-C589 PolarHBondContact O-N 2.98Å; L585-C589 PolarHBondContact O-SG 2.76Å; F586-C589 PolarHBondContact O-N 3.14Å; R587-C589 VanDerWaalsContact C-N 3.34Å; R587-C589 PolarHBondContact O-N 3.45Å; C589-C591 VanDerWaalsContact C-N 3.35Å; C589-C591 PolarHBondContact O-N 2.9Å; C589-T592 PolarHBondContact O-N 2.89Å; C589-T592 PolarHBondContact O-OG1 3.39Å
590	L	93.1	Very high	88.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-42.8	173.9	-71	170	0	0	0	111.9	L478 F520 F586 R587 Q588 T592 G593 Y594 I636	L478-L590 HydrophobicContact CD2-CD2 3.51Å; L478-L590 HydrophobicContact CD2-CG 3.89Å; F520-L590 HydrophobicContact CB-CD1 3.97Å; F520-L590 HydrophobicContact CD1-CD1 4.06Å; F520-L590 HydrophobicContact CD1-CD2 3.88Å; F520-L590 HydrophobicContact CD2-CD1 4.18Å; F520-L590 HydrophobicContact CE1-CD2 3.97Å; F520-L590 HydrophobicContact CG-CD1 3.83Å; F520-L590 HydrophobicContact CG-CD2 4.49Å; F586-L590 HydrophobicContact CD1-CD1 4.1Å; F586-L590 HydrophobicContact CE1-CD1 3.65Å; F586-L590 HydrophobicContact CZ-CD1 3.9Å; F586-L590 WeakPolarHBondContact O-CG 3.34Å; F586-L590 PolarHBondContact O-N 3.44Å; F586-L590 VanDerWaalsContact O-N 3.13Å; R587-L590 WeakPolarHBondContact O-CB 3.48Å; R587-L590 PolarHBondContact O-N 3.38Å; Q588-L590 VanDerWaalsContact C-N 3.33Å; Q588-L590 PolarHBondContact O-N 2.88Å; L590-T592 VanDerWaalsContact C-N 3.27Å; L590-T592 PolarHBondContact O-N 3.02Å; L590-G593 PolarHBondContact O-N 3.04Å; L590-G593 VanDerWaalsContact O-N 3.09Å; L590-Y594 HydrophobicContact CD2-CD2 4.11Å; L590-Y594 HydrophobicContact CD2-CE2 3.98Å; L590-Y594 WeakPolarHBondContact O-CB 3.42Å; L590-Y594 WeakPolarHBondContact O-CD2 3.03Å; L590-Y594 PolarHBondContact O-N 2.84Å; L590-I636 HydrophobicContact CB-CD1 3.54Å
591	C	92.5	Very high	89.4	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.007	17%	0.172	C	C	.	.	H	α-helix	trans	-54.7	-42.8	175.7	-68	0	0	0	0	111.8	R587 Q588 C589 G593 Y594 F595 I654 V659	R587-C591 PolarHBondContact O-N 3.22Å; R587-C591 PolarHBondContact O-SG 2.86Å; Q588-C591 WeakPolarHBondContact O-CB 3.36Å; Q588-C591 PolarHBondContact O-N 2.65Å; Q588-C591 VanDerWaalsContact O-N 3.16Å; C589-C591 VanDerWaalsContact C-N 3.35Å; C589-C591 PolarHBondContact O-N 2.9Å; C591-G593 PolarHBondContact O-N 3.3Å; C591-Y594 PolarHBondContact O-N 3.48Å; C591-F595 WeakPolarHBondContact O-CA 3.42Å; C591-F595 VanDerWaalsContact O-CB 3.25Å; C591-F595 WeakPolarHBondContact O-CB 3.3Å; C591-F595 PolarHBondContact O-N 3.12Å; C591-I654 WeakPolarHBondContact SG-CG2 3.42Å; C591-V659 HydrophobicContact CB-CG1 4.04Å
592	T	90.8	Very high	89.6	Confident	28 Å²	28	34.5 Å²	34.5	17%	0.172	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-27.3	-179.5	65.1	0	0	0	0	114.3	R464 K468 Q588 C589 L590 F595	R464-T592 WeakPolarHBondContact CG-O 3.33Å; K468-T592 WeakPolarHBondContact CB-OG1 3.43Å; K468-T592 HydrophobicContact CD-CG2 4.3Å; K468-T592 HydrophobicContact CG-CG2 3.96Å; Q588-T592 PolarHBondContact O-N 3.04Å; Q588-T592 VanDerWaalsContact O-N 3.12Å; C589-T592 PolarHBondContact O-N 2.89Å; C589-T592 PolarHBondContact O-OG1 3.39Å; L590-T592 VanDerWaalsContact C-N 3.27Å; L590-T592 PolarHBondContact O-N 3.02Å; T592-F595 WeakPolarHBondContact O-CD1 3.49Å
593	G	90.8	Very high	89.6	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-98	-25.1	178.2	0	0	0	0	0	114.9	F437 G461 L590 C591	F437-G593 WeakPolarHBondContact CE1-O 3.35Å; G461-G593 VanDerWaalsContact CA-O 3.28Å; G461-G593 WeakPolarHBondContact CA-O 3.49Å; G461-G593 WeakPolarHBondContact O-CA 3.4Å; L590-G593 PolarHBondContact O-N 3.04Å; L590-G593 VanDerWaalsContact O-N 3.09Å; C591-G593 PolarHBondContact O-N 3.3Å
594	Y	91.8	Very high	89.7	Confident	10 Å²	10	33.8 Å²	33.8	4%	0.039	17%	0.166	C	C	.	.	H	α-helix	trans	-114.3	14.2	-174.8	-71.8	-85.4	0	0	0	113.3	L462 F520 L590 C591 T596 N597 F637 H638	L462-Y594 HydrophobicContact CD1-CE2 4.28Å; F520-Y594 HydrophobicContact CE1-CE2 4.2Å; L590-Y594 HydrophobicContact CD2-CD2 4.11Å; L590-Y594 HydrophobicContact CD2-CE2 3.98Å; L590-Y594 WeakPolarHBondContact O-CB 3.42Å; L590-Y594 WeakPolarHBondContact O-CD2 3.03Å; L590-Y594 PolarHBondContact O-N 2.84Å; C591-Y594 PolarHBondContact O-N 3.48Å; Y594-T596 PolarHBondContact O-N 2.85Å; Y594-N597 HydrophobicContact CD1-CB 4.42Å; Y594-N597 CarbonylContact O-C 3.58Å; Y594-N597 WeakPolarHBondContact O-CA 3.34Å; Y594-N597 WeakPolarHBondContact O-CB 3.46Å; Y594-N597 PolarHBondContact O-N 2.9Å; Y594-F637 WeakPolarHBondContact CD1-O 3.11Å; Y594-H638 HydrophobicContact CE1-CB 4.28Å; Y594-H638 AromaticContact CE1-ND1 3.54Å; Y594-H638 AromaticContact CZ-ND1 3.57Å; Y594-H638 PolarHBondContact OH-CE1 2.95Å; Y594-H638 PolarHBondContact OH-ND1 3.37Å
595	F	89.3	Confident	89.7	Confident	3 Å²	3	36 Å²	36	1%	0.013	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-64.3	-23.1	179.7	74.1	-83.3	0	0	0	113	Q436 F437 C591 T592 N597 V598 L662 L666	Q436-F595 HydrophobicContact CB-CE2 4.27Å; Q436-F595 HydrophobicContact CB-CZ 3.64Å; Q436-F595 HydrophobicContact CG-CE2 4.47Å; Q436-F595 HydrophobicContact CG-CZ 4.3Å; Q436-F595 WeakPolarHBondContact O-CE1 3.45Å; Q436-F595 WeakPolarHBondContact O-CZ 3.24Å; F437-F595 HydrophobicContact CD1-CE1 4.41Å; C591-F595 WeakPolarHBondContact O-CA 3.42Å; C591-F595 VanDerWaalsContact O-CB 3.25Å; C591-F595 WeakPolarHBondContact O-CB 3.3Å; C591-F595 PolarHBondContact O-N 3.12Å; T592-F595 WeakPolarHBondContact O-CD1 3.49Å; F595-N597 PolarHBondContact O-N 2.8Å; F595-V598 HydrophobicContact CB-CG2 4.44Å; F595-V598 WeakPolarHBondContact O-CG2 3.23Å; F595-L662 HydrophobicContact CB-CB 4.18Å; F595-L662 HydrophobicContact CB-CD1 4Å; F595-L662 HydrophobicContact CD1-CD1 4.3Å; F595-L662 HydrophobicContact CD2-CB 3.86Å; F595-L662 HydrophobicContact CE2-CB 4.39Å; F595-L662 HydrophobicContact CG-CB 4Å; F595-L662 HydrophobicContact CG-CD1 4.14Å; F595-L666 HydrophobicContact CD2-CD1 4.44Å; F595-L666 HydrophobicContact CD2-CD2 3.7Å; F595-L666 HydrophobicContact CD2-CG 4.08Å; F595-L666 HydrophobicContact CE2-CD2 3.56Å; F595-L666 HydrophobicContact CE2-CG 4.1Å
596	T	87.6	Confident	89.8	Confident	20 Å²	20	37 Å²	37	12%	0.123	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-64.9	-22.7	169.1	56.9	0	0	0	0	112.3	Q436 F437 Y594 L666	Q436-T596 HydrophobicContact CB-CG2 4.25Å; Q436-T596 VanDerWaalsContact OE1-CG2 3.27Å; F437-T596 HydrophobicContact CE1-CG2 3.86Å; F437-T596 HydrophobicContact CZ-CG2 4.15Å; Y594-T596 PolarHBondContact O-N 2.85Å; T596-L666 HydrophobicContact CG2-CD2 4.02Å
597	N	91.2	Very high	89.9	Confident	24 Å²	24	36.6 Å²	36.6	13%	0.128	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-111.6	42.8	-175.3	-55.3	8.2	0	0	0	110.1	M344 Y594 F595 I636 F637	M344-N597 HydrophobicContact CE-CB 3.71Å; M344-N597 VanDerWaalsContact CE-ND2 3.26Å; M344-N597 WeakPolarHBondContact CE-ND2 3.37Å; M344-N597 WeakPolarHBondContact CE-OD1 3.5Å; Y594-N597 HydrophobicContact CD1-CB 4.42Å; Y594-N597 CarbonylContact O-C 3.58Å; Y594-N597 WeakPolarHBondContact O-CA 3.34Å; Y594-N597 WeakPolarHBondContact O-CB 3.46Å; Y594-N597 PolarHBondContact O-N 2.9Å; F595-N597 PolarHBondContact O-N 2.8Å; N597-I636 WeakPolarHBondContact O-CA 3.26Å; N597-F637 VanDerWaalsContact C-CE1 3.43Å; N597-F637 HydrophobicContact CB-CD1 4.33Å; N597-F637 HydrophobicContact CB-CD2 4.33Å; N597-F637 HydrophobicContact CB-CE1 4.15Å; N597-F637 HydrophobicContact CB-CE2 4.17Å; N597-F637 HydrophobicContact CB-CG 4.41Å; N597-F637 HydrophobicContact CB-CZ 4.07Å; N597-F637 VanDerWaalsContact CB-O 3.24Å; N597-F637 WeakPolarHBondContact CB-O 3.45Å; N597-F637 PolarHBondContact ND2-O 2.99Å; N597-F637 WeakPolarHBondContact O-CD1 3.42Å; N597-F637 WeakPolarHBondContact O-CE1 3.37Å; N597-F637 PolarHBondContact O-N 3.38Å
598	V	92.4	Very high	89.9	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	135.4	176.8	172	0	0	0	0	109.5	F595 M610 W634 V635 I636 I654 V659	F595-V598 HydrophobicContact CB-CG2 4.44Å; F595-V598 WeakPolarHBondContact O-CG2 3.23Å; V598-M610 HydrophobicContact CB-CB 4.42Å; V598-M610 HydrophobicContact CG1-CB 4.36Å; V598-M610 HydrophobicContact CG1-CG 3.97Å; V598-M610 PolarHBondContact O-N 2.92Å; V598-W634 HydrophobicContact CG1-CE3 3.79Å; V598-W634 HydrophobicContact CG1-CZ3 4.05Å; V598-V635 WeakPolarHBondContact CA-O 3.31Å; V598-I636 HydrophobicContact CG2-CG2 3.71Å; V598-I654 HydrophobicContact CG1-CD1 4.3Å; V598-I654 HydrophobicContact CG2-CD1 4.22Å; V598-V659 HydrophobicContact CG2-CG1 4.1Å
599	A	92.1	Very high	89.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137	170.3	0	0	0	0	0	111.2	F607 C608 V617 V635 F637	A599-F607 HydrophobicContact CB-CB 3.99Å; A599-C608 CarbonylContact C-O 3.44Å; A599-C608 VanDerWaalsContact CA-O 3.25Å; A599-C608 WeakPolarHBondContact CA-O 3.31Å; A599-V617 HydrophobicContact CB-CG2 4.25Å; A599-V635 HydrophobicContact CB-CG2 3.96Å; A599-V635 PolarHBondContact N-O 3.04Å; A599-V635 PolarHBondContact O-N 3.12Å; A599-F637 HydrophobicContact CB-CD1 4.38Å; A599-F637 HydrophobicContact CB-CE1 4.06Å
600	R	92.1	Very high	89.6	Confident	131 Å²	131	36.3 Å²	36.3	49%	0.494	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	137.6	175.8	-177.6	-173.8	171.8	170.2	-1.5	109.5	S602 F607 C608 M610 W634	R600-S602 PolarHBondContact O-N 3.48Å; R600-F607 CarbonylContact O-C 3.6Å; R600-F607 WeakPolarHBondContact O-CA 3.28Å; R600-C608 PolarHBondContact N-O 2.68Å; R600-C608 PolarHBondContact O-N 3.47Å; R600-M610 HydrophobicContact CB-CG 4.34Å; R600-M610 HydrophobicContact CB-SD 3.8Å; R600-W634 HydrophobicContact CB-CD2 4.22Å; R600-W634 HydrophobicContact CB-CE3 3.94Å; R600-W634 HydrophobicContact CB-CH2 4.17Å; R600-W634 HydrophobicContact CB-CZ2 4.39Å; R600-W634 HydrophobicContact CB-CZ3 3.93Å; R600-W634 HydrophobicContact CG-CD2 4.1Å; R600-W634 HydrophobicContact CG-CE3 4.29Å; R600-W634 HydrophobicContact CG-CH2 4.1Å; R600-W634 HydrophobicContact CG-CZ2 3.86Å; R600-W634 HydrophobicContact CG-CZ3 4.3Å
601	R	90.9	Very high	88.8	Confident	59 Å²	59	37.6 Å²	37.6	22%	0.223	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	129.4	173.4	-173.3	169.5	171.9	-153.1	11.9	110.9	G604 F607 V630 L632 N633	R601-G604 VanDerWaalsContact CZ-O 3.25Å; R601-G604 PolarHBondContact NE-O 3.43Å; R601-G604 PolarHBondContact NH2-O 2.87Å; R601-F607 HydrophobicContact CB-CD1 3.94Å; R601-F607 HydrophobicContact CB-CE1 3.79Å; R601-F607 HydrophobicContact CB-CZ 4.41Å; R601-F607 HydrophobicContact CG-CE1 4.37Å; R601-V630 VanDerWaalsContact CZ-O 3.24Å; R601-V630 PolarHBondContact NH1-O 3.43Å; R601-V630 PolarHBondContact NH2-O 2.81Å; R601-L632 WeakPolarHBondContact CD-O 3.42Å; R601-N633 PolarHBondContact N-O 3.44Å
