G4VIM8_SCHMA Loading...

RuvB-like helicase

AlphaFold DB , UniProt , Accession G4VIM8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 456 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	39	Very low	37.5	Very low	239 Å²	239	164.9 Å²	164.9	100%	1.177	83%	0.828	S	S	*	*				0	121.5	0	-87.5	167.7	162.9	0	0	107.7
2	K	37.9	Very low	37.8	Very low	211 Å²	211	161.9 Å²	161.9	92%	0.917	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-79.6	117.8	169.7	-87.2	-178.2	172.6	-179.3	0	106.9	E4	K2-E4 PolarHBondContact O-N 3.18Å
3	I	42.7	Very low	38.4	Very low	165 Å²	165	162.2 Å²	162.2	85%	0.846	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-73.1	118.1	175.9	-61.6	168.6	0	0	0	106.7
4	E	39.6	Very low	39.5	Very low	177 Å²	177	167.6 Å²	167.6	83%	0.827	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-86.3	129.7	164.1	-87.4	-173.9	155.6	0	0	108.7	K2 V6	K2-E4 PolarHBondContact O-N 3.18Å; E4-V6 PolarHBondContact O-N 3.17Å
5	E	40.6	Very low	41	Very low	164 Å²	164	161.6 Å²	161.6	77%	0.766	80%	0.798	S	S	*	*			trans	-67.4	110.9	174.7	-167.3	-179.9	-155.8	0	0	108.9	R7	E5-R7 VanDerWaalsContact C-N 3.27Å; E5-R7 PolarHBondContact O-N 3.45Å
6	V	43.2	Very low	43.1	Very low	140 Å²	140	155.1 Å²	155.1	85%	0.848	78%	0.777	S	S	*	*			trans	-68.4	90.2	171.2	-177.7	0	0	0	0	107.5	E4 S8	E4-V6 PolarHBondContact O-N 3.17Å; V6-S8 PolarHBondContact O-N 3.21Å; V6-S8 VanDerWaalsContact O-N 3.13Å
7	R	38.1	Very low	45.1	Very low	205 Å²	205	149.8 Å²	149.8	77%	0.774	76%	0.763	S	S	*	*			trans	-57.2	119	166.1	-73.7	-176.1	176.7	-176.6	-0.4	107	E5 T9	E5-R7 VanDerWaalsContact C-N 3.27Å; E5-R7 PolarHBondContact O-N 3.45Å; R7-T9 PolarHBondContact O-N 3.11Å
8	S	33.8	Very low	47.2	Very low	97 Å²	97	144.8 Å²	144.8	68%	0.678	74%	0.736	S	S	*	*			trans	-49.9	116.3	174.2	80.4	0	0	0	0	107.6	V6 S10	V6-S8 PolarHBondContact O-N 3.21Å; V6-S8 VanDerWaalsContact O-N 3.13Å; S8-S10 PolarHBondContact O-N 3.23Å
9	T	34.2	Very low	49	Very low	135 Å²	135	139.5 Å²	139.5	83%	0.828	71%	0.712	S	S	*	*			trans	-71.8	64.9	162.7	49.2	0	0	0	0	106.3	R7 K11	R7-T9 PolarHBondContact O-N 3.11Å; T9-K11 VanDerWaalsContact C-N 3.3Å; T9-K11 PolarHBondContact O-N 3.31Å
10	S	30.7	Very low	50.9	Low	83 Å²	83	134.3 Å²	134.3	58%	0.58	68%	0.684	S	S	*	*			trans	-46.2	111.4	149.3	52.4	0	0	0	0	103.9	S8 T12	S8-S10 PolarHBondContact O-N 3.23Å; S10-T12 VanDerWaalsContact C-N 3.26Å; S10-T12 PolarHBondContact O-N 2.69Å
11	K	33.1	Very low	52.8	Low	198 Å²	198	128 Å²	128	86%	0.861	65%	0.653	S	S	*	*			trans	-51	99.3	-175.6	-79.8	176.5	177.3	171.5	0	106.2	T9 Q13	T9-K11 VanDerWaalsContact C-N 3.3Å; T9-K11 PolarHBondContact O-N 3.31Å; K11-Q13 VanDerWaalsContact C-N 3.32Å; K11-Q13 PolarHBondContact O-N 3.44Å
12	T	40.3	Very low	55.2	Low	129 Å²	129	123.2 Å²	123.2	79%	0.791	63%	0.625	S	S	*	*			trans	-59	105.6	176.8	30.2	0	0	0	0	104.3	S10 R14	S10-T12 VanDerWaalsContact C-N 3.26Å; S10-T12 PolarHBondContact O-N 2.69Å; T12-R14 PolarHBondContact O-N 2.83Å; T12-R14 VanDerWaalsContact O-N 3.09Å
13	Q	46.3	Very low	57.8	Low	165 Å²	165	113.1 Å²	113.1	77%	0.771	58%	0.581	S	S	*	*			trans	-54.3	123.8	-179.1	-72.5	-175.6	-0.9	0	0	106.2	K11 I15	K11-Q13 VanDerWaalsContact C-N 3.32Å; K11-Q13 PolarHBondContact O-N 3.44Å; Q13-I15 PolarHBondContact O-N 3.02Å; Q13-I15 VanDerWaalsContact O-N 3.1Å
14	R	53.6	Low	60.3	Low	239 Å²	239	105.3 Å²	105.3	90%	0.902	54%	0.541	S	S	*	.			trans	-54.9	124	177.6	-71.8	-178.9	179.2	172.1	-0.7	107.5	T12 A16	T12-R14 PolarHBondContact O-N 2.83Å; T12-R14 VanDerWaalsContact O-N 3.09Å; R14-A16 PolarHBondContact O-N 2.84Å
15	I	61.7	Low	62.9	Low	77 Å²	77	97.1 Å²	97.1	40%	0.395	50%	0.504	S	S	.	.			trans	-72.5	96.9	-180	-57.2	172.8	0	0	0	107.6	Q13 T381 E382	Q13-I15 PolarHBondContact O-N 3.02Å; Q13-I15 VanDerWaalsContact O-N 3.1Å; I15-T381 VanDerWaalsContact CD1-O 3.29Å; I15-T381 WeakPolarHBondContact CD1-O 3.22Å; I15-T381 HydrophobicContact CG2-CG2 3.9Å; I15-E382 HydrophobicContact CD1-CG 4.29Å; I15-E382 HydrophobicContact CG2-CG 4.17Å
16	A	74.8	Confident	65.5	Low	57 Å²	57	91.4 Å²	91.4	47%	0.471	48%	0.479	S	S	.	.			trans	-75.6	165.5	173	0	0	0	0	0	110.3	R14 H18 T19 R378	R14-A16 PolarHBondContact O-N 2.84Å; A16-H18 PolarHBondContact O-N 2.84Å; A16-T19 PolarHBondContact N-OG1 2.76Å; A16-T19 PolarHBondContact O-N 3.05Å; A16-T19 PolarHBondContact O-OG1 3.19Å; A16-R378 PolarHBondContact O-NH1 3.38Å
17	A	76.9	Confident	67.9	Low	65 Å²	65	87.6 Å²	87.6	54%	0.537	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-31.1	-177.1	0	0	0	0	0	113.6	H20 R378	A17-H20 PolarHBondContact O-CE1 2.84Å; A17-H20 PolarHBondContact O-ND1 2.88Å; A17-R378 PolarHBondContact O-NH1 2.96Å
18	H	83.1	Confident	70.4	Confident	60 Å²	60	87.7 Å²	87.7	28%	0.278	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	15.1	-174.4	-59.2	-63.8	0	0	0	114.9	A16 H20 V21 L81	A16-H18 PolarHBondContact O-N 2.84Å; H18-H20 PolarHBondContact O-N 3.33Å; H18-H20 VanDerWaalsContact O-N 3.1Å; H18-V21 HydrophobicContact CB-CG2 4.24Å; H18-V21 WeakPolarHBondContact O-CB 3.35Å; H18-V21 PolarHBondContact O-N 2.91Å; H18-L81 HydrophobicContact CB-CD2 3.63Å
19	T	81.6	Confident	73.1	Confident	45 Å²	45	88.5 Å²	88.5	28%	0.276	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.2	-179.1	-59.8	0	0	0	0	114	A16 V21 K22	A16-T19 PolarHBondContact N-OG1 2.76Å; A16-T19 PolarHBondContact O-N 3.05Å; A16-T19 PolarHBondContact O-OG1 3.19Å; T19-V21 VanDerWaalsContact C-N 3.33Å; T19-K22 PolarHBondContact O-NZ 3.42Å; T19-K22 VanDerWaalsContact O-NZ 3.11Å
20	H	86.9	Confident	75.9	Confident	34 Å²	34	83.6 Å²	83.6	16%	0.157	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-19	178.6	57.1	-91.2	0	0	0	113.7	A17 H18 K22 G38 I377 T381	A17-H20 PolarHBondContact O-CE1 2.84Å; A17-H20 PolarHBondContact O-ND1 2.88Å; H18-H20 PolarHBondContact O-N 3.33Å; H18-H20 VanDerWaalsContact O-N 3.1Å; H20-K22 PolarHBondContact O-N 3.27Å; H20-G38 PolarHBondContact CD2-O 3.07Å; H20-I377 HydrophobicContact CB-CG2 4.01Å; H20-T381 HydrophobicContact CB-CG2 4.45Å
21	V	89.9	Confident	78.9	Confident	4 Å²	4	82.8 Å²	82.8	2%	0.024	43%	0.432	C	S	.	.			trans	-76.7	122	-178.2	-177.9	0	0	0	0	109.6	H18 T19 L39 A78 L81 A82	H18-V21 HydrophobicContact CB-CG2 4.24Å; H18-V21 WeakPolarHBondContact O-CB 3.35Å; H18-V21 PolarHBondContact O-N 2.91Å; T19-V21 VanDerWaalsContact C-N 3.33Å; V21-L39 HydrophobicContact CG1-CD2 4.19Å; V21-L39 HydrophobicContact CG1-CG 4.39Å; V21-L39 HydrophobicContact CG2-CD2 4.07Å; V21-A78 HydrophobicContact CG2-CB 4.1Å; V21-L81 HydrophobicContact CB-CD2 4.35Å; V21-A82 HydrophobicContact CG1-CB 3.73Å
22	K	90.2	Very high	81.9	Confident	137 Å²	137	73.7 Å²	73.7	60%	0.596	39%	0.393	S	S	*	.			trans	-117.6	-9.2	-178.7	-59.6	-56.6	-178.8	-160.5	0	114.3	T19 H20 C37	T19-K22 PolarHBondContact O-NZ 3.42Å; T19-K22 VanDerWaalsContact O-NZ 3.11Å; H20-K22 PolarHBondContact O-N 3.27Å; K22-C37 HydrophobicContact CB-CB 4.31Å; K22-C37 PolarHBondContact N-O 3.23Å
23	G	93.3	Very high	84.4	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.377	C	S	.	.	S	Bend	trans	164.8	-179.1	-177.7	0	0	0	0	0	111.6	G25 C37 D86	G23-G25 VanDerWaalsContact C-N 3.29Å; G23-G25 PolarHBondContact O-N 3.49Å; G23-C37 WeakPolarHBondContact O-CB 3.45Å; G23-D86 WeakPolarHBondContact CA-OD1 3.11Å
24	L	95.1	Very high	86.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	37%	0.365	C	S	.	.			trans	-77.3	-14	-179.3	-66.8	167.7	0	0	0	113.5	L26 L39 R46 A49 V53 I79 A82 I83 D86	L24-L26 HydrophobicContact CB-CD1 4.18Å; L24-L26 HydrophobicContact CB-CD2 4.48Å; L24-L26 HydrophobicContact CB-CG 3.89Å; L24-L26 HydrophobicContact CD1-CD1 4.33Å; L24-L26 PolarHBondContact O-N 3.46Å; L24-L39 HydrophobicContact CD2-CD1 4.44Å; L24-R46 PolarHBondContact O-NE 3.45Å; L24-R46 PolarHBondContact O-NH2 3.22Å; L24-A49 HydrophobicContact CD1-CB 3.86Å; L24-A49 HydrophobicContact CD2-CB 3.64Å; L24-A49 HydrophobicContact CG-CB 4.44Å; L24-V53 HydrophobicContact CD1-CG2 3.84Å; L24-I79 HydrophobicContact CD2-CG2 4.1Å; L24-A82 HydrophobicContact CD2-CB 3.56Å; L24-A82 HydrophobicContact CG-CB 3.97Å; L24-I83 HydrophobicContact CD1-CG1 4.24Å; L24-I83 HydrophobicContact CD2-CG1 4.25Å; L24-D86 WeakPolarHBondContact CB-OD2 3.26Å; L24-D86 WeakPolarHBondContact CD1-OD2 3.34Å; L24-D86 VanDerWaalsContact CG-OD2 3.29Å; L24-D86 WeakPolarHBondContact CG-OD2 3.43Å; L24-D86 PolarHBondContact N-OD1 3.02Å; L24-D86 PolarHBondContact N-OD2 2.97Å
25	G	94	Very high	88.3	Confident	5 Å²	5	59.8 Å²	59.8	5%	0.052	34%	0.343	C	S	.	.			trans	65.1	37.8	177.9	0	0	0	0	0	113.6	G23 L33 R46	G23-G25 VanDerWaalsContact C-N 3.29Å; G23-G25 PolarHBondContact O-N 3.49Å; G25-L33 PolarHBondContact O-N 2.78Å; G25-R46 PolarHBondContact O-NH2 3.13Å
26	L	95.4	Very high	89.7	Confident	44 Å²	44	56.9 Å²	56.9	23%	0.23	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-90.1	152.1	177.2	-52.9	179.5	0	0	0	110.2	L24 T31 A32 R46	L24-L26 HydrophobicContact CB-CD1 4.18Å; L24-L26 HydrophobicContact CB-CD2 4.48Å; L24-L26 HydrophobicContact CB-CG 3.89Å; L24-L26 HydrophobicContact CD1-CD1 4.33Å; L24-L26 PolarHBondContact O-N 3.46Å; L26-T31 WeakPolarHBondContact CA-O 3.45Å; L26-A32 HydrophobicContact CD2-CB 3.73Å; L26-R46 HydrophobicContact CD2-CB 4.09Å
27	D	93.4	Very high	90.4	Very high	61 Å²	61	57.2 Å²	57.2	33%	0.326	33%	0.329	S	S	.	.			trans	-80.3	-179	168.2	69.6	21.3	0	0	0	112.2	T29 G30 T31 L33	D27-T29 PolarHBondContact O-N 3Å; D27-T29 WeakPolarHBondContact OD1-CA 3.5Å; D27-T29 WeakPolarHBondContact OD1-CB 3.18Å; D27-T29 PolarHBondContact OD1-N 3.17Å; D27-T29 PolarHBondContact OD1-OG1 3.47Å; D27-T29 PolarHBondContact OD2-OG1 2.93Å; D27-G30 PolarHBondContact O-N 3.11Å; D27-G30 PolarHBondContact OD1-N 3.03Å; D27-T31 PolarHBondContact N-O 3.23Å; D27-T31 PolarHBondContact OD1-N 2.92Å; D27-L33 HydrophobicContact CB-CD2 4.45Å
28	E	90	Very high	91.1	Very high	206 Å²	206	55 Å²	55	96%	0.963	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.7	179.8	-60.9	-178.6	179.1	0	0	113.5
29	T	91.5	Very high	91.6	Very high	114 Å²	114	52.7 Å²	52.7	70%	0.699	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-8.1	177.7	70.8	0	0	0	0	112.8	D27 T31	D27-T29 PolarHBondContact O-N 3Å; D27-T29 WeakPolarHBondContact OD1-CA 3.5Å; D27-T29 WeakPolarHBondContact OD1-CB 3.18Å; D27-T29 PolarHBondContact OD1-N 3.17Å; D27-T29 PolarHBondContact OD1-OG1 3.47Å; D27-T29 PolarHBondContact OD2-OG1 2.93Å; T29-T31 PolarHBondContact OG1-OG1 3.5Å
30	G	91.4	Very high	92.2	Very high	32 Å²	32	50.9 Å²	50.9	33%	0.33	29%	0.291	S	S	.	.	S	Bend	trans	87.8	7.3	-176.8	0	0	0	0	0	114	D27	D27-G30 PolarHBondContact O-N 3.11Å; D27-G30 PolarHBondContact OD1-N 3.03Å
31	T	94.6	Very high	92.5	Very high	66 Å²	66	49.4 Å²	49.4	41%	0.405	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-80.3	138.9	176.5	-66.8	0	0	0	0	110.4	L26 D27 T29 L33	L26-T31 WeakPolarHBondContact CA-O 3.45Å; D27-T31 PolarHBondContact N-O 3.23Å; D27-T31 PolarHBondContact OD1-N 2.92Å; T29-T31 PolarHBondContact OG1-OG1 3.5Å; T31-L33 PolarHBondContact O-N 3.1Å
32	A	95.1	Very high	92.7	Very high	7 Å²	7	50.1 Å²	50.1	6%	0.058	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-78.8	123	-178.1	0	0	0	0	0	111.8	L26 E43 R46 E47	L26-A32 HydrophobicContact CD2-CB 3.73Å; A32-E43 HydrophobicContact CB-CB 3.95Å; A32-E43 HydrophobicContact CB-CG 4.16Å; A32-R46 HydrophobicContact CB-CB 4.06Å; A32-E47 HydrophobicContact CB-CG 3.81Å; A32-E47 PolarHBondContact N-OE1 2.84Å
33	L	93.5	Very high	93	Very high	85 Å²	85	48 Å²	48	45%	0.445	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-73.5	137.2	170.5	-60.1	175.9	0	0	0	110	G25 D27 T31 N35 A36 R46	G25-L33 PolarHBondContact O-N 2.78Å; D27-L33 HydrophobicContact CB-CD2 4.45Å; T31-L33 PolarHBondContact O-N 3.1Å; L33-N35 VanDerWaalsContact C-N 3.26Å; L33-N35 PolarHBondContact O-N 2.9Å; L33-N35 VanDerWaalsContact O-N 3.13Å; L33-A36 HydrophobicContact CB-CB 3.8Å; L33-A36 HydrophobicContact CD1-CB 4.02Å; L33-R46 PolarHBondContact O-NH1 2.89Å; L33-R46 PolarHBondContact O-NH2 3.44Å
34	S	90	Very high	93.1	Very high	74 Å²	74	52.6 Å²	52.6	52%	0.517	31%	0.311	S	S	.	.	S	Bend	trans	-54.1	-38.1	-174.4	57.6	0	0	0	0	114.2	V40 G41	S34-V40 WeakPolarHBondContact O-CA 3.39Å; S34-G41 PolarHBondContact O-N 2.76Å
35	N	91.2	Very high	93.2	Very high	82 Å²	82	52.7 Å²	52.7	44%	0.439	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	107	172.4	179.6	5.9	0	0	0	110.4	L33 L39 V40	L33-N35 VanDerWaalsContact C-N 3.26Å; L33-N35 PolarHBondContact O-N 2.9Å; L33-N35 VanDerWaalsContact O-N 3.13Å; N35-L39 WeakPolarHBondContact CA-O 3.16Å; N35-V40 HydrophobicContact CB-CG2 4.43Å
36	A	92.4	Very high	93.3	Very high	17 Å²	17	52.5 Å²	52.5	14%	0.14	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	148.2	179	0	0	0	0	0	111.5	L33 G38 L39	L33-A36 HydrophobicContact CB-CB 3.8Å; L33-A36 HydrophobicContact CD1-CB 4.02Å; A36-G38 PolarHBondContact O-N 3.27Å; A36-L39 PolarHBondContact N-O 3.1Å; A36-L39 VanDerWaalsContact N-O 3.09Å; A36-L39 PolarHBondContact O-N 3.07Å
37	C	89.8	Confident	93.4	Very high	64 Å²	64	53.2 Å²	53.2	43%	0.432	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	28.9	177.2	-62.3	0	0	0	0	114.8	K22 G23 L39	K22-C37 HydrophobicContact CB-CB 4.31Å; K22-C37 PolarHBondContact N-O 3.23Å; G23-C37 WeakPolarHBondContact O-CB 3.45Å; C37-L39 VanDerWaalsContact C-N 3.29Å; C37-L39 PolarHBondContact O-N 3.31Å
38	G	90.1	Very high	93.5	Very high	19 Å²	19	51.9 Å²	51.9	20%	0.196	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-0.7	-179.1	0	0	0	0	0	115.1	H20 A36	H20-G38 PolarHBondContact CD2-O 3.07Å; A36-G38 PolarHBondContact O-N 3.27Å
39	L	93.9	Very high	93.8	Very high	11 Å²	11	42 Å²	42	6%	0.058	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	142.9	170.5	-65	-178.1	0	0	0	110.5	V21 L24 N35 A36 C37 R46 A78 A82	V21-L39 HydrophobicContact CG1-CD2 4.19Å; V21-L39 HydrophobicContact CG1-CG 4.39Å; V21-L39 HydrophobicContact CG2-CD2 4.07Å; L24-L39 HydrophobicContact CD2-CD1 4.44Å; N35-L39 WeakPolarHBondContact CA-O 3.16Å; A36-L39 PolarHBondContact N-O 3.1Å; A36-L39 VanDerWaalsContact N-O 3.09Å; A36-L39 PolarHBondContact O-N 3.07Å; C37-L39 VanDerWaalsContact C-N 3.29Å; C37-L39 PolarHBondContact O-N 3.31Å; L39-R46 HydrophobicContact CD1-CG 4.05Å; L39-A78 HydrophobicContact CD2-CB 3.98Å; L39-A82 HydrophobicContact CD1-CB 3.82Å
40	V	94	Very high	94	Very high	7 Å²	7	37.3 Å²	37.3	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	135	177.6	176.4	0	0	0	0	108.6	S34 N35 Y366 E370 Q373 I374 I377	S34-V40 WeakPolarHBondContact O-CA 3.39Å; N35-V40 HydrophobicContact CB-CG2 4.43Å; V40-Y366 WeakPolarHBondContact O-CE1 3.42Å; V40-E370 HydrophobicContact CG1-CB 4.12Å; V40-E370 HydrophobicContact CG1-CG 4.3Å; V40-Q373 HydrophobicContact CG1-CB 3.83Å; V40-Q373 HydrophobicContact CG2-CB 4.13Å; V40-I374 HydrophobicContact CB-CD1 4.41Å; V40-I374 HydrophobicContact CB-CG1 3.7Å; V40-I374 HydrophobicContact CG1-CG1 4.18Å; V40-I374 HydrophobicContact CG2-CG1 4.07Å; V40-I377 HydrophobicContact CG2-CD1 3.37Å
41	G	93.8	Very high	94.1	Very high	2 Å²	2	41 Å²	41	2%	0.021	25%	0.248	C	C	.	.	S	Bend	trans	60.7	-148.7	179.1	0	0	0	0	0	112.2	S34 E43 R46 E370	S34-G41 PolarHBondContact O-N 2.76Å; G41-E43 PolarHBondContact O-N 2.91Å; G41-R46 WeakPolarHBondContact O-CD 3.45Å; G41-R46 PolarHBondContact O-NH1 3.05Å; G41-R46 VanDerWaalsContact O-NH1 3.08Å; G41-E370 VanDerWaalsContact CA-OE1 3.25Å; G41-E370 WeakPolarHBondContact CA-OE1 3.46Å
42	Q	95.1	Very high	94.1	Very high	19 Å²	19	38 Å²	38	9%	0.089	23%	0.23	C	C	.	.			trans	48.8	42	-176.2	-70.7	-67.8	19.1	0	0	113.7	C44 A45 R46 T74 I79 L364 Y366	Q42-C44 PolarHBondContact O-N 3.39Å; Q42-A45 HydrophobicContact CB-CB 4.31Å; Q42-A45 PolarHBondContact O-N 3.09Å; Q42-A45 VanDerWaalsContact O-N 3.15Å; Q42-R46 WeakPolarHBondContact O-CB 3.37Å; Q42-R46 WeakPolarHBondContact O-CG 3.26Å; Q42-R46 PolarHBondContact O-N 2.93Å; Q42-T74 PolarHBondContact NE2-O 3.24Å; Q42-I79 HydrophobicContact CB-CD1 4.38Å; Q42-L364 PolarHBondContact NE2-O 3.4Å; Q42-Y366 HydrophobicContact CG-CD1 4.48Å; Q42-Y366 HydrophobicContact CG-CE1 3.57Å
43	E	95.1	Very high	93.9	Very high	93 Å²	93	38 Å²	38	44%	0.435	23%	0.229	S	C	.	.	H	α-helix	trans	-54.9	-56	-172.6	-64.2	174.3	176.9	0	0	111.3	A32 G41 A45 R46 E47	A32-E43 HydrophobicContact CB-CB 3.95Å; A32-E43 HydrophobicContact CB-CG 4.16Å; G41-E43 PolarHBondContact O-N 2.91Å; E43-A45 VanDerWaalsContact C-N 3.28Å; E43-A45 PolarHBondContact O-N 3.44Å; E43-R46 PolarHBondContact O-N 2.92Å; E43-E47 WeakPolarHBondContact O-CG 3.13Å; E43-E47 PolarHBondContact O-N 3.16Å
44	C	95.2	Very high	93.8	Very high	97 Å²	97	39 Å²	39	66%	0.655	23%	0.231	S	C	*	.	H	α-helix	trans	-58.1	-37.6	179.9	-55.3	0	0	0	0	113.5	Q42 A48	Q42-C44 PolarHBondContact O-N 3.39Å; C44-A48 VanDerWaalsContact O-CB 3.29Å; C44-A48 WeakPolarHBondContact O-CB 3.35Å; C44-A48 PolarHBondContact O-N 3.42Å
45	A	96.9	Very high	93.8	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-72.9	-33.7	-179.6	0	0	0	0	0	111.7	Q42 E43 A49 I79 I361 T363	Q42-A45 HydrophobicContact CB-CB 4.31Å; Q42-A45 PolarHBondContact O-N 3.09Å; Q42-A45 VanDerWaalsContact O-N 3.15Å; E43-A45 VanDerWaalsContact C-N 3.28Å; E43-A45 PolarHBondContact O-N 3.44Å; A45-A49 VanDerWaalsContact O-CB 3.29Å; A45-A49 WeakPolarHBondContact O-CB 3.43Å; A45-A49 PolarHBondContact O-N 2.87Å; A45-I79 HydrophobicContact CB-CD1 3.76Å; A45-I361 HydrophobicContact CB-CG2 3.76Å; A45-T363 HydrophobicContact CB-CG2 4.26Å
46	R	97.1	Very high	93.6	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-74.2	-41.3	176.1	-73.7	165.9	54.6	-162.9	-9.8	112.2	L24 G25 L26 A32 L33 L39 G41 Q42 E43 A49 G50	L24-R46 PolarHBondContact O-NE 3.45Å; L24-R46 PolarHBondContact O-NH2 3.22Å; G25-R46 PolarHBondContact O-NH2 3.13Å; L26-R46 HydrophobicContact CD2-CB 4.09Å; A32-R46 HydrophobicContact CB-CB 4.06Å; L33-R46 PolarHBondContact O-NH1 2.89Å; L33-R46 PolarHBondContact O-NH2 3.44Å; L39-R46 HydrophobicContact CD1-CG 4.05Å; G41-R46 WeakPolarHBondContact O-CD 3.45Å; G41-R46 PolarHBondContact O-NH1 3.05Å; G41-R46 VanDerWaalsContact O-NH1 3.08Å; Q42-R46 WeakPolarHBondContact O-CB 3.37Å; Q42-R46 WeakPolarHBondContact O-CG 3.26Å; Q42-R46 PolarHBondContact O-N 2.93Å; E43-R46 PolarHBondContact O-N 2.92Å; R46-A49 CarbonylContact O-C 3.54Å; R46-A49 WeakPolarHBondContact O-CB 3.2Å; R46-A49 PolarHBondContact O-N 3.49Å; R46-G50 PolarHBondContact O-N 2.84Å
47	E	96.8	Very high	93.4	Very high	60 Å²	60	40.5 Å²	40.5	28%	0.28	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-47	173.6	-68.3	177.3	168.4	0	0	110.6	A32 E43 A49 G50 I51	A32-E47 HydrophobicContact CB-CG 3.81Å; A32-E47 PolarHBondContact N-OE1 2.84Å; E43-E47 WeakPolarHBondContact O-CG 3.13Å; E43-E47 PolarHBondContact O-N 3.16Å; E47-A49 VanDerWaalsContact C-N 3.3Å; E47-A49 PolarHBondContact O-N 2.67Å; E47-G50 WeakPolarHBondContact O-CA 3.31Å; E47-G50 PolarHBondContact O-N 2.86Å; E47-I51 WeakPolarHBondContact O-CG1 3.41Å; E47-I51 PolarHBondContact O-N 2.9Å
48	A	96.6	Very high	93.2	Very high	32 Å²	32	39.9 Å²	39.9	26%	0.264	22%	0.215	S	C	.	.	H	α-helix	trans	-59.3	-41.4	174	0	0	0	0	0	112	C44 G50 I51 V52 I361	C44-A48 VanDerWaalsContact O-CB 3.29Å; C44-A48 WeakPolarHBondContact O-CB 3.35Å; C44-A48 PolarHBondContact O-N 3.42Å; A48-G50 VanDerWaalsContact C-N 3.32Å; A48-G50 PolarHBondContact O-N 2.75Å; A48-I51 PolarHBondContact O-N 2.93Å; A48-V52 WeakPolarHBondContact O-CG2 3.4Å; A48-V52 PolarHBondContact O-N 3.14Å; A48-I361 HydrophobicContact CB-CD1 3.9Å; A48-I361 HydrophobicContact CB-CG1 4Å; A48-I361 HydrophobicContact CB-CG2 4.18Å
49	A	96.1	Very high	92.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-35.1	173.8	0	0	0	0	0	112.6	L24 A45 R46 E47 V52 V53 I79 I83	L24-A49 HydrophobicContact CD1-CB 3.86Å; L24-A49 HydrophobicContact CD2-CB 3.64Å; L24-A49 HydrophobicContact CG-CB 4.44Å; A45-A49 VanDerWaalsContact O-CB 3.29Å; A45-A49 WeakPolarHBondContact O-CB 3.43Å; A45-A49 PolarHBondContact O-N 2.87Å; R46-A49 CarbonylContact O-C 3.54Å; R46-A49 WeakPolarHBondContact O-CB 3.2Å; R46-A49 PolarHBondContact O-N 3.49Å; E47-A49 VanDerWaalsContact C-N 3.3Å; E47-A49 PolarHBondContact O-N 2.67Å; A49-V52 WeakPolarHBondContact O-CB 3.42Å; A49-V52 PolarHBondContact O-N 2.83Å; A49-V53 WeakPolarHBondContact O-CG2 3.5Å; A49-V53 PolarHBondContact O-N 3.3Å; A49-I79 HydrophobicContact CB-CG2 3.71Å; A49-I83 HydrophobicContact CB-CD1 3.79Å; A49-I83 HydrophobicContact CB-CG1 3.79Å
50	G	95.3	Very high	92.2	Very high	15 Å²	15	54.7 Å²	54.7	16%	0.155	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-45.2	173.1	0	0	0	0	0	112.6	R46 E47 A48 V52 V53 E54	R46-G50 PolarHBondContact O-N 2.84Å; E47-G50 WeakPolarHBondContact O-CA 3.31Å; E47-G50 PolarHBondContact O-N 2.86Å; A48-G50 VanDerWaalsContact C-N 3.32Å; A48-G50 PolarHBondContact O-N 2.75Å; G50-V52 VanDerWaalsContact C-N 3.26Å; G50-V52 PolarHBondContact O-N 3.45Å; G50-V53 WeakPolarHBondContact O-CB 3.45Å; G50-V53 PolarHBondContact O-N 2.8Å; G50-V53 VanDerWaalsContact O-N 3.14Å; G50-E54 PolarHBondContact O-N 2.8Å
51	I	94.1	Very high	91.5	Very high	109 Å²	109	55.2 Å²	55.2	56%	0.559	28%	0.276	S	S	*	.	H	α-helix	trans	-60.8	-40	173.8	-60.6	169.1	0	0	0	110.1	E47 A48 E54 M55	E47-I51 WeakPolarHBondContact O-CG1 3.41Å; E47-I51 PolarHBondContact O-N 2.9Å; A48-I51 PolarHBondContact O-N 2.93Å; I51-E54 PolarHBondContact O-N 3.34Å; I51-M55 HydrophobicContact CG2-CE 4.15Å; I51-M55 HydrophobicContact CG2-CG 4.5Å; I51-M55 WeakPolarHBondContact O-CG 3.26Å; I51-M55 PolarHBondContact O-N 2.87Å
52	V	93.2	Very high	90.5	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.024	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-48.1	173.1	167.2	0	0	0	0	111.3	A48 A49 G50 E54 M55 I56 V66 M359 I361	A48-V52 WeakPolarHBondContact O-CG2 3.4Å; A48-V52 PolarHBondContact O-N 3.14Å; A49-V52 WeakPolarHBondContact O-CB 3.42Å; A49-V52 PolarHBondContact O-N 2.83Å; G50-V52 VanDerWaalsContact C-N 3.26Å; G50-V52 PolarHBondContact O-N 3.45Å; V52-E54 VanDerWaalsContact C-N 3.26Å; V52-E54 PolarHBondContact O-N 2.81Å; V52-M55 HydrophobicContact CB-CE 4.34Å; V52-M55 HydrophobicContact CG2-CE 3.83Å; V52-M55 PolarHBondContact O-N 3.13Å; V52-M55 VanDerWaalsContact O-N 3.16Å; V52-I56 HydrophobicContact CG1-CD1 3.67Å; V52-I56 HydrophobicContact CG1-CG1 4.32Å; V52-I56 WeakPolarHBondContact O-CD1 3.28Å; V52-I56 WeakPolarHBondContact O-CG1 3.41Å; V52-I56 PolarHBondContact O-N 3.44Å; V52-V66 HydrophobicContact CG1-CG2 3.93Å; V52-V66 HydrophobicContact CG2-CG2 3.96Å; V52-M359 HydrophobicContact CG2-CE 4.31Å; V52-I361 HydrophobicContact CG2-CD1 4.23Å
53	V	92.7	Very high	89.4	Confident	7 Å²	7	60 Å²	60	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-55.7	-42.5	176.2	169.5	0	0	0	0	111.1	L24 A49 G50 I56 R57 I83 D86 L87	L24-V53 HydrophobicContact CD1-CG2 3.84Å; A49-V53 WeakPolarHBondContact O-CG2 3.5Å; A49-V53 PolarHBondContact O-N 3.3Å; G50-V53 WeakPolarHBondContact O-CB 3.45Å; G50-V53 PolarHBondContact O-N 2.8Å; G50-V53 VanDerWaalsContact O-N 3.14Å; V53-I56 WeakPolarHBondContact O-CB 3.45Å; V53-I56 PolarHBondContact O-N 2.82Å; V53-R57 WeakPolarHBondContact O-CG 3.34Å; V53-R57 PolarHBondContact O-N 2.79Å; V53-I83 HydrophobicContact CG2-CB 4.3Å; V53-I83 HydrophobicContact CG2-CG1 4.29Å; V53-I83 HydrophobicContact CG2-CG2 3.9Å; V53-D86 HydrophobicContact CG1-CB 4.33Å; V53-D86 HydrophobicContact CG2-CB 4.26Å; V53-L87 HydrophobicContact CG1-CD2 4.06Å