602	S	87.8	Confident	87.7	Confident	76 Å²	76	40 Å²	40	53%	0.531	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-71.1	176.6	178.7	0	0	0	0	110.2	R600 V606	R600-S602 PolarHBondContact O-N 3.48Å; S602-V606 PolarHBondContact N-O 2.87Å
603	F	82.1	Confident	86.9	Confident	171 Å²	171	44 Å²	44	75%	0.75	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	141.5	179.4	-178.5	-98	0	0	0	111.3	K605 V606	F603-K605 PolarHBondContact O-N 2.74Å; F603-K605 VanDerWaalsContact O-N 3.08Å; F603-V606 PolarHBondContact N-O 2.78Å; F603-V606 WeakPolarHBondContact O-CB 3.41Å; F603-V606 WeakPolarHBondContact O-CG2 3.4Å; F603-V606 PolarHBondContact O-N 2.95Å
604	G	85.1	Confident	86.5	Confident	30 Å²	30	45.5 Å²	45.5	31%	0.309	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	-115	176.2	0	0	0	0	0	112.2	R601	R601-G604 VanDerWaalsContact CZ-O 3.25Å; R601-G604 PolarHBondContact NE-O 3.43Å; R601-G604 PolarHBondContact NH2-O 2.87Å
605	K	85.3	Confident	86.2	Confident	94 Å²	94	45.9 Å²	45.9	41%	0.409	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	17.1	179.4	-62.2	-173.4	158.9	-110	0	113.4	F603 H618 D629 V630	F603-K605 PolarHBondContact O-N 2.74Å; F603-K605 VanDerWaalsContact O-N 3.08Å; K605-H618 PolarHBondContact O-ND1 3.33Å; K605-D629 VanDerWaalsContact CB-OD2 3.23Å; K605-D629 WeakPolarHBondContact CB-OD2 3.48Å; K605-D629 WeakPolarHBondContact CD-OD2 3.46Å; K605-D629 WeakPolarHBondContact CE-OD1 3.37Å; K605-D629 WeakPolarHBondContact CE-OD2 3.27Å; K605-D629 WeakPolarHBondContact CG-OD2 3.28Å; K605-D629 IonicContact NZ-OD1 2.65Å; K605-D629 PolarHBondContact NZ-OD1 2.93Å; K605-D629 IonicContact NZ-OD2 3.91Å; K605-D629 PolarHBondContact NZ-OD2 2.74Å; K605-V630 HydrophobicContact CG-CG2 4.33Å
606	V	90	Very high	86.3	Confident	32 Å²	32	50.1 Å²	50.1	19%	0.194	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.4	-173.4	-160.3	0	0	0	0	110.5	S602 F603 M616	S602-V606 PolarHBondContact N-O 2.87Å; F603-V606 PolarHBondContact N-O 2.78Å; F603-V606 WeakPolarHBondContact O-CB 3.41Å; F603-V606 WeakPolarHBondContact O-CG2 3.4Å; F603-V606 PolarHBondContact O-N 2.95Å; V606-M616 HydrophobicContact CB-CE 4.05Å; V606-M616 HydrophobicContact CG1-CB 4.15Å; V606-M616 HydrophobicContact CG1-CE 3.36Å; V606-M616 HydrophobicContact CG1-SD 4.22Å
607	F	91.4	Very high	86.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	155	176.7	-64	-102.3	0	0	0	109.4	A599 R600 R601 M616 V617 I619 D629 L632 V635	A599-F607 HydrophobicContact CB-CB 3.99Å; R600-F607 CarbonylContact O-C 3.6Å; R600-F607 WeakPolarHBondContact O-CA 3.28Å; R601-F607 HydrophobicContact CB-CD1 3.94Å; R601-F607 HydrophobicContact CB-CE1 3.79Å; R601-F607 HydrophobicContact CB-CZ 4.41Å; R601-F607 HydrophobicContact CG-CE1 4.37Å; F607-M616 CarbonylContact O-C 3.59Å; F607-M616 WeakPolarHBondContact O-CA 3.35Å; F607-V617 HydrophobicContact CB-CG2 3.83Å; F607-V617 PolarHBondContact N-O 3.48Å; F607-V617 PolarHBondContact O-N 2.89Å; F607-I619 HydrophobicContact CD2-CG1 4.32Å; F607-I619 HydrophobicContact CE2-CD1 3.81Å; F607-I619 HydrophobicContact CE2-CG1 3.93Å; F607-I619 HydrophobicContact CZ-CD1 3.97Å; F607-D629 HydrophobicContact CE2-CB 4.45Å; F607-L632 HydrophobicContact CE1-CB 4.28Å; F607-L632 HydrophobicContact CZ-CB 4.12Å; F607-V635 HydrophobicContact CD1-CG2 3.89Å; F607-V635 HydrophobicContact CE1-CG1 4.03Å; F607-V635 HydrophobicContact CE1-CG2 4.11Å
608	C	90.7	Very high	86.5	Confident	32 Å²	32	49.9 Å²	49.9	22%	0.216	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.8	179.3	-178.1	0	0	0	0	108.3	A599 R600 G614 S615 M616	A599-C608 CarbonylContact C-O 3.44Å; A599-C608 VanDerWaalsContact CA-O 3.25Å; A599-C608 WeakPolarHBondContact CA-O 3.31Å; R600-C608 PolarHBondContact N-O 2.68Å; R600-C608 PolarHBondContact O-N 3.47Å; C608-G614 VanDerWaalsContact SG-C 3.51Å; C608-G614 WeakPolarHBondContact SG-CA 3.31Å; C608-G614 PolarHBondContact SG-O 3.09Å; C608-G614 VanDerWaalsContact SG-O 3.4Å; C608-S615 WeakPolarHBondContact CA-O 3.37Å; C608-M616 HydrophobicContact CB-SD 4.02Å
609	T	89.6	Confident	86.5	Confident	5 Å²	5	50 Å²	50	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	146.4	178.2	59.1	0	0	0	0	111.3	D611 G614 S615 V617 F637	T609-D611 WeakPolarHBondContact CB-OD1 3.5Å; T609-D611 PolarHBondContact OG1-OD1 2.89Å; T609-D611 PolarHBondContact OG1-OD2 2.64Å; T609-G614 WeakPolarHBondContact O-CA 3.19Å; T609-S615 PolarHBondContact N-O 2.86Å; T609-S615 WeakPolarHBondContact OG1-CB 3.39Å; T609-S615 PolarHBondContact OG1-N 2.9Å; T609-V617 HydrophobicContact CG2-CG1 3.97Å; T609-V617 HydrophobicContact CG2-CG2 4.35Å; T609-F637 HydrophobicContact CG2-CE1 4.44Å; T609-F637 HydrophobicContact CG2-CZ 4.19Å
610	M	85.8	Confident	86.4	Confident	45 Å²	45	51 Å²	51	22%	0.222	28%	0.275	C	S	.	.	S	Bend	trans	-101.7	15.3	-179.7	-54.4	-61	-81.3	0	0	112.5	V598 R600 G612 W634 L663 L666 H667	V598-M610 HydrophobicContact CB-CB 4.42Å; V598-M610 HydrophobicContact CG1-CB 4.36Å; V598-M610 HydrophobicContact CG1-CG 3.97Å; V598-M610 PolarHBondContact O-N 2.92Å; R600-M610 HydrophobicContact CB-CG 4.34Å; R600-M610 HydrophobicContact CB-SD 3.8Å; M610-G612 PolarHBondContact O-N 2.93Å; M610-W634 HydrophobicContact CE-CH2 3.77Å; M610-W634 HydrophobicContact CE-CZ3 3.89Å; M610-W634 HydrophobicContact CG-CZ3 4.05Å; M610-W634 HydrophobicContact SD-CZ3 4.42Å; M610-L663 HydrophobicContact CB-CD2 4.16Å; M610-L666 WeakPolarHBondContact O-CD1 3.43Å; M610-H667 PolarHBondContact O-CE1 3.34Å
611	D	74.8	Confident	86.1	Confident	27 Å²	27	48 Å²	48	14%	0.144	27%	0.273	C	S	.	.	S	Bend	trans	-70.7	-5.7	178.7	59.6	-11.6	0	0	0	114	T609 H613 G614	T609-D611 WeakPolarHBondContact CB-OD1 3.5Å; T609-D611 PolarHBondContact OG1-OD1 2.89Å; T609-D611 PolarHBondContact OG1-OD2 2.64Å; D611-H613 PolarHBondContact OD1-N 3.12Å; D611-H613 VanDerWaalsContact OD1-N 3.12Å; D611-H613 IonicContact OD2-CD2 2.97Å; D611-G614 PolarHBondContact OD1-N 2.74Å
612	G	70.2	Confident	85.8	Confident	52 Å²	52	47.4 Å²	47.4	54%	0.536	28%	0.278	S	S	.	.	S	Bend	trans	100.8	-15.6	-176.9	0	0	0	0	0	113.6	M610	M610-G612 PolarHBondContact O-N 2.93Å
613	H	74.8	Confident	85.7	Confident	111 Å²	111	44.3 Å²	44.3	51%	0.514	26%	0.256	S	S	.	.	S	Bend	trans	-86.7	-27.8	175.3	-64.3	-61.6	0	0	0	112.7	S340 R341 D611	S340-H613 PolarHBondContact O-NE2 2.81Å; R341-H613 VanDerWaalsContact O-CB 3.24Å; R341-H613 WeakPolarHBondContact O-CB 3.34Å; D611-H613 PolarHBondContact OD1-N 3.12Å; D611-H613 VanDerWaalsContact OD1-N 3.12Å; D611-H613 IonicContact OD2-CD2 2.97Å
614	G	81.1	Confident	85.7	Confident	33 Å²	33	37.5 Å²	37.5	34%	0.34	23%	0.23	S	C	.	.			trans	68.3	35	179.8	0	0	0	0	0	113	C608 T609 D611	C608-G614 VanDerWaalsContact SG-C 3.51Å; C608-G614 WeakPolarHBondContact SG-CA 3.31Å; C608-G614 PolarHBondContact SG-O 3.09Å; C608-G614 VanDerWaalsContact SG-O 3.4Å; T609-G614 WeakPolarHBondContact O-CA 3.19Å; D611-G614 PolarHBondContact OD1-N 2.74Å
615	S	86.9	Confident	85.6	Confident	17 Å²	17	36.1 Å²	36.1	12%	0.119	22%	0.215	C	C	.	.			trans	-66.1	133.4	-178	-77.6	0	0	0	0	111.2	R341 C608 T609	R341-S615 PolarHBondContact O-OG 2.59Å; C608-S615 WeakPolarHBondContact CA-O 3.37Å; T609-S615 PolarHBondContact N-O 2.86Å; T609-S615 WeakPolarHBondContact OG1-CB 3.39Å; T609-S615 PolarHBondContact OG1-N 2.9Å
616	M	90.3	Very high	85.5	Confident	92 Å²	92	35 Å²	35	45%	0.453	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	120.7	179.7	-64.8	-63.1	-87.4	0	0	110.6	V606 F607 C608	V606-M616 HydrophobicContact CB-CE 4.05Å; V606-M616 HydrophobicContact CG1-CB 4.15Å; V606-M616 HydrophobicContact CG1-CE 3.36Å; V606-M616 HydrophobicContact CG1-SD 4.22Å; F607-M616 CarbonylContact O-C 3.59Å; F607-M616 WeakPolarHBondContact O-CA 3.35Å; C608-M616 HydrophobicContact CB-SD 4.02Å
617	V	91.1	Very high	85	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	156.4	-173.6	-57.2	0	0	0	0	112.2	A599 F607 T609 M646 I648	A599-V617 HydrophobicContact CB-CG2 4.25Å; F607-V617 HydrophobicContact CB-CG2 3.83Å; F607-V617 PolarHBondContact N-O 3.48Å; F607-V617 PolarHBondContact O-N 2.89Å; T609-V617 HydrophobicContact CG2-CG1 3.97Å; T609-V617 HydrophobicContact CG2-CG2 4.35Å; V617-M646 HydrophobicContact CG1-CB 4.09Å; V617-I648 HydrophobicContact CB-CG2 3.93Å; V617-I648 HydrophobicContact CG1-CG2 4.31Å; V617-I648 HydrophobicContact CG2-CD1 4.41Å; V617-I648 HydrophobicContact CG2-CG2 3.79Å
618	H	92.3	Very high	84.4	Confident	40 Å²	40	43.5 Å²	43.5	19%	0.185	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.3	178.1	-59.9	-83.7	0	0	0	111	K605 H620 M646 Y647 I648	K605-H618 PolarHBondContact O-ND1 3.33Å; H618-H620 PolarHBondContact O-N 3.37Å; H618-M646 PolarHBondContact N-O 3.08Å; H618-Y647 HydrophobicContact CB-CD1 3.77Å; H618-Y647 HydrophobicContact CB-CE1 3.9Å; H618-Y647 CarbonylContact O-C 3.58Å; H618-Y647 WeakPolarHBondContact O-CA 3.5Å; H618-I648 WeakPolarHBondContact O-CG1 3.32Å; H618-I648 PolarHBondContact O-N 3.34Å
619	I	91.9	Very high	83.7	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	130.6	171	-63.8	179.4	0	0	0	108.8	F607 F626 D629 L632 I648 V651	F607-I619 HydrophobicContact CD2-CG1 4.32Å; F607-I619 HydrophobicContact CE2-CD1 3.81Å; F607-I619 HydrophobicContact CE2-CG1 3.93Å; F607-I619 HydrophobicContact CZ-CD1 3.97Å; I619-F626 HydrophobicContact CG2-CB 4.41Å; I619-F626 VanDerWaalsContact O-CD2 3.3Å; I619-F626 WeakPolarHBondContact O-CD2 3.33Å; I619-D629 HydrophobicContact CD1-CB 3.91Å; I619-L632 HydrophobicContact CD1-CD1 3.88Å; I619-I648 HydrophobicContact CG1-CD1 4.11Å; I619-I648 HydrophobicContact CG1-CG1 4.23Å; I619-V651 HydrophobicContact CD1-CG1 4.44Å; I619-V651 HydrophobicContact CG2-CG2 4.39Å
620	H	90.9	Very high	82.9	Confident	22 Å²	22	45.6 Å²	45.6	10%	0.102	26%	0.259	C	S	.	.			trans	-66.6	141.1	178.6	-170.5	-99.8	0	0	0	110.9	H618 S622 S623 Y647 I648 R649	H618-H620 PolarHBondContact O-N 3.37Å; H620-S622 WeakPolarHBondContact ND1-CB 3.2Å; H620-S622 PolarHBondContact ND1-N 3.06Å; H620-S622 VanDerWaalsContact ND1-N 3.12Å; H620-S622 PolarHBondContact ND1-OG 3.28Å; H620-S622 PolarHBondContact O-N 3.4Å; H620-S623 WeakPolarHBondContact O-CB 3.37Å; H620-S623 PolarHBondContact O-N 3Å; H620-Y647 HydrophobicContact CB-CD1 4.5Å; H620-Y647 HydrophobicContact CB-CG 4.5Å; H620-Y647 AromaticContact CD2-CG 3.93Å; H620-I648 VanDerWaalsContact CB-O 3.26Å; H620-I648 WeakPolarHBondContact CB-O 3.5Å; H620-I648 PolarHBondContact N-O 3.43Å; H620-R649 HydrophobicContact CB-CG 3.67Å; H620-R649 PolarHBondContact CE1-NH2 2.89Å; H620-R649 PolarHBondContact NE2-NH2 2.65Å
621	P	86.1	Confident	82.6	Confident	68 Å²	68	51 Å²	51	44%	0.442	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-5.7	178.1	-24.4	33.7	0	0	0	115.8	F626	P621-F626 HydrophobicContact CB-CD1 4.48Å; P621-F626 HydrophobicContact CB-CD2 4.31Å; P621-F626 HydrophobicContact CB-CE1 4.44Å; P621-F626 HydrophobicContact CB-CE2 4.26Å; P621-F626 HydrophobicContact CB-CG 4.41Å; P621-F626 HydrophobicContact CB-CZ 4.33Å; P621-F626 HydrophobicContact CG-CD2 4.26Å; P621-F626 HydrophobicContact CG-CE2 3.85Å; P621-F626 HydrophobicContact CG-CZ 4.06Å
622	S	83.4	Confident	83.1	Confident	47 Å²	47	50.6 Å²	50.6	33%	0.329	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-18	172.7	69.4	0	0	0	0	114.6	R493 H620	R493-S622 VanDerWaalsContact CZ-CB 3.43Å; H620-S622 WeakPolarHBondContact ND1-CB 3.2Å; H620-S622 PolarHBondContact ND1-N 3.06Å; H620-S622 VanDerWaalsContact ND1-N 3.12Å; H620-S622 PolarHBondContact ND1-OG 3.28Å; H620-S622 PolarHBondContact O-N 3.4Å
623	S	86.2	Confident	83.9	Confident	10 Å²	10	53 Å²	53	7%	0.07	28%	0.283	C	S	.	.	S	Bend	trans	-69.9	144.8	-179.9	-179.9	0	0	0	0	109.9	D519 H620 L625 F626	D519-S623 VanDerWaalsContact CG-OG 3.27Å; D519-S623 PolarHBondContact OD1-OG 3.46Å; D519-S623 VanDerWaalsContact OD2-CB 3.26Å; D519-S623 WeakPolarHBondContact OD2-CB 3.5Å; D519-S623 PolarHBondContact OD2-OG 2.92Å; H620-S623 WeakPolarHBondContact O-CB 3.37Å; H620-S623 PolarHBondContact O-N 3Å; S623-L625 PolarHBondContact O-N 2.85Å; S623-L625 WeakPolarHBondContact OG-CB 3.28Å; S623-L625 PolarHBondContact OG-N 3.01Å; S623-L625 VanDerWaalsContact OG-N 3.13Å; S623-F626 PolarHBondContact O-N 2.96Å
624	S	82.6	Confident	84.8	Confident	28 Å²	28	49.3 Å²	49.3	20%	0.196	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.1	169.3	59.4	0	0	0	0	112.6	D519	D519-S624 WeakPolarHBondContact OD1-CB 3.37Å; D519-S624 PolarHBondContact OD1-N 3.03Å; D519-S624 PolarHBondContact OD1-OG 2.92Å
625	L	83.1	Confident	85.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	0.1	-176.4	-65.6	167.7	0	0	0	114.1	S516 S623 E627 Q628 D629 L632 V651	S516-L625 WeakPolarHBondContact O-CD2 3.43Å; S623-L625 PolarHBondContact O-N 2.85Å; S623-L625 WeakPolarHBondContact OG-CB 3.28Å; S623-L625 PolarHBondContact OG-N 3.01Å; S623-L625 VanDerWaalsContact OG-N 3.13Å; L625-E627 VanDerWaalsContact C-N 3.3Å; L625-E627 PolarHBondContact O-N 2.77Å; L625-Q628 CarbonylContact O-C 3.5Å; L625-Q628 PolarHBondContact O-N 2.86Å; L625-Q628 VanDerWaalsContact O-N 3.15Å; L625-D629 PolarHBondContact O-N 3.35Å; L625-D629 VanDerWaalsContact O-N 3.11Å; L625-L632 HydrophobicContact CB-CD1 4.1Å; L625-L632 HydrophobicContact CD1-CD1 4.33Å; L625-L632 HydrophobicContact CD2-CD1 4.25Å; L625-L632 HydrophobicContact CG-CD1 4.47Å; L625-V651 HydrophobicContact CD1-CB 3.98Å; L625-V651 HydrophobicContact CD1-CG1 3.97Å; L625-V651 WeakPolarHBondContact CD1-O 3.38Å
626	F	83.2	Confident	85.7	Confident	71 Å²	71	46.9 Å²	46.9	31%	0.311	24%	0.242	S	C	.	.	S	Bend	trans	-60.9	-35.3	-174.7	179.8	-104.4	0	0	0	113.8	I619 P621 S623	I619-F626 HydrophobicContact CG2-CB 4.41Å; I619-F626 VanDerWaalsContact O-CD2 3.3Å; I619-F626 WeakPolarHBondContact O-CD2 3.33Å; P621-F626 HydrophobicContact CB-CD1 4.48Å; P621-F626 HydrophobicContact CB-CD2 4.31Å; P621-F626 HydrophobicContact CB-CE1 4.44Å; P621-F626 HydrophobicContact CB-CE2 4.26Å; P621-F626 HydrophobicContact CB-CG 4.41Å; P621-F626 HydrophobicContact CB-CZ 4.33Å; P621-F626 HydrophobicContact CG-CD2 4.26Å; P621-F626 HydrophobicContact CG-CE2 3.85Å; P621-F626 HydrophobicContact CG-CZ 4.06Å; S623-F626 PolarHBondContact O-N 2.96Å
627	E	79.5	Confident	85.9	Confident	144 Å²	144	42.7 Å²	42.7	67%	0.673	22%	0.221	S	C	*	.	S	Bend	trans	-85.3	-18.5	179.3	-66.9	178.1	177.4	0	0	112.7	R508 L625	R508-E627 IonicContact NH1-OE1 2.76Å; L625-E627 VanDerWaalsContact C-N 3.3Å; L625-E627 PolarHBondContact O-N 2.77Å
628	Q	78.2	Confident	85.9	Confident	66 Å²	66	45.3 Å²	45.3	31%	0.308	23%	0.234	S	C	.	.	S	Bend	trans	-101.2	6.9	-178.7	-62.6	179	-1.6	0	0	112.7	L625 V630 E631	L625-Q628 CarbonylContact O-C 3.5Å; L625-Q628 PolarHBondContact O-N 2.86Å; L625-Q628 VanDerWaalsContact O-N 3.15Å; Q628-V630 PolarHBondContact O-N 2.97Å; Q628-E631 PolarHBondContact O-N 2.85Å
629	D	75.1	Confident	85.7	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.016	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-57.2	-25.7	-175.3	61.1	-21.9	0	0	0	114	K605 F607 I619 L625 E631 L632	K605-D629 VanDerWaalsContact CB-OD2 3.23Å; K605-D629 WeakPolarHBondContact CB-OD2 3.48Å; K605-D629 WeakPolarHBondContact CD-OD2 3.46Å; K605-D629 WeakPolarHBondContact CE-OD1 3.37Å; K605-D629 WeakPolarHBondContact CE-OD2 3.27Å; K605-D629 WeakPolarHBondContact CG-OD2 3.28Å; K605-D629 IonicContact NZ-OD1 2.65Å; K605-D629 PolarHBondContact NZ-OD1 2.93Å; K605-D629 IonicContact NZ-OD2 3.91Å; K605-D629 PolarHBondContact NZ-OD2 2.74Å; F607-D629 HydrophobicContact CE2-CB 4.45Å; I619-D629 HydrophobicContact CD1-CB 3.91Å; L625-D629 PolarHBondContact O-N 3.35Å; L625-D629 VanDerWaalsContact O-N 3.11Å; D629-E631 VanDerWaalsContact C-N 3.27Å; D629-E631 PolarHBondContact O-N 3.38Å; D629-L632 PolarHBondContact O-N 2.81Å
630	V	74	Confident	85.5	Confident	78 Å²	78	46.4 Å²	46.4	47%	0.473	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-72.8	-16.3	177.1	-174.9	0	0	0	0	112.9	R601 K605 Q628	R601-V630 VanDerWaalsContact CZ-O 3.24Å; R601-V630 PolarHBondContact NH1-O 3.43Å; R601-V630 PolarHBondContact NH2-O 2.81Å; K605-V630 HydrophobicContact CG-CG2 4.33Å; Q628-V630 PolarHBondContact O-N 2.97Å
631	E	78.9	Confident	85.2	Confident	158 Å²	158	47.3 Å²	47.3	74%	0.738	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-98.6	-7.5	179.6	-62	-179	176.1	0	0	112.5	Q628 D629	Q628-E631 PolarHBondContact O-N 2.85Å; D629-E631 VanDerWaalsContact C-N 3.27Å; D629-E631 PolarHBondContact O-N 3.38Å
632	L	85.1	Confident	85	Confident	20 Å²	20	46 Å²	46	11%	0.105	24%	0.237	C	C	.	.			trans	-95.5	130.4	-174.5	-48.3	-179.3	0	0	0	111	R601 F607 I619 L625 D629 V635 P653	R601-L632 WeakPolarHBondContact CD-O 3.42Å; F607-L632 HydrophobicContact CE1-CB 4.28Å; F607-L632 HydrophobicContact CZ-CB 4.12Å; I619-L632 HydrophobicContact CD1-CD1 3.88Å; L625-L632 HydrophobicContact CB-CD1 4.1Å; L625-L632 HydrophobicContact CD1-CD1 4.33Å; L625-L632 HydrophobicContact CD2-CD1 4.25Å; L625-L632 HydrophobicContact CG-CD1 4.47Å; D629-L632 PolarHBondContact O-N 2.81Å; L632-V635 HydrophobicContact CB-CG1 4.08Å; L632-V635 HydrophobicContact CD1-CG1 4.03Å; L632-P653 HydrophobicContact CD2-CB 4.01Å
633	N	88.1	Confident	84.9	Confident	103 Å²	103	47.4 Å²	47.4	55%	0.551	24%	0.244	S	C	*	.	S	Bend	trans	-101.7	-38.8	176.4	-70.2	-34.3	0	0	0	112.9	R601	R601-N633 PolarHBondContact N-O 3.44Å
634	W	92.4	Very high	84.6	Confident	32 Å²	32	52.5 Å²	52.5	12%	0.121	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	134.2	-177.7	-66	85.7	0	0	0	109.8	V598 R600 M610 I654 Y656 L663	V598-W634 HydrophobicContact CG1-CE3 3.79Å; V598-W634 HydrophobicContact CG1-CZ3 4.05Å; R600-W634 HydrophobicContact CB-CD2 4.22Å; R600-W634 HydrophobicContact CB-CE3 3.94Å; R600-W634 HydrophobicContact CB-CH2 4.17Å; R600-W634 HydrophobicContact CB-CZ2 4.39Å; R600-W634 HydrophobicContact CB-CZ3 3.93Å; R600-W634 HydrophobicContact CG-CD2 4.1Å; R600-W634 HydrophobicContact CG-CE3 4.29Å; R600-W634 HydrophobicContact CG-CH2 4.1Å; R600-W634 HydrophobicContact CG-CZ2 3.86Å; R600-W634 HydrophobicContact CG-CZ3 4.3Å; M610-W634 HydrophobicContact CE-CH2 3.77Å; M610-W634 HydrophobicContact CE-CZ3 3.89Å; M610-W634 HydrophobicContact CG-CZ3 4.05Å; M610-W634 HydrophobicContact SD-CZ3 4.42Å; W634-I654 HydrophobicContact CB-CD1 4.3Å; W634-I654 HydrophobicContact CB-CG1 3.78Å; W634-I654 PolarHBondContact O-N 3.23Å; W634-Y656 HydrophobicContact CD2-CD2 4.34Å; W634-Y656 AromaticContact CE2-CD2 3.78Å; W634-Y656 HydrophobicContact CE3-CD2 4.45Å; W634-Y656 AromaticContact CH2-CD2 3.46Å; W634-Y656 HydrophobicContact CH2-CD2 3.46Å; W634-Y656 VanDerWaalsContact CH2-CD2 3.46Å; W634-Y656 AromaticContact CH2-CE2 3.7Å; W634-Y656 HydrophobicContact CH2-CE2 3.7Å; W634-Y656 AromaticContact CZ2-CD2 3.33Å; W634-Y656 HydrophobicContact CZ2-CD2 3.33Å; W634-Y656 AromaticContact CZ2-CE2 3.85Å; W634-Y656 HydrophobicContact CZ2-CE2 3.85Å; W634-Y656 HydrophobicContact CZ2-CG 4.07Å; W634-Y656 HydrophobicContact CZ3-CD2 4.05Å; W634-Y656 HydrophobicContact CZ3-CE2 4.47Å; W634-L663 HydrophobicContact CH2-CD1 4.37Å; W634-L663 HydrophobicContact CZ3-CD1 4.26Å
635	V	93.8	Very high	84.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	151	-178.4	-60	0	0	0	0	110.9	V598 A599 F607 L632 I648 V651 C652	V598-V635 WeakPolarHBondContact CA-O 3.31Å; A599-V635 HydrophobicContact CB-CG2 3.96Å; A599-V635 PolarHBondContact N-O 3.04Å; A599-V635 PolarHBondContact O-N 3.12Å; F607-V635 HydrophobicContact CD1-CG2 3.89Å; F607-V635 HydrophobicContact CE1-CG1 4.03Å; F607-V635 HydrophobicContact CE1-CG2 4.11Å; L632-V635 HydrophobicContact CB-CG1 4.08Å; L632-V635 HydrophobicContact CD1-CG1 4.03Å; V635-I648 HydrophobicContact CG2-CD1 3.89Å; V635-V651 HydrophobicContact CB-CG1 3.66Å; V635-V651 HydrophobicContact CG1-CG1 3.87Å; V635-V651 HydrophobicContact CG2-CG1 4.14Å; V635-C652 CarbonylContact C-O 3.54Å; V635-C652 WeakPolarHBondContact CA-O 3.38Å
636	I	94.2	Very high	84.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	154.8	162.1	59.7	175.5	0	0	0	109.5	L590 N597 V598 V651 C652 I654	L590-I636 HydrophobicContact CB-CD1 3.54Å; N597-I636 WeakPolarHBondContact O-CA 3.26Å; V598-I636 HydrophobicContact CG2-CG2 3.71Å; I636-V651 WeakPolarHBondContact O-CA 3.39Å; I636-C652 HydrophobicContact CD1-CB 4.05Å; I636-C652 HydrophobicContact CG1-CB 3.66Å; I636-C652 PolarHBondContact N-O 3.07Å; I636-C652 PolarHBondContact O-N 3.14Å; I636-I654 HydrophobicContact CB-CG2 4.49Å; I636-I654 HydrophobicContact CD1-CG2 4.1Å; I636-I654 HydrophobicContact CG1-CG2 3.92Å; I636-I654 HydrophobicContact CG2-CD1 3.83Å; I636-I654 HydrophobicContact CG2-CG1 4.32Å; I636-I654 HydrophobicContact CG2-CG2 3.99Å