54	E	90.7	Very high	88.9	Confident	106 Å²	106	61.5 Å²	61.5	50%	0.495	32%	0.323	S	S	.	.	H	α-helix	trans	-69.5	-38.3	178.2	-170.1	53	-144.4	0	0	112.8	G50 I51 V52 I56 R57 S58	G50-E54 PolarHBondContact O-N 2.8Å; I51-E54 PolarHBondContact O-N 3.34Å; V52-E54 VanDerWaalsContact C-N 3.26Å; V52-E54 PolarHBondContact O-N 2.81Å; E54-I56 VanDerWaalsContact C-N 3.25Å; E54-I56 PolarHBondContact O-N 2.98Å; E54-R57 PolarHBondContact O-N 2.91Å; E54-S58 WeakPolarHBondContact O-CB 3.41Å; E54-S58 PolarHBondContact O-N 3.27Å; E54-S58 PolarHBondContact O-OG 2.79Å
55	M	89.2	Confident	88.8	Confident	36 Å²	36	56.9 Å²	56.9	18%	0.177	29%	0.292	C	S	.	.	H	α-helix	trans	-62.8	-34.5	172.3	-73	-171.4	-66.4	0	0	112.2	I51 V52 S58 K59 K60 M61 M359	I51-M55 HydrophobicContact CG2-CE 4.15Å; I51-M55 HydrophobicContact CG2-CG 4.5Å; I51-M55 WeakPolarHBondContact O-CG 3.26Å; I51-M55 PolarHBondContact O-N 2.87Å; V52-M55 HydrophobicContact CB-CE 4.34Å; V52-M55 HydrophobicContact CG2-CE 3.83Å; V52-M55 PolarHBondContact O-N 3.13Å; V52-M55 VanDerWaalsContact O-N 3.16Å; M55-S58 WeakPolarHBondContact CA-OG 3.44Å; M55-S58 PolarHBondContact O-OG 2.89Å; M55-K59 PolarHBondContact O-N 2.84Å; M55-K60 PolarHBondContact O-N 3.19Å; M55-M61 HydrophobicContact CB-CG 3.77Å; M55-M61 HydrophobicContact CB-SD 3.91Å; M55-M61 HydrophobicContact CE-SD 3.98Å; M55-M61 HydrophobicContact SD-SD 4.33Å; M55-M359 HydrophobicContact CE-CE 3.53Å; M55-M359 HydrophobicContact CE-SD 3.81Å; M55-M359 HydrophobicContact SD-CE 4.46Å; M55-M359 HydrophobicContact SD-SD 4.43Å
56	I	88.1	Confident	88.7	Confident	22 Å²	22	56.9 Å²	56.9	11%	0.113	29%	0.292	C	S	.	.	H	α-helix	trans	-68.1	-51	175.8	-66.6	164.3	0	0	0	110	V52 V53 E54 S58 K59 M61 I83 L87 I326	V52-I56 HydrophobicContact CG1-CD1 3.67Å; V52-I56 HydrophobicContact CG1-CG1 4.32Å; V52-I56 WeakPolarHBondContact O-CD1 3.28Å; V52-I56 WeakPolarHBondContact O-CG1 3.41Å; V52-I56 PolarHBondContact O-N 3.44Å; V53-I56 WeakPolarHBondContact O-CB 3.45Å; V53-I56 PolarHBondContact O-N 2.82Å; E54-I56 VanDerWaalsContact C-N 3.25Å; E54-I56 PolarHBondContact O-N 2.98Å; I56-S58 VanDerWaalsContact C-N 3.27Å; I56-S58 PolarHBondContact O-N 3.31Å; I56-K59 PolarHBondContact O-N 3.24Å; I56-M61 HydrophobicContact CB-CG 4.47Å; I56-M61 HydrophobicContact CG1-CB 4.39Å; I56-M61 HydrophobicContact CG1-CG 3.64Å; I56-I83 HydrophobicContact CD1-CG2 4.38Å; I56-L87 HydrophobicContact CB-CD2 3.86Å; I56-L87 HydrophobicContact CD1-CD1 4.04Å; I56-L87 HydrophobicContact CD1-CD2 4.21Å; I56-L87 HydrophobicContact CG2-CD1 4.25Å; I56-L87 HydrophobicContact CG2-CD2 3.43Å; I56-L87 VanDerWaalsContact CG2-CD2 3.43Å; I56-L87 HydrophobicContact CG2-CG 4.5Å; I56-I326 HydrophobicContact CB-CD1 4.37Å; I56-I326 HydrophobicContact CD1-CB 4.39Å; I56-I326 HydrophobicContact CD1-CD1 3.84Å; I56-I326 HydrophobicContact CD1-CG1 3.88Å; I56-I326 HydrophobicContact CD1-CG2 3.76Å; I56-I326 HydrophobicContact CG1-CD1 4.03Å; I56-I326 HydrophobicContact CG1-CG1 3.92Å; I56-I326 HydrophobicContact CG1-CG2 4.41Å; I56-I326 HydrophobicContact CG2-CD1 3.42Å; I56-I326 VanDerWaalsContact CG2-CD1 3.42Å; I56-I326 HydrophobicContact CG2-CG1 4.09Å
57	R	86.9	Confident	88.7	Confident	146 Å²	146	56.8 Å²	56.8	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-58.9	-38.9	178.4	-72.3	174.3	177.1	179.8	0	112.1	V53 E54 K59 D86 L87	V53-R57 WeakPolarHBondContact O-CG 3.34Å; V53-R57 PolarHBondContact O-N 2.79Å; E54-R57 PolarHBondContact O-N 2.91Å; R57-K59 VanDerWaalsContact C-N 3.25Å; R57-K59 PolarHBondContact O-N 2.94Å; R57-D86 PolarHBondContact NH2-O 2.97Å; R57-L87 HydrophobicContact CG-CD2 4.46Å
58	S	86.6	Confident	88.8	Confident	50 Å²	50	54 Å²	54	35%	0.35	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	4.4	176.3	62.7	0	0	0	0	114.7	E54 M55 I56 K60	E54-S58 WeakPolarHBondContact O-CB 3.41Å; E54-S58 PolarHBondContact O-N 3.27Å; E54-S58 PolarHBondContact O-OG 2.79Å; M55-S58 WeakPolarHBondContact CA-OG 3.44Å; M55-S58 PolarHBondContact O-OG 2.89Å; I56-S58 VanDerWaalsContact C-N 3.27Å; I56-S58 PolarHBondContact O-N 3.31Å; S58-K60 VanDerWaalsContact C-N 3.26Å; S58-K60 PolarHBondContact O-N 3.12Å
59	K	82.1	Confident	88.8	Confident	192 Å²	192	52.9 Å²	52.9	84%	0.835	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	29.5	178.6	-55.8	-178.5	179.6	-179.4	0	114.4	M55 I56 R57	M55-K59 PolarHBondContact O-N 2.84Å; I56-K59 PolarHBondContact O-N 3.24Å; R57-K59 VanDerWaalsContact C-N 3.25Å; R57-K59 PolarHBondContact O-N 2.94Å
60	K	81.8	Confident	88.7	Confident	149 Å²	149	53.6 Å²	53.6	65%	0.648	28%	0.277	S	S	*	.			trans	-98.8	10.7	-179.5	-69.3	-179.6	-179.6	174.9	0	114.3	M55 S58	M55-K60 PolarHBondContact O-N 3.19Å; S58-K60 VanDerWaalsContact C-N 3.26Å; S58-K60 PolarHBondContact O-N 3.12Å
61	M	79.2	Confident	88.5	Confident	18 Å²	18	55.6 Å²	55.6	9%	0.089	29%	0.287	C	S	.	.			trans	-93	3.1	-179	-78.6	-62.8	-67.9	0	0	115.2	M55 I56 G63 R64 V66 M359	M55-M61 HydrophobicContact CB-CG 3.77Å; M55-M61 HydrophobicContact CB-SD 3.91Å; M55-M61 HydrophobicContact CE-SD 3.98Å; M55-M61 HydrophobicContact SD-SD 4.33Å; I56-M61 HydrophobicContact CB-CG 4.47Å; I56-M61 HydrophobicContact CG1-CB 4.39Å; I56-M61 HydrophobicContact CG1-CG 3.64Å; M61-G63 PolarHBondContact O-N 2.99Å; M61-R64 HydrophobicContact CE-CB 4.13Å; M61-R64 PolarHBondContact O-N 3.26Å; M61-R64 VanDerWaalsContact O-N 3.08Å; M61-R64 HydrophobicContact SD-CB 4.49Å; M61-V66 HydrophobicContact CE-CG2 4.05Å; M61-M359 HydrophobicContact CE-CE 3.54Å; M61-M359 HydrophobicContact SD-CE 3.4Å; M61-M359 WeakPolarHBondContact SD-CE 3.47Å
62	A	71.5	Confident	88.3	Confident	91 Å²	91	53.7 Å²	53.7	75%	0.752	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	128.8	-176.7	0	0	0	0	0	112	R64	A62-R64 PolarHBondContact O-N 3.46Å
63	G	71.6	Confident	88	Confident	30 Å²	30	54.7 Å²	54.7	31%	0.309	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	7.7	179.1	0	0	0	0	0	115.7	M61 L319	M61-G63 PolarHBondContact O-N 2.99Å; G63-L319 WeakPolarHBondContact CA-O 3.47Å
64	R	84.9	Confident	88	Confident	126 Å²	126	54.6 Å²	54.6	48%	0.475	29%	0.292	S	S	.	.			trans	-112.7	147.8	180	-61.2	-179	-178.7	-173.1	-1	110.9	M61 A62	M61-R64 HydrophobicContact CE-CB 4.13Å; M61-R64 PolarHBondContact O-N 3.26Å; M61-R64 VanDerWaalsContact O-N 3.08Å; M61-R64 HydrophobicContact SD-CB 4.49Å; A62-R64 PolarHBondContact O-N 3.46Å
65	A	93.1	Very high	88.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	165.7	169.3	0	0	0	0	0	110.3	L319 V327 F329 R357 V358 M359	A65-L319 HydrophobicContact CB-CD1 4.21Å; A65-L319 HydrophobicContact CB-CD2 4.27Å; A65-V327 WeakPolarHBondContact CA-O 3.19Å; A65-V327 HydrophobicContact CB-CB 4.18Å; A65-V327 WeakPolarHBondContact CB-O 3.44Å; A65-F329 HydrophobicContact CB-CD2 4.03Å; A65-F329 HydrophobicContact CB-CE2 3.55Å; A65-F329 HydrophobicContact CB-CZ 4.44Å; A65-R357 PolarHBondContact N-O 3.02Å; A65-V358 HydrophobicContact CB-CG1 4.04Å; A65-V358 CarbonylContact O-C 3.51Å; A65-V358 VanDerWaalsContact O-CA 3.3Å; A65-V358 WeakPolarHBondContact O-CA 3.4Å; A65-M359 PolarHBondContact O-N 3.33Å
66	V	95.9	Very high	88.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137.7	174.9	-179.8	0	0	0	0	108.6	V52 M61 M68 V327 I328 F329 M359 I361	V52-V66 HydrophobicContact CG1-CG2 3.93Å; V52-V66 HydrophobicContact CG2-CG2 3.96Å; M61-V66 HydrophobicContact CE-CG2 4.05Å; V66-M68 HydrophobicContact CG1-SD 4.21Å; V66-V327 PolarHBondContact N-O 3.36Å; V66-I328 HydrophobicContact CB-CG1 4.3Å; V66-I328 HydrophobicContact CB-CG2 4.41Å; V66-I328 HydrophobicContact CG1-CG2 4.46Å; V66-I328 CarbonylContact O-C 3.54Å; V66-I328 WeakPolarHBondContact O-CA 3.14Å; V66-F329 PolarHBondContact O-N 2.99Å; V66-M359 CarbonylContact C-O 3.39Å; V66-M359 WeakPolarHBondContact CA-O 3.15Å; V66-M359 HydrophobicContact CG2-CE 4.27Å; V66-I361 HydrophobicContact CG1-CD1 3.69Å; V66-I361 HydrophobicContact CG1-CG1 4.04Å
67	L	97.1	Very high	88.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	112.8	173	176.4	64.5	0	0	0	109.9	A69 V304 F329 T331 H348 I350 L355 V358 M359 I360 I361	L67-A69 PolarHBondContact O-N 3.03Å; L67-V304 HydrophobicContact CD1-CG1 4.3Å; L67-F329 HydrophobicContact CD1-CB 3.59Å; L67-T331 HydrophobicContact CD1-CG2 3.91Å; L67-T331 HydrophobicContact CG-CG2 4.48Å; L67-H348 HydrophobicContact CD2-CB 4.39Å; L67-I350 HydrophobicContact CD1-CD1 3.9Å; L67-I350 HydrophobicContact CD2-CD1 3.91Å; L67-L355 HydrophobicContact CD2-CD2 4.06Å; L67-V358 HydrophobicContact CB-CB 4.19Å; L67-V358 HydrophobicContact CB-CG2 3.79Å; L67-V358 HydrophobicContact CD2-CG2 4.16Å; L67-M359 PolarHBondContact N-O 2.97Å; L67-I360 HydrophobicContact CB-CG1 4.27Å; L67-I360 HydrophobicContact CD2-CD1 4.23Å; L67-I360 HydrophobicContact CD2-CG1 4.08Å; L67-I360 HydrophobicContact CD2-CG2 4.45Å; L67-I360 CarbonylContact O-C 3.58Å; L67-I360 WeakPolarHBondContact O-CA 3.05Å; L67-I361 PolarHBondContact O-N 3.32Å
68	M	97.4	Very high	88.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	110.1	170	-57.5	-61	-67.2	0	0	109.1	V66 K76 I79 I328 F329 A330 T331 I361 T363	V66-M68 HydrophobicContact CG1-SD 4.21Å; M68-K76 HydrophobicContact CB-CB 3.99Å; M68-K76 HydrophobicContact CB-CD 4.04Å; M68-K76 HydrophobicContact CB-CG 3.94Å; M68-K76 VanDerWaalsContact O-CD 3.28Å; M68-K76 WeakPolarHBondContact O-CD 3.45Å; M68-I79 HydrophobicContact CE-CB 3.84Å; M68-I79 HydrophobicContact CE-CD1 3.76Å; M68-I79 HydrophobicContact CE-CG1 4.41Å; M68-I79 HydrophobicContact CE-CG2 3.69Å; M68-I328 HydrophobicContact CG-CG2 3.75Å; M68-F329 PolarHBondContact N-O 3.3Å; M68-A330 HydrophobicContact CB-CB 4.31Å; M68-A330 WeakPolarHBondContact O-CA 3.41Å; M68-T331 PolarHBondContact O-N 3.24Å; M68-I361 WeakPolarHBondContact CA-O 3.38Å; M68-I361 HydrophobicContact CE-CB 4.29Å; M68-I361 HydrophobicContact CE-CG2 3.92Å; M68-I361 HydrophobicContact SD-CB 3.67Å; M68-I361 HydrophobicContact SD-CD1 4.01Å; M68-I361 HydrophobicContact SD-CG1 4.32Å; M68-I361 HydrophobicContact SD-CG2 3.96Å; M68-T363 HydrophobicContact CE-CG2 3.9Å
69	A	96.9	Very high	89.3	Confident	9 Å²	9	41 Å²	41	7%	0.074	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.7	-177.7	0	0	0	0	0	111.5	L67 T331 I360 I361 R362 T363	L67-A69 PolarHBondContact O-N 3.03Å; A69-T331 HydrophobicContact CB-CG2 4.11Å; A69-I360 HydrophobicContact CB-CG2 3.94Å; A69-I361 PolarHBondContact N-O 3.01Å; A69-R362 CarbonylContact O-C 3.53Å; A69-R362 WeakPolarHBondContact O-CA 3.49Å; A69-T363 PolarHBondContact O-N 3.21Å; A69-T363 PolarHBondContact O-OG1 3.4Å
70	G	94.5	Very high	89.8	Confident	16 Å²	16	31.9 Å²	31.9	17%	0.165	20%	0.196	C	C	.	.	S	Bend	trans	162.2	175.1	170.6	0	0	0	0	0	113.9	K76 T331 N332 T363	G70-K76 PolarHBondContact O-NZ 2.76Å; G70-T331 PolarHBondContact N-O 3.39Å; G70-N332 WeakPolarHBondContact O-CA 3.4Å; G70-T363 WeakPolarHBondContact CA-OG1 3.4Å
71	P	91.5	Very high	90.3	Very high	56 Å²	56	26.2 Å²	26.2	36%	0.364	17%	0.173	S	C	.	.	S	Bend	trans	-52.9	160	-176	-26.2	33.2	0	0	0	114.4	T74 K76 P365	P71-T74 HydrophobicContact CB-CG2 3.83Å; P71-T74 HydrophobicContact CG-CG2 4.19Å; P71-T74 WeakPolarHBondContact O-CG2 3.31Å; P71-T74 PolarHBondContact O-OG1 3.42Å; P71-K76 PolarHBondContact O-NZ 3Å; P71-P365 HydrophobicContact CG-CG 4.37Å
72	P	89.1	Confident	91	Very high	70 Å²	70	25.4 Å²	25.4	46%	0.455	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	141.3	172.2	27.1	-34	0	0	0	110.9
73	G	87.3	Confident	92.1	Very high	25 Å²	25	21 Å²	21	26%	0.258	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	10.1	176.6	0	0	0	0	0	116.1	Y366	G73-Y366 WeakPolarHBondContact O-CE2 3.49Å
74	T	92.3	Very high	93	Very high	4 Å²	4	19.8 Å²	19.8	3%	0.025	12%	0.12	C	C	.	.	S	Bend	trans	-89.8	11.5	179.9	58.3	0	0	0	0	115.2	Q42 P71 T363 L364 Y366	Q42-T74 PolarHBondContact NE2-O 3.24Å; P71-T74 HydrophobicContact CB-CG2 3.83Å; P71-T74 HydrophobicContact CG-CG2 4.19Å; P71-T74 WeakPolarHBondContact O-CG2 3.31Å; P71-T74 PolarHBondContact O-OG1 3.42Å; T74-T363 WeakPolarHBondContact OG1-CB 3.44Å; T74-T363 PolarHBondContact OG1-OG1 3.26Å; T74-L364 VanDerWaalsContact CG2-O 3.32Å; T74-L364 WeakPolarHBondContact CG2-O 3.28Å; T74-Y366 PolarHBondContact O-OH 3.47Å
75	G	92.3	Very high	93.3	Very high	15 Å²	15	17.6 Å²	17.6	16%	0.155	12%	0.115	C	C	.	.	S	Bend	trans	87.9	12.1	174.6	0	0	0	0	0	116.8	T77 A78 I79	G75-T77 PolarHBondContact O-N 3.05Å; G75-A78 WeakPolarHBondContact O-CA 3.37Å; G75-A78 WeakPolarHBondContact O-CB 3.38Å; G75-A78 PolarHBondContact O-N 3.05Å; G75-I79 WeakPolarHBondContact O-CG1 3.19Å; G75-I79 PolarHBondContact O-N 2.89Å
76	K	94.5	Very high	93.2	Very high	15 Å²	15	19.7 Å²	19.7	7%	0.065	13%	0.126	C	C	.	.	H	α-helix	trans	-49.2	-52.8	178.4	-64.8	-173.8	-69.5	-71.8	0	113.6	M68 G70 P71 A78 I79 A80 A330 T331 T363	M68-K76 HydrophobicContact CB-CB 3.99Å; M68-K76 HydrophobicContact CB-CD 4.04Å; M68-K76 HydrophobicContact CB-CG 3.94Å; M68-K76 VanDerWaalsContact O-CD 3.28Å; M68-K76 WeakPolarHBondContact O-CD 3.45Å; G70-K76 PolarHBondContact O-NZ 2.76Å; P71-K76 PolarHBondContact O-NZ 3Å; K76-A78 VanDerWaalsContact C-N 3.33Å; K76-A78 PolarHBondContact O-N 2.86Å; K76-I79 PolarHBondContact O-N 2.83Å; K76-A80 PolarHBondContact O-N 3.34Å; K76-A80 VanDerWaalsContact O-N 3.08Å; K76-A330 HydrophobicContact CB-CB 4.27Å; K76-A330 HydrophobicContact CD-CB 4.14Å; K76-T331 WeakPolarHBondContact CE-O 3.46Å; K76-T363 HydrophobicContact CG-CG2 4.02Å
77	T	92.6	Very high	92.9	Very high	36 Å²	36	21.2 Å²	21.2	22%	0.221	13%	0.134	C	C	.	.	H	α-helix	trans	-65.6	-35.4	177.9	-43.4	0	0	0	0	112.1	G75 A80 L81 F300	G75-T77 PolarHBondContact O-N 3.05Å; T77-A80 PolarHBondContact O-N 2.7Å; T77-L81 PolarHBondContact O-N 2.81Å; T77-F300 HydrophobicContact CG2-CD1 4.34Å; T77-F300 HydrophobicContact CG2-CE1 3.68Å; T77-F300 HydrophobicContact CG2-CZ 4.15Å
78	A	93.8	Very high	92.4	Very high	7 Å²	7	22.5 Å²	22.5	6%	0.058	15%	0.147	C	C	.	.	H	α-helix	trans	-66.4	-43.7	178.1	0	0	0	0	0	111.5	V21 L39 G75 K76 L81 A82	V21-A78 HydrophobicContact CG2-CB 4.1Å; L39-A78 HydrophobicContact CD2-CB 3.98Å; G75-A78 WeakPolarHBondContact O-CA 3.37Å; G75-A78 WeakPolarHBondContact O-CB 3.38Å; G75-A78 PolarHBondContact O-N 3.05Å; K76-A78 VanDerWaalsContact C-N 3.33Å; K76-A78 PolarHBondContact O-N 2.86Å; A78-L81 PolarHBondContact O-N 2.86Å; A78-A82 WeakPolarHBondContact O-CB 3.22Å; A78-A82 PolarHBondContact O-N 2.82Å
79	I	95.5	Very high	91.4	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-40.8	176.3	-63.8	167.7	0	0	0	110.6	L24 Q42 A45 A49 M68 G75 K76 L81 A82 I83 T363	L24-I79 HydrophobicContact CD2-CG2 4.1Å; Q42-I79 HydrophobicContact CB-CD1 4.38Å; A45-I79 HydrophobicContact CB-CD1 3.76Å; A49-I79 HydrophobicContact CB-CG2 3.71Å; M68-I79 HydrophobicContact CE-CB 3.84Å; M68-I79 HydrophobicContact CE-CD1 3.76Å; M68-I79 HydrophobicContact CE-CG1 4.41Å; M68-I79 HydrophobicContact CE-CG2 3.69Å; G75-I79 WeakPolarHBondContact O-CG1 3.19Å; G75-I79 PolarHBondContact O-N 2.89Å; K76-I79 PolarHBondContact O-N 2.83Å; I79-L81 VanDerWaalsContact C-N 3.34Å; I79-L81 PolarHBondContact O-N 2.83Å; I79-A82 WeakPolarHBondContact O-CB 3.43Å; I79-A82 PolarHBondContact O-N 3.12Å; I79-I83 HydrophobicContact CG2-CD1 4.32Å; I79-I83 WeakPolarHBondContact O-CG1 3.39Å; I79-I83 PolarHBondContact O-N 3.11Å; I79-T363 HydrophobicContact CD1-CG2 4.08Å
80	A	93.7	Very high	90.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-41.3	176.1	0	0	0	0	0	112.5	K76 T77 I83 A84 F93 F300 I328	K76-A80 PolarHBondContact O-N 3.34Å; K76-A80 VanDerWaalsContact O-N 3.08Å; T77-A80 PolarHBondContact O-N 2.7Å; A80-I83 PolarHBondContact O-N 3.05Å; A80-A84 PolarHBondContact O-N 2.79Å; A80-F93 HydrophobicContact CB-CE2 4.36Å; A80-F300 HydrophobicContact CB-CD2 3.36Å; A80-F300 HydrophobicContact CB-CE2 3.63Å; A80-F300 HydrophobicContact CB-CG 4Å; A80-F300 HydrophobicContact CB-CZ 4.47Å; A80-I328 HydrophobicContact CB-CD1 4.27Å; A80-I328 HydrophobicContact CB-CG2 4.21Å
81	L	92.4	Very high	90.1	Very high	31 Å²	31	31.9 Å²	31.9	16%	0.162	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-39.4	173.9	-175.8	65	0	0	0	111.6	H18 V21 T77 A78 I79 A84 Q85 F93	H18-L81 HydrophobicContact CB-CD2 3.63Å; V21-L81 HydrophobicContact CB-CD2 4.35Å; T77-L81 PolarHBondContact O-N 2.81Å; A78-L81 PolarHBondContact O-N 2.86Å; I79-L81 VanDerWaalsContact C-N 3.34Å; I79-L81 PolarHBondContact O-N 2.83Å; L81-A84 WeakPolarHBondContact O-CB 3.25Å; L81-A84 PolarHBondContact O-N 2.86Å; L81-A84 VanDerWaalsContact O-N 3.16Å; L81-Q85 WeakPolarHBondContact O-CG 3.3Å; L81-Q85 PolarHBondContact O-N 2.98Å; L81-F93 HydrophobicContact CB-CZ 4.35Å; L81-F93 HydrophobicContact CD1-CD1 3.68Å; L81-F93 HydrophobicContact CD1-CE1 3.8Å; L81-F93 HydrophobicContact CD1-CG 4.08Å; L81-F93 HydrophobicContact CD1-CZ 4.29Å
82	A	93.9	Very high	89.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-40.9	176.3	0	0	0	0	0	112.5	V21 L24 L39 A78 I79 A84 Q85 D86	V21-A82 HydrophobicContact CG1-CB 3.73Å; L24-A82 HydrophobicContact CD2-CB 3.56Å; L24-A82 HydrophobicContact CG-CB 3.97Å; L39-A82 HydrophobicContact CD1-CB 3.82Å; A78-A82 WeakPolarHBondContact O-CB 3.22Å; A78-A82 PolarHBondContact O-N 2.82Å; I79-A82 WeakPolarHBondContact O-CB 3.43Å; I79-A82 PolarHBondContact O-N 3.12Å; A82-A84 VanDerWaalsContact C-N 3.29Å; A82-A84 PolarHBondContact O-N 2.87Å; A82-Q85 PolarHBondContact O-N 2.93Å; A82-D86 PolarHBondContact O-N 2.79Å
83	I	93.9	Very high	90	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-55.1	-46.9	171.5	-70.7	164.9	0	0	0	110.1	L24 A49 V53 I56 I79 A80 Q85 D86 L87 I328	L24-I83 HydrophobicContact CD1-CG1 4.24Å; L24-I83 HydrophobicContact CD2-CG1 4.25Å; A49-I83 HydrophobicContact CB-CD1 3.79Å; A49-I83 HydrophobicContact CB-CG1 3.79Å; V53-I83 HydrophobicContact CG2-CB 4.3Å; V53-I83 HydrophobicContact CG2-CG1 4.29Å; V53-I83 HydrophobicContact CG2-CG2 3.9Å; I56-I83 HydrophobicContact CD1-CG2 4.38Å; I79-I83 HydrophobicContact CG2-CD1 4.32Å; I79-I83 WeakPolarHBondContact O-CG1 3.39Å; I79-I83 PolarHBondContact O-N 3.11Å; A80-I83 PolarHBondContact O-N 3.05Å; I83-Q85 PolarHBondContact O-N 2.93Å; I83-D86 PolarHBondContact O-N 3.22Å; I83-L87 HydrophobicContact CG2-CD1 4.04Å; I83-L87 HydrophobicContact CG2-CG 4.49Å; I83-L87 VanDerWaalsContact O-CG 3.27Å; I83-L87 WeakPolarHBondContact O-CG 3.45Å; I83-L87 PolarHBondContact O-N 2.95Å; I83-I328 HydrophobicContact CB-CD1 4.41Å; I83-I328 HydrophobicContact CD1-CD1 3.71Å; I83-I328 HydrophobicContact CG2-CD1 4.2Å
84	A	90.3	Very high	90.3	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.033	18%	0.176	C	C	.	.	H	α-helix	trans	-64.5	-39.6	179.7	0	0	0	0	0	112.8	A80 L81 A82 L87 G88 F93 V298	A80-A84 PolarHBondContact O-N 2.79Å; L81-A84 WeakPolarHBondContact O-CB 3.25Å; L81-A84 PolarHBondContact O-N 2.86Å; L81-A84 VanDerWaalsContact O-N 3.16Å; A82-A84 VanDerWaalsContact C-N 3.29Å; A82-A84 PolarHBondContact O-N 2.87Å; A84-L87 PolarHBondContact O-N 3.46Å; A84-G88 PolarHBondContact O-N 3.15Å; A84-F93 HydrophobicContact CB-CB 3.92Å; A84-F93 HydrophobicContact CB-CD2 3.57Å; A84-F93 HydrophobicContact CB-CE2 4.43Å; A84-F93 HydrophobicContact CB-CG 4.03Å; A84-V298 HydrophobicContact CB-CB 4.42Å; A84-V298 HydrophobicContact CB-CG2 4.19Å
85	Q	91.2	Very high	90.3	Very high	79 Å²	79	32.5 Å²	32.5	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-63.5	-42.3	175.8	-67	-61	-28.2	0	0	112	L81 A82 I83 L87 G88	L81-Q85 WeakPolarHBondContact O-CG 3.3Å; L81-Q85 PolarHBondContact O-N 2.98Å; A82-Q85 PolarHBondContact O-N 2.93Å; I83-Q85 PolarHBondContact O-N 2.93Å; Q85-L87 VanDerWaalsContact C-N 3.35Å; Q85-L87 PolarHBondContact O-N 2.6Å; Q85-G88 WeakPolarHBondContact O-CA 3.4Å; Q85-G88 PolarHBondContact O-N 2.76Å
86	D	92	Very high	90.3	Very high	45 Å²	45	32 Å²	32	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-71.9	-27.3	179.2	-77.2	10.1	0	0	0	112.7	G23 L24 V53 R57 A82 I83 G88	G23-D86 WeakPolarHBondContact CA-OD1 3.11Å; L24-D86 WeakPolarHBondContact CB-OD2 3.26Å; L24-D86 WeakPolarHBondContact CD1-OD2 3.34Å; L24-D86 VanDerWaalsContact CG-OD2 3.29Å; L24-D86 WeakPolarHBondContact CG-OD2 3.43Å; L24-D86 PolarHBondContact N-OD1 3.02Å; L24-D86 PolarHBondContact N-OD2 2.97Å; V53-D86 HydrophobicContact CG1-CB 4.33Å; V53-D86 HydrophobicContact CG2-CB 4.26Å; R57-D86 PolarHBondContact NH2-O 2.97Å; A82-D86 PolarHBondContact O-N 2.79Å; I83-D86 PolarHBondContact O-N 3.22Å; D86-G88 PolarHBondContact O-N 3.41Å
87	L	89.6	Confident	90.3	Very high	31 Å²	31	33.3 Å²	33.3	16%	0.162	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-26.5	168.6	-69.1	170.5	0	0	0	111.9	V53 I56 R57 I83 A84 Q85 V91 V298 I326	V53-L87 HydrophobicContact CG1-CD2 4.06Å; I56-L87 HydrophobicContact CB-CD2 3.86Å; I56-L87 HydrophobicContact CD1-CD1 4.04Å; I56-L87 HydrophobicContact CD1-CD2 4.21Å; I56-L87 HydrophobicContact CG2-CD1 4.25Å; I56-L87 HydrophobicContact CG2-CD2 3.43Å; I56-L87 VanDerWaalsContact CG2-CD2 3.43Å; I56-L87 HydrophobicContact CG2-CG 4.5Å; R57-L87 HydrophobicContact CG-CD2 4.46Å; I83-L87 HydrophobicContact CG2-CD1 4.04Å; I83-L87 HydrophobicContact CG2-CG 4.49Å; I83-L87 VanDerWaalsContact O-CG 3.27Å; I83-L87 WeakPolarHBondContact O-CG 3.45Å; I83-L87 PolarHBondContact O-N 2.95Å; A84-L87 PolarHBondContact O-N 3.46Å; Q85-L87 VanDerWaalsContact C-N 3.35Å; Q85-L87 PolarHBondContact O-N 2.6Å; L87-V91 HydrophobicContact CB-CB 4.29Å; L87-V91 HydrophobicContact CB-CG1 4.18Å; L87-V91 HydrophobicContact CB-CG2 3.94Å; L87-V91 HydrophobicContact CD1-CG1 4.45Å; L87-V298 HydrophobicContact CD1-CG2 3.59Å; L87-I326 HydrophobicContact CD1-CD1 3.96Å
88	G	86.1	Confident	90.3	Very high	27 Å²	27	31.6 Å²	31.6	28%	0.278	19%	0.191	S	C	.	.			trans	135.5	145.9	169.7	0	0	0	0	0	112.2	A84 Q85 D86 K90 V91	A84-G88 PolarHBondContact O-N 3.15Å; Q85-G88 WeakPolarHBondContact O-CA 3.4Å; Q85-G88 PolarHBondContact O-N 2.76Å; D86-G88 PolarHBondContact O-N 3.41Å; G88-K90 PolarHBondContact O-N 2.84Å; G88-V91 VanDerWaalsContact O-CB 3.31Å; G88-V91 WeakPolarHBondContact O-CB 3.14Å; G88-V91 WeakPolarHBondContact O-CG2 3.42Å; G88-V91 PolarHBondContact O-N 3.3Å
89	G	76.6	Confident	90.2	Very high	71 Å²	71	33.8 Å²	33.8	73%	0.732	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-7.1	-175.9	0	0	0	0	0	116.3
90	K	78.9	Confident	90	Very high	124 Å²	124	38.4 Å²	38.4	54%	0.539	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	2	174.5	-60	-172.1	170.3	-158.7	0	113.7	G88 R123 D237	G88-K90 PolarHBondContact O-N 2.84Å; K90-R123 VanDerWaalsContact CD-NH2 3.3Å; K90-D237 IonicContact NZ-OD2 3.54Å
91	V	84.9	Confident	90	Very high	27 Å²	27	38.4 Å²	38.4	16%	0.164	23%	0.228	C	C	.	.	S	Bend	trans	-79.4	126.2	177.9	177	0	0	0	0	108.3	L87 G88 F93 V295	L87-V91 HydrophobicContact CB-CB 4.29Å; L87-V91 HydrophobicContact CB-CG1 4.18Å; L87-V91 HydrophobicContact CB-CG2 3.94Å; L87-V91 HydrophobicContact CD1-CG1 4.45Å; G88-V91 VanDerWaalsContact O-CB 3.31Å; G88-V91 WeakPolarHBondContact O-CB 3.14Å; G88-V91 WeakPolarHBondContact O-CG2 3.42Å; G88-V91 PolarHBondContact O-N 3.3Å; V91-F93 PolarHBondContact O-N 3.36Å; V91-V295 HydrophobicContact CG2-CG1 4.21Å
92	P	87.9	Confident	89.9	Confident	26 Å²	26	41.2 Å²	41.2	17%	0.169	24%	0.236	C	C	.	.			trans	-61.4	131.4	178.6	-22.9	33	0	0	0	111.5	G297 V298	P92-G297 CarbonylContact O-C 3.54Å; P92-G297 WeakPolarHBondContact O-CA 3.45Å; P92-V298 PolarHBondContact O-N 2.95Å