637	F	93.6	Very high	85.2	Confident	3 Å²	3	57.1 Å²	57.1	1%	0.013	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	153.6	-179.8	59.4	-85.1	0	0	0	112.7	M344 Y594 N597 A599 T609 V640 I648 T650 V651	M344-F637 HydrophobicContact CE-CD2 4.12Å; M344-F637 HydrophobicContact CE-CE2 3.21Å; M344-F637 HydrophobicContact CE-CZ 3.63Å; M344-F637 HydrophobicContact SD-CD2 4.36Å; M344-F637 HydrophobicContact SD-CE2 3.65Å; Y594-F637 WeakPolarHBondContact CD1-O 3.11Å; N597-F637 VanDerWaalsContact C-CE1 3.43Å; N597-F637 HydrophobicContact CB-CD1 4.33Å; N597-F637 HydrophobicContact CB-CD2 4.33Å; N597-F637 HydrophobicContact CB-CE1 4.15Å; N597-F637 HydrophobicContact CB-CE2 4.17Å; N597-F637 HydrophobicContact CB-CG 4.41Å; N597-F637 HydrophobicContact CB-CZ 4.07Å; N597-F637 VanDerWaalsContact CB-O 3.24Å; N597-F637 WeakPolarHBondContact CB-O 3.45Å; N597-F637 PolarHBondContact ND2-O 2.99Å; N597-F637 WeakPolarHBondContact O-CD1 3.42Å; N597-F637 WeakPolarHBondContact O-CE1 3.37Å; N597-F637 PolarHBondContact O-N 3.38Å; A599-F637 HydrophobicContact CB-CD1 4.38Å; A599-F637 HydrophobicContact CB-CE1 4.06Å; T609-F637 HydrophobicContact CG2-CE1 4.44Å; T609-F637 HydrophobicContact CG2-CZ 4.19Å; F637-V640 HydrophobicContact CD2-CG2 3.91Å; F637-V640 HydrophobicContact CE2-CG2 3.4Å; F637-V640 VanDerWaalsContact CE2-CG2 3.4Å; F637-V640 HydrophobicContact CZ-CG2 4.39Å; F637-I648 HydrophobicContact CB-CB 3.82Å; F637-I648 HydrophobicContact CB-CD1 4.26Å; F637-I648 HydrophobicContact CB-CG2 4.22Å; F637-I648 HydrophobicContact CD1-CB 4.28Å; F637-I648 HydrophobicContact CD1-CD1 4.21Å; F637-I648 HydrophobicContact CD1-CG2 3.81Å; F637-I648 HydrophobicContact CD2-CB 4Å; F637-I648 HydrophobicContact CD2-CG2 3.58Å; F637-I648 HydrophobicContact CE1-CG2 4.03Å; F637-I648 HydrophobicContact CE2-CG2 3.77Å; F637-I648 HydrophobicContact CG-CB 3.78Å; F637-I648 HydrophobicContact CG-CD1 4.39Å; F637-I648 HydrophobicContact CG-CG2 3.6Å; F637-I648 HydrophobicContact CZ-CG2 4.02Å; F637-T650 WeakPolarHBondContact CA-O 3.19Å; F637-V651 HydrophobicContact CB-CG2 4.41Å
638	H	91.3	Very high	85.8	Confident	56 Å²	56	50.3 Å²	50.3	26%	0.259	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-42.4	-179.5	-179	64.7	0	0	0	113.1	F520 Y594 R649 T650	F520-H638 HydrophobicContact CE1-CB 4.42Å; F520-H638 HydrophobicContact CZ-CB 4.03Å; Y594-H638 HydrophobicContact CE1-CB 4.28Å; Y594-H638 AromaticContact CE1-ND1 3.54Å; Y594-H638 AromaticContact CZ-ND1 3.57Å; Y594-H638 PolarHBondContact OH-CE1 2.95Å; Y594-H638 PolarHBondContact OH-ND1 3.37Å; H638-R649 PolarHBondContact N-O 3Å; H638-R649 VanDerWaalsContact N-O 3.16Å; H638-T650 HydrophobicContact CB-CG2 4.25Å; H638-T650 PolarHBondContact N-O 3.43Å
639	D	88.1	Confident	86.4	Confident	61 Å²	61	50.3 Å²	50.3	33%	0.326	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	157.1	-166.4	-177	28.1	0	0	0	111.4	R649	D639-R649 HydrophobicContact CB-CB 4.29Å; D639-R649 PolarHBondContact N-O 3.33Å; D639-R649 PolarHBondContact O-N 3.49Å
640	V	87.6	Confident	87.2	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.5	179.4	178.4	0	0	0	0	110.2	V342 M344 F637 V642 Y647 I648	V342-V640 HydrophobicContact CG1-CG1 4.32Å; V342-V640 HydrophobicContact CG1-CG2 4.01Å; M344-V640 HydrophobicContact SD-CB 4.42Å; M344-V640 HydrophobicContact SD-CG2 3.58Å; M344-V640 VanDerWaalsContact SD-CG2 3.58Å; F637-V640 HydrophobicContact CD2-CG2 3.91Å; F637-V640 HydrophobicContact CE2-CG2 3.4Å; F637-V640 VanDerWaalsContact CE2-CG2 3.4Å; F637-V640 HydrophobicContact CZ-CG2 4.39Å; V640-V642 HydrophobicContact CG1-CG2 4.16Å; V640-Y647 CarbonylContact C-O 3.38Å; V640-Y647 WeakPolarHBondContact CA-O 3.36Å; V640-I648 HydrophobicContact CG2-CG2 4.24Å
641	L	85.6	Confident	88.1	Confident	41 Å²	41	47.9 Å²	47.9	22%	0.215	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.3	169.3	-176.6	82.7	0	0	0	109.7	T643 Y647	L641-T643 HydrophobicContact CD2-CG2 3.64Å; L641-T643 HydrophobicContact CG-CG2 3.92Å; L641-Y647 PolarHBondContact N-O 3.32Å; L641-Y647 PolarHBondContact O-N 3.14Å
642	V	82	Confident	88.8	Confident	40 Å²	40	40.4 Å²	40.4	24%	0.242	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	124	170.9	-173.3	0	0	0	0	109.1	V346 V640 M646	V346-V642 HydrophobicContact CB-CG2 4.38Å; V346-V642 HydrophobicContact CG1-CB 3.83Å; V346-V642 HydrophobicContact CG1-CG2 3.7Å; V346-V642 HydrophobicContact CG2-CG2 3.84Å; V640-V642 HydrophobicContact CG1-CG2 4.16Å; V642-M646 HydrophobicContact CG1-CG 4.45Å; V642-M646 HydrophobicContact CG2-CG 4.32Å
643	T	79.9	Confident	89.1	Confident	77 Å²	77	40.2 Å²	40.2	47%	0.472	21%	0.212	S	C	.	.	S	Bend	trans	-132.4	-135.5	171.8	58.5	0	0	0	0	108.1	L641 K645 Y647	L641-T643 HydrophobicContact CD2-CG2 3.64Å; L641-T643 HydrophobicContact CG-CG2 3.92Å; T643-K645 PolarHBondContact N-O 3.09Å; T643-K645 PolarHBondContact O-N 3.21Å; T643-K645 PolarHBondContact OG1-N 2.98Å; T643-K645 PolarHBondContact OG1-O 2.92Å; T643-Y647 WeakPolarHBondContact OG1-CE2 3.38Å
644	S	79.2	Confident	89.3	Confident	117 Å²	117	36 Å²	36	82%	0.818	19%	0.189	S	C	*	.	S	Bend	trans	-63.5	-23.6	164.1	57.2	0	0	0	0	112.8
645	K	85.1	Confident	89.2	Confident	110 Å²	110	40.2 Å²	40.2	48%	0.478	21%	0.205	S	C	.	.	S	Bend	trans	-131.5	158.1	171.6	-61.7	-177	-179.5	-177.1	0	109.5	T643 Y647	T643-K645 PolarHBondContact N-O 3.09Å; T643-K645 PolarHBondContact O-N 3.21Å; T643-K645 PolarHBondContact OG1-N 2.98Å; T643-K645 PolarHBondContact OG1-O 2.92Å; K645-Y647 HydrophobicContact CB-CD2 4.42Å; K645-Y647 HydrophobicContact CB-CE2 3.81Å; K645-Y647 WeakPolarHBondContact O-CD2 3.41Å
646	M	87.5	Confident	88.9	Confident	40 Å²	40	44.5 Å²	44.5	20%	0.197	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	123.1	173	-63.3	-177.2	175.6	0	0	109.7	V342 V617 H618 V642	V342-M646 HydrophobicContact CG2-CE 3.97Å; V342-M646 HydrophobicContact CG2-SD 3.8Å; V617-M646 HydrophobicContact CG1-CB 4.09Å; H618-M646 PolarHBondContact N-O 3.08Å; V642-M646 HydrophobicContact CG1-CG 4.45Å; V642-M646 HydrophobicContact CG2-CG 4.32Å
647	Y	90.8	Very high	88.7	Confident	47 Å²	47	50.6 Å²	50.6	18%	0.184	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.2	-179.5	-67.9	-79.3	0	0	0	111.7	H618 H620 V640 L641 T643 K645	H618-Y647 HydrophobicContact CB-CD1 3.77Å; H618-Y647 HydrophobicContact CB-CE1 3.9Å; H618-Y647 CarbonylContact O-C 3.58Å; H618-Y647 WeakPolarHBondContact O-CA 3.5Å; H620-Y647 HydrophobicContact CB-CD1 4.5Å; H620-Y647 HydrophobicContact CB-CG 4.5Å; H620-Y647 AromaticContact CD2-CG 3.93Å; V640-Y647 CarbonylContact C-O 3.38Å; V640-Y647 WeakPolarHBondContact CA-O 3.36Å; L641-Y647 PolarHBondContact N-O 3.32Å; L641-Y647 PolarHBondContact O-N 3.14Å; T643-Y647 WeakPolarHBondContact OG1-CE2 3.38Å; K645-Y647 HydrophobicContact CB-CD2 4.42Å; K645-Y647 HydrophobicContact CB-CE2 3.81Å; K645-Y647 WeakPolarHBondContact O-CD2 3.41Å
648	I	91.8	Very high	88.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	140.8	170.4	57	170.8	0	0	0	110.7	V617 H618 I619 H620 V635 F637 V640 V651	V617-I648 HydrophobicContact CB-CG2 3.93Å; V617-I648 HydrophobicContact CG1-CG2 4.31Å; V617-I648 HydrophobicContact CG2-CD1 4.41Å; V617-I648 HydrophobicContact CG2-CG2 3.79Å; H618-I648 WeakPolarHBondContact O-CG1 3.32Å; H618-I648 PolarHBondContact O-N 3.34Å; I619-I648 HydrophobicContact CG1-CD1 4.11Å; I619-I648 HydrophobicContact CG1-CG1 4.23Å; H620-I648 VanDerWaalsContact CB-O 3.26Å; H620-I648 WeakPolarHBondContact CB-O 3.5Å; H620-I648 PolarHBondContact N-O 3.43Å; V635-I648 HydrophobicContact CG2-CD1 3.89Å; F637-I648 HydrophobicContact CB-CB 3.82Å; F637-I648 HydrophobicContact CB-CD1 4.26Å; F637-I648 HydrophobicContact CB-CG2 4.22Å; F637-I648 HydrophobicContact CD1-CB 4.28Å; F637-I648 HydrophobicContact CD1-CD1 4.21Å; F637-I648 HydrophobicContact CD1-CG2 3.81Å; F637-I648 HydrophobicContact CD2-CB 4Å; F637-I648 HydrophobicContact CD2-CG2 3.58Å; F637-I648 HydrophobicContact CE1-CG2 4.03Å; F637-I648 HydrophobicContact CE2-CG2 3.77Å; F637-I648 HydrophobicContact CG-CB 3.78Å; F637-I648 HydrophobicContact CG-CD1 4.39Å; F637-I648 HydrophobicContact CG-CG2 3.6Å; F637-I648 HydrophobicContact CZ-CG2 4.02Å; V640-I648 HydrophobicContact CG2-CG2 4.24Å; I648-V651 HydrophobicContact CB-CG2 4.48Å; I648-V651 HydrophobicContact CD1-CG1 4.47Å; I648-V651 HydrophobicContact CD1-CG2 3.95Å; I648-V651 HydrophobicContact CG1-CG2 3.96Å
649	R	90.7	Very high	88.3	Confident	66 Å²	66	49.5 Å²	49.5	25%	0.249	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.6	-177.1	-72.5	178.3	167.2	-177.5	-2.9	111.3	H620 H638 D639	H620-R649 HydrophobicContact CB-CG 3.67Å; H620-R649 PolarHBondContact CE1-NH2 2.89Å; H620-R649 PolarHBondContact NE2-NH2 2.65Å; H638-R649 PolarHBondContact N-O 3Å; H638-R649 VanDerWaalsContact N-O 3.16Å; D639-R649 HydrophobicContact CB-CB 4.29Å; D639-R649 PolarHBondContact N-O 3.33Å; D639-R649 PolarHBondContact O-N 3.49Å
650	T	91.6	Very high	88.3	Confident	31 Å²	31	52 Å²	52	19%	0.19	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	53	80.3	-175.2	-48	0	0	0	0	110.3	L485 D519 F520 L523 F637 H638	L485-T650 HydrophobicContact CD2-CG2 4.19Å; D519-T650 HydrophobicContact CB-CG2 4.01Å; D519-T650 WeakPolarHBondContact OD2-CA 3.46Å; F520-T650 HydrophobicContact CD1-CG2 4.17Å; F520-T650 HydrophobicContact CD2-CG2 3.92Å; F520-T650 HydrophobicContact CE1-CG2 4.09Å; F520-T650 HydrophobicContact CE2-CG2 3.86Å; F520-T650 WeakPolarHBondContact CE2-O 3.26Å; F520-T650 HydrophobicContact CG-CG2 4.1Å; F520-T650 HydrophobicContact CZ-CG2 3.94Å; L523-T650 HydrophobicContact CD1-CG2 4.35Å; F637-T650 WeakPolarHBondContact CA-O 3.19Å; H638-T650 HydrophobicContact CB-CG2 4.25Å; H638-T650 PolarHBondContact N-O 3.43Å
651	V	93.2	Very high	88.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	140.7	-168.8	-176.6	0	0	0	0	110.3	D519 I619 L625 V635 I636 F637 I648	D519-V651 WeakPolarHBondContact CB-O 3.43Å; D519-V651 PolarHBondContact N-O 2.89Å; D519-V651 VanDerWaalsContact N-O 3.11Å; D519-V651 PolarHBondContact OD2-N 2.8Å; I619-V651 HydrophobicContact CD1-CG1 4.44Å; I619-V651 HydrophobicContact CG2-CG2 4.39Å; L625-V651 HydrophobicContact CD1-CB 3.98Å; L625-V651 HydrophobicContact CD1-CG1 3.97Å; L625-V651 WeakPolarHBondContact CD1-O 3.38Å; V635-V651 HydrophobicContact CB-CG1 3.66Å; V635-V651 HydrophobicContact CG1-CG1 3.87Å; V635-V651 HydrophobicContact CG2-CG1 4.14Å; I636-V651 WeakPolarHBondContact O-CA 3.39Å; F637-V651 HydrophobicContact CB-CG2 4.41Å; I648-V651 HydrophobicContact CB-CG2 4.48Å; I648-V651 HydrophobicContact CD1-CG1 4.47Å; I648-V651 HydrophobicContact CD1-CG2 3.95Å; I648-V651 HydrophobicContact CG1-CG2 3.96Å
652	C	92.9	Very high	88.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	127.3	170.8	173.2	0	0	0	0	110.1	N518 F520 R587 V635 I636	N518-C652 PolarHBondContact ND2-SG 3.46Å; N518-C652 VanDerWaalsContact ND2-SG 3.37Å; F520-C652 HydrophobicContact CD2-CB 3.64Å; F520-C652 HydrophobicContact CE2-CB 3.83Å; R587-C652 VanDerWaalsContact CG-SG 3.59Å; V635-C652 CarbonylContact C-O 3.54Å; V635-C652 WeakPolarHBondContact CA-O 3.38Å; I636-C652 HydrophobicContact CD1-CB 4.05Å; I636-C652 HydrophobicContact CG1-CB 3.66Å; I636-C652 PolarHBondContact N-O 3.07Å; I636-C652 PolarHBondContact O-N 3.14Å
653	P	91.6	Very high	88.1	Confident	17 Å²	17	56.6 Å²	56.6	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	139	173.7	31.5	-33.9	0	0	0	110.8	M517 L632	M517-P653 WeakPolarHBondContact O-CD 3.3Å; M517-P653 WeakPolarHBondContact O-CG 3.4Å; L632-P653 HydrophobicContact CD2-CB 4.01Å
654	I	92.1	Very high	88.2	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.072	27%	0.27	C	S	.	.			trans	-130.2	163.3	-176.3	60.7	153.6	0	0	0	111.1	C591 V598 W634 I636 W658 V659	C591-I654 WeakPolarHBondContact SG-CG2 3.42Å; V598-I654 HydrophobicContact CG1-CD1 4.3Å; V598-I654 HydrophobicContact CG2-CD1 4.22Å; W634-I654 HydrophobicContact CB-CD1 4.3Å; W634-I654 HydrophobicContact CB-CG1 3.78Å; W634-I654 PolarHBondContact O-N 3.23Å; I636-I654 HydrophobicContact CB-CG2 4.49Å; I636-I654 HydrophobicContact CD1-CG2 4.1Å; I636-I654 HydrophobicContact CG1-CG2 3.92Å; I636-I654 HydrophobicContact CG2-CD1 3.83Å; I636-I654 HydrophobicContact CG2-CG1 4.32Å; I636-I654 HydrophobicContact CG2-CG2 3.99Å; I654-W658 HydrophobicContact CB-CE3 3.98Å; I654-W658 HydrophobicContact CB-CZ3 4.2Å; I654-W658 HydrophobicContact CG2-CE3 4.32Å; I654-W658 HydrophobicContact CG2-CZ3 4.4Å; I654-V659 HydrophobicContact CD1-CB 4.42Å; I654-V659 HydrophobicContact CD1-CG1 3.59Å; I654-V659 HydrophobicContact CD1-CG2 3.93Å
655	R	90.3	Very high	88.2	Confident	120 Å²	120	53.1 Å²	53.1	45%	0.453	24%	0.244	S	C	.	.			trans	-94.9	144.7	169.6	-61.7	-173.2	179.6	146.1	-1.1	109.8	E584 E657 W658	E584-R655 VanDerWaalsContact CD-NH1 3.27Å; E584-R655 IonicContact OE1-NH1 2.89Å; E584-R655 PolarHBondContact OE1-NH1 2.96Å; E584-R655 IonicContact OE2-CZ 3.72Å; E584-R655 IonicContact OE2-NH1 3.66Å; E584-R655 PolarHBondContact OE2-NH1 3.49Å; R655-E657 WeakPolarHBondContact CB-OE2 3.44Å; R655-E657 PolarHBondContact O-N 3.16Å; R655-W658 HydrophobicContact CB-CD2 3.81Å; R655-W658 HydrophobicContact CB-CE3 4.19Å; R655-W658 HydrophobicContact CB-CG 4.2Å; R655-W658 HydrophobicContact CB-CH2 4.41Å; R655-W658 HydrophobicContact CB-CZ2 4.05Å; R655-W658 HydrophobicContact CB-CZ3 4.48Å; R655-W658 HydrophobicContact CG-CD2 4.32Å; R655-W658 HydrophobicContact CG-CH2 3.9Å; R655-W658 HydrophobicContact CG-CZ2 3.62Å; R655-W658 HydrophobicContact CG-CZ3 4.34Å; R655-W658 PolarHBondContact O-N 3.43Å
656	Y	88.8	Confident	87.6	Confident	91 Å²	91	48 Å²	48	36%	0.357	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-60.3	-36.9	-179.8	172.9	-114.1	0	0	0	111.6	W634 W658 V659 K660 L663	W634-Y656 HydrophobicContact CD2-CD2 4.34Å; W634-Y656 AromaticContact CE2-CD2 3.78Å; W634-Y656 HydrophobicContact CE3-CD2 4.45Å; W634-Y656 AromaticContact CH2-CD2 3.46Å; W634-Y656 HydrophobicContact CH2-CD2 3.46Å; W634-Y656 VanDerWaalsContact CH2-CD2 3.46Å; W634-Y656 AromaticContact CH2-CE2 3.7Å; W634-Y656 HydrophobicContact CH2-CE2 3.7Å; W634-Y656 AromaticContact CZ2-CD2 3.33Å; W634-Y656 HydrophobicContact CZ2-CD2 3.33Å; W634-Y656 AromaticContact CZ2-CE2 3.85Å; W634-Y656 HydrophobicContact CZ2-CE2 3.85Å; W634-Y656 HydrophobicContact CZ2-CG 4.07Å; W634-Y656 HydrophobicContact CZ3-CD2 4.05Å; W634-Y656 HydrophobicContact CZ3-CE2 4.47Å; Y656-W658 PolarHBondContact O-N 3.35Å; Y656-W658 VanDerWaalsContact O-N 3.13Å; Y656-V659 HydrophobicContact CD2-CG2 4.46Å; Y656-V659 WeakPolarHBondContact O-CG2 3.31Å; Y656-V659 PolarHBondContact O-N 3.49Å; Y656-K660 HydrophobicContact CD1-CB 4.47Å; Y656-K660 HydrophobicContact CE1-CB 4.08Å; Y656-K660 HydrophobicContact CE1-CD 3.9Å; Y656-K660 HydrophobicContact CE1-CG 3.89Å; Y656-K660 HydrophobicContact CE2-CB 4.43Å; Y656-K660 WeakPolarHBondContact O-CB 3.48Å; Y656-K660 PolarHBondContact O-N 2.9Å; Y656-L663 HydrophobicContact CD2-CD1 4.29Å; Y656-L663 HydrophobicContact CE2-CD1 3.68Å
657	E	89.6	Confident	86.9	Confident	128 Å²	128	51.4 Å²	51.4	60%	0.598	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-58	-29.2	-179.2	-63	71.6	-154	0	0	112.5	R655 V659	R655-E657 WeakPolarHBondContact CB-OE2 3.44Å; R655-E657 PolarHBondContact O-N 3.16Å; E657-V659 VanDerWaalsContact C-N 3.35Å
658	W	89.4	Confident	85.4	Confident	35 Å²	35	56.8 Å²	56.8	13%	0.133	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-78.1	-19.8	-179.2	-54.8	-21.4	0	0	0	113.7	E584 R587 Q588 I654 R655 Y656	E584-W658 HydrophobicContact CG-CH2 4.25Å; E584-W658 HydrophobicContact CG-CZ2 3.58Å; E584-W658 VanDerWaalsContact OE1-CZ2 3.26Å; E584-W658 WeakPolarHBondContact OE1-CZ2 3.43Å; E584-W658 PolarHBondContact OE1-NE1 2.83Å; E584-W658 VanDerWaalsContact OE1-NE1 3.14Å; R587-W658 HydrophobicContact CB-CE3 4.33Å; R587-W658 HydrophobicContact CB-CH2 4.13Å; R587-W658 HydrophobicContact CB-CZ3 3.58Å; Q588-W658 HydrophobicContact CG-CB 4.44Å; Q588-W658 HydrophobicContact CG-CD2 3.82Å; Q588-W658 HydrophobicContact CG-CE3 4.31Å; Q588-W658 HydrophobicContact CG-CG 3.87Å; I654-W658 HydrophobicContact CB-CE3 3.98Å; I654-W658 HydrophobicContact CB-CZ3 4.2Å; I654-W658 HydrophobicContact CG2-CE3 4.32Å; I654-W658 HydrophobicContact CG2-CZ3 4.4Å; R655-W658 HydrophobicContact CB-CD2 3.81Å; R655-W658 HydrophobicContact CB-CE3 4.19Å; R655-W658 HydrophobicContact CB-CG 4.2Å; R655-W658 HydrophobicContact CB-CH2 4.41Å; R655-W658 HydrophobicContact CB-CZ2 4.05Å; R655-W658 HydrophobicContact CB-CZ3 4.48Å; R655-W658 HydrophobicContact CG-CD2 4.32Å; R655-W658 HydrophobicContact CG-CH2 3.9Å; R655-W658 HydrophobicContact CG-CZ2 3.62Å; R655-W658 HydrophobicContact CG-CZ3 4.34Å; R655-W658 PolarHBondContact O-N 3.43Å; Y656-W658 PolarHBondContact O-N 3.35Å; Y656-W658 VanDerWaalsContact O-N 3.13Å
659	V	87.3	Confident	84.2	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-15	-178.7	-66.8	0	0	0	0	112.7	C591 V598 I654 Y656 E657 D661 L662 L663	C591-V659 HydrophobicContact CB-CG1 4.04Å; V598-V659 HydrophobicContact CG2-CG1 4.1Å; I654-V659 HydrophobicContact CD1-CB 4.42Å; I654-V659 HydrophobicContact CD1-CG1 3.59Å; I654-V659 HydrophobicContact CD1-CG2 3.93Å; Y656-V659 HydrophobicContact CD2-CG2 4.46Å; Y656-V659 WeakPolarHBondContact O-CG2 3.31Å; Y656-V659 PolarHBondContact O-N 3.49Å; E657-V659 VanDerWaalsContact C-N 3.35Å; V659-D661 PolarHBondContact O-N 2.98Å; V659-D661 VanDerWaalsContact O-N 3.09Å; V659-L662 CarbonylContact O-C 3.59Å; V659-L662 WeakPolarHBondContact O-CA 3.43Å; V659-L662 WeakPolarHBondContact O-CB 3.14Å; V659-L662 PolarHBondContact O-N 3.29Å; V659-L663 HydrophobicContact CB-CG 4.34Å; V659-L663 HydrophobicContact CG2-CD1 4.22Å; V659-L663 HydrophobicContact CG2-CG 4.37Å; V659-L663 WeakPolarHBondContact O-CG 3.27Å; V659-L663 PolarHBondContact O-N 3.49Å
660	K	87.9	Confident	83	Confident	114 Å²	114	58.9 Å²	58.9	50%	0.496	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-43.7	-176.9	-179	-177.8	174.6	-170	0	113.3	Y656 P664	Y656-K660 HydrophobicContact CD1-CB 4.47Å; Y656-K660 HydrophobicContact CE1-CB 4.08Å; Y656-K660 HydrophobicContact CE1-CD 3.9Å; Y656-K660 HydrophobicContact CE1-CG 3.89Å; Y656-K660 HydrophobicContact CE2-CB 4.43Å; Y656-K660 WeakPolarHBondContact O-CB 3.48Å; Y656-K660 PolarHBondContact O-N 2.9Å; K660-P664 WeakPolarHBondContact O-CD 3.4Å
661	D	85.3	Confident	81.8	Confident	128 Å²	128	58.7 Å²	58.7	68%	0.684	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-15.9	-177.8	-57.5	-27.3	0	0	0	113.2	V659	V659-D661 PolarHBondContact O-N 2.98Å; V659-D661 VanDerWaalsContact O-N 3.09Å
662	L	83.9	Confident	80.4	Confident	37 Å²	37	62.7 Å²	62.7	19%	0.194	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-29.7	177.7	-59.7	175.9	0	0	0	112.1	F595 V659 K665	F595-L662 HydrophobicContact CB-CB 4.18Å; F595-L662 HydrophobicContact CB-CD1 4Å; F595-L662 HydrophobicContact CD1-CD1 4.3Å; F595-L662 HydrophobicContact CD2-CB 3.86Å; F595-L662 HydrophobicContact CE2-CB 4.39Å; F595-L662 HydrophobicContact CG-CB 4Å; F595-L662 HydrophobicContact CG-CD1 4.14Å; V659-L662 CarbonylContact O-C 3.59Å; V659-L662 WeakPolarHBondContact O-CA 3.43Å; V659-L662 WeakPolarHBondContact O-CB 3.14Å; V659-L662 PolarHBondContact O-N 3.29Å; L662-K665 WeakPolarHBondContact O-CB 3.35Å; L662-K665 PolarHBondContact O-N 2.86Å; L662-K665 VanDerWaalsContact O-N 3.14Å
663	L	81.9	Confident	79.1	Confident	17 Å²	17	66.8 Å²	66.8	9%	0.089	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-40	-178.5	-70.8	174.5	0	0	0	113.9	M610 W634 Y656 V659 K665 L666	M610-L663 HydrophobicContact CB-CD2 4.16Å; W634-L663 HydrophobicContact CH2-CD1 4.37Å; W634-L663 HydrophobicContact CZ3-CD1 4.26Å; Y656-L663 HydrophobicContact CD2-CD1 4.29Å; Y656-L663 HydrophobicContact CE2-CD1 3.68Å; V659-L663 HydrophobicContact CB-CG 4.34Å; V659-L663 HydrophobicContact CG2-CD1 4.22Å; V659-L663 HydrophobicContact CG2-CG 4.37Å; V659-L663 WeakPolarHBondContact O-CG 3.27Å; V659-L663 PolarHBondContact O-N 3.49Å; L663-K665 PolarHBondContact O-N 2.89Å; L663-L666 HydrophobicContact CD2-CD1 3.62Å; L663-L666 VanDerWaalsContact O-CB 3.23Å; L663-L666 WeakPolarHBondContact O-CB 3.42Å; L663-L666 PolarHBondContact O-N 2.97Å
664	P	81.9	Confident	78	Confident	58 Å²	58	66.1 Å²	66.1	38%	0.377	31%	0.311	S	S	.	.	H	α-helix	trans	-58.1	-34.8	176.4	-26.8	35.5	0	0	0	113.4	K660 L666 H667 E668	K660-P664 WeakPolarHBondContact O-CD 3.4Å; P664-L666 PolarHBondContact O-N 2.97Å; P664-L666 VanDerWaalsContact O-N 3.1Å; P664-H667 PolarHBondContact O-N 2.97Å; P664-H667 VanDerWaalsContact O-N 3.11Å; P664-E668 PolarHBondContact O-N 3.34Å
665	K	78.5	Confident	76.5	Confident	62 Å²	62	65.8 Å²	65.8	27%	0.27	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-15.4	175.9	-64.4	-174.1	174.5	-175.7	0	113.2	D438 L662 L663 V669	D438-K665 IonicContact OD1-NZ 3.97Å; D438-K665 PolarHBondContact OD1-NZ 2.79Å; D438-K665 IonicContact OD2-NZ 3.92Å; L662-K665 WeakPolarHBondContact O-CB 3.35Å; L662-K665 PolarHBondContact O-N 2.86Å; L662-K665 VanDerWaalsContact O-N 3.14Å; L663-K665 PolarHBondContact O-N 2.89Å; K665-V669 WeakPolarHBondContact O-CG2 3.35Å
666	L	73.6	Confident	74.8	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-74.5	-29.3	176.3	-62.7	174.5	0	0	0	112.5	K432 F595 T596 M610 L663 P664	K432-L666 WeakPolarHBondContact CE-O 3.37Å; K432-L666 PolarHBondContact NZ-O 3.42Å; F595-L666 HydrophobicContact CD2-CD1 4.44Å; F595-L666 HydrophobicContact CD2-CD2 3.7Å; F595-L666 HydrophobicContact CD2-CG 4.08Å; F595-L666 HydrophobicContact CE2-CD2 3.56Å; F595-L666 HydrophobicContact CE2-CG 4.1Å; T596-L666 HydrophobicContact CG2-CD2 4.02Å; M610-L666 WeakPolarHBondContact O-CD1 3.43Å; L663-L666 HydrophobicContact CD2-CD1 3.62Å; L663-L666 VanDerWaalsContact O-CB 3.23Å; L663-L666 WeakPolarHBondContact O-CB 3.42Å; L663-L666 PolarHBondContact O-N 2.97Å; P664-L666 PolarHBondContact O-N 2.97Å; P664-L666 VanDerWaalsContact O-N 3.1Å
667	H	71.4	Confident	72.9	Confident	111 Å²	111	58.4 Å²	58.4	51%	0.514	29%	0.288	S	S	.	.	H	α-helix	trans	-113.2	-31.3	-170.1	-53.6	-57	0	0	0	113.5	M610 P664 V669	M610-H667 PolarHBondContact O-CE1 3.34Å; P664-H667 PolarHBondContact O-N 2.97Å; P664-H667 VanDerWaalsContact O-N 3.11Å; H667-V669 PolarHBondContact O-N 3.4Å
668	E	60.8	Low	70.7	Confident	159 Å²	159	54 Å²	54	74%	0.743	27%	0.274	S	S	*	.			trans	-95.8	68.1	-174.2	-64.4	-178.4	175.6	0	0	112.7	P664	P664-E668 PolarHBondContact O-N 3.34Å