93	F	90.4	Very high	89.6	Confident	55 Å²	55	43.3 Å²	43.3	24%	0.241	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.1	170.2	179.6	-103.8	0	0	0	108.8	A80 L81 A84 V91 P95 V298 F300	A80-F93 HydrophobicContact CB-CE2 4.36Å; L81-F93 HydrophobicContact CB-CZ 4.35Å; L81-F93 HydrophobicContact CD1-CD1 3.68Å; L81-F93 HydrophobicContact CD1-CE1 3.8Å; L81-F93 HydrophobicContact CD1-CG 4.08Å; L81-F93 HydrophobicContact CD1-CZ 4.29Å; A84-F93 HydrophobicContact CB-CB 3.92Å; A84-F93 HydrophobicContact CB-CD2 3.57Å; A84-F93 HydrophobicContact CB-CE2 4.43Å; A84-F93 HydrophobicContact CB-CG 4.03Å; V91-F93 PolarHBondContact O-N 3.36Å; F93-P95 HydrophobicContact CD1-CG 4.21Å; F93-P95 HydrophobicContact CE1-CB 3.83Å; F93-P95 HydrophobicContact CE1-CG 3.91Å; F93-P95 HydrophobicContact CZ-CB 4.35Å; F93-P95 WeakPolarHBondContact O-CD 3.48Å; F93-V298 HydrophobicContact CD2-CB 3.99Å; F93-V298 HydrophobicContact CD2-CG1 3.96Å; F93-V298 HydrophobicContact CE2-CG1 4.06Å; F93-F300 HydrophobicContact CE2-CB 3.74Å; F93-F300 HydrophobicContact CE2-CG 4.47Å; F93-F300 HydrophobicContact CZ-CB 3.74Å; F93-F300 HydrophobicContact CZ-CD1 4.35Å; F93-F300 HydrophobicContact CZ-CG 4.16Å
94	C	92.6	Very high	89.3	Confident	12 Å²	12	49.4 Å²	49.4	8%	0.081	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	95.2	-178.3	-167.6	0	0	0	0	109.6	N115 A119 V298 L299 F300	C94-N115 PolarHBondContact SG-OD1 3.35Å; C94-N115 VanDerWaalsContact SG-OD1 3.33Å; C94-A119 HydrophobicContact CB-CB 3.99Å; C94-V298 PolarHBondContact N-O 3.11Å; C94-L299 HydrophobicContact CB-CD1 4.17Å; C94-F300 PolarHBondContact O-N 2.79Å
95	P	92.9	Very high	89	Confident	76 Å²	76	54.2 Å²	54.2	49%	0.494	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	134	170.9	31.5	-31.2	0	0	0	110.3	F93 F300	F93-P95 HydrophobicContact CD1-CG 4.21Å; F93-P95 HydrophobicContact CE1-CB 3.83Å; F93-P95 HydrophobicContact CE1-CG 3.91Å; F93-P95 HydrophobicContact CZ-CB 4.35Å; F93-P95 WeakPolarHBondContact O-CD 3.48Å; P95-F300 CarbonylContact C-O 3.57Å; P95-F300 WeakPolarHBondContact CA-O 3.25Å; P95-F300 HydrophobicContact CB-CD1 4.32Å
96	M	93.2	Very high	88.9	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.8	169.1	65.2	173.2	-69.2	0	0	110.1	V101 L112 N115 L299 F300 I301 D302	M96-V101 HydrophobicContact CE-CG1 3.74Å; M96-L112 HydrophobicContact CE-CD2 3.84Å; M96-L112 HydrophobicContact SD-CD2 4.27Å; M96-N115 HydrophobicContact SD-CB 3.83Å; M96-L299 HydrophobicContact CG-CD1 4.12Å; M96-L299 HydrophobicContact SD-CD1 3.97Å; M96-F300 PolarHBondContact N-O 3.17Å; M96-I301 HydrophobicContact CG-CB 4.17Å; M96-I301 HydrophobicContact CG-CD1 4.4Å; M96-I301 HydrophobicContact CG-CG1 3.74Å; M96-I301 HydrophobicContact CG-CG2 4.22Å; M96-I301 CarbonylContact O-C 3.1Å; M96-I301 WeakPolarHBondContact O-CA 3.39Å; M96-I301 HydrophobicContact SD-CD1 3.77Å; M96-I301 HydrophobicContact SD-CG1 3.78Å; M96-I301 HydrophobicContact SD-CG2 4.5Å; M96-D302 PolarHBondContact O-N 2.9Å
97	V	94	Very high	88.8	Confident	43 Å²	43	54.6 Å²	54.6	26%	0.261	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	140.6	169.5	-173.7	0	0	0	0	109.6	S99 E100 E303	V97-S99 WeakPolarHBondContact CG1-OG 3.1Å; V97-S99 PolarHBondContact O-N 3.05Å; V97-E100 HydrophobicContact CB-CG 4.13Å; V97-E100 WeakPolarHBondContact CB-OE1 3.3Å; V97-E100 WeakPolarHBondContact CG2-OE1 3Å; V97-E100 PolarHBondContact N-OE1 3.32Å; V97-E100 VanDerWaalsContact O-CB 3.28Å; V97-E100 WeakPolarHBondContact O-CB 3.18Å; V97-E100 PolarHBondContact O-N 3.32Å; V97-E303 HydrophobicContact CG1-CB 4.2Å; V97-E303 HydrophobicContact CG1-CG 4.33Å
98	G	92.1	Very high	89	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-57.6	-22.5	-178.2	0	0	0	0	0	114.3	V101 D302 L307	G98-V101 WeakPolarHBondContact O-CG2 3.5Å; G98-D302 PolarHBondContact N-O 2.62Å; G98-L307 VanDerWaalsContact O-CD2 3.3Å; G98-L307 WeakPolarHBondContact O-CD2 3.4Å
99	S	92.5	Very high	89.2	Confident	53 Å²	53	57.4 Å²	57.4	37%	0.371	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-77.7	-15.5	174.2	56	0	0	0	0	114.2	V97 V101 Y102	V97-S99 WeakPolarHBondContact CG1-OG 3.1Å; V97-S99 PolarHBondContact O-N 3.05Å; S99-V101 PolarHBondContact O-N 3.33Å; S99-Y102 WeakPolarHBondContact O-CD2 3.26Å; S99-Y102 PolarHBondContact O-N 3.49Å
100	E	91.6	Very high	89.9	Confident	100 Å²	100	54.8 Å²	54.8	47%	0.467	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-71.2	-16	-179.1	-68	175.2	-146.7	0	0	113.4	V97 Y102	V97-E100 HydrophobicContact CB-CG 4.13Å; V97-E100 WeakPolarHBondContact CB-OE1 3.3Å; V97-E100 WeakPolarHBondContact CG2-OE1 3Å; V97-E100 PolarHBondContact N-OE1 3.32Å; V97-E100 VanDerWaalsContact O-CB 3.28Å; V97-E100 WeakPolarHBondContact O-CB 3.18Å; V97-E100 PolarHBondContact O-N 3.32Å; E100-Y102 PolarHBondContact O-N 2.82Å
101	V	92.1	Very high	90.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-66.3	-23.2	177.4	-56.2	0	0	0	0	112.7	M96 G98 S99 S103 K108 L112 L307	M96-V101 HydrophobicContact CE-CG1 3.74Å; G98-V101 WeakPolarHBondContact O-CG2 3.5Å; S99-V101 PolarHBondContact O-N 3.33Å; V101-S103 PolarHBondContact O-N 3.14Å; V101-S103 VanDerWaalsContact O-N 3.14Å; V101-K108 HydrophobicContact CB-CB 4.31Å; V101-K108 WeakPolarHBondContact O-CA 3.2Å; V101-L112 HydrophobicContact CG1-CD2 3.81Å; V101-L112 HydrophobicContact CG1-CG 3.93Å; V101-L307 HydrophobicContact CB-CD2 4.3Å; V101-L307 HydrophobicContact CG1-CD2 3.58Å; V101-L307 HydrophobicContact CG2-CD2 3.76Å
102	Y	91.5	Very high	90.9	Very high	89 Å²	89	48 Å²	48	35%	0.349	26%	0.26	S	S	.	.			trans	-83.4	93.1	-179	-56.3	-75.9	0	0	0	109.7	S99 E100 K108 M306	S99-Y102 WeakPolarHBondContact O-CD2 3.26Å; S99-Y102 PolarHBondContact O-N 3.49Å; E100-Y102 PolarHBondContact O-N 2.82Å; Y102-K108 HydrophobicContact CD1-CD 4.11Å; Y102-K108 HydrophobicContact CD1-CG 4.42Å; Y102-K108 HydrophobicContact CE1-CD 4.01Å; Y102-M306 WeakPolarHBondContact CE2-O 3.28Å; Y102-M306 PolarHBondContact OH-O 2.96Å
103	S	87.4	Confident	91.1	Very high	44 Å²	44	48.5 Å²	48.5	31%	0.308	26%	0.261	S	S	.	.			trans	-112.6	145.8	176.9	179.1	0	0	0	0	111.3	V101 E105 I106	V101-S103 PolarHBondContact O-N 3.14Å; V101-S103 VanDerWaalsContact O-N 3.14Å; S103-E105 PolarHBondContact OG-N 3.39Å; S103-E105 VanDerWaalsContact OG-N 3.15Å; S103-I106 PolarHBondContact OG-N 3.04Å
104	S	87.3	Confident	91.1	Very high	128 Å²	128	46.7 Å²	46.7	90%	0.895	25%	0.253	S	S	*	.	S	Bend	trans	-81	-17.3	171.1	65.6	0	0	0	0	113.3
105	E	84.8	Confident	91.1	Very high	106 Å²	106	46.6 Å²	46.6	50%	0.495	25%	0.251	S	S	.	.	S	Bend	trans	-99.4	-30	-173.4	-62	-172	170.9	0	0	113.5	S103 K268	S103-E105 PolarHBondContact OG-N 3.39Å; S103-E105 VanDerWaalsContact OG-N 3.15Å; E105-K268 HydrophobicContact CB-CB 4.37Å; E105-K268 VanDerWaalsContact OE2-CB 3.27Å; E105-K268 WeakPolarHBondContact OE2-CB 3.47Å; E105-K268 WeakPolarHBondContact OE2-CG 3.37Å; E105-K268 PolarHBondContact OE2-N 2.68Å
106	I	88.1	Confident	91.1	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.036	23%	0.23	C	C	.	.	S	Bend	trans	-139	149.7	-172.8	53.9	172.7	0	0	0	110.4	S103 E110 V111 K268 E270	S103-I106 PolarHBondContact OG-N 3.04Å; I106-E110 HydrophobicContact CB-CG 4.43Å; I106-V111 HydrophobicContact CD1-CG2 3.49Å; I106-V111 VanDerWaalsContact CD1-CG2 3.49Å; I106-V111 HydrophobicContact CG1-CG2 3.76Å; I106-K268 HydrophobicContact CD1-CD 4.03Å; I106-K268 HydrophobicContact CG2-CB 3.95Å; I106-E270 HydrophobicContact CB-CG 4.27Å; I106-E270 HydrophobicContact CG2-CG 3.85Å
107	K	91.2	Very high	91	Very high	124 Å²	124	43.7 Å²	43.7	54%	0.539	23%	0.231	S	C	.	.			trans	-60.4	150.5	176.5	-69.1	160.4	-167	140.4	0	112.2	T109 E110 V111 E270	K107-T109 VanDerWaalsContact C-N 3.28Å; K107-T109 PolarHBondContact O-N 2.89Å; K107-E110 HydrophobicContact CB-CB 4.37Å; K107-E110 WeakPolarHBondContact O-CB 3.23Å; K107-E110 PolarHBondContact O-N 2.97Å; K107-V111 PolarHBondContact O-N 2.82Å; K107-E270 WeakPolarHBondContact CD-OE1 3.5Å; K107-E270 VanDerWaalsContact CG-OE1 3.27Å; K107-E270 WeakPolarHBondContact CG-OE1 3.3Å; K107-E270 PolarHBondContact N-OE1 2.75Å; K107-E270 VanDerWaalsContact N-OE1 3.09Å; K107-E270 IonicContact NZ-OE1 3.33Å; K107-E270 IonicContact NZ-OE2 3.96Å; K107-E270 PolarHBondContact NZ-OE2 3.25Å
108	K	92	Very high	91	Very high	62 Å²	62	46.7 Å²	46.7	27%	0.27	24%	0.237	S	C	.	.	H	α-helix	trans	-54.7	-42.9	176.9	-52.1	174.4	-160.9	157.4	0	112.7	V101 Y102 E110 V111 L112 D308 E310	V101-K108 HydrophobicContact CB-CB 4.31Å; V101-K108 WeakPolarHBondContact O-CA 3.2Å; Y102-K108 HydrophobicContact CD1-CD 4.11Å; Y102-K108 HydrophobicContact CD1-CG 4.42Å; Y102-K108 HydrophobicContact CE1-CD 4.01Å; K108-E110 VanDerWaalsContact C-N 3.27Å; K108-E110 PolarHBondContact O-N 2.9Å; K108-V111 PolarHBondContact O-N 3.47Å; K108-L112 PolarHBondContact O-N 3.39Å; K108-D308 WeakPolarHBondContact CE-OD2 3.48Å; K108-D308 IonicContact NZ-OD2 3.05Å; K108-D308 PolarHBondContact NZ-OD2 2.92Å; K108-E310 IonicContact NZ-OE2 3.81Å; K108-E310 PolarHBondContact NZ-OE2 3.3Å
109	T	90.6	Very high	90.9	Very high	55 Å²	55	46.7 Å²	46.7	34%	0.337	24%	0.237	S	C	.	.	H	α-helix	trans	-65.3	-31.1	178.4	51.4	0	0	0	0	112.6	K107 L112 M113 Y314	K107-T109 VanDerWaalsContact C-N 3.28Å; K107-T109 PolarHBondContact O-N 2.89Å; T109-L112 PolarHBondContact O-N 3.41Å; T109-M113 WeakPolarHBondContact O-CB 3.15Å; T109-M113 PolarHBondContact O-N 2.85Å; T109-Y314 HydrophobicContact CG2-CD2 3.96Å; T109-Y314 HydrophobicContact CG2-CG 4.05Å
110	E	91.5	Very high	90.8	Very high	16 Å²	16	44.5 Å²	44.5	8%	0.075	22%	0.221	C	C	.	.	H	α-helix	trans	-70.8	-41.4	176.7	-177	61.9	-173.8	0	0	111	I106 K107 K108 L112 M113 E114 E270 I271 R276	I106-E110 HydrophobicContact CB-CG 4.43Å; K107-E110 HydrophobicContact CB-CB 4.37Å; K107-E110 WeakPolarHBondContact O-CB 3.23Å; K107-E110 PolarHBondContact O-N 2.97Å; K108-E110 VanDerWaalsContact C-N 3.27Å; K108-E110 PolarHBondContact O-N 2.9Å; E110-L112 VanDerWaalsContact C-N 3.3Å; E110-L112 PolarHBondContact O-N 2.95Å; E110-M113 PolarHBondContact O-N 3.47Å; E110-M113 VanDerWaalsContact O-N 3.16Å; E110-E114 WeakPolarHBondContact O-CG 3.39Å; E110-E114 PolarHBondContact O-N 2.93Å; E110-E270 HydrophobicContact CG-CB 4.31Å; E110-E270 HydrophobicContact CG-CG 4.26Å; E110-I271 PolarHBondContact OE1-N 2.99Å; E110-R276 IonicContact OE1-CZ 2.76Å; E110-R276 IonicContact OE1-NH1 2.81Å; E110-R276 IonicContact OE1-NH2 3.14Å; E110-R276 PolarHBondContact OE1-NH2 3.14Å; E110-R276 IonicContact OE2-CZ 2.98Å; E110-R276 IonicContact OE2-NH1 2.7Å; E110-R276 PolarHBondContact OE2-NH1 3.45Å; E110-R276 IonicContact OE2-NH2 3.84Å; E110-R276 PolarHBondContact OE2-NH2 3.46Å; E110-R276 VanDerWaalsContact OE2-NH2 3.13Å
111	V	92.5	Very high	90.8	Very high	10 Å²	10	40 Å²	40	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-58.4	-44.4	173.6	-178.2	0	0	0	0	111	I106 K107 K108 E114 N115	I106-V111 HydrophobicContact CD1-CG2 3.49Å; I106-V111 VanDerWaalsContact CD1-CG2 3.49Å; I106-V111 HydrophobicContact CG1-CG2 3.76Å; K107-V111 PolarHBondContact O-N 2.82Å; K108-V111 PolarHBondContact O-N 3.47Å; V111-E114 PolarHBondContact O-N 3.29Å; V111-N115 PolarHBondContact O-N 3.49Å; V111-N115 VanDerWaalsContact O-N 3.17Å; V111-N115 PolarHBondContact O-ND2 3.49Å
112	L	92.9	Very high	90.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-46.6	175.9	-70.8	168.3	0	0	0	110.8	M96 V101 K108 T109 E110 E114 N115 F116 I301 C311 Y314 L315	M96-L112 HydrophobicContact CE-CD2 3.84Å; M96-L112 HydrophobicContact SD-CD2 4.27Å; V101-L112 HydrophobicContact CG1-CD2 3.81Å; V101-L112 HydrophobicContact CG1-CG 3.93Å; K108-L112 PolarHBondContact O-N 3.39Å; T109-L112 PolarHBondContact O-N 3.41Å; E110-L112 VanDerWaalsContact C-N 3.3Å; E110-L112 PolarHBondContact O-N 2.95Å; L112-E114 PolarHBondContact O-N 3.04Å; L112-N115 PolarHBondContact O-N 2.97Å; L112-F116 VanDerWaalsContact O-CD2 3.3Å; L112-F116 WeakPolarHBondContact O-CD2 3.5Å; L112-F116 PolarHBondContact O-N 3.17Å; L112-I301 HydrophobicContact CD2-CD1 4.48Å; L112-C311 HydrophobicContact CD1-CB 3.83Å; L112-Y314 HydrophobicContact CB-CD1 3.94Å; L112-Y314 HydrophobicContact CB-CE1 3.8Å; L112-Y314 HydrophobicContact CD1-CD1 3.92Å; L112-L315 HydrophobicContact CD1-CG 4.47Å; L112-L315 HydrophobicContact CD2-CD2 4.26Å
113	M	91.3	Very high	90.7	Very high	36 Å²	36	38.2 Å²	38.2	18%	0.177	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-40.8	-179.8	-168.9	50.1	175.6	0	0	113.1	T109 E110 N115 F116 R117 Y314	T109-M113 WeakPolarHBondContact O-CB 3.15Å; T109-M113 PolarHBondContact O-N 2.85Å; E110-M113 PolarHBondContact O-N 3.47Å; E110-M113 VanDerWaalsContact O-N 3.16Å; M113-N115 VanDerWaalsContact C-N 3.35Å; M113-N115 PolarHBondContact O-N 2.9Å; M113-F116 PolarHBondContact O-N 3.11Å; M113-R117 HydrophobicContact CE-CG 4.21Å; M113-R117 WeakPolarHBondContact O-CB 3.01Å; M113-R117 VanDerWaalsContact O-CG 3.26Å; M113-R117 WeakPolarHBondContact O-CG 3.21Å; M113-R117 PolarHBondContact O-N 3.09Å; M113-R117 HydrophobicContact SD-CG 4.44Å; M113-Y314 VanDerWaalsContact CB-OH 3.24Å; M113-Y314 WeakPolarHBondContact CB-OH 3.28Å; M113-Y314 WeakPolarHBondContact CG-OH 3.45Å; M113-Y314 PolarHBondContact SD-OH 3.18Å
114	E	91.9	Very high	90.9	Very high	17 Å²	17	37 Å²	37	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-58.7	-46	173.8	-74	-175.8	173.1	0	0	111.4	E110 V111 L112 R117 R118	E110-E114 WeakPolarHBondContact O-CG 3.39Å; E110-E114 PolarHBondContact O-N 2.93Å; V111-E114 PolarHBondContact O-N 3.29Å; L112-E114 PolarHBondContact O-N 3.04Å; E114-R117 PolarHBondContact O-N 3.17Å; E114-R118 WeakPolarHBondContact O-CG 3.27Å; E114-R118 PolarHBondContact O-N 3.47Å
115	N	92.6	Very high	91	Very high	9 Å²	9	36.5 Å²	36.5	5%	0.048	17%	0.166	C	C	.	.	H	α-helix	trans	-67	-37.3	178.5	-77.1	-72.6	0	0	0	112.6	C94 M96 V111 L112 M113 R117 R118 A119 L299	C94-N115 PolarHBondContact SG-OD1 3.35Å; C94-N115 VanDerWaalsContact SG-OD1 3.33Å; M96-N115 HydrophobicContact SD-CB 3.83Å; V111-N115 PolarHBondContact O-N 3.49Å; V111-N115 VanDerWaalsContact O-N 3.17Å; V111-N115 PolarHBondContact O-ND2 3.49Å; L112-N115 PolarHBondContact O-N 2.97Å; M113-N115 VanDerWaalsContact C-N 3.35Å; M113-N115 PolarHBondContact O-N 2.9Å; N115-R117 VanDerWaalsContact C-N 3.34Å; N115-R117 PolarHBondContact O-N 3.11Å; N115-R118 PolarHBondContact O-N 3.13Å; N115-A119 WeakPolarHBondContact O-CB 3.43Å; N115-A119 PolarHBondContact O-N 2.87Å; N115-L299 HydrophobicContact CB-CD1 3.88Å
116	F	92.5	Very high	91	Very high	10 Å²	10	35.6 Å²	35.6	4%	0.044	16%	0.162	C	C	.	.	H	α-helix	trans	-58.7	-46.1	170.5	-93.8	-105.8	0	0	0	111.4	L112 M113 A119 I120 L299 L315 A318 P325 V327	L112-F116 VanDerWaalsContact O-CD2 3.3Å; L112-F116 WeakPolarHBondContact O-CD2 3.5Å; L112-F116 PolarHBondContact O-N 3.17Å; M113-F116 PolarHBondContact O-N 3.11Å; F116-A119 PolarHBondContact O-N 3.43Å; F116-I120 WeakPolarHBondContact O-CD1 3.28Å; F116-I120 WeakPolarHBondContact O-CG1 3.38Å; F116-I120 PolarHBondContact O-N 3.31Å; F116-L299 HydrophobicContact CD2-CD2 3.4Å; F116-L299 HydrophobicContact CE2-CD2 3.35Å; F116-L299 HydrophobicContact CG-CD2 4.08Å; F116-L299 HydrophobicContact CZ-CD2 4Å; F116-L315 HydrophobicContact CE2-CD2 3.44Å; F116-L315 VanDerWaalsContact CE2-CD2 3.44Å; F116-L315 HydrophobicContact CZ-CD2 3.76Å; F116-A318 HydrophobicContact CD1-CB 4.23Å; F116-A318 HydrophobicContact CE1-CB 3.67Å; F116-A318 HydrophobicContact CE2-CB 4.4Å; F116-A318 HydrophobicContact CZ-CB 3.76Å; F116-P325 VanDerWaalsContact CD1-CD 3.42Å; F116-P325 HydrophobicContact CD1-CG 3.77Å; F116-P325 HydrophobicContact CE1-CG 4.14Å; F116-P325 HydrophobicContact CG-CG 4.32Å; F116-V327 HydrophobicContact CE1-CG2 4.15Å; F116-V327 HydrophobicContact CZ-CG2 3.88Å
117	R	91.6	Very high	91	Very high	9 Å²	9	40.7 Å²	40.7	3%	0.034	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-34.1	179.3	-72.1	-82.4	178.2	149.7	-12.4	112.8	M113 E114 N115 A119 I120 L240 H241 D244 N280	M113-R117 HydrophobicContact CE-CG 4.21Å; M113-R117 WeakPolarHBondContact O-CB 3.01Å; M113-R117 VanDerWaalsContact O-CG 3.26Å; M113-R117 WeakPolarHBondContact O-CG 3.21Å; M113-R117 PolarHBondContact O-N 3.09Å; M113-R117 HydrophobicContact SD-CG 4.44Å; E114-R117 PolarHBondContact O-N 3.17Å; N115-R117 VanDerWaalsContact C-N 3.34Å; N115-R117 PolarHBondContact O-N 3.11Å; R117-A119 VanDerWaalsContact C-N 3.35Å; R117-I120 PolarHBondContact O-N 3.28Å; R117-L240 HydrophobicContact CB-CB 4.3Å; R117-L240 PolarHBondContact O-N 3.45Å; R117-H241 HydrophobicContact CB-CB 3.82Å; R117-H241 PolarHBondContact O-N 3.05Å; R117-D244 VanDerWaalsContact CD-OD2 3.31Å; R117-D244 WeakPolarHBondContact CD-OD2 3.37Å; R117-D244 IonicContact CZ-OD2 3.73Å; R117-D244 IonicContact NE-OD2 2.75Å; R117-D244 IonicContact NH1-OD1 3.35Å; R117-D244 PolarHBondContact NH1-OD1 2.83Å; R117-D244 VanDerWaalsContact NH1-OD1 3.16Å; R117-D244 IonicContact NH1-OD2 2.66Å; R117-D244 PolarHBondContact NH1-OD2 2.85Å; R117-N280 VanDerWaalsContact CZ-OD1 3.26Å; R117-N280 PolarHBondContact NH1-OD1 3.13Å; R117-N280 VanDerWaalsContact NH2-CG 3.35Å; R117-N280 PolarHBondContact NH2-ND2 3.47Å; R117-N280 PolarHBondContact NH2-OD1 3.47Å
118	R	92.5	Very high	90.8	Very high	105 Å²	105	37.2 Å²	37.2	40%	0.396	17%	0.173	S	C	.	.	H	α-helix	trans	-68.6	-34	173.5	-74.3	176.4	-176.6	-177.3	-0	112.5	E114 N115 I120 T239 H241	E114-R118 WeakPolarHBondContact O-CG 3.27Å; E114-R118 PolarHBondContact O-N 3.47Å; N115-R118 PolarHBondContact O-N 3.13Å; R118-I120 PolarHBondContact O-N 3.09Å; R118-T239 WeakPolarHBondContact O-CG2 3.42Å; R118-H241 HydrophobicContact CB-CB 4.35Å; R118-H241 HydrophobicContact CG-CB 3.49Å; R118-H241 VanDerWaalsContact CG-CB 3.49Å; R118-H241 PolarHBondContact NE-CD2 3.3Å; R118-H241 PolarHBondContact NE-NE2 3.26Å; R118-H241 VanDerWaalsContact NE-NE2 3.13Å; R118-H241 PolarHBondContact NH2-NE2 2.95Å
119	A	91.4	Very high	90.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-1.6	176.9	0	0	0	0	0	113.3	C94 N115 F116 R117 G297 L299 P325	C94-A119 HydrophobicContact CB-CB 3.99Å; N115-A119 WeakPolarHBondContact O-CB 3.43Å; N115-A119 PolarHBondContact O-N 2.87Å; F116-A119 PolarHBondContact O-N 3.43Å; R117-A119 VanDerWaalsContact C-N 3.35Å; A119-G297 CarbonylContact O-C 3.46Å; A119-G297 WeakPolarHBondContact O-CA 3.49Å; A119-G297 PolarHBondContact O-N 3.44Å; A119-L299 HydrophobicContact CB-CB 3.89Å; A119-P325 HydrophobicContact CB-CB 3.59Å; A119-P325 HydrophobicContact CB-CG 3.85Å
120	I	90.6	Very high	90.8	Very high	7 Å²	7	34.9 Å²	34.9	4%	0.036	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	113	176.1	-59.1	160.7	0	0	0	108.9	F116 R117 R118 T239 L240 L294 I323 P325	F116-I120 WeakPolarHBondContact O-CD1 3.28Å; F116-I120 WeakPolarHBondContact O-CG1 3.38Å; F116-I120 PolarHBondContact O-N 3.31Å; R117-I120 PolarHBondContact O-N 3.28Å; R118-I120 PolarHBondContact O-N 3.09Å; I120-T239 WeakPolarHBondContact O-CA 3.39Å; I120-L240 HydrophobicContact CB-CD1 3.91Å; I120-L240 HydrophobicContact CB-CG 4.09Å; I120-L240 HydrophobicContact CD1-CD1 4.02Å; I120-L240 HydrophobicContact CG2-CD1 3.58Å; I120-L240 HydrophobicContact CG2-CG 3.83Å; I120-L240 PolarHBondContact O-N 2.77Å; I120-L294 HydrophobicContact CG2-CD1 3.51Å; I120-L294 HydrophobicContact CG2-CD2 4.34Å; I120-L294 HydrophobicContact CG2-CG 4Å; I120-I323 WeakPolarHBondContact CD1-O 3.34Å; I120-P325 HydrophobicContact CG1-CB 4.27Å; I120-P325 HydrophobicContact CG1-CG 4.45Å
121	G	90.9	Very high	90.9	Very high	6 Å²	6	36.6 Å²	36.6	6%	0.062	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	148.9	176.1	0	0	0	0	0	112.1	V238 V295	G121-V238 CarbonylContact C-O 3.52Å; G121-V295 WeakPolarHBondContact CA-O 3.5Å; G121-V295 PolarHBondContact N-O 3.1Å; G121-V295 PolarHBondContact O-N 2.8Å
122	L	91.1	Very high	91	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.5	169.5	-172.9	69.5	0	0	0	107.6	I124 V238 L243 V283 A292 L294	L122-I124 HydrophobicContact CD2-CD1 4.1Å; L122-I124 HydrophobicContact CD2-CG1 4.06Å; L122-I124 HydrophobicContact CG-CG1 4.07Å; L122-V238 WeakPolarHBondContact CA-O 3.33Å; L122-V238 PolarHBondContact N-O 3.08Å; L122-V238 PolarHBondContact O-N 3.38Å; L122-L243 HydrophobicContact CD2-CD1 3.99Å; L122-V283 HydrophobicContact CD1-CG1 3.78Å; L122-V283 HydrophobicContact CD2-CG1 4.3Å; L122-V283 HydrophobicContact CD2-CG2 4.08Å; L122-A292 HydrophobicContact CD1-CB 3.69Å; L122-A292 HydrophobicContact CD2-CB 4.41Å; L122-A292 HydrophobicContact CG-CB 4.03Å; L122-L294 HydrophobicContact CD1-CD1 4.45Å
123	R	91.3	Very high	91.1	Very high	48 Å²	48	36.9 Å²	36.9	18%	0.181	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	109.9	174.7	175.4	166.4	-67.7	145.1	18.1	109	K90 K125 V235 D237 A292 E293 V295	K90-R123 VanDerWaalsContact CD-NH2 3.3Å; R123-K125 HydrophobicContact CG-CG 4.36Å; R123-V235 HydrophobicContact CG-CG1 3.68Å; R123-D237 WeakPolarHBondContact CB-OD1 3.43Å; R123-D237 IonicContact CZ-OD1 3.02Å; R123-D237 IonicContact NE-OD1 2.71Å; R123-D237 PolarHBondContact NE-OD1 3.43Å; R123-D237 IonicContact NE-OD2 3.37Å; R123-D237 IonicContact NH2-OD1 3.08Å; R123-D237 PolarHBondContact NH2-OD1 2.77Å; R123-D237 IonicContact NH2-OD2 3.67Å; R123-A292 CarbonylContact O-C 3.56Å; R123-A292 VanDerWaalsContact O-CA 3.25Å; R123-A292 WeakPolarHBondContact O-CA 3.37Å; R123-E293 HydrophobicContact CB-CB 4.49Å; R123-E293 PolarHBondContact N-O 3.16Å; R123-E293 PolarHBondContact O-N 3.48Å; R123-V295 HydrophobicContact CB-CG2 4.05Å
124	I	90.8	Very high	91.3	Very high	20 Å²	20	35.2 Å²	35.2	10%	0.103	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.3	177.2	-52.8	176.8	0	0	0	107.8	L122 E126 V235 Q236 I291 A292	L122-I124 HydrophobicContact CD2-CD1 4.1Å; L122-I124 HydrophobicContact CD2-CG1 4.06Å; L122-I124 HydrophobicContact CG-CG1 4.07Å; I124-E126 HydrophobicContact CG2-CG 3.97Å; I124-V235 WeakPolarHBondContact O-CA 3.31Å; I124-Q236 PolarHBondContact N-O 3.16Å; I124-Q236 PolarHBondContact O-N 3.12Å; I124-I291 HydrophobicContact CG2-CG2 4.15Å; I124-A292 HydrophobicContact CG1-CB 4.15Å
125	K	89.3	Confident	91.5	Very high	116 Å²	116	34.4 Å²	34.4	50%	0.504	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	111.8	175.9	-63.1	179.9	-172.9	161.6	0	108.2	R123 V235 I291 E293	R123-K125 HydrophobicContact CG-CG 4.36Å; K125-V235 HydrophobicContact CG-CG1 4.46Å; K125-V235 HydrophobicContact CG-CG2 4.28Å; K125-I291 PolarHBondContact N-O 3.18Å; K125-E293 IonicContact NZ-OE2 3.61Å
126	E	85.4	Confident	91.6	Very high	88 Å²	88	36.1 Å²	36.1	41%	0.411	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	138.3	178.2	-72.4	179.3	-176.7	0	0	110.3	I124 V234	I124-E126 HydrophobicContact CG2-CG 3.97Å; E126-V234 PolarHBondContact N-O 3.35Å; E126-V234 PolarHBondContact O-N 2.93Å
127	I	87.1	Confident	91.6	Very high	114 Å²	114	39 Å²	39	59%	0.585	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	110.6	169.8	-53.2	-175.7	0	0	0	106.8	K231 D233	I127-K231 HydrophobicContact CG2-CB 3.86Å; I127-K231 HydrophobicContact CG2-CD 4.26Å; I127-K231 HydrophobicContact CG2-CG 4.3Å; I127-D233 WeakPolarHBondContact CG1-OD1 3.47Å