669	V	65.6	Low	68.6	Low	27 Å²	27	59.4 Å²	59.4	16%	0.164	29%	0.294	C	S	.	.			trans	-139	117.5	176.9	-170.3	0	0	0	0	110.9	K432 Y435 K665 H667 V671 L674	K432-V669 HydrophobicContact CG-CB 4.47Å; K432-V669 HydrophobicContact CG-CG1 4.5Å; Y435-V669 HydrophobicContact CD1-CG1 3.91Å; Y435-V669 HydrophobicContact CD1-CG2 3.82Å; Y435-V669 HydrophobicContact CE1-CG1 4.22Å; Y435-V669 HydrophobicContact CE1-CG2 3.79Å; K665-V669 WeakPolarHBondContact O-CG2 3.35Å; H667-V669 PolarHBondContact O-N 3.4Å; V669-V671 PolarHBondContact O-N 3.08Å; V669-L674 HydrophobicContact CG1-CD1 3.69Å; V669-L674 HydrophobicContact CG1-CG 4.33Å
670	D	65.4	Low	66.5	Low	83 Å²	83	67.7 Å²	67.7	44%	0.444	33%	0.333	S	S	.	.			trans	-76.8	109.8	162.1	-172.6	-15.2	0	0	0	108.7	Y672 E673	D670-Y672 VanDerWaalsContact C-N 3.27Å; D670-Y672 PolarHBondContact O-N 2.65Å; D670-Y672 PolarHBondContact OD1-N 2.74Å; D670-E673 HydrophobicContact CB-CG 4.04Å; D670-E673 PolarHBondContact O-N 2.81Å
671	V	65.6	Low	64.4	Low	28 Å²	28	68 Å²	68	17%	0.17	34%	0.336	C	S	.	.	H	α-helix	trans	-74.2	-22.2	-172.9	-161.1	0	0	0	0	111.7	L428 K432 V669 L674	L428-V671 HydrophobicContact CB-CB 4.45Å; L428-V671 HydrophobicContact CB-CG1 3.57Å; L428-V671 HydrophobicContact CD2-CG1 3.98Å; L428-V671 HydrophobicContact CG-CG1 4.29Å; L428-V671 WeakPolarHBondContact O-CG1 3.45Å; K432-V671 HydrophobicContact CB-CG1 4.18Å; K432-V671 HydrophobicContact CB-CG2 4.4Å; K432-V671 HydrophobicContact CD-CG2 4.34Å; V669-V671 PolarHBondContact O-N 3.08Å; V671-L674 WeakPolarHBondContact O-CB 3.29Å; V671-L674 PolarHBondContact O-N 2.59Å
672	Y	65.3	Low	62.5	Low	83 Å²	83	64.2 Å²	64.2	33%	0.325	32%	0.317	S	S	.	.	H	α-helix	trans	-74.4	-32.8	178.4	-73.7	-87.6	0	0	0	111.9	L428 D670 L674 S675 A678 W690	L428-Y672 HydrophobicContact CD1-CE1 4.15Å; L428-Y672 HydrophobicContact CD1-CE2 4.23Å; D670-Y672 VanDerWaalsContact C-N 3.27Å; D670-Y672 PolarHBondContact O-N 2.65Å; D670-Y672 PolarHBondContact OD1-N 2.74Å; Y672-L674 PolarHBondContact O-N 3.12Å; Y672-S675 PolarHBondContact O-N 3.12Å; Y672-S675 VanDerWaalsContact O-O 3.06Å; Y672-S675 PolarHBondContact O-OG 2.72Å; Y672-A678 WeakPolarHBondContact O-CB 3.33Å; Y672-W690 AromaticContact CD2-CH2 3.99Å; Y672-W690 HydrophobicContact CD2-CH2 3.99Å; Y672-W690 AromaticContact CD2-CZ2 3.61Å; Y672-W690 HydrophobicContact CD2-CZ2 3.61Å; Y672-W690 AromaticContact CE2-CE2 3.86Å; Y672-W690 HydrophobicContact CE2-CH2 4.04Å; Y672-W690 AromaticContact CE2-CZ2 3.22Å; Y672-W690 HydrophobicContact CE2-CZ2 3.22Å; Y672-W690 HydrophobicContact CG-CZ2 4.41Å; Y672-W690 AromaticContact CZ-CE2 3.85Å; Y672-W690 AromaticContact CZ-CZ2 3.72Å; Y672-W690 AromaticContact CZ-NE1 3.59Å; Y672-W690 PolarHBondContact OH-NE1 3.15Å
673	E	64.4	Low	61	Low	87 Å²	87	66.3 Å²	66.3	41%	0.407	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-29	172.5	-66.8	-161.3	140.6	0	0	112.8	D670 S675	D670-E673 HydrophobicContact CB-CG 4.04Å; D670-E673 PolarHBondContact O-N 2.81Å; E673-S675 VanDerWaalsContact C-N 3.33Å
674	L	68.1	Low	59.6	Low	3 Å²	3	73.3 Å²	73.3	2%	0.016	36%	0.364	C	S	.	.	H	α-helix	trans	-76	-22.5	177.6	-58.3	178.4	0	0	0	112.6	L431 Y435 G444 V669 V671 Y672 S676	L431-L674 HydrophobicContact CB-CB 4.22Å; L431-L674 HydrophobicContact CB-CD1 4.42Å; Y435-L674 HydrophobicContact CD2-CD2 3.9Å; Y435-L674 HydrophobicContact CG-CD1 4.24Å; Y435-L674 HydrophobicContact CG-CD2 3.98Å; G444-L674 VanDerWaalsContact CA-O 3.27Å; G444-L674 WeakPolarHBondContact CA-O 3.45Å; V669-L674 HydrophobicContact CG1-CD1 3.69Å; V669-L674 HydrophobicContact CG1-CG 4.33Å; V671-L674 WeakPolarHBondContact O-CB 3.29Å; V671-L674 PolarHBondContact O-N 2.59Å; Y672-L674 PolarHBondContact O-N 3.12Å; L674-S676 PolarHBondContact O-N 3.35Å
675	S	60.7	Low	58.2	Low	6 Å²	6	76.2 Å²	76.2	4%	0.042	38%	0.376	C	S	.	.	S	Bend	trans	-80	112.6	168	83.1	0	0	0	0	107.2	Y672 E673 V677 A678	Y672-S675 PolarHBondContact O-N 3.12Å; Y672-S675 VanDerWaalsContact O-O 3.06Å; Y672-S675 PolarHBondContact O-OG 2.72Å; E673-S675 VanDerWaalsContact C-N 3.33Å; S675-V677 PolarHBondContact O-N 3.31Å; S675-A678 PolarHBondContact O-N 3.34Å
676	S	55.3	Low	56.9	Low	28 Å²	28	78.3 Å²	78.3	20%	0.196	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-10.9	178.1	48.1	0	0	0	0	113.8	H411 L674 A678	H411-S676 VanDerWaalsContact C-OG 3.32Å; H411-S676 PolarHBondContact O-OG 2.89Å; L674-S676 PolarHBondContact O-N 3.35Å; S676-A678 VanDerWaalsContact C-N 3.32Å
677	V	48.1	Very low	55.8	Low	29 Å²	29	82.5 Å²	82.5	18%	0.176	41%	0.408	C	S	.	.	H	α-helix	trans	-61.8	-34.5	173.2	-174.3	0	0	0	0	112	D412 I414 S675 R679	D412-V677 HydrophobicContact CB-CG2 4.31Å; D412-V677 WeakPolarHBondContact OD1-CG2 3.45Å; I414-V677 HydrophobicContact CD1-CG2 4.43Å; S675-V677 PolarHBondContact O-N 3.31Å; V677-R679 PolarHBondContact O-N 3.48Å
678	A	45.1	Very low	55.2	Low	35 Å²	35	81.5 Å²	81.5	29%	0.289	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-15.4	-176.2	0	0	0	0	0	114.7	Y672 S675 S676	Y672-A678 WeakPolarHBondContact O-CB 3.33Å; S675-A678 PolarHBondContact O-N 3.34Å; S676-A678 VanDerWaalsContact C-N 3.32Å
679	R	45.5	Very low	55.2	Low	149 Å²	149	80.5 Å²	80.5	56%	0.562	40%	0.402	S	S	*	.	H	α-helix	trans	-114.6	-17	-175.7	-68.4	-173.2	-175.1	-173.8	1.3	116	V677	V677-R679 PolarHBondContact O-N 3.48Å
680	Q	43	Very low	54.6	Low	174 Å²	174	83.5 Å²	83.5	81%	0.813	41%	0.411	S	S	*	.	H	α-helix	trans	-107.1	-20.5	-172.6	-74.3	-172.8	-29.5	0	0	114.1
681	E	43.8	Very low	54.3	Low	119 Å²	119	84.6 Å²	84.6	56%	0.556	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.1	4	-175.6	-68.9	-170.8	173.6	0	0	116.1	R415 T683	R415-E681 IonicContact CZ-OE2 2.95Å; R415-E681 IonicContact NH1-OE2 2.74Å; R415-E681 PolarHBondContact NH1-OE2 3.14Å; R415-E681 IonicContact NH2-OE2 3Å; R415-E681 PolarHBondContact NH2-OE2 2.86Å; E681-T683 PolarHBondContact O-N 2.84Å
682	V	44.6	Very low	53.9	Low	49 Å²	49	86.6 Å²	86.6	30%	0.297	43%	0.428	S	S	.	.			trans	-81.9	102.2	173.2	-172	0	0	0	0	107.8	E686 M687	V682-E686 HydrophobicContact CG1-CB 3.78Å; V682-M687 HydrophobicContact CG1-CB 3.98Å; V682-M687 HydrophobicContact CG1-CG 3.85Å
683	T	53.3	Low	53.9	Low	82 Å²	82	92 Å²	92	50%	0.503	45%	0.448	S	S	.	.			trans	-56.2	143.2	165	43.9	0	0	0	0	109	E681 D685 E686 M687	E681-T683 PolarHBondContact O-N 2.84Å; T683-D685 PolarHBondContact O-N 3.33Å; T683-E686 PolarHBondContact O-N 3.08Å; T683-M687 PolarHBondContact O-N 3.07Å
684	E	51.4	Low	53.5	Low	164 Å²	164	90.2 Å²	90.2	77%	0.766	44%	0.44	S	S	*	.	H	α-helix	trans	-47.8	-33.8	179.6	-70.3	-177.2	158.8	0	0	112.3	E686 M687 V688	E684-E686 PolarHBondContact O-N 3.32Å; E684-M687 WeakPolarHBondContact O-CB 3.29Å; E684-M687 PolarHBondContact O-N 3.07Å; E684-V688 WeakPolarHBondContact O-CG2 3.49Å; E684-V688 PolarHBondContact O-N 3.2Å
685	D	52.8	Low	53.3	Low	118 Å²	118	92.6 Å²	92.6	63%	0.631	46%	0.46	S	S	*	.	H	α-helix	trans	-62.1	-34.4	175.9	-71.3	-19.6	0	0	0	115.2	T683 K689	T683-D685 PolarHBondContact O-N 3.33Å; D685-K689 WeakPolarHBondContact O-CB 3.25Å; D685-K689 VanDerWaalsContact O-CG 3.28Å; D685-K689 WeakPolarHBondContact O-CG 3.32Å; D685-K689 PolarHBondContact O-N 3.39Å
686	E	52.2	Low	53.5	Low	106 Å²	106	94.6 Å²	94.6	50%	0.495	48%	0.477	S	S	.	.	H	α-helix	trans	-77.9	-34.2	178.1	-75.5	-170.6	156.6	0	0	111.5	V682 T683 E684 K689 W690	V682-E686 HydrophobicContact CG1-CB 3.78Å; T683-E686 PolarHBondContact O-N 3.08Å; E684-E686 PolarHBondContact O-N 3.32Å; E686-K689 PolarHBondContact O-N 2.9Å; E686-W690 WeakPolarHBondContact O-CB 3.47Å; E686-W690 PolarHBondContact O-N 3.07Å
687	M	48.6	Very low	53.9	Low	93 Å²	93	98.9 Å²	98.9	46%	0.458	49%	0.492	S	S	.	.	H	α-helix	trans	-62.6	-47.3	172	-119.7	171.6	64.3	0	0	110.8	V682 T683 E684 K689 W690 E691	V682-M687 HydrophobicContact CG1-CB 3.98Å; V682-M687 HydrophobicContact CG1-CG 3.85Å; T683-M687 PolarHBondContact O-N 3.07Å; E684-M687 WeakPolarHBondContact O-CB 3.29Å; E684-M687 PolarHBondContact O-N 3.07Å; M687-K689 PolarHBondContact O-N 3.11Å; M687-W690 PolarHBondContact O-N 3.25Å; M687-E691 WeakPolarHBondContact O-CG 3.44Å; M687-E691 PolarHBondContact O-N 2.91Å
688	V	60.1	Low	54.8	Low	89 Å²	89	105.1 Å²	105.1	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-40.6	176.9	173.3	0	0	0	0	111.7	E684 W690 E691 S692	E684-V688 WeakPolarHBondContact O-CG2 3.49Å; E684-V688 PolarHBondContact O-N 3.2Å; V688-W690 VanDerWaalsContact C-N 3.3Å; V688-W690 PolarHBondContact O-N 2.89Å; V688-E691 PolarHBondContact O-N 3.36Å; V688-S692 WeakPolarHBondContact O-CB 3.43Å; V688-S692 PolarHBondContact O-N 2.95Å; V688-S692 PolarHBondContact O-OG 3.13Å
689	K	60.8	Low	55.3	Low	138 Å²	138	110.4 Å²	110.4	60%	0.6	53%	0.531	S	S	*	.	H	α-helix	trans	-63.1	-36.8	174.2	-81	173.8	-175.8	167.9	0	112.2	D685 E686 M687 S692 R693	D685-K689 WeakPolarHBondContact O-CB 3.25Å; D685-K689 VanDerWaalsContact O-CG 3.28Å; D685-K689 WeakPolarHBondContact O-CG 3.32Å; D685-K689 PolarHBondContact O-N 3.39Å; E686-K689 PolarHBondContact O-N 2.9Å; M687-K689 PolarHBondContact O-N 3.11Å; K689-S692 WeakPolarHBondContact CA-OG 3.33Å; K689-S692 PolarHBondContact O-OG 3.4Å; K689-R693 WeakPolarHBondContact O-CG 3.44Å; K689-R693 PolarHBondContact O-N 3.04Å; K689-R693 VanDerWaalsContact O-N 3.14Å
690	W	53	Low	55.8	Low	90 Å²	90	109.9 Å²	109.9	34%	0.341	54%	0.535	S	S	.	.	H	α-helix	trans	-72.4	-46.7	177	179.6	88.3	0	0	0	112.1	Y672 E686 M687 V688 S692 R693 E694	Y672-W690 AromaticContact CD2-CH2 3.99Å; Y672-W690 HydrophobicContact CD2-CH2 3.99Å; Y672-W690 AromaticContact CD2-CZ2 3.61Å; Y672-W690 HydrophobicContact CD2-CZ2 3.61Å; Y672-W690 AromaticContact CE2-CE2 3.86Å; Y672-W690 HydrophobicContact CE2-CH2 4.04Å; Y672-W690 AromaticContact CE2-CZ2 3.22Å; Y672-W690 HydrophobicContact CE2-CZ2 3.22Å; Y672-W690 HydrophobicContact CG-CZ2 4.41Å; Y672-W690 AromaticContact CZ-CE2 3.85Å; Y672-W690 AromaticContact CZ-CZ2 3.72Å; Y672-W690 AromaticContact CZ-NE1 3.59Å; Y672-W690 PolarHBondContact OH-NE1 3.15Å; E686-W690 WeakPolarHBondContact O-CB 3.47Å; E686-W690 PolarHBondContact O-N 3.07Å; M687-W690 PolarHBondContact O-N 3.25Å; V688-W690 VanDerWaalsContact C-N 3.3Å; V688-W690 PolarHBondContact O-N 2.89Å; W690-S692 PolarHBondContact O-N 3.14Å; W690-R693 CarbonylContact O-C 3.56Å; W690-R693 WeakPolarHBondContact O-CA 3.49Å; W690-R693 WeakPolarHBondContact O-CB 3.49Å; W690-R693 PolarHBondContact O-N 3.43Å; W690-E694 HydrophobicContact CD2-CG 4.29Å; W690-E694 HydrophobicContact CH2-CG 3.82Å; W690-E694 HydrophobicContact CZ2-CG 3.45Å; W690-E694 VanDerWaalsContact CZ2-CG 3.45Å; W690-E694 HydrophobicContact CZ3-CG 4.36Å; W690-E694 PolarHBondContact O-N 2.83Å