128	K	86.8	Confident	91.6	Very high	51 Å²	51	40.8 Å²	40.8	22%	0.222	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.5	175.6	-64.7	-161.9	178.6	-165.2	0	110.2	V130 E194 K232 V234	K128-V130 HydrophobicContact CB-CG1 4.16Å; K128-E194 HydrophobicContact CD-CG 4.46Å; K128-E194 IonicContact NZ-OE1 3.75Å; K128-E194 PolarHBondContact NZ-OE1 3.4Å; K128-E194 IonicContact NZ-OE2 3.16Å; K128-E194 PolarHBondContact NZ-OE2 3.35Å; K128-K232 PolarHBondContact N-O 3.23Å; K128-K232 PolarHBondContact O-N 3.4Å; K128-V234 HydrophobicContact CB-CG2 4.24Å; K128-V234 HydrophobicContact CD-CG2 4.08Å; K128-V234 HydrophobicContact CG-CG2 4.02Å
129	E	91.2	Very high	91.5	Very high	65 Å²	65	38.6 Å²	38.6	30%	0.304	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.8	166.2	-67.6	-169.1	166.3	0	0	108.5	A195 K231	E129-A195 HydrophobicContact CB-CB 3.86Å; E129-A195 WeakPolarHBondContact O-CB 3.2Å; E129-A195 PolarHBondContact O-N 2.92Å; E129-K231 HydrophobicContact CG-CG 4.13Å; E129-K231 WeakPolarHBondContact OE1-CE 3.11Å; E129-K231 IonicContact OE1-NZ 3.72Å; E129-K231 PolarHBondContact OE1-NZ 2.98Å
130	V	92.5	Very high	91.2	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.9	-176.4	-59.8	0	0	0	0	111.2	K128 Y192 I193 E194 K230 K232	K128-V130 HydrophobicContact CB-CG1 4.16Å; V130-Y192 HydrophobicContact CG1-CD2 4.38Å; V130-I193 CarbonylContact C-O 3.43Å; V130-I193 VanDerWaalsContact CA-O 3.3Å; V130-I193 WeakPolarHBondContact CA-O 3.47Å; V130-E194 HydrophobicContact CG1-CG 4.44Å; V130-K230 HydrophobicContact CG2-CG 3.78Å; V130-K230 PolarHBondContact N-O 3.01Å; V130-K230 PolarHBondContact O-N 2.88Å; V130-K232 HydrophobicContact CG2-CB 3.89Å; V130-K232 HydrophobicContact CG2-CD 4.35Å
131	Y	94	Very high	91	Very high	51 Å²	51	42.4 Å²	42.4	20%	0.2	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.1	165.2	-65.1	-89.1	0	0	0	108.1	L170 Y192 I193 A195 V228 H229	Y131-L170 HydrophobicContact CD1-CD1 3.49Å; Y131-L170 VanDerWaalsContact CD1-CD1 3.49Å; Y131-L170 HydrophobicContact CD1-CD2 3.81Å; Y131-L170 HydrophobicContact CD1-CG 4.29Å; Y131-L170 HydrophobicContact CD2-CD1 4.46Å; Y131-L170 HydrophobicContact CE1-CD1 4.07Å; Y131-L170 HydrophobicContact CE1-CD2 3.54Å; Y131-L170 HydrophobicContact CE1-CG 4.48Å; Y131-L170 HydrophobicContact CG-CD1 3.71Å; Y131-Y192 CarbonylContact O-C 3.51Å; Y131-Y192 VanDerWaalsContact O-CA 3.25Å; Y131-Y192 WeakPolarHBondContact O-CA 3.44Å; Y131-I193 PolarHBondContact N-O 3.22Å; Y131-I193 PolarHBondContact O-N 3.36Å; Y131-A195 HydrophobicContact CD2-CB 4.3Å; Y131-A195 HydrophobicContact CE2-CB 3.89Å; Y131-V228 CarbonylContact C-O 3.57Å; Y131-V228 VanDerWaalsContact CA-O 3.26Å; Y131-V228 WeakPolarHBondContact CA-O 3.38Å; Y131-V228 HydrophobicContact CD1-CG1 4.37Å; Y131-H229 HydrophobicContact CD1-CB 3.87Å; Y131-H229 AromaticContact CD1-CD2 3.93Å; Y131-H229 HydrophobicContact CE1-CB 3.65Å; Y131-H229 AromaticContact CE1-CD2 3.49Å; Y131-H229 VanDerWaalsContact CE1-CD2 3.49Å; Y131-H229 WeakPolarHBondContact CE1-CD2 3.19Å; Y131-H229 AromaticContact CE1-CG 3.66Å; Y131-H229 AromaticContact CE2-CD2 3.82Å; Y131-H229 AromaticContact CZ-CD2 3.41Å; Y131-H229 VanDerWaalsContact CZ-CD2 3.41Å; Y131-H229 AromaticContact CZ-CG 3.95Å; Y131-H229 AromaticContact CZ-NE2 3.91Å
132	E	93.7	Very high	90.7	Very high	17 Å²	17	46.7 Å²	46.7	8%	0.079	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.4	-177.7	-172.8	-176	122.1	0	0	109.4	T163 I191 P224 V228 K230	E132-T163 WeakPolarHBondContact O-CG2 3.43Å; E132-I191 WeakPolarHBondContact CA-O 3.33Å; E132-P224 HydrophobicContact CG-CB 4.25Å; E132-P224 HydrophobicContact CG-CG 4.02Å; E132-P224 WeakPolarHBondContact OE1-CB 3.21Å; E132-V228 PolarHBondContact N-O 3.44Å; E132-V228 WeakPolarHBondContact O-CA 3.42Å; E132-K230 IonicContact OE1-NZ 2.76Å; E132-K230 PolarHBondContact OE1-NZ 3.14Å; E132-K230 WeakPolarHBondContact OE2-CE 3.29Å; E132-K230 IonicContact OE2-NZ 3.56Å; E132-K230 PolarHBondContact OE2-NZ 3.24Å
133	G	95	Very high	90	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.6	169.1	179.5	0	0	0	0	0	112.5	R162 I191	G133-R162 CarbonylContact C-O 3.55Å; G133-R162 VanDerWaalsContact CA-O 3.26Å; G133-R162 WeakPolarHBondContact CA-O 3.35Å; G133-I191 PolarHBondContact N-O 3.22Å; G133-I191 VanDerWaalsContact N-O 3.12Å; G133-I191 PolarHBondContact O-N 3.36Å
134	E	95.3	Very high	89.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	133.1	167.5	179.8	-157.6	157.9	0	0	110	T136 L161 R162 D189 V190 C206 Y209 L223	E134-T136 PolarHBondContact O-N 2.97Å; E134-L161 CarbonylContact O-C 3.58Å; E134-L161 VanDerWaalsContact O-CA 3.31Å; E134-L161 WeakPolarHBondContact O-CA 3.4Å; E134-R162 HydrophobicContact CB-CB 4.46Å; E134-R162 PolarHBondContact N-O 3.38Å; E134-R162 PolarHBondContact O-N 3.13Å; E134-R162 IonicContact OE1-CZ 3.45Å; E134-R162 IonicContact OE1-NE 2.7Å; E134-R162 IonicContact OE1-NH2 3.13Å; E134-R162 PolarHBondContact OE1-NH2 2.95Å; E134-R162 IonicContact OE2-CZ 3.52Å; E134-R162 IonicContact OE2-NE 2.79Å; E134-R162 PolarHBondContact OE2-NE 3.36Å; E134-R162 IonicContact OE2-NH2 3.53Å; E134-R162 PolarHBondContact OE2-NH2 3.26Å; E134-D189 CarbonylContact C-O 3.52Å; E134-D189 VanDerWaalsContact CA-O 3.3Å; E134-D189 WeakPolarHBondContact CA-O 3.44Å; E134-V190 HydrophobicContact CB-CG2 4.37Å; E134-C206 HydrophobicContact CG-CB 4Å; E134-Y209 WeakPolarHBondContact OE1-CE2 3.3Å; E134-Y209 PolarHBondContact OE1-OH 2.84Å; E134-L223 HydrophobicContact CB-CD1 3.7Å; E134-L223 WeakPolarHBondContact OE2-CD1 3.27Å
135	V	95.7	Very high	87.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	115	172.8	-176.3	0	0	0	0	109.4	L138 I159 L161 V185 V187 G188 D189 I191	V135-L138 HydrophobicContact CG1-CB 4.17Å; V135-I159 HydrophobicContact CG1-CD1 4.2Å; V135-I159 HydrophobicContact CG1-CG1 4.06Å; V135-I159 HydrophobicContact CG2-CD1 4.02Å; V135-L161 HydrophobicContact CG2-CD2 3.92Å; V135-V185 HydrophobicContact CG2-CG1 3.84Å; V135-V187 HydrophobicContact CG1-CG2 4.49Å; V135-V187 CarbonylContact O-C 3.59Å; V135-V187 WeakPolarHBondContact O-CA 3.43Å; V135-G188 PolarHBondContact O-N 3.5Å; V135-D189 PolarHBondContact N-O 2.8Å; V135-I191 HydrophobicContact CG2-CD1 3.6Å; V135-I191 HydrophobicContact CG2-CG1 3.77Å; V135-I191 HydrophobicContact CG2-CG2 4.09Å
136	T	94.2	Very high	86.5	Confident	45 Å²	45	57.6 Å²	57.6	28%	0.276	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-23.7	176.7	53.1	0	0	0	0	112.8	E134 S160 R162	E134-T136 PolarHBondContact O-N 2.97Å; T136-S160 PolarHBondContact N-O 3.37Å; T136-S160 WeakPolarHBondContact OG1-CB 3.34Å; T136-S160 PolarHBondContact OG1-O 2.99Å; T136-R162 HydrophobicContact CG2-CB 3.54Å; T136-R162 HydrophobicContact CG2-CG 4.41Å
137	E	93.4	Very high	85.4	Confident	71 Å²	71	58.7 Å²	58.7	33%	0.332	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	138.4	178.7	-168.4	-170.2	177.4	0	0	108.4	T139 I159 S160 Q169	E137-T139 PolarHBondContact OE1-OG1 2.94Å; E137-I159 CarbonylContact O-C 3.58Å; E137-I159 VanDerWaalsContact O-CA 3.31Å; E137-I159 WeakPolarHBondContact O-CA 3.24Å; E137-I159 WeakPolarHBondContact O-CG1 3.44Å; E137-S160 PolarHBondContact O-N 2.85Å; E137-S160 PolarHBondContact OE2-OG 3.2Å; E137-Q169 PolarHBondContact OE2-NE2 3.09Å; E137-Q169 VanDerWaalsContact OE2-NE2 3.1Å
138	L	91.2	Very high	83.9	Confident	47 Å²	47	57 Å²	57	25%	0.246	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	99.3	174.3	-179.6	69.4	0	0	0	108.9	V135 V157 I159 L180	V135-L138 HydrophobicContact CG1-CB 4.17Å; L138-V157 HydrophobicContact CD1-CG1 3.65Å; L138-I159 HydrophobicContact CD1-CB 4.33Å; L138-I159 HydrophobicContact CD1-CD1 4.09Å; L138-I159 HydrophobicContact CD1-CG1 4.11Å; L138-L180 HydrophobicContact CD1-CD1 3.96Å
139	T	90.3	Very high	82.5	Confident	58 Å²	58	57.2 Å²	57.2	36%	0.356	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	104.5	-173.5	-52.6	0	0	0	0	110.1	E137 I158	E137-T139 PolarHBondContact OE1-OG1 2.94Å; T139-I158 PolarHBondContact N-O 2.91Å; T139-I158 PolarHBondContact O-N 3.45Å
140	P	86.5	Confident	80.7	Confident	45 Å²	45	64.5 Å²	64.5	29%	0.292	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	129.5	171.4	28.8	-31.4	0	0	0	110.2	I154 Y177	P140-I154 HydrophobicContact CB-CD1 4.23Å; P140-I154 HydrophobicContact CB-CG1 4.48Å; P140-I154 HydrophobicContact CB-CG2 4.34Å; P140-Y177 HydrophobicContact CB-CE2 4.07Å; P140-Y177 HydrophobicContact CG-CE2 4.29Å
141	V	86	Confident	79.2	Confident	43 Å²	43	67 Å²	67	26%	0.261	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	109.2	178.5	-177	0	0	0	0	109.4	S155 H156 I158	V141-S155 PolarHBondContact O-N 3.41Å; V141-S155 PolarHBondContact O-OG 3.48Å; V141-H156 VanDerWaalsContact CG1-CE1 3.5Å; V141-H156 WeakPolarHBondContact CG1-CE1 3.5Å; V141-H156 PolarHBondContact N-O 3.04Å; V141-I158 HydrophobicContact CG2-CD1 3.8Å; V141-I158 HydrophobicContact CG2-CG1 4.02Å
142	E	83.1	Confident	78	Confident	96 Å²	96	72 Å²	72	45%	0.449	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	139.3	-179.9	-62	175.1	157.5	0	0	111.5	K152 T153	E142-K152 HydrophobicContact CB-CB 4.19Å; E142-K152 HydrophobicContact CG-CB 4.25Å; E142-K152 WeakPolarHBondContact OE2-CD 3.47Å; E142-K152 WeakPolarHBondContact OE2-CE 3.39Å; E142-K152 IonicContact OE2-NZ 2.69Å; E142-K152 PolarHBondContact OE2-NZ 3.13Å; E142-T153 WeakPolarHBondContact CA-O 3.34Å
143	T	76.8	Confident	77	Confident	69 Å²	69	74.1 Å²	74.1	42%	0.423	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	155.2	167.7	50.6	0	0	0	0	109.8	S145 T153 S155	T143-S145 PolarHBondContact O-N 3.13Å; T143-T153 PolarHBondContact N-O 2.71Å; T143-T153 PolarHBondContact O-N 3.26Å; T143-T153 PolarHBondContact OG1-O 3.16Å; T143-S155 WeakPolarHBondContact OG1-CB 3.35Å
144	E	72.1	Confident	76	Confident	184 Å²	184	76.1 Å²	76.1	86%	0.86	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	133.3	171.1	-67.8	-174.1	165.8	0	0	110.1
145	S	62.4	Low	75.4	Confident	32 Å²	32	78 Å²	78	22%	0.224	46%	0.461	C	S	.	.			trans	-63.6	127.7	-178.6	-161.8	0	0	0	0	110.2	T143 T147 T153	T143-S145 PolarHBondContact O-N 3.13Å; S145-T147 PolarHBondContact O-N 2.96Å; S145-T147 PolarHBondContact OG-OG1 3.17Å; S145-T147 VanDerWaalsContact OG-OG1 3.11Å; S145-T153 WeakPolarHBondContact CB-OG1 3.42Å; S145-T153 PolarHBondContact OG-OG1 2.67Å
146	P	63.4	Low	74.9	Confident	130 Å²	130	79.5 Å²	79.5	84%	0.844	47%	0.468	S	S	*	.	S	Bend	trans	-64.2	-22.6	178.1	20.3	-27.8	0	0	0	112.5	G148	P146-G148 PolarHBondContact O-N 3.46Å
147	T	63.4	Low	74.6	Confident	112 Å²	112	77.3 Å²	77.3	69%	0.687	46%	0.455	S	S	*	.	S	Bend	trans	-82.5	83.4	166	42.7	0	0	0	0	109.2	S145 G149	S145-T147 PolarHBondContact O-N 2.96Å; S145-T147 PolarHBondContact OG-OG1 3.17Å; S145-T147 VanDerWaalsContact OG-OG1 3.11Å; T147-G149 PolarHBondContact O-N 3.15Å
148	G	56.1	Low	74.6	Confident	77 Å²	77	76 Å²	76	79%	0.794	45%	0.45	S	S	*	.			trans	-47.5	119.9	-179.6	0	0	0	0	0	112.2	P146	P146-G148 PolarHBondContact O-N 3.46Å
149	G	55.7	Low	74.7	Confident	57 Å²	57	73.8 Å²	73.8	59%	0.588	44%	0.438	S	S	*	.	S	Bend	trans	174.6	-87	-175.6	0	0	0	0	0	114.2	T147	T147-G149 PolarHBondContact O-N 3.15Å
150	F	53.2	Low	74.9	Confident	218 Å²	218	71.4 Å²	71.4	96%	0.956	42%	0.424	S	S	*	.	S	Bend	trans	-155.7	110.1	-176.1	-75.5	-84.7	0	0	0	110.2
151	G	62.3	Low	75.4	Confident	54 Å²	54	69.3 Å²	69.3	56%	0.557	41%	0.41	S	S	*	.			trans	140.2	136.6	168.2	0	0	0	0	0	114
152	K	68.7	Low	75.8	Confident	157 Å²	157	71 Å²	71	68%	0.683	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.2	161.2	-76.9	155.9	150	-138.1	0	107.4	E142	E142-K152 HydrophobicContact CB-CB 4.19Å; E142-K152 HydrophobicContact CG-CB 4.25Å; E142-K152 WeakPolarHBondContact OE2-CD 3.47Å; E142-K152 WeakPolarHBondContact OE2-CE 3.39Å; E142-K152 IonicContact OE2-NZ 2.69Å; E142-K152 PolarHBondContact OE2-NZ 3.13Å
153	T	72.2	Confident	76.3	Confident	62 Å²	62	66.8 Å²	66.8	38%	0.38	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.3	175.6	-46.7	0	0	0	0	108.4	E142 T143 S145 S155	E142-T153 WeakPolarHBondContact CA-O 3.34Å; T143-T153 PolarHBondContact N-O 2.71Å; T143-T153 PolarHBondContact O-N 3.26Å; T143-T153 PolarHBondContact OG1-O 3.16Å; S145-T153 WeakPolarHBondContact CB-OG1 3.42Å; S145-T153 PolarHBondContact OG-OG1 2.67Å; T153-S155 PolarHBondContact O-N 2.96Å
154	I	74.8	Confident	77.1	Confident	42 Å²	42	66.8 Å²	66.8	22%	0.215	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	120.8	176.6	-61.5	173.3	0	0	0	107.9	P140 V157 P174 Y177	P140-I154 HydrophobicContact CB-CD1 4.23Å; P140-I154 HydrophobicContact CB-CG1 4.48Å; P140-I154 HydrophobicContact CB-CG2 4.34Å; I154-V157 HydrophobicContact CG2-CG2 4.14Å; I154-P174 HydrophobicContact CG2-CB 4.47Å; I154-P174 WeakPolarHBondContact O-CG 3.49Å; I154-Y177 HydrophobicContact CD1-CD1 3.21Å; I154-Y177 HydrophobicContact CD1-CE1 3.16Å; I154-Y177 HydrophobicContact CD1-CG 4Å
155	S	82.2	Confident	78	Confident	38 Å²	38	65.1 Å²	65.1	27%	0.266	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-36.3	179.2	64.4	0	0	0	0	112.6	V141 T143 T153 P174	V141-S155 PolarHBondContact O-N 3.41Å; V141-S155 PolarHBondContact O-OG 3.48Å; T143-S155 WeakPolarHBondContact OG1-CB 3.35Å; T153-S155 PolarHBondContact O-N 2.96Å; S155-P174 VanDerWaalsContact C-CG 3.45Å; S155-P174 WeakPolarHBondContact O-CD 3.25Å; S155-P174 WeakPolarHBondContact O-CG 3.33Å
156	H	85.3	Confident	79.4	Confident	32 Å²	32	65.3 Å²	65.3	15%	0.148	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	163.3	175.9	54.9	-72.7	0	0	0	109.3	V141 K171 L172	V141-H156 VanDerWaalsContact CG1-CE1 3.5Å; V141-H156 WeakPolarHBondContact CG1-CE1 3.5Å; V141-H156 PolarHBondContact N-O 3.04Å; H156-K171 HydrophobicContact CB-CD 4.39Å; H156-K171 HydrophobicContact CB-CG 4.02Å; H156-K171 VanDerWaalsContact CD2-CD 3.41Å; H156-K171 WeakPolarHBondContact CD2-CD 3.34Å; H156-K171 WeakPolarHBondContact CD2-CE 3.38Å; H156-K171 PolarHBondContact CD2-NZ 2.7Å; H156-K171 VanDerWaalsContact CD2-NZ 3.33Å; H156-K171 PolarHBondContact CE1-NZ 3.17Å; H156-K171 PolarHBondContact ND1-NZ 2.75Å; H156-K171 PolarHBondContact NE2-NZ 2.9Å; H156-L172 WeakPolarHBondContact CA-O 3.38Å; H156-L172 WeakPolarHBondContact CB-O 3.47Å
157	V	88.5	Confident	80.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.1	173.1	-177.9	0	0	0	0	108.8	L138 I154 L172 Y177	L138-V157 HydrophobicContact CD1-CG1 3.65Å; I154-V157 HydrophobicContact CG2-CG2 4.14Å; V157-L172 HydrophobicContact CB-CB 4.4Å; V157-L172 PolarHBondContact N-O 2.97Å; V157-L172 PolarHBondContact O-N 3.15Å; V157-Y177 HydrophobicContact CG1-CD2 4.35Å; V157-Y177 HydrophobicContact CG2-CD2 3.5Å; V157-Y177 HydrophobicContact CG2-CE2 4.48Å; V157-Y177 HydrophobicContact CG2-CG 3.76Å
158	I	92.3	Very high	82.4	Confident	43 Å²	43	62.3 Å²	62.3	22%	0.221	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.6	170.3	-60.5	177.5	0	0	0	107.3	T139 V141 Q169 L170	T139-I158 PolarHBondContact N-O 2.91Å; T139-I158 PolarHBondContact O-N 3.45Å; V141-I158 HydrophobicContact CG2-CD1 3.8Å; V141-I158 HydrophobicContact CG2-CG1 4.02Å; I158-Q169 HydrophobicContact CG2-CG 3.54Å; I158-Q169 VanDerWaalsContact CG2-NE2 3.35Å; I158-L170 WeakPolarHBondContact CA-O 3.42Å
159	I	93.3	Very high	84.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134	175.3	-164.5	173.1	0	0	0	109.7	V135 E137 L138 L161 Q169 L170 L172 L180 I191	V135-I159 HydrophobicContact CG1-CD1 4.2Å; V135-I159 HydrophobicContact CG1-CG1 4.06Å; V135-I159 HydrophobicContact CG2-CD1 4.02Å; E137-I159 CarbonylContact O-C 3.58Å; E137-I159 VanDerWaalsContact O-CA 3.31Å; E137-I159 WeakPolarHBondContact O-CA 3.24Å; E137-I159 WeakPolarHBondContact O-CG1 3.44Å; L138-I159 HydrophobicContact CD1-CB 4.33Å; L138-I159 HydrophobicContact CD1-CD1 4.09Å; L138-I159 HydrophobicContact CD1-CG1 4.11Å; I159-L161 HydrophobicContact CD1-CD2 4.04Å; I159-L161 HydrophobicContact CG1-CD2 4.21Å; I159-Q169 CarbonylContact O-C 3.56Å; I159-Q169 WeakPolarHBondContact O-CA 3.31Å; I159-L170 HydrophobicContact CG2-CB 3.82Å; I159-L170 HydrophobicContact CG2-CD1 4.34Å; I159-L170 PolarHBondContact N-O 3.32Å; I159-L170 PolarHBondContact O-N 3.01Å; I159-L172 HydrophobicContact CB-CD1 4.27Å; I159-L172 HydrophobicContact CG2-CD1 3.45Å; I159-L172 VanDerWaalsContact CG2-CD1 3.45Å; I159-L172 HydrophobicContact CG2-CG 3.9Å; I159-L180 HydrophobicContact CD1-CD2 4.28Å; I159-I191 HydrophobicContact CD1-CD1 3.69Å
160	S	95.1	Very high	86	Confident	9 Å²	9	62.4 Å²	62.4	6%	0.063	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.3	174.8	-63.7	0	0	0	0	109.3	T136 E137 Q169	T136-S160 PolarHBondContact N-O 3.37Å; T136-S160 WeakPolarHBondContact OG1-CB 3.34Å; T136-S160 PolarHBondContact OG1-O 2.99Å; E137-S160 PolarHBondContact O-N 2.85Å; E137-S160 PolarHBondContact OE2-OG 3.2Å; S160-Q169 WeakPolarHBondContact OG-CG 3.42Å; S160-Q169 PolarHBondContact OG-NE2 3.13Å
161	L	95.5	Very high	87.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.5	179.4	-64.9	-178.9	0	0	0	111.3	E134 V135 I159 V167 K168 L170 I191 V228	E134-L161 CarbonylContact O-C 3.58Å; E134-L161 VanDerWaalsContact O-CA 3.31Å; E134-L161 WeakPolarHBondContact O-CA 3.4Å; V135-L161 HydrophobicContact CG2-CD2 3.92Å; I159-L161 HydrophobicContact CD1-CD2 4.04Å; I159-L161 HydrophobicContact CG1-CD2 4.21Å; L161-V167 CarbonylContact O-C 3.51Å; L161-V167 WeakPolarHBondContact O-CA 3.4Å; L161-K168 PolarHBondContact N-O 3.12Å; L161-K168 PolarHBondContact O-N 3.27Å; L161-L170 HydrophobicContact CD1-CD1 3.8Å; L161-L170 HydrophobicContact CG-CD1 4.41Å; L161-I191 HydrophobicContact CD2-CD1 4.05Å; L161-I191 HydrophobicContact CD2-CG1 3.94Å; L161-V228 HydrophobicContact CB-CG1 3.65Å; L161-V228 HydrophobicContact CD1-CG1 4.02Å; L161-V228 HydrophobicContact CG-CG1 4.49Å
162	R	95	Very high	89.1	Confident	80 Å²	80	57.2 Å²	57.2	30%	0.302	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.5	179.3	177.8	169.6	72.4	-177.9	4.8	111.4	G133 E134 T136 V167	G133-R162 CarbonylContact C-O 3.55Å; G133-R162 VanDerWaalsContact CA-O 3.26Å; G133-R162 WeakPolarHBondContact CA-O 3.35Å; E134-R162 HydrophobicContact CB-CB 4.46Å; E134-R162 PolarHBondContact N-O 3.38Å; E134-R162 PolarHBondContact O-N 3.13Å; E134-R162 IonicContact OE1-CZ 3.45Å; E134-R162 IonicContact OE1-NE 2.7Å; E134-R162 IonicContact OE1-NH2 3.13Å; E134-R162 PolarHBondContact OE1-NH2 2.95Å; E134-R162 IonicContact OE2-CZ 3.52Å; E134-R162 IonicContact OE2-NE 2.79Å; E134-R162 PolarHBondContact OE2-NE 3.36Å; E134-R162 IonicContact OE2-NH2 3.53Å; E134-R162 PolarHBondContact OE2-NH2 3.26Å; T136-R162 HydrophobicContact CG2-CB 3.54Å; T136-R162 HydrophobicContact CG2-CG 4.41Å; R162-V167 HydrophobicContact CB-CG2 4.03Å; R162-V167 HydrophobicContact CG-CG2 3.88Å
163	T	94.6	Very high	89.9	Confident	7 Å²	7	54.1 Å²	54.1	4%	0.043	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	175.5	166.8	66.4	0	0	0	0	110.1	E132 K165 G166 P224 G226 V228	E132-T163 WeakPolarHBondContact O-CG2 3.43Å; T163-K165 PolarHBondContact O-N 3.3Å; T163-K165 VanDerWaalsContact O-N 3.14Å; T163-K165 PolarHBondContact OG1-N 3.47Å; T163-G166 PolarHBondContact N-O 2.94Å; T163-G166 PolarHBondContact O-N 3.2Å; T163-G166 PolarHBondContact OG1-O 2.99Å; T163-P224 WeakPolarHBondContact CB-O 3.47Å; T163-P224 HydrophobicContact CG2-CB 4.11Å; T163-G226 VanDerWaalsContact CB-O 3.28Å; T163-G226 WeakPolarHBondContact CB-O 3.31Å; T163-G226 PolarHBondContact OG1-O 2.9Å; T163-V228 HydrophobicContact CG2-CB 4.33Å; T163-V228 HydrophobicContact CG2-CG2 3.77Å
164	A	92.4	Very high	90.5	Very high	68 Å²	68	53.1 Å²	53.1	56%	0.562	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.1	175.7	0	0	0	0	0	114	L223 P224	A164-L223 HydrophobicContact CB-CD2 4.25Å; A164-P224 PolarHBondContact N-O 3.02Å
165	K	91.9	Very high	91	Very high	150 Å²	150	55.4 Å²	55.4	65%	0.652	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-23.3	179.1	-68.8	-165.4	177	-176.7	0	114.2	T163 G226 E227	T163-K165 PolarHBondContact O-N 3.3Å; T163-K165 VanDerWaalsContact O-N 3.14Å; T163-K165 PolarHBondContact OG1-N 3.47Å; K165-G226 WeakPolarHBondContact CB-O 3.48Å; K165-E227 HydrophobicContact CD-CG 4.23Å
166	G	91.7	Very high	91.2	Very high	35 Å²	35	54.6 Å²	54.6	36%	0.361	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.5	176.6	-176	0	0	0	0	0	114.1	T163	T163-G166 PolarHBondContact N-O 2.94Å; T163-G166 PolarHBondContact O-N 3.2Å; T163-G166 PolarHBondContact OG1-O 2.99Å
167	V	94.7	Very high	91.3	Very high	96 Å²	96	55.3 Å²	55.3	58%	0.582	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	141.9	178.5	-177.7	0	0	0	0	108.6	L161 R162	L161-V167 CarbonylContact O-C 3.51Å; L161-V167 WeakPolarHBondContact O-CA 3.4Å; R162-V167 HydrophobicContact CB-CG2 4.03Å; R162-V167 HydrophobicContact CG-CG2 3.88Å
168	K	94.2	Very high	91.1	Very high	84 Å²	84	60.7 Å²	60.7	37%	0.365	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	123.8	175.8	-166.1	171.5	-176.4	175.5	0	110	L161 L170 V228	L161-K168 PolarHBondContact N-O 3.12Å; L161-K168 PolarHBondContact O-N 3.27Å; K168-L170 HydrophobicContact CD-CD2 4.1Å; K168-L170 HydrophobicContact CG-CD2 4.02Å; K168-V228 HydrophobicContact CB-CB 3.99Å; K168-V228 HydrophobicContact CB-CG1 3.99Å; K168-V228 HydrophobicContact CB-CG2 3.96Å
169	Q	94.6	Very high	90.8	Very high	118 Å²	118	60.3 Å²	60.3	55%	0.551	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.5	171.6	-168.3	175.1	53.9	0	0	109.4	E137 I158 I159 S160	E137-Q169 PolarHBondContact OE2-NE2 3.09Å; E137-Q169 VanDerWaalsContact OE2-NE2 3.1Å; I158-Q169 HydrophobicContact CG2-CG 3.54Å; I158-Q169 VanDerWaalsContact CG2-NE2 3.35Å; I159-Q169 CarbonylContact O-C 3.56Å; I159-Q169 WeakPolarHBondContact O-CA 3.31Å; S160-Q169 WeakPolarHBondContact OG-CG 3.42Å; S160-Q169 PolarHBondContact OG-NE2 3.13Å
170	L	92.3	Very high	90.7	Very high	17 Å²	17	60.4 Å²	60.4	9%	0.089	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.7	-176.8	-56.6	172.9	0	0	0	109.1	Y131 I158 I159 L161 K168 L172	Y131-L170 HydrophobicContact CD1-CD1 3.49Å; Y131-L170 VanDerWaalsContact CD1-CD1 3.49Å; Y131-L170 HydrophobicContact CD1-CD2 3.81Å; Y131-L170 HydrophobicContact CD1-CG 4.29Å; Y131-L170 HydrophobicContact CD2-CD1 4.46Å; Y131-L170 HydrophobicContact CE1-CD1 4.07Å; Y131-L170 HydrophobicContact CE1-CD2 3.54Å; Y131-L170 HydrophobicContact CE1-CG 4.48Å; Y131-L170 HydrophobicContact CG-CD1 3.71Å; I158-L170 WeakPolarHBondContact CA-O 3.42Å; I159-L170 HydrophobicContact CG2-CB 3.82Å; I159-L170 HydrophobicContact CG2-CD1 4.34Å; I159-L170 PolarHBondContact N-O 3.32Å; I159-L170 PolarHBondContact O-N 3.01Å; L161-L170 HydrophobicContact CD1-CD1 3.8Å; L161-L170 HydrophobicContact CG-CD1 4.41Å; K168-L170 HydrophobicContact CD-CD2 4.1Å; K168-L170 HydrophobicContact CG-CD2 4.02Å; L170-L172 HydrophobicContact CB-CD2 4.31Å; L170-L172 HydrophobicContact CB-CG 4.49Å
171	K	91.3	Very high	90.3	Very high	144 Å²	144	65 Å²	65	63%	0.626	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	112.3	168.7	172.8	163.6	171.4	152.1	0	108	H156	H156-K171 HydrophobicContact CB-CD 4.39Å; H156-K171 HydrophobicContact CB-CG 4.02Å; H156-K171 VanDerWaalsContact CD2-CD 3.41Å; H156-K171 WeakPolarHBondContact CD2-CD 3.34Å; H156-K171 WeakPolarHBondContact CD2-CE 3.38Å; H156-K171 PolarHBondContact CD2-NZ 2.7Å; H156-K171 VanDerWaalsContact CD2-NZ 3.33Å; H156-K171 PolarHBondContact CE1-NZ 3.17Å; H156-K171 PolarHBondContact ND1-NZ 2.75Å; H156-K171 PolarHBondContact NE2-NZ 2.9Å
172	L	89.4	Confident	89.9	Confident	19 Å²	19	72.2 Å²	72.2	10%	0.099	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	151.2	-176.2	-61.4	179.7	0	0	0	111.2	H156 V157 I159 L170 I176 L180 I193	H156-L172 WeakPolarHBondContact CA-O 3.38Å; H156-L172 WeakPolarHBondContact CB-O 3.47Å; V157-L172 HydrophobicContact CB-CB 4.4Å; V157-L172 PolarHBondContact N-O 2.97Å; V157-L172 PolarHBondContact O-N 3.15Å; I159-L172 HydrophobicContact CB-CD1 4.27Å; I159-L172 HydrophobicContact CG2-CD1 3.45Å; I159-L172 VanDerWaalsContact CG2-CD1 3.45Å; I159-L172 HydrophobicContact CG2-CG 3.9Å; L170-L172 HydrophobicContact CB-CD2 4.31Å; L170-L172 HydrophobicContact CB-CG 4.49Å; L172-I176 HydrophobicContact CB-CB 4.32Å; L172-I176 HydrophobicContact CB-CD1 4.09Å; L172-I176 HydrophobicContact CD1-CG2 3.91Å; L172-I176 HydrophobicContact CD2-CD1 3.97Å; L172-I176 HydrophobicContact CG-CD1 4.46Å; L172-L180 HydrophobicContact CD1-CD1 4.34Å; L172-I193 HydrophobicContact CD1-CD1 3.85Å
173	D	87	Confident	89.6	Confident	93 Å²	93	72.1 Å²	72.1	50%	0.497	38%	0.376	S	S	.	.			trans	-65.6	147.1	174.4	-169.6	-85.4	0	0	0	111.2	C175 I176	D173-C175 PolarHBondContact O-N 2.98Å; D173-C175 VanDerWaalsContact O-N 3.11Å; D173-C175 WeakPolarHBondContact OD1-CB 3.5Å; D173-C175 PolarHBondContact OD1-N 3.16Å; D173-C175 PolarHBondContact OD1-SG 3.06Å; D173-I176 PolarHBondContact O-N 3.29Å
174	P	85	Confident	89.4	Confident	41 Å²	41	78.8 Å²	78.8	27%	0.266	41%	0.406	S	S	.	.	H	α-helix	trans	-50.4	-32.7	175	-29.7	37	0	0	0	114.6	I154 S155 I176 Y177	I154-P174 HydrophobicContact CG2-CB 4.47Å; I154-P174 WeakPolarHBondContact O-CG 3.49Å; S155-P174 VanDerWaalsContact C-CG 3.45Å; S155-P174 WeakPolarHBondContact O-CD 3.25Å; S155-P174 WeakPolarHBondContact O-CG 3.33Å; P174-I176 PolarHBondContact O-N 2.96Å; P174-Y177 WeakPolarHBondContact O-CB 3.49Å; P174-Y177 PolarHBondContact O-N 2.92Å
175	C	84.9	Confident	89.4	Confident	89 Å²	89	76.1 Å²	76.1	60%	0.601	38%	0.383	S	S	*	.	H	α-helix	trans	-62.4	-29.4	179.3	-57.8	0	0	0	0	112.5	D173 Y177 E178	D173-C175 PolarHBondContact O-N 2.98Å; D173-C175 VanDerWaalsContact O-N 3.11Å; D173-C175 WeakPolarHBondContact OD1-CB 3.5Å; D173-C175 PolarHBondContact OD1-N 3.16Å; D173-C175 PolarHBondContact OD1-SG 3.06Å; C175-Y177 VanDerWaalsContact C-N 3.28Å; C175-Y177 PolarHBondContact O-N 2.77Å; C175-E178 PolarHBondContact O-N 2.75Å
176	I	87.1	Confident	89.4	Confident	22 Å²	22	74.4 Å²	74.4	11%	0.113	38%	0.377	C	S	.	.	H	α-helix	trans	-73.8	-25	178.6	-55.9	176	0	0	0	110.6	L172 D173 P174 E178 S179 L180 V200	L172-I176 HydrophobicContact CB-CB 4.32Å; L172-I176 HydrophobicContact CB-CD1 4.09Å; L172-I176 HydrophobicContact CD1-CG2 3.91Å; L172-I176 HydrophobicContact CD2-CD1 3.97Å; L172-I176 HydrophobicContact CG-CD1 4.46Å; D173-I176 PolarHBondContact O-N 3.29Å; P174-I176 PolarHBondContact O-N 2.96Å; I176-E178 VanDerWaalsContact C-N 3.3Å; I176-E178 PolarHBondContact O-N 2.86Å; I176-S179 WeakPolarHBondContact O-CB 3.33Å; I176-S179 PolarHBondContact O-N 2.85Å; I176-S179 VanDerWaalsContact O-N 3.16Å; I176-L180 HydrophobicContact CG2-CD1 4.24Å; I176-L180 HydrophobicContact CG2-CG 4.39Å; I176-L180 WeakPolarHBondContact O-CG 3.34Å; I176-L180 PolarHBondContact O-N 3.37Å; I176-V200 HydrophobicContact CG2-CG2 3.68Å
177	Y	85.4	Confident	89.5	Confident	47 Å²	47	76 Å²	76	18%	0.184	38%	0.379	C	S	.	.	H	α-helix	trans	-60.1	-41.5	174.8	-169.5	-118.4	0	0	0	112	P140 I154 V157 P174 C175 S179 L180 Q181	P140-Y177 HydrophobicContact CB-CE2 4.07Å; P140-Y177 HydrophobicContact CG-CE2 4.29Å; I154-Y177 HydrophobicContact CD1-CD1 3.21Å; I154-Y177 HydrophobicContact CD1-CE1 3.16Å; I154-Y177 HydrophobicContact CD1-CG 4Å; V157-Y177 HydrophobicContact CG1-CD2 4.35Å; V157-Y177 HydrophobicContact CG2-CD2 3.5Å; V157-Y177 HydrophobicContact CG2-CE2 4.48Å; V157-Y177 HydrophobicContact CG2-CG 3.76Å; P174-Y177 WeakPolarHBondContact O-CB 3.49Å; P174-Y177 PolarHBondContact O-N 2.92Å; C175-Y177 VanDerWaalsContact C-N 3.28Å; C175-Y177 PolarHBondContact O-N 2.77Å; Y177-S179 VanDerWaalsContact C-N 3.29Å; Y177-S179 PolarHBondContact O-N 2.91Å; Y177-L180 PolarHBondContact O-N 2.66Å; Y177-Q181 HydrophobicContact CD1-CG 4.34Å; Y177-Q181 VanDerWaalsContact CE1-CD 3.45Å; Y177-Q181 HydrophobicContact CE1-CG 4.02Å; Y177-Q181 HydrophobicContact CE2-CG 4.39Å; Y177-Q181 WeakPolarHBondContact O-CG 3.46Å; Y177-Q181 PolarHBondContact O-N 2.81Å; Y177-Q181 PolarHBondContact OH-NE2 2.99Å; Y177-Q181 VanDerWaalsContact OH-NE2 3.07Å
178	E	84.6	Confident	89.3	Confident	113 Å²	113	71.4 Å²	71.4	53%	0.528	35%	0.352	S	S	.	.	H	α-helix	trans	-62.6	-39.1	176.5	-63.3	-172.8	-179.4	0	0	111.5	C175 I176 Q181 K182	C175-E178 PolarHBondContact O-N 2.75Å; I176-E178 VanDerWaalsContact C-N 3.3Å; I176-E178 PolarHBondContact O-N 2.86Å; E178-Q181 PolarHBondContact O-N 2.89Å; E178-K182 WeakPolarHBondContact O-CB 3.35Å; E178-K182 VanDerWaalsContact O-CG 3.26Å; E178-K182 WeakPolarHBondContact O-CG 3.24Å; E178-K182 PolarHBondContact O-N 2.84Å
179	S	87.4	Confident	89.3	Confident	35 Å²	35	67.4 Å²	67.4	25%	0.245	33%	0.334	C	S	.	.	H	α-helix	trans	-65.5	-41.6	175.3	-62.3	0	0	0	0	111.8	I176 Y177 K182 E183	I176-S179 WeakPolarHBondContact O-CB 3.33Å; I176-S179 PolarHBondContact O-N 2.85Å; I176-S179 VanDerWaalsContact O-N 3.16Å; Y177-S179 VanDerWaalsContact C-N 3.29Å; Y177-S179 PolarHBondContact O-N 2.91Å; S179-K182 PolarHBondContact O-N 2.81Å; S179-E183 WeakPolarHBondContact O-CB 3.45Å; S179-E183 WeakPolarHBondContact O-CG 3.47Å; S179-E183 PolarHBondContact O-N 2.84Å; S179-E183 VanDerWaalsContact O-N 3.09Å
180	L	89.6	Confident	89.3	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-41.3	175.5	-72.6	163	0	0	0	111.8	L138 I159 L172 I176 Y177 H184 V185 I191 V200	L138-L180 HydrophobicContact CD1-CD1 3.96Å; I159-L180 HydrophobicContact CD1-CD2 4.28Å; L172-L180 HydrophobicContact CD1-CD1 4.34Å; I176-L180 HydrophobicContact CG2-CD1 4.24Å; I176-L180 HydrophobicContact CG2-CG 4.39Å; I176-L180 WeakPolarHBondContact O-CG 3.34Å; I176-L180 PolarHBondContact O-N 3.37Å; Y177-L180 PolarHBondContact O-N 2.66Å; L180-H184 PolarHBondContact O-N 3.17Å; L180-V185 HydrophobicContact CD2-CB 3.96Å; L180-V185 HydrophobicContact CD2-CG1 3.94Å; L180-V185 HydrophobicContact CD2-CG2 3.99Å; L180-V185 PolarHBondContact O-N 3.49Å; L180-V185 VanDerWaalsContact O-N 3.07Å; L180-I191 HydrophobicContact CD2-CD1 3.98Å; L180-V200 HydrophobicContact CD2-CB 4.43Å; L180-V200 HydrophobicContact CD2-CG1 3.79Å; L180-V200 HydrophobicContact CD2-CG2 4.1Å; L180-V200 HydrophobicContact CG-CG2 4.13Å
181	Q	87.7	Confident	89.4	Confident	106 Å²	106	61 Å²	61	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-42.2	176.2	-74.6	-169.8	-23	0	0	112.5	Y177 E178 E183 H184	Y177-Q181 HydrophobicContact CD1-CG 4.34Å; Y177-Q181 VanDerWaalsContact CE1-CD 3.45Å; Y177-Q181 HydrophobicContact CE1-CG 4.02Å; Y177-Q181 HydrophobicContact CE2-CG 4.39Å; Y177-Q181 WeakPolarHBondContact O-CG 3.46Å; Y177-Q181 PolarHBondContact O-N 2.81Å; Y177-Q181 PolarHBondContact OH-NE2 2.99Å; Y177-Q181 VanDerWaalsContact OH-NE2 3.07Å; E178-Q181 PolarHBondContact O-N 2.89Å; Q181-E183 VanDerWaalsContact C-N 3.26Å; Q181-E183 PolarHBondContact O-N 3.31Å; Q181-H184 PolarHBondContact O-N 3.19Å; Q181-H184 VanDerWaalsContact O-N 3.1Å
182	K	88.2	Confident	89.4	Confident	150 Å²	150	55.8 Å²	55.8	65%	0.652	28%	0.281	S	S	*	.	H	α-helix	trans	-61.7	-34.8	177.4	-78.2	169.9	-175.3	163	0	112.5	E178 S179 H184	E178-K182 WeakPolarHBondContact O-CB 3.35Å; E178-K182 VanDerWaalsContact O-CG 3.26Å; E178-K182 WeakPolarHBondContact O-CG 3.24Å; E178-K182 PolarHBondContact O-N 2.84Å; S179-K182 PolarHBondContact O-N 2.81Å; K182-H184 VanDerWaalsContact C-N 3.3Å
183	E	87.9	Confident	89.6	Confident	79 Å²	79	55 Å²	55	37%	0.369	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3	177.5	-70	-76.1	137.3	0	0	113.2	S179 Q181 V185 R202	S179-E183 WeakPolarHBondContact O-CB 3.45Å; S179-E183 WeakPolarHBondContact O-CG 3.47Å; S179-E183 PolarHBondContact O-N 2.84Å; S179-E183 VanDerWaalsContact O-N 3.09Å; Q181-E183 VanDerWaalsContact C-N 3.26Å; Q181-E183 PolarHBondContact O-N 3.31Å; E183-V185 VanDerWaalsContact C-N 3.28Å; E183-V185 HydrophobicContact CB-CG2 3.83Å; E183-V185 PolarHBondContact O-N 2.89Å; E183-R202 PolarHBondContact OE2-N 2.82Å
184	H	90.6	Very high	89.7	Confident	146 Å²	146	52.1 Å²	52.1	68%	0.676	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	45.8	-177.7	-61.9	-73	0	0	0	113.3	L180 Q181 K182	L180-H184 PolarHBondContact O-N 3.17Å; Q181-H184 PolarHBondContact O-N 3.19Å; Q181-H184 VanDerWaalsContact O-N 3.1Å; K182-H184 VanDerWaalsContact C-N 3.3Å
185	V	92	Very high	89.9	Confident	12 Å²	12	52.1 Å²	52.1	7%	0.073	26%	0.264	C	S	.	.			trans	-76	126.9	-177.4	176	0	0	0	0	111.1	V135 L180 E183 I191 V200	V135-V185 HydrophobicContact CG2-CG1 3.84Å; L180-V185 HydrophobicContact CD2-CB 3.96Å; L180-V185 HydrophobicContact CD2-CG1 3.94Å; L180-V185 HydrophobicContact CD2-CG2 3.99Å; L180-V185 PolarHBondContact O-N 3.49Å; L180-V185 VanDerWaalsContact O-N 3.07Å; E183-V185 VanDerWaalsContact C-N 3.28Å; E183-V185 HydrophobicContact CB-CG2 3.83Å; E183-V185 PolarHBondContact O-N 2.89Å; V185-I191 HydrophobicContact CB-CG2 4.43Å; V185-I191 HydrophobicContact CG1-CD1 4.27Å; V185-I191 HydrophobicContact CG1-CG2 3.64Å; V185-I191 HydrophobicContact CG2-CG2 3.88Å; V185-V200 HydrophobicContact CG2-CG1 4.31Å
186	E	91.3	Very high	89.9	Confident	115 Å²	115	54.7 Å²	54.7	54%	0.537	27%	0.272	S	S	.	.			trans	-120.6	165.2	178	-65	-174.2	170	0	0	112.8	G188 D189 R205	E186-G188 PolarHBondContact O-N 3.23Å; E186-D189 PolarHBondContact N-OD2 3.02Å; E186-D189 WeakPolarHBondContact O-CB 3.26Å; E186-D189 PolarHBondContact O-N 3.27Å; E186-D189 VanDerWaalsContact O-N 3.13Å; E186-R205 IonicContact OE2-NH1 3.85Å
187	V	93.6	Very high	89.7	Confident	67 Å²	67	57.1 Å²	57.1	41%	0.406	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	124.3	171.7	179.2	0	0	0	0	108.6	V135 R205	V135-V187 HydrophobicContact CG1-CG2 4.49Å; V135-V187 CarbonylContact O-C 3.59Å; V135-V187 WeakPolarHBondContact O-CA 3.43Å; V187-R205 PolarHBondContact O-NH1 2.95Å; V187-R205 VanDerWaalsContact O-NH1 3.14Å; V187-R205 PolarHBondContact O-NH2 2.88Å
188	G	91.8	Very high	89.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	105.5	-9.7	-174.2	0	0	0	0	0	114.3	V135 E186 C206	V135-G188 PolarHBondContact O-N 3.5Å; E186-G188 PolarHBondContact O-N 3.23Å; G188-C206 VanDerWaalsContact O-CB 3.25Å; G188-C206 WeakPolarHBondContact O-CB 3.3Å; G188-C206 PolarHBondContact O-N 2.88Å
189	D	94.2	Very high	89.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	143.3	175.2	-66.6	-17.1	0	0	0	111.9	E134 V135 E186 I191 R202 R205	E134-D189 CarbonylContact C-O 3.52Å; E134-D189 VanDerWaalsContact CA-O 3.3Å; E134-D189 WeakPolarHBondContact CA-O 3.44Å; V135-D189 PolarHBondContact N-O 2.8Å; E186-D189 PolarHBondContact N-OD2 3.02Å; E186-D189 WeakPolarHBondContact O-CB 3.26Å; E186-D189 PolarHBondContact O-N 3.27Å; E186-D189 VanDerWaalsContact O-N 3.13Å; D189-I191 HydrophobicContact CB-CG2 4.31Å; D189-R202 HydrophobicContact CB-CG 4.42Å; D189-R202 VanDerWaalsContact CG-NE 3.26Å; D189-R202 IonicContact OD1-CZ 3.71Å; D189-R202 IonicContact OD1-NE 3.85Å; D189-R202 IonicContact OD1-NH2 3.45Å; D189-R202 PolarHBondContact OD1-NH2 2.95Å; D189-R202 IonicContact OD2-CZ 2.93Å; D189-R202 IonicContact OD2-NE 3.66Å; D189-R202 PolarHBondContact OD2-NE 3.16Å; D189-R202 IonicContact OD2-NH2 3.66Å; D189-R202 PolarHBondContact OD2-NH2 3.09Å; D189-R205 WeakPolarHBondContact OD1-CD 3.44Å; D189-R205 IonicContact OD1-CZ 3.59Å; D189-R205 IonicContact OD1-NE 3.78Å; D189-R205 IonicContact OD1-NH1 2.9Å; D189-R205 PolarHBondContact OD1-NH1 3.38Å
190	V	94.4	Very high	90	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.3	167.8	179.8	0	0	0	0	108.5	E134 Q203 G204 C206 V221 P224	E134-V190 HydrophobicContact CB-CG2 4.37Å; V190-Q203 HydrophobicContact CB-CB 4.49Å; V190-Q203 HydrophobicContact CG1-CB 4.35Å; V190-Q203 WeakPolarHBondContact O-CB 3.12Å; V190-Q203 PolarHBondContact O-N 2.98Å; V190-G204 PolarHBondContact N-O 3.1Å; V190-C206 HydrophobicContact CG2-CB 4.04Å; V190-V221 HydrophobicContact CB-CG2 3.6Å; V190-V221 HydrophobicContact CG1-CG2 4.32Å; V190-V221 HydrophobicContact CG2-CG2 3.67Å; V190-P224 HydrophobicContact CG1-CG 3.58Å
191	I	94.5	Very high	90.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	161.5	179.7	68.3	171.4	0	0	0	110.8	E132 G133 V135 I159 L161 L180 V185 D189 I193 V200 K201	E132-I191 WeakPolarHBondContact CA-O 3.33Å; G133-I191 PolarHBondContact N-O 3.22Å; G133-I191 VanDerWaalsContact N-O 3.12Å; G133-I191 PolarHBondContact O-N 3.36Å; V135-I191 HydrophobicContact CG2-CD1 3.6Å; V135-I191 HydrophobicContact CG2-CG1 3.77Å; V135-I191 HydrophobicContact CG2-CG2 4.09Å; I159-I191 HydrophobicContact CD1-CD1 3.69Å; L161-I191 HydrophobicContact CD2-CD1 4.05Å; L161-I191 HydrophobicContact CD2-CG1 3.94Å; L180-I191 HydrophobicContact CD2-CD1 3.98Å; V185-I191 HydrophobicContact CB-CG2 4.43Å; V185-I191 HydrophobicContact CG1-CD1 4.27Å; V185-I191 HydrophobicContact CG1-CG2 3.64Å; V185-I191 HydrophobicContact CG2-CG2 3.88Å; D189-I191 HydrophobicContact CB-CG2 4.31Å; I191-I193 HydrophobicContact CD1-CD1 3.94Å; I191-I193 HydrophobicContact CD1-CG1 3.99Å; I191-I193 HydrophobicContact CG1-CG1 4.49Å; I191-V200 HydrophobicContact CB-CG1 4.32Å; I191-V200 HydrophobicContact CD1-CG1 4.14Å; I191-K201 WeakPolarHBondContact CA-O 3.48Å
192	Y	91.5	Very high	90.3	Very high	35 Å²	35	54 Å²	54	14%	0.137	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.1	161.1	87.5	-87.4	0	0	0	110.8	V130 Y131 E194 V200 K201 Q203	V130-Y192 HydrophobicContact CG1-CD2 4.38Å; Y131-Y192 CarbonylContact O-C 3.51Å; Y131-Y192 VanDerWaalsContact O-CA 3.25Å; Y131-Y192 WeakPolarHBondContact O-CA 3.44Å; Y192-E194 HydrophobicContact CD2-CG 4.37Å; Y192-E194 HydrophobicContact CE2-CG 3.79Å; Y192-V200 WeakPolarHBondContact O-CA 3.46Å; Y192-K201 HydrophobicContact CD1-CB 3.93Å; Y192-K201 HydrophobicContact CE1-CB 3.43Å; Y192-K201 VanDerWaalsContact CE1-CB 3.43Å; Y192-K201 HydrophobicContact CE1-CD 3.67Å; Y192-K201 HydrophobicContact CE1-CG 3.66Å; Y192-K201 PolarHBondContact N-O 3.43Å; Y192-K201 VanDerWaalsContact N-O 3.11Å; Y192-K201 PolarHBondContact O-N 3.4Å; Y192-K201 WeakPolarHBondContact OH-CD 3.42Å; Y192-K201 WeakPolarHBondContact OH-CE 3.47Å; Y192-K201 PolarHBondContact OH-NZ 2.86Å; Y192-K201 VanDerWaalsContact OH-NZ 3.15Å; Y192-Q203 HydrophobicContact CD1-CG 4.32Å
193	I	92.5	Very high	90.4	Very high	3 Å²	3	50 Å²	50	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.4	-179.8	-49.9	-178	0	0	0	108	V130 Y131 L172 I191 A199 V200	V130-I193 CarbonylContact C-O 3.43Å; V130-I193 VanDerWaalsContact CA-O 3.3Å; V130-I193 WeakPolarHBondContact CA-O 3.47Å; Y131-I193 PolarHBondContact N-O 3.22Å; Y131-I193 PolarHBondContact O-N 3.36Å; L172-I193 HydrophobicContact CD1-CD1 3.85Å; I191-I193 HydrophobicContact CD1-CD1 3.94Å; I191-I193 HydrophobicContact CD1-CG1 3.99Å; I191-I193 HydrophobicContact CG1-CG1 4.49Å; I193-A199 WeakPolarHBondContact CA-O 3.38Å; I193-V200 HydrophobicContact CD1-CG2 4.41Å; I193-V200 HydrophobicContact CG1-CG1 4.28Å; I193-V200 HydrophobicContact CG1-CG2 4.05Å; I193-V200 HydrophobicContact CG2-CG2 4.25Å
194	E	90.3	Very high	90.5	Very high	32 Å²	32	46.5 Å²	46.5	15%	0.15	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	122.2	171.7	-66.5	-169.4	178.4	0	0	110	K128 V130 Y192 N196 S197 G198 A199	K128-E194 HydrophobicContact CD-CG 4.46Å; K128-E194 IonicContact NZ-OE1 3.75Å; K128-E194 PolarHBondContact NZ-OE1 3.4Å; K128-E194 IonicContact NZ-OE2 3.16Å; K128-E194 PolarHBondContact NZ-OE2 3.35Å; V130-E194 HydrophobicContact CG1-CG 4.44Å; Y192-E194 HydrophobicContact CD2-CG 4.37Å; Y192-E194 HydrophobicContact CE2-CG 3.79Å; E194-N196 VanDerWaalsContact C-N 3.28Å; E194-N196 PolarHBondContact O-N 3.49Å; E194-S197 WeakPolarHBondContact CB-OG 2.99Å; E194-S197 PolarHBondContact OE2-OG 3.14Å; E194-S197 VanDerWaalsContact OE2-OG 3.12Å; E194-G198 WeakPolarHBondContact O-CA 3.28Å; E194-G198 PolarHBondContact O-N 2.95Å; E194-A199 PolarHBondContact N-O 3.4Å
195	A	88	Confident	90.5	Very high	42 Å²	42	40.2 Å²	40.2	35%	0.347	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.7	-172.8	0	0	0	0	0	113.3	E129 Y131	E129-A195 HydrophobicContact CB-CB 3.86Å; E129-A195 WeakPolarHBondContact O-CB 3.2Å; E129-A195 PolarHBondContact O-N 2.92Å; Y131-A195 HydrophobicContact CD2-CB 4.3Å; Y131-A195 HydrophobicContact CE2-CB 3.89Å
196	N	84.5	Confident	90.3	Very high	143 Å²	143	39.7 Å²	39.7	77%	0.765	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-35.2	-174.9	-66.3	-20.5	0	0	0	113.5	E194	E194-N196 VanDerWaalsContact C-N 3.28Å; E194-N196 PolarHBondContact O-N 3.49Å
197	S	84.1	Confident	90.1	Very high	73 Å²	73	37.5 Å²	37.5	51%	0.51	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-19.2	-174.7	60.9	0	0	0	0	113	E194 A199	E194-S197 WeakPolarHBondContact CB-OG 2.99Å; E194-S197 PolarHBondContact OE2-OG 3.14Å; E194-S197 VanDerWaalsContact OE2-OG 3.12Å; S197-A199 PolarHBondContact O-N 3.17Å; S197-A199 WeakPolarHBondContact OG-CB 3.44Å; S197-A199 PolarHBondContact OG-N 3.47Å
198	G	84.8	Confident	89.6	Confident	11 Å²	11	38.7 Å²	38.7	11%	0.113	21%	0.214	C	C	.	.			trans	67.5	10.1	-170.4	0	0	0	0	0	113.3	E194 V200	E194-G198 WeakPolarHBondContact O-CA 3.28Å; E194-G198 PolarHBondContact O-N 2.95Å; G198-V200 PolarHBondContact O-N 3.31Å
199	A	87.4	Confident	89	Confident	38 Å²	38	40.4 Å²	40.4	31%	0.314	22%	0.22	S	C	.	.			trans	-69.6	127.9	176.5	0	0	0	0	0	109.7	I193 E194 S197	I193-A199 WeakPolarHBondContact CA-O 3.38Å; E194-A199 PolarHBondContact N-O 3.4Å; S197-A199 PolarHBondContact O-N 3.17Å; S197-A199 WeakPolarHBondContact OG-CB 3.44Å; S197-A199 PolarHBondContact OG-N 3.47Å
200	V	91.3	Very high	88	Confident	8 Å²	8	44 Å²	44	5%	0.048	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	142.9	177	-173.9	0	0	0	0	108.5	I176 L180 V185 I191 Y192 I193 G198	I176-V200 HydrophobicContact CG2-CG2 3.68Å; L180-V200 HydrophobicContact CD2-CB 4.43Å; L180-V200 HydrophobicContact CD2-CG1 3.79Å; L180-V200 HydrophobicContact CD2-CG2 4.1Å; L180-V200 HydrophobicContact CG-CG2 4.13Å; V185-V200 HydrophobicContact CG2-CG1 4.31Å; I191-V200 HydrophobicContact CB-CG1 4.32Å; I191-V200 HydrophobicContact CD1-CG1 4.14Å; Y192-V200 WeakPolarHBondContact O-CA 3.46Å; I193-V200 HydrophobicContact CD1-CG2 4.41Å; I193-V200 HydrophobicContact CG1-CG1 4.28Å; I193-V200 HydrophobicContact CG1-CG2 4.05Å; I193-V200 HydrophobicContact CG2-CG2 4.25Å; G198-V200 PolarHBondContact O-N 3.31Å
201	K	90.7	Very high	86.8	Confident	108 Å²	108	48.9 Å²	48.9	47%	0.47	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	139	162.1	-53.3	-167.6	-174	160	0	111.4	I191 Y192	I191-K201 WeakPolarHBondContact CA-O 3.48Å; Y192-K201 HydrophobicContact CD1-CB 3.93Å; Y192-K201 HydrophobicContact CE1-CB 3.43Å; Y192-K201 VanDerWaalsContact CE1-CB 3.43Å; Y192-K201 HydrophobicContact CE1-CD 3.67Å; Y192-K201 HydrophobicContact CE1-CG 3.66Å; Y192-K201 PolarHBondContact N-O 3.43Å; Y192-K201 VanDerWaalsContact N-O 3.11Å; Y192-K201 PolarHBondContact O-N 3.4Å; Y192-K201 WeakPolarHBondContact OH-CD 3.42Å; Y192-K201 WeakPolarHBondContact OH-CE 3.47Å; Y192-K201 PolarHBondContact OH-NZ 2.86Å; Y192-K201 VanDerWaalsContact OH-NZ 3.15Å
202	R	92.3	Very high	85.6	Confident	72 Å²	72	54.5 Å²	54.5	27%	0.272	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	122.7	170.8	-168.4	-177.9	-173.5	-127.3	-6.5	109.5	E183 D189 D218	E183-R202 PolarHBondContact OE2-N 2.82Å; D189-R202 HydrophobicContact CB-CG 4.42Å; D189-R202 VanDerWaalsContact CG-NE 3.26Å; D189-R202 IonicContact OD1-CZ 3.71Å; D189-R202 IonicContact OD1-NE 3.85Å; D189-R202 IonicContact OD1-NH2 3.45Å; D189-R202 PolarHBondContact OD1-NH2 2.95Å; D189-R202 IonicContact OD2-CZ 2.93Å; D189-R202 IonicContact OD2-NE 3.66Å; D189-R202 PolarHBondContact OD2-NE 3.16Å; D189-R202 IonicContact OD2-NH2 3.66Å; D189-R202 PolarHBondContact OD2-NH2 3.09Å; R202-D218 IonicContact CZ-OD1 3.47Å; R202-D218 IonicContact CZ-OD2 3.6Å; R202-D218 IonicContact NH1-OD1 3.38Å; R202-D218 PolarHBondContact NH1-OD1 3.16Å; R202-D218 IonicContact NH1-OD2 2.75Å; R202-D218 IonicContact NH2-OD1 2.75Å; R202-D218 IonicContact NH2-OD2 3.84Å; R202-D218 PolarHBondContact NH2-OD2 2.66Å
203	Q	89.8	Confident	84.1	Confident	66 Å²	66	57.8 Å²	57.8	31%	0.308	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-28.5	174.6	-64.8	-172.8	-4.5	0	0	112.2	V190 Y192 V221	V190-Q203 HydrophobicContact CB-CB 4.49Å; V190-Q203 HydrophobicContact CG1-CB 4.35Å; V190-Q203 WeakPolarHBondContact O-CB 3.12Å; V190-Q203 PolarHBondContact O-N 2.98Å; Y192-Q203 HydrophobicContact CD1-CG 4.32Å; Q203-V221 HydrophobicContact CB-CG2 4.42Å; Q203-V221 WeakPolarHBondContact O-CG1 3.48Å
204	G	90.9	Very high	82.5	Confident	5 Å²	5	65.6 Å²	65.6	5%	0.052	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150	-178.1	-178.5	0	0	0	0	0	111.6	V190 E219	V190-G204 PolarHBondContact N-O 3.1Å; G204-E219 CarbonylContact C-O 3.58Å; G204-E219 WeakPolarHBondContact CA-O 3.31Å
205	R	90.2	Very high	81.2	Confident	15 Å²	15	72.4 Å²	72.4	6%	0.057	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	142	175.8	-163.3	67.5	175.4	-168.1	-3.6	110.4	E186 V187 D189 D207 D218 E219 Y220 V221	E186-R205 IonicContact OE2-NH1 3.85Å; V187-R205 PolarHBondContact O-NH1 2.95Å; V187-R205 VanDerWaalsContact O-NH1 3.14Å; V187-R205 PolarHBondContact O-NH2 2.88Å; D189-R205 WeakPolarHBondContact OD1-CD 3.44Å; D189-R205 IonicContact OD1-CZ 3.59Å; D189-R205 IonicContact OD1-NE 3.78Å; D189-R205 IonicContact OD1-NH1 2.9Å; D189-R205 PolarHBondContact OD1-NH1 3.38Å; R205-D207 PolarHBondContact O-N 2.82Å; R205-D218 HydrophobicContact CB-CB 4.24Å; R205-E219 PolarHBondContact N-O 3.09Å; R205-Y220 HydrophobicContact CB-CD1 4.03Å; R205-Y220 HydrophobicContact CB-CE1 4.04Å; R205-Y220 HydrophobicContact CG-CD1 4.31Å; R205-Y220 HydrophobicContact CG-CE1 3.95Å; R205-Y220 CarbonylContact O-C 3.57Å; R205-Y220 VanDerWaalsContact O-CA 3.28Å; R205-Y220 WeakPolarHBondContact O-CA 3.32Å; R205-V221 PolarHBondContact O-N 3.36Å
206	C	88.9	Confident	80	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	136.4	177.6	-164	0	0	0	0	110.9	E134 G188 V190 V208 Y209 V221	E134-C206 HydrophobicContact CG-CB 4Å; G188-C206 VanDerWaalsContact O-CB 3.25Å; G188-C206 WeakPolarHBondContact O-CB 3.3Å; G188-C206 PolarHBondContact O-N 2.88Å; V190-C206 HydrophobicContact CG2-CB 4.04Å; C206-V208 PolarHBondContact O-N 2.99Å; C206-Y209 HydrophobicContact CB-CD2 3.96Å; C206-Y209 HydrophobicContact CB-CE2 4.16Å; C206-Y209 PolarHBondContact O-N 2.92Å; C206-V221 WeakPolarHBondContact CA-O 3.35Å
207	D	86.8	Confident	79.2	Confident	70 Å²	70	73.8 Å²	73.8	37%	0.374	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-50.8	-26.9	176.2	59.5	-9.2	0	0	0	115.1	R205 Y209 T210 V221	R205-D207 PolarHBondContact O-N 2.82Å; D207-Y209 PolarHBondContact O-N 2.86Å; D207-T210 WeakPolarHBondContact O-CB 3.31Å; D207-T210 PolarHBondContact O-N 2.81Å; D207-T210 VanDerWaalsContact O-N 3.17Å; D207-T210 PolarHBondContact O-OG1 3.23Å; D207-V221 PolarHBondContact N-O 3.33Å
208	V	82.4	Confident	78.7	Confident	91 Å²	91	72.7 Å²	72.7	55%	0.552	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-58.8	-30.5	175.3	-177.7	0	0	0	0	112.6	C206	C206-V208 PolarHBondContact O-N 2.99Å