691	E	58	Low	56.4	Low	107 Å²	107	107.2 Å²	107.2	50%	0.5	52%	0.523	S	S	.	.	H	α-helix	trans	-57.3	-40.5	175.6	-75.7	-177.3	162.1	0	0	111.4	M687 V688 R693 E694 A695	M687-E691 WeakPolarHBondContact O-CG 3.44Å; M687-E691 PolarHBondContact O-N 2.91Å; V688-E691 PolarHBondContact O-N 3.36Å; E691-R693 PolarHBondContact O-N 2.95Å; E691-E694 PolarHBondContact O-N 3.43Å; E691-A695 WeakPolarHBondContact O-CB 3.16Å; E691-A695 PolarHBondContact O-N 2.87Å
692	S	58.5	Low	57.1	Low	69 Å²	69	104 Å²	104	48%	0.483	52%	0.516	S	S	.	.	H	α-helix	trans	-65.9	-35.6	174.8	71.8	0	0	0	0	113.1	V688 K689 W690 A696	V688-S692 WeakPolarHBondContact O-CB 3.43Å; V688-S692 PolarHBondContact O-N 2.95Å; V688-S692 PolarHBondContact O-OG 3.13Å; K689-S692 WeakPolarHBondContact CA-OG 3.33Å; K689-S692 PolarHBondContact O-OG 3.4Å; W690-S692 PolarHBondContact O-N 3.14Å; S692-A696 VanDerWaalsContact O-CB 3.32Å; S692-A696 WeakPolarHBondContact O-CB 3.12Å; S692-A696 PolarHBondContact O-N 3.22Å
693	R	64	Low	57.6	Low	196 Å²	196	104.9 Å²	104.9	74%	0.74	53%	0.525	S	S	*	.	H	α-helix	trans	-71.5	-42.7	175.5	-81	178	170.6	-178	-1.5	112.2	K689 W690 E691 A696 K697	K689-R693 WeakPolarHBondContact O-CG 3.44Å; K689-R693 PolarHBondContact O-N 3.04Å; K689-R693 VanDerWaalsContact O-N 3.14Å; W690-R693 CarbonylContact O-C 3.56Å; W690-R693 WeakPolarHBondContact O-CA 3.49Å; W690-R693 WeakPolarHBondContact O-CB 3.49Å; W690-R693 PolarHBondContact O-N 3.43Å; E691-R693 PolarHBondContact O-N 2.95Å; R693-A696 PolarHBondContact O-N 3.36Å; R693-K697 WeakPolarHBondContact O-CB 3.4Å; R693-K697 PolarHBondContact O-N 3.1Å
694	E	56.8	Low	57.7	Low	51 Å²	51	103.4 Å²	103.4	24%	0.238	52%	0.521	C	S	.	.	H	α-helix	trans	-64.6	-44.4	174.7	-101	-74.4	120.7	0	0	111.3	W690 E691 A696 K697 R698	W690-E694 HydrophobicContact CD2-CG 4.29Å; W690-E694 HydrophobicContact CH2-CG 3.82Å; W690-E694 HydrophobicContact CZ2-CG 3.45Å; W690-E694 VanDerWaalsContact CZ2-CG 3.45Å; W690-E694 HydrophobicContact CZ3-CG 4.36Å; W690-E694 PolarHBondContact O-N 2.83Å; E691-E694 PolarHBondContact O-N 3.43Å; E694-A696 VanDerWaalsContact C-N 3.3Å; E694-A696 PolarHBondContact O-N 3.26Å; E694-K697 PolarHBondContact O-N 2.91Å; E694-K697 VanDerWaalsContact O-N 3.13Å; E694-R698 WeakPolarHBondContact O-CB 3.49Å; E694-R698 WeakPolarHBondContact O-CG 3.47Å; E694-R698 PolarHBondContact O-N 2.94Å; E694-R698 IonicContact OE2-CZ 2.99Å; E694-R698 IonicContact OE2-NE 3.92Å; E694-R698 PolarHBondContact OE2-NE 3.45Å; E694-R698 IonicContact OE2-NH2 3.78Å; E694-R698 PolarHBondContact OE2-NH2 2.98Å
695	A	64.8	Low	58	Low	52 Å²	52	101 Å²	101	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-60.4	-40.8	175.4	0	0	0	0	0	111.6	E691 Q699	E691-A695 WeakPolarHBondContact O-CB 3.16Å; E691-A695 PolarHBondContact O-N 2.87Å; A695-Q699 WeakPolarHBondContact O-CB 3.45Å; A695-Q699 WeakPolarHBondContact O-CG 3.4Å; A695-Q699 PolarHBondContact O-N 3.14Å
696	A	64.5	Low	58.1	Low	49 Å²	49	99.9 Å²	99.9	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-37.6	174.6	0	0	0	0	0	112.5	S692 R693 E694 Q699 Q700	S692-A696 VanDerWaalsContact O-CB 3.32Å; S692-A696 WeakPolarHBondContact O-CB 3.12Å; S692-A696 PolarHBondContact O-N 3.22Å; R693-A696 PolarHBondContact O-N 3.36Å; E694-A696 VanDerWaalsContact C-N 3.3Å; E694-A696 PolarHBondContact O-N 3.26Å; A696-Q699 PolarHBondContact O-N 3.03Å; A696-Q700 PolarHBondContact O-N 3.41Å
697	K	63.9	Low	58.4	Low	118 Å²	118	98.8 Å²	98.8	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-70.3	-43.8	178.3	-142.3	178.4	-176.1	-172.1	0	111.9	R693 E694 Q699 Q700 E701	R693-K697 WeakPolarHBondContact O-CB 3.4Å; R693-K697 PolarHBondContact O-N 3.1Å; E694-K697 PolarHBondContact O-N 2.91Å; E694-K697 VanDerWaalsContact O-N 3.13Å; K697-Q699 VanDerWaalsContact C-N 3.31Å; K697-Q699 PolarHBondContact O-N 3.22Å; K697-Q700 WeakPolarHBondContact O-CB 3.3Å; K697-Q700 PolarHBondContact O-N 2.91Å; K697-Q700 VanDerWaalsContact O-N 3.14Å; K697-E701 WeakPolarHBondContact O-CG 3.39Å; K697-E701 PolarHBondContact O-N 2.89Å
698	R	65.6	Low	58.6	Low	159 Å²	159	99.9 Å²	99.9	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-62.5	-36.2	172.6	-70.4	179.8	-166.3	-172	3.5	112.1	E694 A702	E694-R698 WeakPolarHBondContact O-CB 3.49Å; E694-R698 WeakPolarHBondContact O-CG 3.47Å; E694-R698 PolarHBondContact O-N 2.94Å; E694-R698 IonicContact OE2-CZ 2.99Å; E694-R698 IonicContact OE2-NE 3.92Å; E694-R698 PolarHBondContact OE2-NE 3.45Å; E694-R698 IonicContact OE2-NH2 3.78Å; E694-R698 PolarHBondContact OE2-NH2 2.98Å; R698-A702 WeakPolarHBondContact O-CB 3.41Å; R698-A702 PolarHBondContact O-N 3.02Å
699	Q	56	Low	58.5	Low	146 Å²	146	101.4 Å²	101.4	68%	0.682	51%	0.509	S	S	*	.	H	α-helix	trans	-67.2	-38.5	172.3	-84.7	-179.5	-15.4	0	0	112.6	A695 A696 K697 S703	A695-Q699 WeakPolarHBondContact O-CB 3.45Å; A695-Q699 WeakPolarHBondContact O-CG 3.4Å; A695-Q699 PolarHBondContact O-N 3.14Å; A696-Q699 PolarHBondContact O-N 3.03Å; K697-Q699 VanDerWaalsContact C-N 3.31Å; K697-Q699 PolarHBondContact O-N 3.22Å; Q699-S703 WeakPolarHBondContact O-CB 3.39Å; Q699-S703 PolarHBondContact O-N 2.91Å
700	Q	55.9	Low	58.2	Low	139 Å²	139	102 Å²	102	65%	0.65	51%	0.512	S	S	*	.	H	α-helix	trans	-66.1	-43.9	174.3	-87.3	-177	-16.8	0	0	112.4	A696 K697 S703 A704	A696-Q700 PolarHBondContact O-N 3.41Å; K697-Q700 WeakPolarHBondContact O-CB 3.3Å; K697-Q700 PolarHBondContact O-N 2.91Å; K697-Q700 VanDerWaalsContact O-N 3.14Å; Q700-S703 PolarHBondContact O-N 3.35Å; Q700-S703 PolarHBondContact O-OG 2.91Å; Q700-S703 VanDerWaalsContact O-OG 3.14Å; Q700-A704 WeakPolarHBondContact O-CB 3.47Å; Q700-A704 PolarHBondContact O-N 3.43Å
701	E	55.4	Low	58	Low	117 Å²	117	102.7 Å²	102.7	55%	0.547	52%	0.521	S	S	.	.	H	α-helix	trans	-66.4	-42.5	177.4	-72.7	174.1	177.6	0	0	111.4	K697 S703 A704 E705	K697-E701 WeakPolarHBondContact O-CG 3.39Å; K697-E701 PolarHBondContact O-N 2.89Å; E701-S703 PolarHBondContact O-N 3.21Å; E701-A704 PolarHBondContact O-N 3.48Å; E701-E705 PolarHBondContact O-N 2.68Å
702	A	59	Low	57.7	Low	51 Å²	51	103.6 Å²	103.6	42%	0.421	53%	0.525	S	S	.	.	H	α-helix	trans	-63.9	-39	173.4	0	0	0	0	0	112.3	R698 A704 E705 D706	R698-A702 WeakPolarHBondContact O-CB 3.41Å; R698-A702 PolarHBondContact O-N 3.02Å; A702-A704 VanDerWaalsContact C-N 3.33Å; A702-E705 PolarHBondContact O-N 2.89Å; A702-D706 WeakPolarHBondContact O-CB 3.45Å; A702-D706 PolarHBondContact O-N 2.89Å
703	S	54.3	Low	57.5	Low	68 Å²	68	108 Å²	108	48%	0.476	54%	0.536	S	S	.	.	H	α-helix	trans	-68.2	-34.6	174.8	95.4	0	0	0	0	111.9	Q699 Q700 E701 D706 V707	Q699-S703 WeakPolarHBondContact O-CB 3.39Å; Q699-S703 PolarHBondContact O-N 2.91Å; Q700-S703 PolarHBondContact O-N 3.35Å; Q700-S703 PolarHBondContact O-OG 2.91Å; Q700-S703 VanDerWaalsContact O-OG 3.14Å; E701-S703 PolarHBondContact O-N 3.21Å; S703-D706 PolarHBondContact O-N 3.3Å; S703-V707 WeakPolarHBondContact O-CB 3.19Å; S703-V707 WeakPolarHBondContact O-CG2 3.42Å; S703-V707 PolarHBondContact O-N 2.95Å
704	A	55.8	Low	56.7	Low	51 Å²	51	108.5 Å²	108.5	42%	0.421	54%	0.538	S	S	.	.	H	α-helix	trans	-68.5	-39.5	176.4	0	0	0	0	0	111.2	Q700 E701 A702 V707 M708	Q700-A704 WeakPolarHBondContact O-CB 3.47Å; Q700-A704 PolarHBondContact O-N 3.43Å; E701-A704 PolarHBondContact O-N 3.48Å; A702-A704 VanDerWaalsContact C-N 3.33Å; A704-V707 PolarHBondContact O-N 2.91Å; A704-M708 WeakPolarHBondContact O-CB 3.4Å; A704-M708 PolarHBondContact O-N 2.9Å
705	E	58.1	Low	56.4	Low	114 Å²	114	111.8 Å²	111.8	53%	0.533	56%	0.557	S	S	.	*	H	α-helix	trans	-65.3	-40	171.2	-80.8	-166.4	161.2	0	0	112.7	E701 A702 V707 M708 K709	E701-E705 PolarHBondContact O-N 2.68Å; A702-E705 PolarHBondContact O-N 2.89Å; E705-V707 VanDerWaalsContact C-N 3.34Å; E705-M708 PolarHBondContact O-N 3.4Å; E705-K709 WeakPolarHBondContact O-CB 3.38Å; E705-K709 WeakPolarHBondContact O-CG 3.35Å; E705-K709 PolarHBondContact O-N 2.95Å
706	D	55.7	Low	55.9	Low	95 Å²	95	113.5 Å²	113.5	51%	0.508	56%	0.559	S	S	.	*	H	α-helix	trans	-68.3	-34	176.4	-107.1	2.4	0	0	0	112.3	A702 S703 K710	A702-D706 WeakPolarHBondContact O-CB 3.45Å; A702-D706 PolarHBondContact O-N 2.89Å; S703-D706 PolarHBondContact O-N 3.3Å; D706-K710 WeakPolarHBondContact O-CB 3.49Å; D706-K710 VanDerWaalsContact O-CG 3.31Å; D706-K710 WeakPolarHBondContact O-CG 3.4Å; D706-K710 PolarHBondContact O-N 3.04Å
707	V	56.8	Low	55.3	Low	82 Å²	82	119.6 Å²	119.6	50%	0.497	58%	0.579	S	S	.	*	H	α-helix	trans	-68.9	-41.2	171.8	170.4	0	0	0	0	110.6	S703 A704 E705 K710 L711	S703-V707 WeakPolarHBondContact O-CB 3.19Å; S703-V707 WeakPolarHBondContact O-CG2 3.42Å; S703-V707 PolarHBondContact O-N 2.95Å; A704-V707 PolarHBondContact O-N 2.91Å; E705-V707 VanDerWaalsContact C-N 3.34Å; V707-K710 PolarHBondContact O-N 3.37Å; V707-L711 HydrophobicContact CG1-CD1 4.05Å; V707-L711 PolarHBondContact O-N 3.44Å
708	M	52.7	Low	55	Low	117 Å²	117	117.5 Å²	117.5	58%	0.576	58%	0.584	S	S	*	*	H	α-helix	trans	-63.9	-45.8	173.6	-99.4	-162.3	-72.1	0	0	112.2	A704 E705 K710 L711 E712	A704-M708 WeakPolarHBondContact O-CB 3.4Å; A704-M708 PolarHBondContact O-N 2.9Å; E705-M708 PolarHBondContact O-N 3.4Å; M708-K710 VanDerWaalsContact C-N 3.3Å; M708-K710 PolarHBondContact O-N 2.81Å; M708-L711 CarbonylContact O-C 3.47Å; M708-L711 WeakPolarHBondContact O-CA 3.4Å; M708-L711 WeakPolarHBondContact O-CB 3.45Å; M708-L711 PolarHBondContact O-N 3.37Å; M708-E712 PolarHBondContact O-N 2.98Å
709	K	59.4	Low	54.6	Low	120 Å²	120	113.1 Å²	113.1	52%	0.522	58%	0.575	S	S	.	*	H	α-helix	trans	-61.8	-36.6	175.3	-78.9	173.1	-179.8	160.4	0	112	E705 K713	E705-K709 WeakPolarHBondContact O-CB 3.38Å; E705-K709 WeakPolarHBondContact O-CG 3.35Å; E705-K709 PolarHBondContact O-N 2.95Å; K709-K713 WeakPolarHBondContact O-CB 3.31Å; K709-K713 PolarHBondContact O-N 2.79Å
710	K	53.3	Low	54.6	Low	152 Å²	152	109.4 Å²	109.4	66%	0.661	56%	0.562	S	S	*	*	H	α-helix	trans	-68.6	-32.6	172.5	-80.3	174.3	-179.6	168.6	0	112.8	D706 V707 M708 R714	D706-K710 WeakPolarHBondContact O-CB 3.49Å; D706-K710 VanDerWaalsContact O-CG 3.31Å; D706-K710 WeakPolarHBondContact O-CG 3.4Å; D706-K710 PolarHBondContact O-N 3.04Å; V707-K710 PolarHBondContact O-N 3.37Å; M708-K710 VanDerWaalsContact C-N 3.3Å; M708-K710 PolarHBondContact O-N 2.81Å; K710-R714 PolarHBondContact O-N 3.25Å
711	L	50.5	Low	54.9	Low	103 Å²	103	106.6 Å²	106.6	54%	0.539	56%	0.557	S	S	.	*	H	α-helix	trans	-71.7	-40.7	173.2	-108.2	124.4	0	0	0	112.1	V707 M708 R714 N715	V707-L711 HydrophobicContact CG1-CD1 4.05Å; V707-L711 PolarHBondContact O-N 3.44Å; M708-L711 CarbonylContact O-C 3.47Å; M708-L711 WeakPolarHBondContact O-CA 3.4Å; M708-L711 WeakPolarHBondContact O-CB 3.45Å; M708-L711 PolarHBondContact O-N 3.37Å; L711-R714 WeakPolarHBondContact O-CB 3.46Å; L711-R714 PolarHBondContact O-N 3.27Å; L711-N715 PolarHBondContact O-N 3.33Å
712	E	51.5	Low	55.6	Low	127 Å²	127	106.2 Å²	106.2	59%	0.593	56%	0.556	S	S	*	*	H	α-helix	trans	-65.5	-41.6	174.2	-74.2	-179	157.8	0	0	111.6	M708 R714 N715 N716	M708-E712 PolarHBondContact O-N 2.98Å; E712-R714 PolarHBondContact O-N 3.31Å; E712-N715 CarbonylContact O-C 3.4Å; E712-N715 WeakPolarHBondContact O-CA 3.43Å; E712-N715 PolarHBondContact O-N 2.92Å; E712-N716 PolarHBondContact O-N 3.24Å
713	K	52.6	Low	55.8	Low	160 Å²	160	106.6 Å²	106.6	70%	0.696	56%	0.559	S	S	*	*	H	α-helix	trans	-62.6	-27.6	175.1	-132.5	176.3	-174.2	177.6	0	113.1	K709	K709-K713 WeakPolarHBondContact O-CB 3.31Å; K709-K713 PolarHBondContact O-N 2.79Å
714	R	48.5	Very low	56.4	Low	207 Å²	207	112 Å²	112	78%	0.781	57%	0.569	S	S	*	*	H	α-helix	trans	-75.3	-23.8	172	-90.1	178.9	163.4	177.5	-3.9	112.9	K710 L711 E712	K710-R714 PolarHBondContact O-N 3.25Å; L711-R714 WeakPolarHBondContact O-CB 3.46Å; L711-R714 PolarHBondContact O-N 3.27Å; E712-R714 PolarHBondContact O-N 3.31Å
715	N	50.4	Low	57.2	Low	120 Å²	120	112.1 Å²	112.1	64%	0.642	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	20.8	179.8	-79.5	-10.6	0	0	0	113.6	L711 E712	L711-N715 PolarHBondContact O-N 3.33Å; E712-N715 CarbonylContact O-C 3.4Å; E712-N715 WeakPolarHBondContact O-CA 3.43Å; E712-N715 PolarHBondContact O-N 2.92Å
716	N	53.8	Low	58.1	Low	89 Å²	89	113.8 Å²	113.8	48%	0.476	57%	0.571	S	S	.	*			trans	-64.7	138.3	171.7	-84.6	-11.6	0	0	0	111	E712 A718 T719 V720	E712-N716 PolarHBondContact O-N 3.24Å; N716-A718 PolarHBondContact O-N 3.19Å; N716-T719 PolarHBondContact O-N 3.04Å; N716-T719 PolarHBondContact O-OG1 3.39Å; N716-V720 PolarHBondContact O-N 3.06Å
717	E	52.8	Low	59	Low	176 Å²	176	116.7 Å²	116.7	82%	0.822	58%	0.576	S	S	*	*	H	α-helix	trans	-54.8	-29.9	-178.6	-73.8	-176.6	145.5	0	0	113.2	S721	E717-S721 WeakPolarHBondContact O-CB 3.21Å; E717-S721 PolarHBondContact O-N 3.06Å
718	A	57.5	Low	59.8	Low	74 Å²	74	117.7 Å²	117.7	61%	0.612	58%	0.578	S	S	*	*	H	α-helix	trans	-64.9	-45	176.3	0	0	0	0	0	113	N716 S721 E722	N716-A718 PolarHBondContact O-N 3.19Å; A718-S721 PolarHBondContact O-N 2.98Å; A718-E722 PolarHBondContact O-N 2.86Å
719	T	56.6	Low	60.9	Low	67 Å²	67	118.4 Å²	118.4	41%	0.411	58%	0.58	S	S	.	*	H	α-helix	trans	-71.7	-33.2	178	30	0	0	0	0	112.1	N716 A723	N716-T719 PolarHBondContact O-N 3.04Å; N716-T719 PolarHBondContact O-OG1 3.39Å; T719-A723 WeakPolarHBondContact O-CB 3.46Å; T719-A723 PolarHBondContact O-N 2.87Å
720	V	56.9	Low	61.7	Low	69 Å²	69	121.1 Å²	121.1	42%	0.418	59%	0.587	S	S	.	*	H	α-helix	trans	-69.1	-37.9	173.5	178	0	0	0	0	111.3	N716 A723 R724	N716-V720 PolarHBondContact O-N 3.06Å; V720-A723 PolarHBondContact O-N 2.9Å; V720-R724 PolarHBondContact O-N 3.03Å
721	S	60.7	Low	62.6	Low	79 Å²	79	119 Å²	119	55%	0.552	58%	0.577	S	S	*	*	H	α-helix	trans	-67	-44.3	175.3	-170.2	0	0	0	0	112.2	E717 A718 A723 R724 A725	E717-S721 WeakPolarHBondContact O-CB 3.21Å; E717-S721 PolarHBondContact O-N 3.06Å; A718-S721 PolarHBondContact O-N 2.98Å; S721-A723 PolarHBondContact O-N 3.25Å; S721-R724 PolarHBondContact O-N 3.44Å; S721-A725 PolarHBondContact O-N 3.49Å
722	E	69.7	Low	63.6	Low	110 Å²	110	120 Å²	120	51%	0.514	58%	0.58	S	S	.	*	H	α-helix	trans	-62	-40.2	174	-84.4	-164.8	147.7	0	0	112.7	A718 A725 R726	A718-E722 PolarHBondContact O-N 2.86Å; E722-A725 PolarHBondContact O-N 2.99Å; E722-R726 WeakPolarHBondContact O-CG 3.39Å; E722-R726 PolarHBondContact O-N 3.31Å; E722-R726 IonicContact OE2-NH2 3.67Å
723	A	64.8	Low	64.6	Low	59 Å²	59	119.9 Å²	119.9	49%	0.488	58%	0.579	S	S	.	*	H	α-helix	trans	-65.2	-39.4	176.4	0	0	0	0	0	111.9	T719 V720 S721 R726 Y727	T719-A723 WeakPolarHBondContact O-CB 3.46Å; T719-A723 PolarHBondContact O-N 2.87Å; V720-A723 PolarHBondContact O-N 2.9Å; S721-A723 PolarHBondContact O-N 3.25Å; A723-R726 PolarHBondContact O-N 2.97Å; A723-Y727 WeakPolarHBondContact O-CB 3.48Å; A723-Y727 PolarHBondContact O-N 3.3Å
724	R	66	Low	65.4	Low	182 Å²	182	121.5 Å²	121.5	69%	0.687	58%	0.581	S	S	*	*	H	α-helix	trans	-63.2	-42.2	172	-95.3	-178.4	173.1	174.6	-0.5	112.2	V720 S721 Y727 L728	V720-R724 PolarHBondContact O-N 3.03Å; S721-R724 PolarHBondContact O-N 3.44Å; R724-Y727 PolarHBondContact O-N 3.03Å; R724-L728 WeakPolarHBondContact O-CG 3.46Å; R724-L728 PolarHBondContact O-N 2.98Å
725	A	71.9	Confident	66.3	Low	53 Å²	53	117.4 Å²	117.4	44%	0.438	57%	0.57	S	S	.	*	H	α-helix	trans	-62.4	-44.7	177.4	0	0	0	0	0	111.9	S721 E722 Y727 L728 Q729	S721-A725 PolarHBondContact O-N 3.49Å; E722-A725 PolarHBondContact O-N 2.99Å; A725-Y727 VanDerWaalsContact C-N 3.34Å; A725-Y727 PolarHBondContact O-N 3.09Å; A725-L728 PolarHBondContact O-N 2.94Å; A725-Q729 PolarHBondContact O-N 3.31Å
726	R	77.6	Confident	66.9	Low	149 Å²	149	118 Å²	118	56%	0.562	57%	0.569	S	S	*	*	H	α-helix	trans	-64.4	-36.3	175.6	-70.6	-179	-162	162.5	11	112.7	E722 A723 R730	E722-R726 WeakPolarHBondContact O-CG 3.39Å; E722-R726 PolarHBondContact O-N 3.31Å; E722-R726 IonicContact OE2-NH2 3.67Å; A723-R726 PolarHBondContact O-N 2.97Å; R726-R730 WeakPolarHBondContact O-CG 3.34Å; R726-R730 PolarHBondContact O-N 3.44Å; R726-R730 VanDerWaalsContact O-N 3.09Å
727	Y	74.9	Confident	67.3	Low	156 Å²	156	119.6 Å²	119.6	61%	0.612	58%	0.578	S	S	*	*	H	α-helix	trans	-66	-44	175.2	177.2	-97.1	0	0	0	111.9	A723 R724 A725 R730 K731	A723-Y727 WeakPolarHBondContact O-CB 3.48Å; A723-Y727 PolarHBondContact O-N 3.3Å; R724-Y727 PolarHBondContact O-N 3.03Å; A725-Y727 VanDerWaalsContact C-N 3.34Å; A725-Y727 PolarHBondContact O-N 3.09Å; Y727-R730 PolarHBondContact O-N 3.49Å; Y727-K731 HydrophobicContact CE1-CD 4.42Å; Y727-K731 WeakPolarHBondContact O-CB 3.43Å; Y727-K731 PolarHBondContact O-N 3.4Å
728	L	72.9	Confident	67.5	Low	102 Å²	102	120 Å²	120	53%	0.534	58%	0.577	S	S	.	*	H	α-helix	trans	-64.8	-41.4	177.7	-76.2	164.9	0	0	0	112.1	R724 A725 K731 Q732	R724-L728 WeakPolarHBondContact O-CG 3.46Å; R724-L728 PolarHBondContact O-N 2.98Å; A725-L728 PolarHBondContact O-N 2.94Å; L728-K731 PolarHBondContact O-N 3.23Å; L728-Q732 PolarHBondContact O-N 3.32Å
729	Q	75.8	Confident	67.2	Low	132 Å²	132	120.9 Å²	120.9	62%	0.617	58%	0.584	S	S	*	*	H	α-helix	trans	-60.2	-45	172.8	-92.5	-177.6	-21.5	0	0	112.4	A725 K731 Q732 Q733	A725-Q729 PolarHBondContact O-N 3.31Å; Q729-K731 VanDerWaalsContact C-N 3.28Å; Q729-K731 PolarHBondContact O-N 2.96Å; Q729-Q732 PolarHBondContact O-N 2.92Å; Q729-Q733 PolarHBondContact O-N 3.28Å
730	R	76.6	Confident	66.7	Low	178 Å²	178	127.2 Å²	127.2	67%	0.672	61%	0.614	S	S	*	*	H	α-helix	trans	-64.6	-32.7	176.7	-74.8	176.4	178.6	-175.9	-0.6	112.6	R726 Y727 R734	R726-R730 WeakPolarHBondContact O-CG 3.34Å; R726-R730 PolarHBondContact O-N 3.44Å; R726-R730 VanDerWaalsContact O-N 3.09Å; Y727-R730 PolarHBondContact O-N 3.49Å; R730-R734 WeakPolarHBondContact O-CB 3.4Å; R730-R734 WeakPolarHBondContact O-CG 3.39Å; R730-R734 PolarHBondContact O-N 3.04Å
731	K	72.8	Confident	67.2	Low	106 Å²	106	130.1 Å²	130.1	46%	0.461	62%	0.624	S	S	.	*	H	α-helix	trans	-70.7	-40.9	175.8	-166.8	178.4	179.2	-177.5	0	111.5	Y727 L728 Q729 R734 Q735	Y727-K731 HydrophobicContact CE1-CD 4.42Å; Y727-K731 WeakPolarHBondContact O-CB 3.43Å; Y727-K731 PolarHBondContact O-N 3.4Å; L728-K731 PolarHBondContact O-N 3.23Å; Q729-K731 VanDerWaalsContact C-N 3.28Å; Q729-K731 PolarHBondContact O-N 2.96Å; K731-R734 PolarHBondContact O-N 3.38Å; K731-Q735 WeakPolarHBondContact O-CG 3.47Å; K731-Q735 PolarHBondContact O-N 3.06Å
732	Q	71.8	Confident	67.5	Low	126 Å²	126	132.8 Å²	132.8	59%	0.589	63%	0.628	S	S	*	*	H	α-helix	trans	-66.2	-43.4	174.4	-80.8	179.7	-19.4	0	0	112.3	L728 Q729 R734 Q735 Q736	L728-Q732 PolarHBondContact O-N 3.32Å; Q729-Q732 PolarHBondContact O-N 2.92Å; Q732-R734 VanDerWaalsContact C-N 3.32Å; Q732-R734 PolarHBondContact O-N 2.87Å; Q732-Q735 PolarHBondContact O-N 3.46Å; Q732-Q735 VanDerWaalsContact O-N 3.1Å; Q732-Q736 PolarHBondContact O-N 3.4Å
733	Q	72.6	Confident	67.4	Low	123 Å²	123	134.1 Å²	134.1	58%	0.575	63%	0.634	S	S	*	*	H	α-helix	trans	-61	-38.9	173.6	-93.5	177.9	-19.3	0	0	112.6	Q729 Q735 Q736 N737	Q729-Q733 PolarHBondContact O-N 3.28Å; Q733-Q735 VanDerWaalsContact C-N 3.3Å; Q733-Q735 PolarHBondContact O-N 3.1Å; Q733-Q736 PolarHBondContact O-N 2.95Å; Q733-N737 WeakPolarHBondContact O-CB 3.37Å; Q733-N737 PolarHBondContact O-N 3.45Å
734	R	69.8	Low	67.6	Low	195 Å²	195	138.5 Å²	138.5	74%	0.736	64%	0.643	S	S	*	*	H	α-helix	trans	-69.2	-25.9	174.6	-81.2	179.8	171.2	-172.8	-2.7	113.6	R730 K731 Q732 K738	R730-R734 WeakPolarHBondContact O-CB 3.4Å; R730-R734 WeakPolarHBondContact O-CG 3.39Å; R730-R734 PolarHBondContact O-N 3.04Å; K731-R734 PolarHBondContact O-N 3.38Å; Q732-R734 VanDerWaalsContact C-N 3.32Å; Q732-R734 PolarHBondContact O-N 2.87Å; R734-K738 WeakPolarHBondContact O-CG 3.49Å
735	Q	65.8	Low	67.7	Low	120 Å²	120	135.8 Å²	135.8	56%	0.561	64%	0.64	S	S	*	*	H	α-helix	trans	-80.7	-37.5	174.3	-76.8	178.8	-25.2	0	0	111.6	K731 Q732 Q733 K738 A739	K731-Q735 WeakPolarHBondContact O-CG 3.47Å; K731-Q735 PolarHBondContact O-N 3.06Å; Q732-Q735 PolarHBondContact O-N 3.46Å; Q732-Q735 VanDerWaalsContact O-N 3.1Å; Q733-Q735 VanDerWaalsContact C-N 3.3Å; Q733-Q735 PolarHBondContact O-N 3.1Å; Q735-K738 PolarHBondContact O-N 3.1Å; Q735-A739 PolarHBondContact O-N 3.17Å
736	Q	63.9	Low	67.4	Low	133 Å²	133	141.3 Å²	141.3	62%	0.621	65%	0.653	S	S	*	*	H	α-helix	trans	-65.6	-41.6	172.6	-78.9	178.8	-22.8	0	0	112.2	Q732 Q733 K738 A739 L740	Q732-Q736 PolarHBondContact O-N 3.4Å; Q733-Q736 PolarHBondContact O-N 2.95Å; Q736-K738 PolarHBondContact O-N 3.22Å; Q736-K738 VanDerWaalsContact O-N 3.17Å; Q736-A739 PolarHBondContact O-N 3.29Å; Q736-A739 VanDerWaalsContact O-N 3.1Å; Q736-L740 PolarHBondContact O-N 3.32Å
737	N	62.6	Low	66.7	Low	122 Å²	122	140.7 Å²	140.7	65%	0.652	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-3.3	174.4	-74.1	2.7	0	0	0	114.3	Q733	Q733-N737 WeakPolarHBondContact O-CB 3.37Å; Q733-N737 PolarHBondContact O-N 3.45Å
738	K	57.3	Low	66	Low	186 Å²	186	139.5 Å²	139.5	81%	0.809	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-7.3	171.4	-86.5	-172.5	172.6	-168	0	112.9	R734 Q735 Q736	R734-K738 WeakPolarHBondContact O-CG 3.49Å; Q735-K738 PolarHBondContact O-N 3.1Å; Q736-K738 PolarHBondContact O-N 3.22Å; Q736-K738 VanDerWaalsContact O-N 3.17Å
739	A	51.2	Low	65.5	Low	92 Å²	92	142.7 Å²	142.7	76%	0.76	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-7.3	178.8	0	0	0	0	0	112.9	Q735 Q736	Q735-A739 PolarHBondContact O-N 3.17Å; Q736-A739 PolarHBondContact O-N 3.29Å; Q736-A739 VanDerWaalsContact O-N 3.1Å
740	L	45.7	Very low	64.5	Low	199 Å²	199	143.6 Å²	143.6	100%	1.042	68%	0.68	S	S	*	*			trans	-94.5	0	156.1	-79.4	154.3	0	0	0	108	Q736	Q736-L740 PolarHBondContact O-N 3.32Å

Retrieved 740 of 740 residues in 3171.8 ms (Link to these results)

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