209	Y	79.8	Confident	78.6	Confident	37 Å²	37	79.1 Å²	79.1	15%	0.145	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-91.6	4.5	-178.6	-58.6	-84	0	0	0	113.8	E134 C206 D207 A211 E212	E134-Y209 WeakPolarHBondContact OE1-CE2 3.3Å; E134-Y209 PolarHBondContact OE1-OH 2.84Å; C206-Y209 HydrophobicContact CB-CD2 3.96Å; C206-Y209 HydrophobicContact CB-CE2 4.16Å; C206-Y209 PolarHBondContact O-N 2.92Å; D207-Y209 PolarHBondContact O-N 2.86Å; Y209-A211 PolarHBondContact O-N 3.29Å; Y209-E212 WeakPolarHBondContact CD1-OE2 3.4Å; Y209-E212 PolarHBondContact O-N 2.89Å
210	T	72.2	Confident	78.5	Confident	76 Å²	76	80.6 Å²	80.6	47%	0.466	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-28.5	-179.8	-50.4	0	0	0	0	112.6	D207 Y220	D207-T210 WeakPolarHBondContact O-CB 3.31Å; D207-T210 PolarHBondContact O-N 2.81Å; D207-T210 VanDerWaalsContact O-N 3.17Å; D207-T210 PolarHBondContact O-OG1 3.23Å; T210-Y220 WeakPolarHBondContact OG1-CD1 3.49Å
211	A	69.6	Low	78.4	Confident	101 Å²	101	81.1 Å²	81.1	84%	0.835	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-10.1	-177.5	0	0	0	0	0	114.9	Y209	Y209-A211 PolarHBondContact O-N 3.29Å
212	E	68.7	Low	78.4	Confident	118 Å²	118	80.4 Å²	80.4	55%	0.551	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-27.7	-173.7	-70.3	-170.3	176.1	0	0	113.4	Y209	Y209-E212 WeakPolarHBondContact CD1-OE2 3.4Å; Y209-E212 PolarHBondContact O-N 2.89Å
213	Y	61.6	Low	78.4	Confident	105 Å²	105	78.9 Å²	78.9	41%	0.412	43%	0.434	S	S	.	.			trans	-132	105.7	-174.2	-57.2	-82.8	0	0	0	111.1	L215	Y213-L215 VanDerWaalsContact C-N 3.25Å; Y213-L215 PolarHBondContact O-N 3.4Å
214	D	58.3	Low	78.5	Confident	167 Å²	167	76.1 Å²	76.1	89%	0.893	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-5	-174.6	-150	13	0	0	0	113.5
215	L	62.5	Low	78.4	Confident	174 Å²	174	84.9 Å²	84.9	91%	0.911	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	6.5	-170	-73.3	169.8	0	0	0	115.1	Y213	Y213-L215 VanDerWaalsContact C-N 3.25Å; Y213-L215 PolarHBondContact O-N 3.4Å
216	E	63.7	Low	78.4	Confident	103 Å²	103	85 Å²	85	48%	0.481	46%	0.463	S	S	.	.			trans	-97.8	133.5	-179.3	-68.4	-173.1	172.8	0	0	112.5	D218	E216-D218 VanDerWaalsContact C-N 3.3Å; E216-D218 PolarHBondContact O-N 3.04Å
217	A	66.2	Low	78.6	Confident	111 Å²	111	91 Å²	91	92%	0.917	49%	0.492	S	S	*	.			trans	-95.2	35.8	-179.8	0	0	0	0	0	112.3
218	D	73.8	Confident	78.9	Confident	51 Å²	51	88 Å²	88	27%	0.273	48%	0.476	S	S	.	.			trans	-74.5	148.5	176.8	-104.9	-18.1	0	0	0	111.2	R202 R205 E216 Y220	R202-D218 IonicContact CZ-OD1 3.47Å; R202-D218 IonicContact CZ-OD2 3.6Å; R202-D218 IonicContact NH1-OD1 3.38Å; R202-D218 PolarHBondContact NH1-OD1 3.16Å; R202-D218 IonicContact NH1-OD2 2.75Å; R202-D218 IonicContact NH2-OD1 2.75Å; R202-D218 IonicContact NH2-OD2 3.84Å; R202-D218 PolarHBondContact NH2-OD2 2.66Å; R205-D218 HydrophobicContact CB-CB 4.24Å; E216-D218 VanDerWaalsContact C-N 3.3Å; E216-D218 PolarHBondContact O-N 3.04Å; D218-Y220 VanDerWaalsContact O-CD2 3.23Å; D218-Y220 WeakPolarHBondContact O-CD2 3.49Å; D218-Y220 WeakPolarHBondContact O-CE2 3.43Å; D218-Y220 PolarHBondContact O-N 3.21Å
219	E	82.7	Confident	79.4	Confident	146 Å²	146	86.4 Å²	86.4	68%	0.682	46%	0.462	S	S	*	.			trans	-75.3	113.5	173.8	-174.2	173	178.6	0	0	109.1	G204 R205	G204-E219 CarbonylContact C-O 3.58Å; G204-E219 WeakPolarHBondContact CA-O 3.31Å; R205-E219 PolarHBondContact N-O 3.09Å
220	Y	85.2	Confident	80	Confident	68 Å²	68	87.3 Å²	87.3	27%	0.267	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	124.7	178.3	-70.2	-88.6	0	0	0	111	R205 T210 D218	R205-Y220 HydrophobicContact CB-CD1 4.03Å; R205-Y220 HydrophobicContact CB-CE1 4.04Å; R205-Y220 HydrophobicContact CG-CD1 4.31Å; R205-Y220 HydrophobicContact CG-CE1 3.95Å; R205-Y220 CarbonylContact O-C 3.57Å; R205-Y220 VanDerWaalsContact O-CA 3.28Å; R205-Y220 WeakPolarHBondContact O-CA 3.32Å; T210-Y220 WeakPolarHBondContact OG1-CD1 3.49Å; D218-Y220 VanDerWaalsContact O-CD2 3.23Å; D218-Y220 WeakPolarHBondContact O-CD2 3.49Å; D218-Y220 WeakPolarHBondContact O-CE2 3.43Å; D218-Y220 PolarHBondContact O-N 3.21Å
221	V	89.6	Confident	80.8	Confident	20 Å²	20	90.4 Å²	90.4	12%	0.121	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142.9	179.9	-67.2	0	0	0	0	110.7	V190 Q203 R205 C206 D207	V190-V221 HydrophobicContact CB-CG2 3.6Å; V190-V221 HydrophobicContact CG1-CG2 4.32Å; V190-V221 HydrophobicContact CG2-CG2 3.67Å; Q203-V221 HydrophobicContact CB-CG2 4.42Å; Q203-V221 WeakPolarHBondContact O-CG1 3.48Å; R205-V221 PolarHBondContact O-N 3.36Å; C206-V221 WeakPolarHBondContact CA-O 3.35Å; D207-V221 PolarHBondContact N-O 3.33Å
222	P	92.2	Very high	81.6	Confident	92 Å²	92	89.8 Å²	89.8	60%	0.597	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-70.4	150.1	-179.4	29.3	-35	0	0	0	111.3
223	L	91.9	Very high	82.4	Confident	40 Å²	40	90 Å²	90	21%	0.209	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-53.4	127.3	173.8	-171.7	70.8	0	0	0	110.9	E134 A164 K225	E134-L223 HydrophobicContact CB-CD1 3.7Å; E134-L223 WeakPolarHBondContact OE2-CD1 3.27Å; A164-L223 HydrophobicContact CB-CD2 4.25Å; L223-K225 PolarHBondContact O-N 3.08Å
224	P	91.6	Very high	83.5	Confident	8 Å²	8	87.2 Å²	87.2	5%	0.052	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-56.1	132.1	-177.9	-30.6	37.3	0	0	0	113.3	E132 T163 A164 V190	E132-P224 HydrophobicContact CG-CB 4.25Å; E132-P224 HydrophobicContact CG-CG 4.02Å; E132-P224 WeakPolarHBondContact OE1-CB 3.21Å; T163-P224 WeakPolarHBondContact CB-O 3.47Å; T163-P224 HydrophobicContact CG2-CB 4.11Å; A164-P224 PolarHBondContact N-O 3.02Å; V190-P224 HydrophobicContact CG1-CG 3.58Å
225	K	88.1	Confident	84.8	Confident	190 Å²	190	82.5 Å²	82.5	83%	0.826	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-84.6	127.2	171.8	-61.2	-179.8	-176.2	177.4	0	108.7	L223	L223-K225 PolarHBondContact O-N 3.08Å
226	G	90.4	Very high	86.1	Confident	16 Å²	16	79.4 Å²	79.4	17%	0.165	41%	0.409	C	S	.	.	S	Bend	trans	121.2	-173.2	179.1	0	0	0	0	0	113.2	T163 K165	T163-G226 VanDerWaalsContact CB-O 3.28Å; T163-G226 WeakPolarHBondContact CB-O 3.31Å; T163-G226 PolarHBondContact OG1-O 2.9Å; K165-G226 WeakPolarHBondContact CB-O 3.48Å
227	E	93	Very high	87.4	Confident	127 Å²	127	78 Å²	78	59%	0.593	41%	0.405	S	S	*	.			trans	-76	150.3	177.1	-64.7	179.9	-170.9	0	0	110.6	K165 H229	K165-E227 HydrophobicContact CD-CG 4.23Å; E227-H229 VanDerWaalsContact C-N 3.3Å; E227-H229 PolarHBondContact O-N 3.26Å
228	V	93.3	Very high	88.6	Confident	8 Å²	8	73.7 Å²	73.7	5%	0.048	37%	0.367	C	S	.	.	S	Bend	trans	-59.1	-44.7	176.1	177.1	0	0	0	0	110.5	Y131 E132 L161 T163 K168	Y131-V228 CarbonylContact C-O 3.57Å; Y131-V228 VanDerWaalsContact CA-O 3.26Å; Y131-V228 WeakPolarHBondContact CA-O 3.38Å; Y131-V228 HydrophobicContact CD1-CG1 4.37Å; E132-V228 PolarHBondContact N-O 3.44Å; E132-V228 WeakPolarHBondContact O-CA 3.42Å; L161-V228 HydrophobicContact CB-CG1 3.65Å; L161-V228 HydrophobicContact CD1-CG1 4.02Å; L161-V228 HydrophobicContact CG-CG1 4.49Å; T163-V228 HydrophobicContact CG2-CB 4.33Å; T163-V228 HydrophobicContact CG2-CG2 3.77Å; K168-V228 HydrophobicContact CB-CB 3.99Å; K168-V228 HydrophobicContact CB-CG1 3.99Å; K168-V228 HydrophobicContact CB-CG2 3.96Å
229	H	93.7	Very high	89.5	Confident	56 Å²	56	72.3 Å²	72.3	26%	0.259	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	119.4	177.4	-179	-130	0	0	0	109.3	Y131 E227	Y131-H229 HydrophobicContact CD1-CB 3.87Å; Y131-H229 AromaticContact CD1-CD2 3.93Å; Y131-H229 HydrophobicContact CE1-CB 3.65Å; Y131-H229 AromaticContact CE1-CD2 3.49Å; Y131-H229 VanDerWaalsContact CE1-CD2 3.49Å; Y131-H229 WeakPolarHBondContact CE1-CD2 3.19Å; Y131-H229 AromaticContact CE1-CG 3.66Å; Y131-H229 AromaticContact CE2-CD2 3.82Å; Y131-H229 AromaticContact CZ-CD2 3.41Å; Y131-H229 VanDerWaalsContact CZ-CD2 3.41Å; Y131-H229 AromaticContact CZ-CG 3.95Å; Y131-H229 AromaticContact CZ-NE2 3.91Å; E227-H229 VanDerWaalsContact C-N 3.3Å; E227-H229 PolarHBondContact O-N 3.26Å
230	K	91.2	Very high	89.9	Confident	56 Å²	56	65.5 Å²	65.5	24%	0.243	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.1	-179.2	64.2	-171.5	178.8	-170.1	0	112	V130 E132	V130-K230 HydrophobicContact CG2-CG 3.78Å; V130-K230 PolarHBondContact N-O 3.01Å; V130-K230 PolarHBondContact O-N 2.88Å; E132-K230 IonicContact OE1-NZ 2.76Å; E132-K230 PolarHBondContact OE1-NZ 3.14Å; E132-K230 WeakPolarHBondContact OE2-CE 3.29Å; E132-K230 IonicContact OE2-NZ 3.56Å; E132-K230 PolarHBondContact OE2-NZ 3.24Å
231	K	90.4	Very high	90.2	Very high	141 Å²	141	62.9 Å²	62.9	61%	0.613	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.4	166.2	-67.5	-172.1	178.4	-160.2	0	108.1	I127 E129	I127-K231 HydrophobicContact CG2-CB 3.86Å; I127-K231 HydrophobicContact CG2-CD 4.26Å; I127-K231 HydrophobicContact CG2-CG 4.3Å; E129-K231 HydrophobicContact CG-CG 4.13Å; E129-K231 WeakPolarHBondContact OE1-CE 3.11Å; E129-K231 IonicContact OE1-NZ 3.72Å; E129-K231 PolarHBondContact OE1-NZ 2.98Å
232	K	85	Confident	90.3	Very high	89 Å²	89	65.6 Å²	65.6	39%	0.387	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.2	179.4	-170.2	172.3	-175	172.4	0	108.9	K128 V130 V234	K128-K232 PolarHBondContact N-O 3.23Å; K128-K232 PolarHBondContact O-N 3.4Å; V130-K232 HydrophobicContact CG2-CB 3.89Å; V130-K232 HydrophobicContact CG2-CD 4.35Å; K232-V234 HydrophobicContact CG-CG2 4.46Å; K232-V234 PolarHBondContact O-N 2.92Å
233	D	85.8	Confident	90.2	Very high	121 Å²	121	63.2 Å²	63.2	65%	0.647	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	113.5	172.1	-63.6	-22.2	0	0	0	108.6	I127	I127-D233 WeakPolarHBondContact CG1-OD1 3.47Å
234	V	84.2	Confident	90.2	Very high	48 Å²	48	61.3 Å²	61.3	29%	0.291	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115.9	177	-177.9	0	0	0	0	107.7	E126 K128 K232	E126-V234 PolarHBondContact N-O 3.35Å; E126-V234 PolarHBondContact O-N 2.93Å; K128-V234 HydrophobicContact CB-CG2 4.24Å; K128-V234 HydrophobicContact CD-CG2 4.08Å; K128-V234 HydrophobicContact CG-CG2 4.02Å; K232-V234 HydrophobicContact CG-CG2 4.46Å; K232-V234 PolarHBondContact O-N 2.92Å
235	V	87.3	Confident	90	Very high	67 Å²	67	63.2 Å²	63.2	41%	0.406	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.1	172.9	-174.7	0	0	0	0	108	R123 I124 K125	R123-V235 HydrophobicContact CG-CG1 3.68Å; I124-V235 WeakPolarHBondContact O-CA 3.31Å; K125-V235 HydrophobicContact CG-CG1 4.46Å; K125-V235 HydrophobicContact CG-CG2 4.28Å
236	Q	88.7	Confident	89.9	Confident	109 Å²	109	57 Å²	57	51%	0.509	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.8	176.2	-165	178.6	-8.3	0	0	109.3	I124 V238	I124-Q236 PolarHBondContact N-O 3.16Å; I124-Q236 PolarHBondContact O-N 3.12Å; Q236-V238 HydrophobicContact CG-CG2 3.78Å
237	D	90.3	Very high	89.7	Confident	73 Å²	73	60.8 Å²	60.8	39%	0.39	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	119.2	174.5	-65	-60	0	0	0	107.9	K90 R123	K90-D237 IonicContact NZ-OD2 3.54Å; R123-D237 WeakPolarHBondContact CB-OD1 3.43Å; R123-D237 IonicContact CZ-OD1 3.02Å; R123-D237 IonicContact NE-OD1 2.71Å; R123-D237 PolarHBondContact NE-OD1 3.43Å; R123-D237 IonicContact NE-OD2 3.37Å; R123-D237 IonicContact NH2-OD1 3.08Å; R123-D237 PolarHBondContact NH2-OD1 2.77Å; R123-D237 IonicContact NH2-OD2 3.67Å
238	V	91.9	Very high	89.2	Confident	21 Å²	21	56.7 Å²	56.7	13%	0.127	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.5	-178	-174.2	0	0	0	0	108.9	G121 L122 Q236 D242 L243	G121-V238 CarbonylContact C-O 3.52Å; L122-V238 WeakPolarHBondContact CA-O 3.33Å; L122-V238 PolarHBondContact N-O 3.08Å; L122-V238 PolarHBondContact O-N 3.38Å; Q236-V238 HydrophobicContact CG-CG2 3.78Å; V238-D242 HydrophobicContact CG1-CB 3.69Å; V238-L243 HydrophobicContact CG1-CD2 4.07Å; V238-L243 HydrophobicContact CG1-CG 4.09Å
239	T	92.7	Very high	88.3	Confident	23 Å²	23	60.1 Å²	60.1	14%	0.141	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	157.7	173.7	72	0	0	0	0	111.7	R118 I120 H241 D242 L243	R118-T239 WeakPolarHBondContact O-CG2 3.42Å; I120-T239 WeakPolarHBondContact O-CA 3.39Å; T239-H241 PolarHBondContact O-N 3.38Å; T239-D242 WeakPolarHBondContact CB-OD2 3.49Å; T239-D242 PolarHBondContact N-OD2 3.47Å; T239-D242 PolarHBondContact O-N 3.11Å; T239-D242 VanDerWaalsContact O-N 3.13Å; T239-D242 PolarHBondContact OG1-N 3.39Å; T239-D242 VanDerWaalsContact OG1-N 3.15Å; T239-D242 PolarHBondContact OG1-OD1 3.24Å; T239-D242 PolarHBondContact OG1-OD2 3.04Å; T239-L243 PolarHBondContact O-N 3.1Å
240	L	91.9	Very high	86.9	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-60.9	-31.1	173.3	-65.9	-174.1	0	0	0	111.9	R117 I120 L243 D244 V283	R117-L240 HydrophobicContact CB-CB 4.3Å; R117-L240 PolarHBondContact O-N 3.45Å; I120-L240 HydrophobicContact CB-CD1 3.91Å; I120-L240 HydrophobicContact CB-CG 4.09Å; I120-L240 HydrophobicContact CD1-CD1 4.02Å; I120-L240 HydrophobicContact CG2-CD1 3.58Å; I120-L240 HydrophobicContact CG2-CG 3.83Å; I120-L240 PolarHBondContact O-N 2.77Å; L240-L243 HydrophobicContact CD2-CD1 4.34Å; L240-L243 PolarHBondContact O-N 2.98Å; L240-D244 PolarHBondContact O-N 2.78Å; L240-V283 HydrophobicContact CD2-CG1 4.29Å; L240-V283 HydrophobicContact CD2-CG2 3.9Å
241	H	91.9	Very high	85.3	Confident	12 Å²	12	67.7 Å²	67.7	6%	0.056	36%	0.362	C	S	.	.	H	α-helix	trans	-66.3	-38.9	175.5	-179.6	73.2	0	0	0	112.2	R117 R118 T239 L243 D244 V245	R117-H241 HydrophobicContact CB-CB 3.82Å; R117-H241 PolarHBondContact O-N 3.05Å; R118-H241 HydrophobicContact CB-CB 4.35Å; R118-H241 HydrophobicContact CG-CB 3.49Å; R118-H241 VanDerWaalsContact CG-CB 3.49Å; R118-H241 PolarHBondContact NE-CD2 3.3Å; R118-H241 PolarHBondContact NE-NE2 3.26Å; R118-H241 VanDerWaalsContact NE-NE2 3.13Å; R118-H241 PolarHBondContact NH2-NE2 2.95Å; T239-H241 PolarHBondContact O-N 3.38Å; H241-L243 VanDerWaalsContact C-N 3.28Å; H241-L243 PolarHBondContact O-N 2.88Å; H241-D244 WeakPolarHBondContact O-CB 3.29Å; H241-D244 PolarHBondContact O-N 3.23Å; H241-V245 WeakPolarHBondContact O-CG2 3.35Å; H241-V245 PolarHBondContact O-N 2.87Å
242	D	91.3	Very high	83.7	Confident	78 Å²	78	64 Å²	64	42%	0.417	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-38.9	177.3	-58.5	-40.5	0	0	0	110.9	V238 T239 A246	V238-D242 HydrophobicContact CG1-CB 3.69Å; T239-D242 WeakPolarHBondContact CB-OD2 3.49Å; T239-D242 PolarHBondContact N-OD2 3.47Å; T239-D242 PolarHBondContact O-N 3.11Å; T239-D242 VanDerWaalsContact O-N 3.13Å; T239-D242 PolarHBondContact OG1-N 3.39Å; T239-D242 VanDerWaalsContact OG1-N 3.15Å; T239-D242 PolarHBondContact OG1-OD1 3.24Å; T239-D242 PolarHBondContact OG1-OD2 3.04Å; D242-A246 WeakPolarHBondContact O-CB 3.44Å; D242-A246 PolarHBondContact O-N 3.25Å
243	L	90.5	Very high	82	Confident	41 Å²	41	61.1 Å²	61.1	22%	0.215	36%	0.36	C	S	.	.	H	α-helix	trans	-65.4	-44.4	172.7	-63.2	177.9	0	0	0	111.7	L122 V238 T239 L240 H241 V245 A246 N247 I279 V283	L122-L243 HydrophobicContact CD2-CD1 3.99Å; V238-L243 HydrophobicContact CG1-CD2 4.07Å; V238-L243 HydrophobicContact CG1-CG 4.09Å; T239-L243 PolarHBondContact O-N 3.1Å; L240-L243 HydrophobicContact CD2-CD1 4.34Å; L240-L243 PolarHBondContact O-N 2.98Å; H241-L243 VanDerWaalsContact C-N 3.28Å; H241-L243 PolarHBondContact O-N 2.88Å; L243-V245 VanDerWaalsContact C-N 3.34Å; L243-V245 PolarHBondContact O-N 2.86Å; L243-A246 PolarHBondContact O-N 2.81Å; L243-N247 PolarHBondContact O-N 2.91Å; L243-N247 VanDerWaalsContact O-N 3.11Å; L243-N247 PolarHBondContact O-ND2 2.79Å; L243-I279 HydrophobicContact CB-CG2 4.14Å; L243-I279 HydrophobicContact CD1-CG2 4.39Å; L243-V283 HydrophobicContact CD1-CG2 4Å
244	D	91.1	Very high	80.7	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-58.4	-46.5	177.2	-68.6	-19.4	0	0	0	110.7	R117 L240 H241 A248 I271 R276 I279	R117-D244 VanDerWaalsContact CD-OD2 3.31Å; R117-D244 WeakPolarHBondContact CD-OD2 3.37Å; R117-D244 IonicContact CZ-OD2 3.73Å; R117-D244 IonicContact NE-OD2 2.75Å; R117-D244 IonicContact NH1-OD1 3.35Å; R117-D244 PolarHBondContact NH1-OD1 2.83Å; R117-D244 VanDerWaalsContact NH1-OD1 3.16Å; R117-D244 IonicContact NH1-OD2 2.66Å; R117-D244 PolarHBondContact NH1-OD2 2.85Å; L240-D244 PolarHBondContact O-N 2.78Å; H241-D244 WeakPolarHBondContact O-CB 3.29Å; H241-D244 PolarHBondContact O-N 3.23Å; D244-A248 WeakPolarHBondContact O-CB 3.22Å; D244-A248 PolarHBondContact O-N 3.07Å; D244-I271 HydrophobicContact CB-CD1 3.59Å; D244-I271 HydrophobicContact CB-CG2 4.23Å; D244-R276 IonicContact OD2-NE 2.99Å; D244-I279 HydrophobicContact CB-CD1 4.25Å; D244-I279 WeakPolarHBondContact OD1-CD1 2.97Å
245	V	87.8	Confident	79.4	Confident	49 Å²	49	67.1 Å²	67.1	30%	0.297	38%	0.384	S	S	.	.	H	α-helix	trans	-68.7	-44.6	179.8	173.1	0	0	0	0	111.8	H241 L243 N247 A248 R249 I271	H241-V245 WeakPolarHBondContact O-CG2 3.35Å; H241-V245 PolarHBondContact O-N 2.87Å; L243-V245 VanDerWaalsContact C-N 3.34Å; L243-V245 PolarHBondContact O-N 2.86Å; V245-N247 VanDerWaalsContact C-N 3.28Å; V245-N247 PolarHBondContact O-N 3.03Å; V245-A248 PolarHBondContact O-N 3.44Å; V245-R249 PolarHBondContact O-N 3.04Å; V245-I271 HydrophobicContact CG2-CD1 4.25Å
246	A	85.6	Confident	78.2	Confident	59 Å²	59	70.9 Å²	70.9	49%	0.488	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-36.2	-179.7	0	0	0	0	0	112.5	D242 L243 R249	D242-A246 WeakPolarHBondContact O-CB 3.44Å; D242-A246 PolarHBondContact O-N 3.25Å; L243-A246 PolarHBondContact O-N 2.81Å; A246-R249 CarbonylContact O-C 3.5Å
247	N	85.8	Confident	77.2	Confident	96 Å²	96	71.5 Å²	71.5	51%	0.513	41%	0.411	S	S	.	.	H	α-helix	trans	-82.2	-32.7	177	-72.7	-83	0	0	0	112.9	L243 V245 R249 L275 I279	L243-N247 PolarHBondContact O-N 2.91Å; L243-N247 VanDerWaalsContact O-N 3.11Å; L243-N247 PolarHBondContact O-ND2 2.79Å; V245-N247 VanDerWaalsContact C-N 3.28Å; V245-N247 PolarHBondContact O-N 3.03Å; N247-R249 VanDerWaalsContact C-N 3.34Å; N247-L275 HydrophobicContact CB-CD1 3.98Å; N247-L275 HydrophobicContact CB-CD2 4.37Å; N247-I279 HydrophobicContact CB-CD1 4.27Å
248	A	82.8	Confident	76	Confident	41 Å²	41	69.4 Å²	69.4	34%	0.339	40%	0.403	S	S	.	.	H	α-helix	trans	-72.1	-30.3	175.5	0	0	0	0	0	112.3	D244 V245 L275	D244-A248 WeakPolarHBondContact O-CB 3.22Å; D244-A248 PolarHBondContact O-N 3.07Å; V245-A248 PolarHBondContact O-N 3.44Å; A248-L275 HydrophobicContact CB-CD2 3.83Å
249	R	73.5	Confident	74.5	Confident	80 Å²	80	73.2 Å²	73.2	30%	0.302	42%	0.42	S	S	.	.	S	Bend	trans	-134.9	89.2	178.8	-63.2	-175.4	-168.6	-173.1	6.2	110.2	V245 A246 N247 Q251 K267 T269	V245-R249 PolarHBondContact O-N 3.04Å; A246-R249 CarbonylContact O-C 3.5Å; N247-R249 VanDerWaalsContact C-N 3.34Å; R249-Q251 PolarHBondContact O-N 3.4Å; R249-K267 PolarHBondContact NH1-O 3.42Å; R249-K267 PolarHBondContact NH2-O 3.26Å; R249-T269 PolarHBondContact NE-OG1 3.44Å; R249-T269 VanDerWaalsContact NH2-CG2 3.28Å; R249-T269 PolarHBondContact NH2-OG1 2.89Å
250	P	65.4	Low	73.2	Confident	100 Å²	100	77.1 Å²	77.1	65%	0.649	44%	0.438	S	S	*	.			trans	-58.4	110.6	173.1	-20.6	31.9	0	0	0	109.6
251	Q	57.6	Low	71.9	Confident	171 Å²	171	79.2 Å²	79.2	80%	0.799	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	130.6	169.3	-68.5	-170.2	0.3	0	0	108.3	R249	R249-Q251 PolarHBondContact O-N 3.4Å
252	G	56	Low	70.6	Confident	62 Å²	62	84.3 Å²	84.3	64%	0.639	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.4	17.7	177.1	0	0	0	0	0	115.7
253	G	50.2	Low	69.3	Low	30 Å²	30	88 Å²	88	31%	0.309	50%	0.503	S	S	.	.			trans	-60.2	137.1	160.3	0	0	0	0	0	110.1	S258	G253-S258 WeakPolarHBondContact CA-OG 3.16Å; G253-S258 PolarHBondContact O-OG 3.33Å
254	Q	57.6	Low	68.3	Low	174 Å²	174	91.3 Å²	91.3	81%	0.813	52%	0.519	S	S	*	.			trans	-81	-4.8	170.5	-69.4	-177.1	-8.9	0	0	111.9
255	D	58	Low	67	Low	121 Å²	121	100.9 Å²	100.9	65%	0.647	56%	0.561	S	S	*	*	S	Bend	trans	-73.9	139.1	-176.3	-64.7	-21.9	0	0	0	111.2	V257 S258 M259	D255-V257 PolarHBondContact O-N 2.92Å; D255-S258 PolarHBondContact N-OG 3.15Å; D255-S258 WeakPolarHBondContact O-CA 3.33Å; D255-S258 PolarHBondContact O-N 2.76Å; D255-S258 PolarHBondContact O-OG 3.22Å; D255-M259 PolarHBondContact O-N 3.35Å; D255-M259 VanDerWaalsContact O-N 3.13Å
256	I	61.3	Low	65.9	Low	145 Å²	145	103.5 Å²	103.5	74%	0.744	58%	0.579	S	S	*	*	H	α-helix	trans	-49.5	-37.6	-179	-63.5	170.1	0	0	0	111.8	S258 M259 M260	I256-S258 PolarHBondContact O-N 3.47Å; I256-M259 PolarHBondContact O-N 3.02Å; I256-M260 VanDerWaalsContact O-CB 3.28Å; I256-M260 WeakPolarHBondContact O-CB 3.47Å; I256-M260 PolarHBondContact O-N 3.21Å
257	V	68.4	Low	65	Low	122 Å²	122	108.4 Å²	108.4	74%	0.739	59%	0.589	S	S	*	*	H	α-helix	trans	-64.3	-39.9	178.7	-178.9	0	0	0	0	111.8	D255 M260 G261	D255-V257 PolarHBondContact O-N 2.92Å; V257-M260 PolarHBondContact O-N 3.03Å; V257-G261 PolarHBondContact O-N 2.93Å
258	S	63.7	Low	64.2	Low	30 Å²	30	109.4 Å²	109.4	21%	0.21	59%	0.589	C	S	.	*	H	α-helix	trans	-73.4	-36.7	178.9	65.4	0	0	0	0	112.4	G253 D255 I256 G261 Q262	G253-S258 WeakPolarHBondContact CA-OG 3.16Å; G253-S258 PolarHBondContact O-OG 3.33Å; D255-S258 PolarHBondContact N-OG 3.15Å; D255-S258 WeakPolarHBondContact O-CA 3.33Å; D255-S258 PolarHBondContact O-N 2.76Å; D255-S258 PolarHBondContact O-OG 3.22Å; I256-S258 PolarHBondContact O-N 3.47Å; S258-G261 PolarHBondContact O-N 3.27Å; S258-Q262 WeakPolarHBondContact O-CG 3.14Å; S258-Q262 PolarHBondContact O-N 3.22Å
259	M	61.6	Low	63.7	Low	101 Å²	101	110.8 Å²	110.8	50%	0.498	59%	0.593	S	S	.	*	H	α-helix	trans	-64.1	-41.3	170.6	-69.2	-169.8	176.6	0	0	111.6	D255 I256 G261 Q262 L263	D255-M259 PolarHBondContact O-N 3.35Å; D255-M259 VanDerWaalsContact O-N 3.13Å; I256-M259 PolarHBondContact O-N 3.02Å; M259-G261 VanDerWaalsContact C-N 3.34Å; M259-Q262 PolarHBondContact O-N 3.31Å; M259-L263 PolarHBondContact O-N 3.24Å
260	M	65	Low	64.2	Low	105 Å²	105	110.7 Å²	110.7	52%	0.517	60%	0.596	S	S	.	*	H	α-helix	trans	-67.3	-36.6	176.7	-167.1	168.4	168.7	0	0	111.6	I256 V257 Q262 L263 M264	I256-M260 VanDerWaalsContact O-CB 3.28Å; I256-M260 WeakPolarHBondContact O-CB 3.47Å; I256-M260 PolarHBondContact O-N 3.21Å; V257-M260 PolarHBondContact O-N 3.03Å; M260-Q262 VanDerWaalsContact C-N 3.31Å; M260-Q262 PolarHBondContact O-N 3.42Å; M260-L263 PolarHBondContact O-N 3.38Å; M260-M264 HydrophobicContact CE-CE 3.42Å; M260-M264 VanDerWaalsContact CE-CE 3.42Å; M260-M264 HydrophobicContact CG-CE 4.28Å; M260-M264 WeakPolarHBondContact O-CG 3.38Å; M260-M264 PolarHBondContact O-N 3.06Å
261	G	64.5	Low	65.2	Low	47 Å²	47	106.4 Å²	106.4	49%	0.485	57%	0.567	S	S	.	*	H	α-helix	trans	-64	-32.1	172.4	0	0	0	0	0	113.6	V257 S258 M259	V257-G261 PolarHBondContact O-N 2.93Å; S258-G261 PolarHBondContact O-N 3.27Å; M259-G261 VanDerWaalsContact C-N 3.34Å
262	Q	65.5	Low	66.7	Low	119 Å²	119	102.4 Å²	102.4	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-75.6	-30.7	173.6	-72.4	176.1	-18.3	0	0	112.9	S258 M259 M260	S258-Q262 WeakPolarHBondContact O-CG 3.14Å; S258-Q262 PolarHBondContact O-N 3.22Å; M259-Q262 PolarHBondContact O-N 3.31Å; M260-Q262 VanDerWaalsContact C-N 3.31Å; M260-Q262 PolarHBondContact O-N 3.42Å
263	L	63.6	Low	68.2	Low	154 Å²	154	104.7 Å²	104.7	81%	0.806	55%	0.552	S	S	*	*	H	α-helix	trans	-76.8	-29.1	175.9	-78.1	158.1	0	0	0	112.9	M259 M260	M259-L263 PolarHBondContact O-N 3.24Å; M260-L263 PolarHBondContact O-N 3.38Å
264	M	68.4	Low	70.1	Confident	111 Å²	111	110.3 Å²	110.3	55%	0.547	57%	0.568	S	S	.	*	S	Bend	trans	-81.5	148.6	175.3	-70.8	-170	174.1	0	0	111.5	M260	M260-M264 HydrophobicContact CE-CE 3.42Å; M260-M264 VanDerWaalsContact CE-CE 3.42Å; M260-M264 HydrophobicContact CG-CE 4.28Å; M260-M264 WeakPolarHBondContact O-CG 3.38Å; M260-M264 PolarHBondContact O-N 3.06Å
265	K	65.1	Low	71.7	Confident	201 Å²	201	103.5 Å²	103.5	87%	0.874	54%	0.538	S	S	*	.			trans	-55.4	126.5	174	-77.6	-174.4	178.7	-179.9	0	109.3	K267	K265-K267 PolarHBondContact O-N 3.03Å
266	P	64.4	Low	73.3	Confident	104 Å²	104	98 Å²	98	68%	0.675	51%	0.508	S	S	*	.			trans	-66.3	106.7	178.3	25.7	-32.3	0	0	0	108.8
267	K	67	Low	74.7	Confident	163 Å²	163	97.9 Å²	97.9	71%	0.709	50%	0.502	S	S	*	.			trans	-60	149.7	165.3	-70.3	-171.5	175	-175.3	0	108.7	R249 K265	R249-K267 PolarHBondContact NH1-O 3.42Å; R249-K267 PolarHBondContact NH2-O 3.26Å; K265-K267 PolarHBondContact O-N 3.03Å
268	K	68.8	Low	75.9	Confident	117 Å²	117	96.5 Å²	96.5	51%	0.509	49%	0.487	S	S	.	.			trans	-73.9	134.2	166.1	-64.3	-177	178.8	-175.6	0	109.1	E105 I106	E105-K268 HydrophobicContact CB-CB 4.37Å; E105-K268 VanDerWaalsContact OE2-CB 3.27Å; E105-K268 WeakPolarHBondContact OE2-CB 3.47Å; E105-K268 WeakPolarHBondContact OE2-CG 3.37Å; E105-K268 PolarHBondContact OE2-N 2.68Å; I106-K268 HydrophobicContact CD1-CD 4.03Å; I106-K268 HydrophobicContact CG2-CB 3.95Å
269	T	72.6	Confident	77.2	Confident	70 Å²	70	95.6 Å²	95.6	43%	0.429	48%	0.48	S	S	.	.			trans	-121.4	131.2	177.7	55.2	0	0	0	0	108	R249 I271	R249-T269 PolarHBondContact NE-OG1 3.44Å; R249-T269 VanDerWaalsContact NH2-CG2 3.28Å; R249-T269 PolarHBondContact NH2-OG1 2.89Å; T269-I271 PolarHBondContact O-N 3.45Å
270	E	83.3	Confident	78.7	Confident	78 Å²	78	92.7 Å²	92.7	36%	0.364	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-59.7	136.3	175.3	-56.2	-169.6	158	0	0	110.5	I106 K107 E110	I106-E270 HydrophobicContact CB-CG 4.27Å; I106-E270 HydrophobicContact CG2-CG 3.85Å; K107-E270 WeakPolarHBondContact CD-OE1 3.5Å; K107-E270 VanDerWaalsContact CG-OE1 3.27Å; K107-E270 WeakPolarHBondContact CG-OE1 3.3Å; K107-E270 PolarHBondContact N-OE1 2.75Å; K107-E270 VanDerWaalsContact N-OE1 3.09Å; K107-E270 IonicContact NZ-OE1 3.33Å; K107-E270 IonicContact NZ-OE2 3.96Å; K107-E270 PolarHBondContact NZ-OE2 3.25Å; E110-E270 HydrophobicContact CG-CB 4.31Å; E110-E270 HydrophobicContact CG-CG 4.26Å
271	I	86.7	Confident	80	Confident	9 Å²	9	94.9 Å²	94.9	5%	0.046	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-91.5	122.6	177.8	-56.5	-173.4	0	0	0	108.3	E110 D244 V245 T269 L275 R276	E110-I271 PolarHBondContact OE1-N 2.99Å; D244-I271 HydrophobicContact CB-CD1 3.59Å; D244-I271 HydrophobicContact CB-CG2 4.23Å; V245-I271 HydrophobicContact CG2-CD1 4.25Å; T269-I271 PolarHBondContact O-N 3.45Å; I271-L275 HydrophobicContact CG2-CD2 4.01Å; I271-L275 HydrophobicContact CG2-CG 4.46Å; I271-R276 HydrophobicContact CG2-CG 4.05Å
272	T	88.5	Confident	81.3	Confident	88 Å²	88	96.1 Å²	96.1	54%	0.54	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-65.4	144.9	-177	70.6	0	0	0	0	112.3	K274 L275 R276	T272-K274 PolarHBondContact O-N 3.05Å; T272-L275 PolarHBondContact O-N 3.08Å; T272-L275 VanDerWaalsContact O-N 3.16Å; T272-L275 PolarHBondContact OG1-N 3.4Å; T272-R276 PolarHBondContact O-N 2.93Å
273	D	87.7	Confident	82.6	Confident	109 Å²	109	90.9 Å²	90.9	58%	0.583	45%	0.447	S	S	*	.	H	α-helix	trans	-60.5	-27.3	174.9	-74.2	-30.2	0	0	0	113.1	K277	D273-K277 WeakPolarHBondContact O-CB 3.46Å; D273-K277 VanDerWaalsContact O-CG 3.24Å; D273-K277 WeakPolarHBondContact O-CG 3.43Å; D273-K277 PolarHBondContact O-N 3.25Å
274	K	91.1	Very high	83.9	Confident	148 Å²	148	87.5 Å²	87.5	64%	0.643	43%	0.43	S	S	*	.	H	α-helix	trans	-64.2	-48.5	176.3	-172.2	-177.4	175.2	-170.3	0	110.6	T272 R276 K277 E278	T272-K274 PolarHBondContact O-N 3.05Å; K274-R276 PolarHBondContact O-N 3.29Å; K274-K277 WeakPolarHBondContact O-CB 3.38Å; K274-K277 PolarHBondContact O-N 3.41Å; K274-E278 VanDerWaalsContact CE-OE1 3.28Å; K274-E278 WeakPolarHBondContact CE-OE1 3.31Å; K274-E278 WeakPolarHBondContact O-CG 3.49Å; K274-E278 PolarHBondContact O-N 2.95Å
275	L	90.9	Very high	85.1	Confident	32 Å²	32	88.1 Å²	88.1	17%	0.168	43%	0.43	C	S	.	.	H	α-helix	trans	-61.2	-45.4	177.3	178.9	58.5	0	0	0	111.2	N247 A248 I271 T272 K277 E278 I279	N247-L275 HydrophobicContact CB-CD1 3.98Å; N247-L275 HydrophobicContact CB-CD2 4.37Å; A248-L275 HydrophobicContact CB-CD2 3.83Å; I271-L275 HydrophobicContact CG2-CD2 4.01Å; I271-L275 HydrophobicContact CG2-CG 4.46Å; T272-L275 PolarHBondContact O-N 3.08Å; T272-L275 VanDerWaalsContact O-N 3.16Å; T272-L275 PolarHBondContact OG1-N 3.4Å; L275-K277 VanDerWaalsContact C-N 3.29Å; L275-K277 PolarHBondContact O-N 2.93Å; L275-E278 WeakPolarHBondContact O-CB 3.43Å; L275-E278 PolarHBondContact O-N 3.48Å; L275-E278 VanDerWaalsContact O-N 3.11Å; L275-I279 HydrophobicContact CD1-CD1 3.99Å; L275-I279 HydrophobicContact CD1-CG1 4.26Å; L275-I279 HydrophobicContact CG-CD1 3.91Å; L275-I279 WeakPolarHBondContact O-CG1 3.43Å; L275-I279 PolarHBondContact O-N 3.16Å
276	R	90.9	Very high	86.4	Confident	6 Å²	6	83 Å²	83	2%	0.023	41%	0.406	C	S	.	.	H	α-helix	trans	-58.5	-38.9	175.8	-75.9	179.1	170.4	147.5	4.7	113.2	E110 D244 I271 T272 K274 N280	E110-R276 IonicContact OE1-CZ 2.76Å; E110-R276 IonicContact OE1-NH1 2.81Å; E110-R276 IonicContact OE1-NH2 3.14Å; E110-R276 PolarHBondContact OE1-NH2 3.14Å; E110-R276 IonicContact OE2-CZ 2.98Å; E110-R276 IonicContact OE2-NH1 2.7Å; E110-R276 PolarHBondContact OE2-NH1 3.45Å; E110-R276 IonicContact OE2-NH2 3.84Å; E110-R276 PolarHBondContact OE2-NH2 3.46Å; E110-R276 VanDerWaalsContact OE2-NH2 3.13Å; D244-R276 IonicContact OD2-NE 2.99Å; I271-R276 HydrophobicContact CG2-CG 4.05Å; T272-R276 PolarHBondContact O-N 2.93Å; K274-R276 PolarHBondContact O-N 3.29Å; R276-N280 WeakPolarHBondContact O-CB 3.44Å; R276-N280 PolarHBondContact O-N 3.13Å; R276-N280 PolarHBondContact O-OD1 2.97Å
277	K	91.4	Very high	87.7	Confident	141 Å²	141	80.8 Å²	80.8	61%	0.613	39%	0.387	S	S	*	.	H	α-helix	trans	-67.7	-39.2	175.6	-75.9	171.6	-175.6	177.4	0	111.9	D273 K274 L275 K281	D273-K277 WeakPolarHBondContact O-CB 3.46Å; D273-K277 VanDerWaalsContact O-CG 3.24Å; D273-K277 WeakPolarHBondContact O-CG 3.43Å; D273-K277 PolarHBondContact O-N 3.25Å; K274-K277 WeakPolarHBondContact O-CB 3.38Å; K274-K277 PolarHBondContact O-N 3.41Å; L275-K277 VanDerWaalsContact C-N 3.29Å; L275-K277 PolarHBondContact O-N 2.93Å; K277-K281 WeakPolarHBondContact O-CG 3.49Å; K277-K281 PolarHBondContact O-N 3.26Å; K277-K281 VanDerWaalsContact O-N 3.09Å
278	E	92.9	Very high	88.9	Confident	94 Å²	94	79.6 Å²	79.6	44%	0.439	39%	0.389	S	S	.	.	H	α-helix	trans	-64.8	-47	176	-73	171.8	-174.1	0	0	111.1	K274 L275 N280 K281 V282	K274-E278 VanDerWaalsContact CE-OE1 3.28Å; K274-E278 WeakPolarHBondContact CE-OE1 3.31Å; K274-E278 WeakPolarHBondContact O-CG 3.49Å; K274-E278 PolarHBondContact O-N 2.95Å; L275-E278 WeakPolarHBondContact O-CB 3.43Å; L275-E278 PolarHBondContact O-N 3.48Å; L275-E278 VanDerWaalsContact O-N 3.11Å; E278-N280 VanDerWaalsContact C-N 3.35Å; E278-N280 PolarHBondContact O-N 2.85Å; E278-K281 WeakPolarHBondContact O-CB 3.28Å; E278-K281 PolarHBondContact O-N 3.19Å; E278-K281 VanDerWaalsContact O-N 3.13Å; E278-V282 PolarHBondContact O-N 3.46Å; E278-V282 VanDerWaalsContact O-N 3.11Å
279	I	92.2	Very high	90	Very high	11 Å²	11	79 Å²	79	6%	0.056	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-46.7	175.6	-69	169.1	0	0	0	110.6	L243 D244 N247 L275 K281 V282 V283	L243-I279 HydrophobicContact CB-CG2 4.14Å; L243-I279 HydrophobicContact CD1-CG2 4.39Å; D244-I279 HydrophobicContact CB-CD1 4.25Å; D244-I279 WeakPolarHBondContact OD1-CD1 2.97Å; N247-I279 HydrophobicContact CB-CD1 4.27Å; L275-I279 HydrophobicContact CD1-CD1 3.99Å; L275-I279 HydrophobicContact CD1-CG1 4.26Å; L275-I279 HydrophobicContact CG-CD1 3.91Å; L275-I279 WeakPolarHBondContact O-CG1 3.43Å; L275-I279 PolarHBondContact O-N 3.16Å; I279-K281 VanDerWaalsContact C-N 3.27Å; I279-K281 PolarHBondContact O-N 3.45Å; I279-V282 PolarHBondContact O-N 2.75Å; I279-V282 VanDerWaalsContact O-N 3.09Å; I279-V283 HydrophobicContact CG2-CG2 4.15Å; I279-V283 WeakPolarHBondContact O-CG2 3.33Å; I279-V283 PolarHBondContact O-N 2.93Å
280	N	91.8	Very high	90.8	Very high	40 Å²	40	78.8 Å²	78.8	21%	0.214	40%	0.399	C	S	.	.	H	α-helix	trans	-58.9	-37.6	177.3	-74	5.5	0	0	0	112.7	R117 R276 E278 N284	R117-N280 VanDerWaalsContact CZ-OD1 3.26Å; R117-N280 PolarHBondContact NH1-OD1 3.13Å; R117-N280 VanDerWaalsContact NH2-CG 3.35Å; R117-N280 PolarHBondContact NH2-ND2 3.47Å; R117-N280 PolarHBondContact NH2-OD1 3.47Å; R276-N280 WeakPolarHBondContact O-CB 3.44Å; R276-N280 PolarHBondContact O-N 3.13Å; R276-N280 PolarHBondContact O-OD1 2.97Å; E278-N280 VanDerWaalsContact C-N 3.35Å; E278-N280 PolarHBondContact O-N 2.85Å; N280-N284 WeakPolarHBondContact O-CB 3.25Å; N280-N284 PolarHBondContact O-N 3.45Å; N280-N284 PolarHBondContact O-ND2 2.98Å
281	K	92.6	Very high	91.2	Very high	151 Å²	151	77.9 Å²	77.9	66%	0.657	40%	0.396	S	S	*	.	H	α-helix	trans	-63.9	-42.4	175.4	-74.1	174.2	179.9	-177	0	111.8	K277 E278 I279 K285	K277-K281 WeakPolarHBondContact O-CG 3.49Å; K277-K281 PolarHBondContact O-N 3.26Å; K277-K281 VanDerWaalsContact O-N 3.09Å; E278-K281 WeakPolarHBondContact O-CB 3.28Å; E278-K281 PolarHBondContact O-N 3.19Å; E278-K281 VanDerWaalsContact O-N 3.13Å; I279-K281 VanDerWaalsContact C-N 3.27Å; I279-K281 PolarHBondContact O-N 3.45Å; K281-K285 PolarHBondContact O-N 2.94Å; K281-K285 VanDerWaalsContact O-N 3.1Å
282	V	92	Very high	91.4	Very high	73 Å²	73	77.9 Å²	77.9	44%	0.442	40%	0.397	S	S	.	.	H	α-helix	trans	-66.9	-44.7	178.1	177.6	0	0	0	0	110.9	E278 I279 N284 K285 Y286	E278-V282 PolarHBondContact O-N 3.46Å; E278-V282 VanDerWaalsContact O-N 3.11Å; I279-V282 PolarHBondContact O-N 2.75Å; I279-V282 VanDerWaalsContact O-N 3.09Å; V282-N284 PolarHBondContact O-N 2.86Å; V282-K285 WeakPolarHBondContact O-CB 3.44Å; V282-K285 PolarHBondContact O-N 3.48Å; V282-K285 VanDerWaalsContact O-N 3.17Å; V282-Y286 HydrophobicContact CG1-CD2 4.41Å; V282-Y286 HydrophobicContact CG1-CE2 4.01Å; V282-Y286 PolarHBondContact O-N 3.07Å
283	V	92.2	Very high	91.5	Very high	9 Å²	9	78.2 Å²	78.2	6%	0.055	39%	0.393	C	S	.	.	H	α-helix	trans	-60	-46.9	177.6	171.1	0	0	0	0	111	L122 L240 L243 I279 K285 Y286 I287	L122-V283 HydrophobicContact CD1-CG1 3.78Å; L122-V283 HydrophobicContact CD2-CG1 4.3Å; L122-V283 HydrophobicContact CD2-CG2 4.08Å; L240-V283 HydrophobicContact CD2-CG1 4.29Å; L240-V283 HydrophobicContact CD2-CG2 3.9Å; L243-V283 HydrophobicContact CD1-CG2 4Å; I279-V283 HydrophobicContact CG2-CG2 4.15Å; I279-V283 WeakPolarHBondContact O-CG2 3.33Å; I279-V283 PolarHBondContact O-N 2.93Å; V283-K285 VanDerWaalsContact C-N 3.29Å; V283-K285 PolarHBondContact O-N 3.2Å; V283-Y286 PolarHBondContact O-N 2.72Å; V283-Y286 VanDerWaalsContact O-N 3.12Å; V283-I287 HydrophobicContact CG1-CD1 3.81Å; V283-I287 HydrophobicContact CG1-CG1 4.47Å; V283-I287 WeakPolarHBondContact O-CG1 3.46Å; V283-I287 PolarHBondContact O-N 3.39Å
284	N	91.8	Very high	91.5	Very high	83 Å²	83	75.3 Å²	75.3	44%	0.444	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-41.6	176.1	-72.1	-18.3	0	0	0	111.6	N280 V282 Y286 I287 D288	N280-N284 WeakPolarHBondContact O-CB 3.25Å; N280-N284 PolarHBondContact O-N 3.45Å; N280-N284 PolarHBondContact O-ND2 2.98Å; V282-N284 PolarHBondContact O-N 2.86Å; N284-Y286 VanDerWaalsContact C-N 3.33Å; N284-Y286 PolarHBondContact O-N 3.05Å; N284-I287 PolarHBondContact O-N 3.1Å; N284-D288 WeakPolarHBondContact O-CB 3.48Å; N284-D288 PolarHBondContact O-N 3.29Å
285	K	93.2	Very high	91.3	Very high	124 Å²	124	69.1 Å²	69.1	54%	0.539	35%	0.352	S	S	.	.	H	α-helix	trans	-59.8	-40.9	175.6	-174	-177.3	177.8	-175.3	0	112.4	K281 V282 V283 D288 Q289	K281-K285 PolarHBondContact O-N 2.94Å; K281-K285 VanDerWaalsContact O-N 3.1Å; V282-K285 WeakPolarHBondContact O-CB 3.44Å; V282-K285 PolarHBondContact O-N 3.48Å; V282-K285 VanDerWaalsContact O-N 3.17Å; V283-K285 VanDerWaalsContact C-N 3.29Å; V283-K285 PolarHBondContact O-N 3.2Å; K285-D288 PolarHBondContact O-N 2.71Å; K285-Q289 WeakPolarHBondContact O-CB 3.47Å; K285-Q289 WeakPolarHBondContact O-CG 3.47Å; K285-Q289 PolarHBondContact O-N 3.44Å
286	Y	91.7	Very high	91	Very high	94 Å²	94	70.6 Å²	70.6	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-70.2	-32.7	176.9	-70.9	-18.8	0	0	0	113.5	V282 V283 N284 G290 I291 A292	V282-Y286 HydrophobicContact CG1-CD2 4.41Å; V282-Y286 HydrophobicContact CG1-CE2 4.01Å; V282-Y286 PolarHBondContact O-N 3.07Å; V283-Y286 PolarHBondContact O-N 2.72Å; V283-Y286 VanDerWaalsContact O-N 3.12Å; N284-Y286 VanDerWaalsContact C-N 3.33Å; N284-Y286 PolarHBondContact O-N 3.05Å; Y286-G290 PolarHBondContact O-N 3.04Å; Y286-I291 HydrophobicContact CD1-CD1 4.41Å; Y286-I291 PolarHBondContact O-N 2.9Å; Y286-A292 PolarHBondContact O-N 3.02Å; Y286-A292 VanDerWaalsContact O-N 3.16Å
287	I	91.5	Very high	91	Very high	57 Å²	57	70.3 Å²	70.3	29%	0.292	36%	0.362	S	S	.	.	H	α-helix	trans	-67.2	-47	172.9	-64.8	165.8	0	0	0	110	V283 N284 Q289 G290 A292 L294	V283-I287 HydrophobicContact CG1-CD1 3.81Å; V283-I287 HydrophobicContact CG1-CG1 4.47Å; V283-I287 WeakPolarHBondContact O-CG1 3.46Å; V283-I287 PolarHBondContact O-N 3.39Å; N284-I287 PolarHBondContact O-N 3.1Å; I287-Q289 PolarHBondContact O-N 3Å; I287-G290 PolarHBondContact O-N 2.84Å; I287-A292 WeakPolarHBondContact CA-O 3.46Å; I287-L294 HydrophobicContact CD1-CB 4.1Å
288	D	93	Very high	91	Very high	138 Å²	138	63.6 Å²	63.6	74%	0.738	33%	0.333	S	S	*	.	H	α-helix	trans	-62.4	-32.2	178.7	-66.6	-22.7	0	0	0	112.2	N284 K285 G290	N284-D288 WeakPolarHBondContact O-CB 3.48Å; N284-D288 PolarHBondContact O-N 3.29Å; K285-D288 PolarHBondContact O-N 2.71Å; D288-G290 VanDerWaalsContact C-N 3.3Å
289	Q	92	Very high	91	Very high	104 Å²	104	59.1 Å²	59.1	49%	0.486	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.3	174.5	-71.4	176	-19.1	0	0	113.7	K285 I287 I291	K285-Q289 WeakPolarHBondContact O-CB 3.47Å; K285-Q289 WeakPolarHBondContact O-CG 3.47Å; K285-Q289 PolarHBondContact O-N 3.44Å; I287-Q289 PolarHBondContact O-N 3Å; Q289-I291 VanDerWaalsContact C-N 3.26Å; Q289-I291 HydrophobicContact CB-CD1 3.84Å; Q289-I291 HydrophobicContact CB-CG1 3.88Å; Q289-I291 PolarHBondContact O-N 3.38Å; Q289-I291 VanDerWaalsContact OE1-CD1 3.31Å
290	G	89.9	Confident	91.2	Very high	65 Å²	65	58.7 Å²	58.7	67%	0.67	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	13.6	-176.8	0	0	0	0	0	114.8	Y286 I287 D288	Y286-G290 PolarHBondContact O-N 3.04Å; I287-G290 PolarHBondContact O-N 2.84Å; D288-G290 VanDerWaalsContact C-N 3.3Å
291	I	90.3	Very high	91.4	Very high	59 Å²	59	56.8 Å²	56.8	30%	0.303	30%	0.3	S	S	.	.	S	Bend	trans	-82.6	-31.4	179.6	-56.3	172.4	0	0	0	110.5	I124 K125 Y286 Q289	I124-I291 HydrophobicContact CG2-CG2 4.15Å; K125-I291 PolarHBondContact N-O 3.18Å; Y286-I291 HydrophobicContact CD1-CD1 4.41Å; Y286-I291 PolarHBondContact O-N 2.9Å; Q289-I291 VanDerWaalsContact C-N 3.26Å; Q289-I291 HydrophobicContact CB-CD1 3.84Å; Q289-I291 HydrophobicContact CB-CG1 3.88Å; Q289-I291 PolarHBondContact O-N 3.38Å; Q289-I291 VanDerWaalsContact OE1-CD1 3.31Å
292	A	92	Very high	91.5	Very high	9 Å²	9	51.3 Å²	51.3	7%	0.074	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151.5	-178.2	0	0	0	0	0	112.6	L122 R123 I124 Y286 I287	L122-A292 HydrophobicContact CD1-CB 3.69Å; L122-A292 HydrophobicContact CD2-CB 4.41Å; L122-A292 HydrophobicContact CG-CB 4.03Å; R123-A292 CarbonylContact O-C 3.56Å; R123-A292 VanDerWaalsContact O-CA 3.25Å; R123-A292 WeakPolarHBondContact O-CA 3.37Å; I124-A292 HydrophobicContact CG1-CB 4.15Å; Y286-A292 PolarHBondContact O-N 3.02Å; Y286-A292 VanDerWaalsContact O-N 3.16Å; I287-A292 WeakPolarHBondContact CA-O 3.46Å
293	E	90.7	Very high	91.6	Very high	96 Å²	96	51 Å²	51	45%	0.449	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.8	176.3	-177.3	-178.9	178.2	0	0	109.2	R123 K125	R123-E293 HydrophobicContact CB-CB 4.49Å; R123-E293 PolarHBondContact N-O 3.16Å; R123-E293 PolarHBondContact O-N 3.48Å; K125-E293 IonicContact NZ-OE2 3.61Å
294	L	88.3	Confident	91.8	Very high	47 Å²	47	50.6 Å²	50.6	25%	0.246	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.5	174.4	-162.5	76.2	0	0	0	109.6	I120 L122 I287 I323	I120-L294 HydrophobicContact CG2-CD1 3.51Å; I120-L294 HydrophobicContact CG2-CD2 4.34Å; I120-L294 HydrophobicContact CG2-CG 4Å; L122-L294 HydrophobicContact CD1-CD1 4.45Å; I287-L294 HydrophobicContact CD1-CB 4.1Å; L294-I323 HydrophobicContact CD2-CB 4.12Å; L294-I323 HydrophobicContact CD2-CG2 3.84Å
295	V	86.4	Confident	92	Very high	18 Å²	18	47 Å²	47	11%	0.109	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	102.6	177.3	-176.9	0	0	0	0	108.1	V91 G121 R123 G297	V91-V295 HydrophobicContact CG2-CG1 4.21Å; G121-V295 WeakPolarHBondContact CA-O 3.5Å; G121-V295 PolarHBondContact N-O 3.1Å; G121-V295 PolarHBondContact O-N 2.8Å; R123-V295 HydrophobicContact CB-CG2 4.05Å; V295-G297 PolarHBondContact O-N 3.01Å
296	P	85.2	Confident	92	Very high	63 Å²	63	42.7 Å²	42.7	41%	0.409	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	119.9	175.1	27.9	-32.2	0	0	0	109.2
297	G	89.6	Confident	92.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.			trans	-91.2	-170.3	173.6	0	0	0	0	0	112.7	P92 A119 V295 P325 I326	P92-G297 CarbonylContact O-C 3.54Å; P92-G297 WeakPolarHBondContact O-CA 3.45Å; A119-G297 CarbonylContact O-C 3.46Å; A119-G297 WeakPolarHBondContact O-CA 3.49Å; A119-G297 PolarHBondContact O-N 3.44Å; V295-G297 PolarHBondContact O-N 3.01Å; G297-P325 WeakPolarHBondContact O-CB 3.41Å; G297-I326 PolarHBondContact O-N 3.23Å
298	V	91.4	Very high	92.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.8	-178.2	178.5	0	0	0	0	109.2	A84 L87 P92 F93 C94 I326 I328	A84-V298 HydrophobicContact CB-CB 4.42Å; A84-V298 HydrophobicContact CB-CG2 4.19Å; L87-V298 HydrophobicContact CD1-CG2 3.59Å; P92-V298 PolarHBondContact O-N 2.95Å; F93-V298 HydrophobicContact CD2-CB 3.99Å; F93-V298 HydrophobicContact CD2-CG1 3.96Å; F93-V298 HydrophobicContact CE2-CG1 4.06Å; C94-V298 PolarHBondContact N-O 3.11Å; V298-I326 CarbonylContact C-O 3.5Å; V298-I326 WeakPolarHBondContact CA-O 3.42Å; V298-I326 HydrophobicContact CG2-CB 4.35Å; V298-I326 HydrophobicContact CG2-CD1 4.27Å; V298-I328 HydrophobicContact CG1-CD1 3.6Å; V298-I328 HydrophobicContact CG1-CG1 4Å
299	L	94.3	Very high	92.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	110.5	168.3	176.9	59.9	0	0	0	108.7	C94 M96 N115 F116 A119 I301 P325 I326 V327 I328	C94-L299 HydrophobicContact CB-CD1 4.17Å; M96-L299 HydrophobicContact CG-CD1 4.12Å; M96-L299 HydrophobicContact SD-CD1 3.97Å; N115-L299 HydrophobicContact CB-CD1 3.88Å; F116-L299 HydrophobicContact CD2-CD2 3.4Å; F116-L299 HydrophobicContact CE2-CD2 3.35Å; F116-L299 HydrophobicContact CG-CD2 4.08Å; F116-L299 HydrophobicContact CZ-CD2 4Å; A119-L299 HydrophobicContact CB-CB 3.89Å; L299-I301 HydrophobicContact CD1-CG1 4.42Å; L299-I301 HydrophobicContact CD2-CD1 4.16Å; L299-I301 HydrophobicContact CD2-CG1 4.39Å; L299-I301 HydrophobicContact CG-CD1 4.33Å; L299-I301 HydrophobicContact CG-CG1 4.02Å; L299-P325 HydrophobicContact CB-CG 4.14Å; L299-I326 PolarHBondContact N-O 3.04Å; L299-V327 HydrophobicContact CB-CG2 4.44Å; L299-V327 HydrophobicContact CD2-CG2 4.35Å; L299-V327 WeakPolarHBondContact O-CA 3.38Å; L299-I328 PolarHBondContact O-N 3.16Å
300	F	95.6	Very high	92.5	Very high	3 Å²	3	33.1 Å²	33.1	1%	0.013	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116.8	176.6	176.1	-107.5	0	0	0	110.1	T77 A80 F93 C94 P95 M96 D302 I328 A330	T77-F300 HydrophobicContact CG2-CD1 4.34Å; T77-F300 HydrophobicContact CG2-CE1 3.68Å; T77-F300 HydrophobicContact CG2-CZ 4.15Å; A80-F300 HydrophobicContact CB-CD2 3.36Å; A80-F300 HydrophobicContact CB-CE2 3.63Å; A80-F300 HydrophobicContact CB-CG 4Å; A80-F300 HydrophobicContact CB-CZ 4.47Å; F93-F300 HydrophobicContact CE2-CB 3.74Å; F93-F300 HydrophobicContact CE2-CG 4.47Å; F93-F300 HydrophobicContact CZ-CB 3.74Å; F93-F300 HydrophobicContact CZ-CD1 4.35Å; F93-F300 HydrophobicContact CZ-CG 4.16Å; C94-F300 PolarHBondContact O-N 2.79Å; P95-F300 CarbonylContact C-O 3.57Å; P95-F300 WeakPolarHBondContact CA-O 3.25Å; P95-F300 HydrophobicContact CB-CD1 4.32Å; M96-F300 PolarHBondContact N-O 3.17Å; F300-D302 HydrophobicContact CD1-CB 4.47Å; F300-D302 HydrophobicContact CE1-CB 3.67Å; F300-D302 HydrophobicContact CZ-CB 4.07Å; F300-I328 CarbonylContact C-O 3.52Å; F300-I328 WeakPolarHBondContact CA-O 3.27Å; F300-I328 HydrophobicContact CD2-CB 4.11Å; F300-I328 HydrophobicContact CD2-CG2 3.94Å; F300-I328 WeakPolarHBondContact CD2-O 3.23Å; F300-I328 HydrophobicContact CE2-CG2 4.31Å; F300-A330 HydrophobicContact CE2-CB 3.59Å; F300-A330 HydrophobicContact CZ-CB 3.57Å
301	I	95.8	Very high	92.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	101.6	177.8	-49.8	-166.6	0	0	0	108.9	M96 L112 L299 L307 L315 I328 F329 A330	M96-I301 HydrophobicContact CG-CB 4.17Å; M96-I301 HydrophobicContact CG-CD1 4.4Å; M96-I301 HydrophobicContact CG-CG1 3.74Å; M96-I301 HydrophobicContact CG-CG2 4.22Å; M96-I301 CarbonylContact O-C 3.1Å; M96-I301 WeakPolarHBondContact O-CA 3.39Å; M96-I301 HydrophobicContact SD-CD1 3.77Å; M96-I301 HydrophobicContact SD-CG1 3.78Å; M96-I301 HydrophobicContact SD-CG2 4.5Å; L112-I301 HydrophobicContact CD2-CD1 4.48Å; L299-I301 HydrophobicContact CD1-CG1 4.42Å; L299-I301 HydrophobicContact CD2-CD1 4.16Å; L299-I301 HydrophobicContact CD2-CG1 4.39Å; L299-I301 HydrophobicContact CG-CD1 4.33Å; L299-I301 HydrophobicContact CG-CG1 4.02Å; I301-L307 HydrophobicContact CG2-CD1 4.3Å; I301-L315 HydrophobicContact CD1-CD2 4.29Å; I301-I328 PolarHBondContact N-O 3.29Å; I301-F329 HydrophobicContact CB-CD1 4.03Å; I301-F329 HydrophobicContact CD1-CD1 4.33Å; I301-F329 HydrophobicContact CD1-CE1 3.97Å; I301-F329 HydrophobicContact CG1-CD1 4.4Å; I301-F329 HydrophobicContact CG1-CE1 4.48Å; I301-F329 CarbonylContact O-C 3.49Å; I301-A330 PolarHBondContact O-N 3.39Å
302	D	94.8	Very high	92.9	Very high	35 Å²	35	27.4 Å²	27.4	19%	0.187	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	155	173.8	-149.8	-8.1	0	0	0	111.2	M96 G98 F300 V304	M96-D302 PolarHBondContact O-N 2.9Å; G98-D302 PolarHBondContact N-O 2.62Å; F300-D302 HydrophobicContact CD1-CB 4.47Å; F300-D302 HydrophobicContact CE1-CB 3.67Å; F300-D302 HydrophobicContact CZ-CB 4.07Å; D302-V304 VanDerWaalsContact C-N 3.27Å; D302-V304 PolarHBondContact O-N 3.47Å
303	E	94.6	Very high	92.9	Very high	67 Å²	67	31.6 Å²	31.6	31%	0.313	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	45.7	-179.2	-55.5	-167.3	155.5	0	0	113.7	V97 H305 M306 A330	V97-E303 HydrophobicContact CG1-CB 4.2Å; V97-E303 HydrophobicContact CG1-CG 4.33Å; E303-H305 PolarHBondContact O-N 3.18Å; E303-M306 HydrophobicContact CB-CG 4.06Å; E303-M306 VanDerWaalsContact O-CB 3.29Å; E303-M306 WeakPolarHBondContact O-CB 3.44Å; E303-M306 WeakPolarHBondContact O-CG 3.47Å; E303-M306 PolarHBondContact O-N 3Å; E303-A330 PolarHBondContact N-O 2.7Å; E303-A330 VanDerWaalsContact N-O 3.16Å
304	V	96	Very high	93	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-53.8	-28.5	-174.9	69.7	0	0	0	0	113.8	L67 D302 M306 L307 F312 F329 A330 I350	L67-V304 HydrophobicContact CD1-CG1 4.3Å; D302-V304 VanDerWaalsContact C-N 3.27Å; D302-V304 PolarHBondContact O-N 3.47Å; V304-M306 PolarHBondContact O-N 3.35Å; V304-L307 HydrophobicContact CG2-CD1 4.03Å; V304-L307 WeakPolarHBondContact O-CB 3.37Å; V304-L307 PolarHBondContact O-N 3.48Å; V304-F312 HydrophobicContact CG2-CE1 3.82Å; V304-F312 HydrophobicContact CG2-CZ 4.12Å; V304-F329 HydrophobicContact CB-CB 4.16Å; V304-F329 HydrophobicContact CB-CD1 4.2Å; V304-F329 HydrophobicContact CG1-CB 4.2Å; V304-F329 HydrophobicContact CG2-CB 4.15Å; V304-F329 HydrophobicContact CG2-CD1 3.46Å; V304-F329 VanDerWaalsContact CG2-CD1 3.46Å; V304-F329 HydrophobicContact CG2-CE1 4.07Å; V304-F329 HydrophobicContact CG2-CG 3.97Å; V304-A330 WeakPolarHBondContact CG1-O 3.29Å; V304-A330 PolarHBondContact N-O 2.92Å; V304-I350 HydrophobicContact CG1-CD1 3.83Å; V304-I350 HydrophobicContact CG1-CG1 4.19Å
305	H	94.8	Very high	93.2	Very high	9 Å²	9	27.6 Å²	27.6	4%	0.042	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-63.6	-9.4	176	62	-93.4	0	0	0	114.2	E303 T331 N332 R333 H348	E303-H305 PolarHBondContact O-N 3.18Å; H305-T331 PolarHBondContact ND1-OG1 3.45Å; H305-N332 PolarHBondContact CE1-OD1 3.5Å; H305-R333 WeakPolarHBondContact CD2-CD 3.43Å; H305-R333 PolarHBondContact CD2-NE 2.89Å; H305-R333 PolarHBondContact NE2-NE 2.98Å; H305-H348 VanDerWaalsContact CB-O 3.31Å; H305-H348 WeakPolarHBondContact CB-O 2.99Å
306	M	95	Very high	93.4	Very high	32 Å²	32	28.6 Å²	28.6	16%	0.158	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-84	-13.6	173.9	-66.1	-61	-69.5	0	0	113.1	Y102 E303 V304 R339	Y102-M306 WeakPolarHBondContact CE2-O 3.28Å; Y102-M306 PolarHBondContact OH-O 2.96Å; E303-M306 HydrophobicContact CB-CG 4.06Å; E303-M306 VanDerWaalsContact O-CB 3.29Å; E303-M306 WeakPolarHBondContact O-CB 3.44Å; E303-M306 WeakPolarHBondContact O-CG 3.47Å; E303-M306 PolarHBondContact O-N 3Å; V304-M306 PolarHBondContact O-N 3.35Å; M306-R339 VanDerWaalsContact O-CD 3.22Å; M306-R339 WeakPolarHBondContact O-CD 3.48Å
307	L	95.5	Very high	93.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	-72.8	148.9	172.5	-62.8	-180	0	0	0	110.9	G98 V101 I301 V304 C311 F312 L315	G98-L307 VanDerWaalsContact O-CD2 3.3Å; G98-L307 WeakPolarHBondContact O-CD2 3.4Å; V101-L307 HydrophobicContact CB-CD2 4.3Å; V101-L307 HydrophobicContact CG1-CD2 3.58Å; V101-L307 HydrophobicContact CG2-CD2 3.76Å; I301-L307 HydrophobicContact CG2-CD1 4.3Å; V304-L307 HydrophobicContact CG2-CD1 4.03Å; V304-L307 WeakPolarHBondContact O-CB 3.37Å; V304-L307 PolarHBondContact O-N 3.48Å; L307-C311 HydrophobicContact CB-CB 3.99Å; L307-C311 HydrophobicContact CD1-CB 4.49Å; L307-C311 HydrophobicContact CD2-CB 4.08Å; L307-C311 HydrophobicContact CG-CB 4.43Å; L307-F312 HydrophobicContact CB-CE1 4.4Å; L307-F312 HydrophobicContact CB-CE2 3.99Å; L307-F312 HydrophobicContact CB-CZ 3.94Å; L307-F312 HydrophobicContact CD1-CE1 4.39Å; L307-F312 WeakPolarHBondContact O-CE2 3.41Å; L307-L315 HydrophobicContact CD1-CD1 3.64Å
308	D	94.5	Very high	93.5	Very high	9 Å²	9	35.6 Å²	35.6	5%	0.048	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-94.7	172	174.7	60.4	22.9	0	0	0	112.5	K108 E310 C311 F312 R339	K108-D308 WeakPolarHBondContact CE-OD2 3.48Å; K108-D308 IonicContact NZ-OD2 3.05Å; K108-D308 PolarHBondContact NZ-OD2 2.92Å; D308-E310 PolarHBondContact O-N 3.22Å; D308-E310 PolarHBondContact OD1-N 2.72Å; D308-C311 WeakPolarHBondContact O-CB 3.48Å; D308-C311 PolarHBondContact O-N 2.95Å; D308-C311 VanDerWaalsContact O-N 3.14Å; D308-C311 WeakPolarHBondContact OD1-CB 3.45Å; D308-C311 PolarHBondContact OD1-N 3.11Å; D308-C311 PolarHBondContact OD1-SG 2.87Å; D308-F312 WeakPolarHBondContact O-CD2 3.3Å; D308-F312 PolarHBondContact O-N 3.08Å; D308-R339 CarbonylContact C-O 3.54Å; D308-R339 WeakPolarHBondContact CA-O 3.39Å; D308-R339 HydrophobicContact CB-CB 3.95Å; D308-R339 VanDerWaalsContact CB-O 3.31Å; D308-R339 WeakPolarHBondContact CB-O 3.48Å
309	I	93.8	Very high	93.4	Very high	63 Å²	63	35.9 Å²	35.9	32%	0.323	17%	0.169	S	C	.	.	H	α-helix	trans	-58.4	-31.6	179.4	-167.3	164.4	0	0	0	113.2	F312 T313 I338 R339 T341	I309-F312 PolarHBondContact O-N 3Å; I309-T313 WeakPolarHBondContact O-CB 3.36Å; I309-T313 PolarHBondContact O-N 3.01Å; I309-T313 PolarHBondContact O-OG1 2.77Å; I309-I338 HydrophobicContact CB-CG2 4.3Å; I309-R339 PolarHBondContact N-O 3.29Å; I309-T341 HydrophobicContact CB-CG2 4.14Å; I309-T341 HydrophobicContact CD1-CG2 3.69Å; I309-T341 HydrophobicContact CG1-CG2 4.5Å; I309-T341 HydrophobicContact CG2-CG2 4.28Å
310	E	93.3	Very high	92.9	Very high	121 Å²	121	40.9 Å²	40.9	57%	0.565	19%	0.193	S	C	*	.	H	α-helix	trans	-65.8	-44.7	176	-59.8	-179.3	150.8	0	0	111	K108 D308 T313 Y314	K108-E310 IonicContact NZ-OE2 3.81Å; K108-E310 PolarHBondContact NZ-OE2 3.3Å; D308-E310 PolarHBondContact O-N 3.22Å; D308-E310 PolarHBondContact OD1-N 2.72Å; E310-T313 PolarHBondContact O-N 3.05Å; E310-Y314 PolarHBondContact O-N 3.08Å; E310-Y314 VanDerWaalsContact O-N 3.08Å
311	C	95.4	Very high	92.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-43.4	175.1	-68.1	0	0	0	0	111.5	L112 L307 D308 Y314 L315	L112-C311 HydrophobicContact CD1-CB 3.83Å; L307-C311 HydrophobicContact CB-CB 3.99Å; L307-C311 HydrophobicContact CD1-CB 4.49Å; L307-C311 HydrophobicContact CD2-CB 4.08Å; L307-C311 HydrophobicContact CG-CB 4.43Å; D308-C311 WeakPolarHBondContact O-CB 3.48Å; D308-C311 PolarHBondContact O-N 2.95Å; D308-C311 VanDerWaalsContact O-N 3.14Å; D308-C311 WeakPolarHBondContact OD1-CB 3.45Å; D308-C311 PolarHBondContact OD1-N 3.11Å; D308-C311 PolarHBondContact OD1-SG 2.87Å; C311-Y314 WeakPolarHBondContact O-CB 3.18Å; C311-Y314 PolarHBondContact O-N 3.27Å; C311-L315 WeakPolarHBondContact O-CB 3.31Å; C311-L315 VanDerWaalsContact O-CG 3.32Å; C311-L315 WeakPolarHBondContact O-CG 3.28Å; C311-L315 PolarHBondContact O-N 3.05Å
312	F	94.6	Very high	91.2	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-64.1	-40.7	176.8	-72.3	-60.8	0	0	0	112.8	V304 L307 D308 I309 Y314 L315 H316 I338 G349 I350 P351 L354	V304-F312 HydrophobicContact CG2-CE1 3.82Å; V304-F312 HydrophobicContact CG2-CZ 4.12Å; L307-F312 HydrophobicContact CB-CE1 4.4Å; L307-F312 HydrophobicContact CB-CE2 3.99Å; L307-F312 HydrophobicContact CB-CZ 3.94Å; L307-F312 HydrophobicContact CD1-CE1 4.39Å; L307-F312 WeakPolarHBondContact O-CE2 3.41Å; D308-F312 WeakPolarHBondContact O-CD2 3.3Å; D308-F312 PolarHBondContact O-N 3.08Å; I309-F312 PolarHBondContact O-N 3Å; F312-Y314 VanDerWaalsContact C-N 3.27Å; F312-Y314 PolarHBondContact O-N 2.77Å; F312-L315 HydrophobicContact CD1-CD1 4.27Å; F312-L315 PolarHBondContact O-N 3.34Å; F312-H316 WeakPolarHBondContact O-CB 3.4Å; F312-H316 PolarHBondContact O-N 2.9Å; F312-I338 HydrophobicContact CD2-CG2 4.3Å; F312-I338 HydrophobicContact CE2-CG2 4.33Å; F312-G349 WeakPolarHBondContact CE2-O 3.4Å; F312-I350 HydrophobicContact CD1-CG2 4.45Å; F312-I350 HydrophobicContact CE1-CB 4.46Å; F312-I350 HydrophobicContact CE1-CG1 4.16Å; F312-I350 HydrophobicContact CE1-CG2 4.07Å; F312-I350 HydrophobicContact CZ-CB 4.44Å; F312-I350 HydrophobicContact CZ-CG1 4.07Å; F312-P351 HydrophobicContact CB-CG 3.76Å; F312-P351 VanDerWaalsContact CD2-CD 3.41Å; F312-P351 HydrophobicContact CD2-CG 3.82Å; F312-P351 HydrophobicContact CG-CG 3.83Å; F312-L354 HydrophobicContact CD1-CD2 3.53Å; F312-L354 HydrophobicContact CE1-CD2 4.11Å; F312-L354 HydrophobicContact CG-CD2 4.48Å
313	T	92.6	Very high	90.4	Very high	96 Å²	96	51 Å²	51	59%	0.589	26%	0.257	S	S	*	.	H	α-helix	trans	-58.2	-42.6	174.5	-55.9	0	0	0	0	111	I309 E310 R317	I309-T313 WeakPolarHBondContact O-CB 3.36Å; I309-T313 PolarHBondContact O-N 3.01Å; I309-T313 PolarHBondContact O-OG1 2.77Å; E310-T313 PolarHBondContact O-N 3.05Å; T313-R317 PolarHBondContact O-N 3.16Å
314	Y	92.3	Very high	90	Very high	60 Å²	60	49 Å²	49	24%	0.235	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-47.3	175.5	179.5	-93.1	0	0	0	112.4	T109 L112 M113 E310 C311 F312 H316 R317 A318	T109-Y314 HydrophobicContact CG2-CD2 3.96Å; T109-Y314 HydrophobicContact CG2-CG 4.05Å; L112-Y314 HydrophobicContact CB-CD1 3.94Å; L112-Y314 HydrophobicContact CB-CE1 3.8Å; L112-Y314 HydrophobicContact CD1-CD1 3.92Å; M113-Y314 VanDerWaalsContact CB-OH 3.24Å; M113-Y314 WeakPolarHBondContact CB-OH 3.28Å; M113-Y314 WeakPolarHBondContact CG-OH 3.45Å; M113-Y314 PolarHBondContact SD-OH 3.18Å; E310-Y314 PolarHBondContact O-N 3.08Å; E310-Y314 VanDerWaalsContact O-N 3.08Å; C311-Y314 WeakPolarHBondContact O-CB 3.18Å; C311-Y314 PolarHBondContact O-N 3.27Å; F312-Y314 VanDerWaalsContact C-N 3.27Å; F312-Y314 PolarHBondContact O-N 2.77Å; Y314-H316 VanDerWaalsContact C-N 3.32Å; Y314-H316 PolarHBondContact O-N 2.95Å; Y314-R317 PolarHBondContact O-N 3.36Å; Y314-A318 HydrophobicContact CE1-CB 4.28Å; Y314-A318 WeakPolarHBondContact O-CB 3.43Å; Y314-A318 PolarHBondContact O-N 2.98Å
315	L	92.5	Very high	89.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-41.9	179.2	-76.3	172.9	0	0	0	112.3	L112 F116 I301 L307 C311 F312 R317 A318 L319 F329	L112-L315 HydrophobicContact CD1-CG 4.47Å; L112-L315 HydrophobicContact CD2-CD2 4.26Å; F116-L315 HydrophobicContact CE2-CD2 3.44Å; F116-L315 VanDerWaalsContact CE2-CD2 3.44Å; F116-L315 HydrophobicContact CZ-CD2 3.76Å; I301-L315 HydrophobicContact CD1-CD2 4.29Å; L307-L315 HydrophobicContact CD1-CD1 3.64Å; C311-L315 WeakPolarHBondContact O-CB 3.31Å; C311-L315 VanDerWaalsContact O-CG 3.32Å; C311-L315 WeakPolarHBondContact O-CG 3.28Å; C311-L315 PolarHBondContact O-N 3.05Å; F312-L315 HydrophobicContact CD1-CD1 4.27Å; F312-L315 PolarHBondContact O-N 3.34Å; L315-R317 VanDerWaalsContact C-N 3.32Å; L315-R317 PolarHBondContact O-N 3.38Å; L315-A318 PolarHBondContact O-N 3.37Å; L315-A318 VanDerWaalsContact O-N 3.16Å; L315-L319 WeakPolarHBondContact O-CB 3.5Å; L315-L319 VanDerWaalsContact O-CG 3.3Å; L315-L319 WeakPolarHBondContact O-CG 2.92Å; L315-L319 PolarHBondContact O-N 3.49Å; L315-F329 HydrophobicContact CD1-CE1 3.98Å; L315-F329 HydrophobicContact CD1-CZ 4.28Å
316	H	89.6	Confident	89.5	Confident	38 Å²	38	49.7 Å²	49.7	18%	0.176	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-46	177.7	-175.9	-80.1	0	0	0	111.4	F312 Y314 E320 R357	F312-H316 WeakPolarHBondContact O-CB 3.4Å; F312-H316 PolarHBondContact O-N 2.9Å; Y314-H316 VanDerWaalsContact C-N 3.32Å; Y314-H316 PolarHBondContact O-N 2.95Å; H316-E320 IonicContact CE1-OE1 2.72Å; H316-E320 PolarHBondContact CE1-OE1 2.85Å; H316-E320 IonicContact ND1-OE1 3.83Å; H316-R357 PolarHBondContact CE1-NH1 3.16Å; H316-R357 PolarHBondContact CE1-NH2 2.88Å; H316-R357 PolarHBondContact NE2-NE 3.25Å; H316-R357 PolarHBondContact NE2-NH1 3.3Å; H316-R357 PolarHBondContact NE2-NH2 3.23Å
317	R	89	Confident	89.5	Confident	196 Å²	196	48.1 Å²	48.1	74%	0.74	25%	0.248	S	C	*	.	H	α-helix	trans	-68.4	-37.8	175.6	-175.4	179.8	176.3	-175.1	-0.1	112.5	T313 Y314 L315 E320	T313-R317 PolarHBondContact O-N 3.16Å; Y314-R317 PolarHBondContact O-N 3.36Å; L315-R317 VanDerWaalsContact C-N 3.32Å; L315-R317 PolarHBondContact O-N 3.38Å; R317-E320 PolarHBondContact O-N 3.42Å
318	A	89	Confident	89.5	Confident	15 Å²	15	48.1 Å²	48.1	12%	0.124	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-37.1	-179.3	0	0	0	0	0	112.2	F116 Y314 L315 E320 S321	F116-A318 HydrophobicContact CD1-CB 4.23Å; F116-A318 HydrophobicContact CE1-CB 3.67Å; F116-A318 HydrophobicContact CE2-CB 4.4Å; F116-A318 HydrophobicContact CZ-CB 3.76Å; Y314-A318 HydrophobicContact CE1-CB 4.28Å; Y314-A318 WeakPolarHBondContact O-CB 3.43Å; Y314-A318 PolarHBondContact O-N 2.98Å; L315-A318 PolarHBondContact O-N 3.37Å; L315-A318 VanDerWaalsContact O-N 3.16Å; A318-E320 PolarHBondContact O-N 2.89Å; A318-S321 WeakPolarHBondContact O-CB 3.35Å; A318-S321 PolarHBondContact O-N 3.05Å; A318-S321 VanDerWaalsContact O-N 3.12Å
319	L	88.2	Confident	89.6	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-24.1	176.2	-74.1	170.3	0	0	0	113.6	G63 A65 L315 S321 V327 L354	G63-L319 WeakPolarHBondContact CA-O 3.47Å; A65-L319 HydrophobicContact CB-CD1 4.21Å; A65-L319 HydrophobicContact CB-CD2 4.27Å; L315-L319 WeakPolarHBondContact O-CB 3.5Å; L315-L319 VanDerWaalsContact O-CG 3.3Å; L315-L319 WeakPolarHBondContact O-CG 2.92Å; L315-L319 PolarHBondContact O-N 3.49Å; L319-S321 PolarHBondContact O-N 3.08Å; L319-V327 HydrophobicContact CD2-CB 3.86Å; L319-V327 HydrophobicContact CD2-CG2 3.5Å; L319-V327 VanDerWaalsContact CD2-CG2 3.5Å; L319-L354 HydrophobicContact CD1-CD1 3.77Å
320	E	83.8	Confident	89.8	Confident	106 Å²	106	44.8 Å²	44.8	50%	0.495	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-9.6	175.5	-67.7	175.6	172	0	0	112.8	H316 R317 A318 R357	H316-E320 IonicContact CE1-OE1 2.72Å; H316-E320 PolarHBondContact CE1-OE1 2.85Å; H316-E320 IonicContact ND1-OE1 3.83Å; R317-E320 PolarHBondContact O-N 3.42Å; A318-E320 PolarHBondContact O-N 2.89Å; E320-R357 IonicContact OE1-CZ 3.72Å; E320-R357 IonicContact OE1-NH1 2.93Å; E320-R357 PolarHBondContact OE1-NH1 3.13Å; E320-R357 IonicContact OE1-NH2 3.05Å; E320-R357 PolarHBondContact OE1-NH2 3.42Å
321	S	82.5	Confident	89.9	Confident	58 Å²	58	39 Å²	39	41%	0.406	20%	0.204	S	C	.	.	S	Bend	trans	-70.1	137.8	177.3	-165.8	0	0	0	0	111.5	A318 L319 I323 A324	A318-S321 WeakPolarHBondContact O-CB 3.35Å; A318-S321 PolarHBondContact O-N 3.05Å; A318-S321 VanDerWaalsContact O-N 3.12Å; L319-S321 PolarHBondContact O-N 3.08Å; S321-I323 PolarHBondContact O-N 3.28Å; S321-I323 WeakPolarHBondContact OG-CG1 3.46Å; S321-A324 VanDerWaalsContact O-CB 3.31Å; S321-A324 WeakPolarHBondContact O-CB 3.49Å; S321-A324 PolarHBondContact O-N 3.29Å; S321-A324 VanDerWaalsContact O-N 3.16Å
322	T	74.3	Confident	89.8	Confident	144 Å²	144	42.2 Å²	42.2	88%	0.883	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.6	177.1	53.2	0	0	0	0	113.6
323	I	78	Confident	89.8	Confident	48 Å²	48	48.1 Å²	48.1	25%	0.246	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	12.3	179.5	60.9	168.3	0	0	0	112.5	I120 L294 S321	I120-I323 WeakPolarHBondContact CD1-O 3.34Å; L294-I323 HydrophobicContact CD2-CB 4.12Å; L294-I323 HydrophobicContact CD2-CG2 3.84Å; S321-I323 PolarHBondContact O-N 3.28Å; S321-I323 WeakPolarHBondContact OG-CG1 3.46Å
324	A	84.7	Confident	89.8	Confident	26 Å²	26	45.9 Å²	45.9	22%	0.215	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-62.8	137.2	-179.1	0	0	0	0	0	111	S321	S321-A324 VanDerWaalsContact O-CB 3.31Å; S321-A324 WeakPolarHBondContact O-CB 3.49Å; S321-A324 PolarHBondContact O-N 3.29Å; S321-A324 VanDerWaalsContact O-N 3.16Å
325	P	89.9	Confident	89.8	Confident	6 Å²	6	51.5 Å²	51.5	4%	0.039	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-67.6	167.7	170.6	33.3	-35.8	0	0	0	110.1	F116 A119 I120 G297 L299 V327	F116-P325 VanDerWaalsContact CD1-CD 3.42Å; F116-P325 HydrophobicContact CD1-CG 3.77Å; F116-P325 HydrophobicContact CE1-CG 4.14Å; F116-P325 HydrophobicContact CG-CG 4.32Å; A119-P325 HydrophobicContact CB-CB 3.59Å; A119-P325 HydrophobicContact CB-CG 3.85Å; I120-P325 HydrophobicContact CG1-CB 4.27Å; I120-P325 HydrophobicContact CG1-CG 4.45Å; G297-P325 WeakPolarHBondContact O-CB 3.41Å; L299-P325 HydrophobicContact CB-CG 4.14Å; P325-V327 PolarHBondContact O-N 3.33Å
326	I	91.6	Very high	89.9	Confident	16 Å²	16	52.3 Å²	52.3	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	116.9	172.2	-60.3	128.4	0	0	0	108.1	I56 L87 G297 V298 L299 I328	I56-I326 HydrophobicContact CB-CD1 4.37Å; I56-I326 HydrophobicContact CD1-CB 4.39Å; I56-I326 HydrophobicContact CD1-CD1 3.84Å; I56-I326 HydrophobicContact CD1-CG1 3.88Å; I56-I326 HydrophobicContact CD1-CG2 3.76Å; I56-I326 HydrophobicContact CG1-CD1 4.03Å; I56-I326 HydrophobicContact CG1-CG1 3.92Å; I56-I326 HydrophobicContact CG1-CG2 4.41Å; I56-I326 HydrophobicContact CG2-CD1 3.42Å; I56-I326 VanDerWaalsContact CG2-CD1 3.42Å; I56-I326 HydrophobicContact CG2-CG1 4.09Å; L87-I326 HydrophobicContact CD1-CD1 3.96Å; G297-I326 PolarHBondContact O-N 3.23Å; V298-I326 CarbonylContact C-O 3.5Å; V298-I326 WeakPolarHBondContact CA-O 3.42Å; V298-I326 HydrophobicContact CG2-CB 4.35Å; V298-I326 HydrophobicContact CG2-CD1 4.27Å; L299-I326 PolarHBondContact N-O 3.04Å; I326-I328 HydrophobicContact CG2-CG1 4.28Å
327	V	94.5	Very high	90.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123	179.8	-174.8	0	0	0	0	110.2	A65 V66 F116 L299 L319 P325 F329	A65-V327 WeakPolarHBondContact CA-O 3.19Å; A65-V327 HydrophobicContact CB-CB 4.18Å; A65-V327 WeakPolarHBondContact CB-O 3.44Å; V66-V327 PolarHBondContact N-O 3.36Å; F116-V327 HydrophobicContact CE1-CG2 4.15Å; F116-V327 HydrophobicContact CZ-CG2 3.88Å; L299-V327 HydrophobicContact CB-CG2 4.44Å; L299-V327 HydrophobicContact CD2-CG2 4.35Å; L299-V327 WeakPolarHBondContact O-CA 3.38Å; L319-V327 HydrophobicContact CD2-CB 3.86Å; L319-V327 HydrophobicContact CD2-CG2 3.5Å; L319-V327 VanDerWaalsContact CD2-CG2 3.5Å; P325-V327 PolarHBondContact O-N 3.33Å; V327-F329 HydrophobicContact CG1-CD1 4.02Å; V327-F329 HydrophobicContact CG1-CD2 4.47Å; V327-F329 HydrophobicContact CG1-CE1 3.5Å; V327-F329 HydrophobicContact CG1-CE2 4.03Å; V327-F329 HydrophobicContact CG1-CG 4.47Å; V327-F329 HydrophobicContact CG1-CZ 3.51Å
328	I	95.7	Very high	90.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.5	174.2	-53.9	-179.2	0	0	0	108.1	V66 M68 A80 I83 V298 L299 F300 I301 I326	V66-I328 HydrophobicContact CB-CG1 4.3Å; V66-I328 HydrophobicContact CB-CG2 4.41Å; V66-I328 HydrophobicContact CG1-CG2 4.46Å; V66-I328 CarbonylContact O-C 3.54Å; V66-I328 WeakPolarHBondContact O-CA 3.14Å; M68-I328 HydrophobicContact CG-CG2 3.75Å; A80-I328 HydrophobicContact CB-CD1 4.27Å; A80-I328 HydrophobicContact CB-CG2 4.21Å; I83-I328 HydrophobicContact CB-CD1 4.41Å; I83-I328 HydrophobicContact CD1-CD1 3.71Å; I83-I328 HydrophobicContact CG2-CD1 4.2Å; V298-I328 HydrophobicContact CG1-CD1 3.6Å; V298-I328 HydrophobicContact CG1-CG1 4Å; L299-I328 PolarHBondContact O-N 3.16Å; F300-I328 CarbonylContact C-O 3.52Å; F300-I328 WeakPolarHBondContact CA-O 3.27Å; F300-I328 HydrophobicContact CD2-CB 4.11Å; F300-I328 HydrophobicContact CD2-CG2 3.94Å; F300-I328 WeakPolarHBondContact CD2-O 3.23Å; F300-I328 HydrophobicContact CE2-CG2 4.31Å; I301-I328 PolarHBondContact N-O 3.29Å; I326-I328 HydrophobicContact CG2-CG1 4.28Å
329	F	96.9	Very high	90.6	Very high	1 Å²	1	49.2 Å²	49.2	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	147.2	171.9	-58	-61.4	0	0	0	110.3	A65 V66 L67 M68 I301 V304 L315 V327 L354 V358	A65-F329 HydrophobicContact CB-CD2 4.03Å; A65-F329 HydrophobicContact CB-CE2 3.55Å; A65-F329 HydrophobicContact CB-CZ 4.44Å; V66-F329 PolarHBondContact O-N 2.99Å; L67-F329 HydrophobicContact CD1-CB 3.59Å; M68-F329 PolarHBondContact N-O 3.3Å; I301-F329 HydrophobicContact CB-CD1 4.03Å; I301-F329 HydrophobicContact CD1-CD1 4.33Å; I301-F329 HydrophobicContact CD1-CE1 3.97Å; I301-F329 HydrophobicContact CG1-CD1 4.4Å; I301-F329 HydrophobicContact CG1-CE1 4.48Å; I301-F329 CarbonylContact O-C 3.49Å; V304-F329 HydrophobicContact CB-CB 4.16Å; V304-F329 HydrophobicContact CB-CD1 4.2Å; V304-F329 HydrophobicContact CG1-CB 4.2Å; V304-F329 HydrophobicContact CG2-CB 4.15Å; V304-F329 HydrophobicContact CG2-CD1 3.46Å; V304-F329 VanDerWaalsContact CG2-CD1 3.46Å; V304-F329 HydrophobicContact CG2-CE1 4.07Å; V304-F329 HydrophobicContact CG2-CG 3.97Å; L315-F329 HydrophobicContact CD1-CE1 3.98Å; L315-F329 HydrophobicContact CD1-CZ 4.28Å; V327-F329 HydrophobicContact CG1-CD1 4.02Å; V327-F329 HydrophobicContact CG1-CD2 4.47Å; V327-F329 HydrophobicContact CG1-CE1 3.5Å; V327-F329 HydrophobicContact CG1-CE2 4.03Å; V327-F329 HydrophobicContact CG1-CG 4.47Å; V327-F329 HydrophobicContact CG1-CZ 3.51Å; F329-L354 HydrophobicContact CE2-CD2 4.46Å; F329-L354 HydrophobicContact CZ-CD2 4.4Å; F329-V358 HydrophobicContact CD2-CG1 4.12Å; F329-V358 HydrophobicContact CE2-CG1 4.06Å
330	A	97	Very high	90.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.6	167.2	0	0	0	0	0	112	M68 K76 F300 I301 E303 V304	M68-A330 HydrophobicContact CB-CB 4.31Å; M68-A330 WeakPolarHBondContact O-CA 3.41Å; K76-A330 HydrophobicContact CB-CB 4.27Å; K76-A330 HydrophobicContact CD-CB 4.14Å; F300-A330 HydrophobicContact CE2-CB 3.59Å; F300-A330 HydrophobicContact CZ-CB 3.57Å; I301-A330 PolarHBondContact O-N 3.39Å; E303-A330 PolarHBondContact N-O 2.7Å; E303-A330 VanDerWaalsContact N-O 3.16Å; V304-A330 WeakPolarHBondContact CG1-O 3.29Å; V304-A330 PolarHBondContact N-O 2.92Å
331	T	96.6	Very high	91.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	143	176.6	-169.1	0	0	0	0	111.4	L67 M68 A69 G70 K76 H305 R333 H348	L67-T331 HydrophobicContact CD1-CG2 3.91Å; L67-T331 HydrophobicContact CG-CG2 4.48Å; M68-T331 PolarHBondContact O-N 3.24Å; A69-T331 HydrophobicContact CB-CG2 4.11Å; G70-T331 PolarHBondContact N-O 3.39Å; K76-T331 WeakPolarHBondContact CE-O 3.46Å; H305-T331 PolarHBondContact ND1-OG1 3.45Å; T331-R333 PolarHBondContact OG1-N 3.48Å; T331-H348 HydrophobicContact CG2-CB 3.81Å; T331-H348 WeakPolarHBondContact CG2-ND1 3.42Å
332	N	93.7	Very high	91.2	Very high	68 Å²	68	54.2 Å²	54.2	36%	0.364	30%	0.299	S	S	.	.			trans	-109.2	1.7	169.5	61.6	-10.1	0	0	0	112.4	G70 H305	G70-N332 WeakPolarHBondContact O-CA 3.4Å; H305-N332 PolarHBondContact CE1-OD1 3.5Å
333	R	92.9	Very high	91.8	Very high	127 Å²	127	54.1 Å²	54.1	48%	0.479	29%	0.293	S	S	.	.			trans	-97.3	142.6	180	-65.7	-162.3	-177	-144.6	-2.2	111.7	H305 T331 H348	H305-R333 WeakPolarHBondContact CD2-CD 3.43Å; H305-R333 PolarHBondContact CD2-NE 2.89Å; H305-R333 PolarHBondContact NE2-NE 2.98Å; T331-R333 PolarHBondContact OG1-N 3.48Å; R333-H348 PolarHBondContact O-ND1 2.87Å
334	G	92.5	Very high	92.4	Very high	50 Å²	50	56.3 Å²	56.3	52%	0.515	30%	0.304	S	S	.	.	S	Bend	trans	-78.5	-118.6	167	0	0	0	0	0	109.9	H348	G334-H348 WeakPolarHBondContact O-CA 3.48Å; G334-H348 PolarHBondContact O-N 2.92Å
335	K	93.6	Very high	92.8	Very high	178 Å²	178	60.5 Å²	60.5	77%	0.774	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.2	173	-65.3	-176.6	-179.4	-176.6	0	110.5	I345 S346	K335-I345 HydrophobicContact CB-CG2 3.94Å; K335-S346 WeakPolarHBondContact CA-O 3.45Å
336	C	93.4	Very high	93	Very high	17 Å²	17	60.4 Å²	60.4	12%	0.115	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	160.2	171.8	54.7	0	0	0	0	111.1	S346 G349	C336-S346 PolarHBondContact N-O 2.64Å; C336-S346 VanDerWaalsContact N-O 3.12Å; C336-S346 PolarHBondContact O-N 3.36Å; C336-G349 WeakPolarHBondContact SG-CA 3.5Å; C336-G349 PolarHBondContact SG-N 2.82Å
337	T	94.3	Very high	93.2	Very high	64 Å²	64	62.1 Å²	62.1	39%	0.393	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	134.1	175.3	-47	0	0	0	0	110.5	R339 I344	T337-R339 PolarHBondContact O-N 2.95Å; T337-I344 WeakPolarHBondContact CA-O 3.49Å
338	I	94.8	Very high	93.2	Very high	5 Å²	5	63.8 Å²	63.8	3%	0.026	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-69.8	124.6	171.8	-56.5	172.6	0	0	0	107.7	I309 F312 T341 I344 S346 P351	I309-I338 HydrophobicContact CB-CG2 4.3Å; F312-I338 HydrophobicContact CD2-CG2 4.3Å; F312-I338 HydrophobicContact CE2-CG2 4.33Å; I338-T341 HydrophobicContact CB-CG2 4.14Å; I338-T341 HydrophobicContact CG2-CG2 4.2Å; I338-T341 PolarHBondContact O-N 3.04Å; I338-T341 VanDerWaalsContact O-N 3.15Å; I338-T341 PolarHBondContact O-OG1 3.48Å; I338-I344 HydrophobicContact CD1-CB 4.48Å; I338-I344 HydrophobicContact CD1-CG2 3.84Å; I338-I344 PolarHBondContact N-O 3.5Å; I338-S346 VanDerWaalsContact CG1-OG 3.28Å; I338-S346 WeakPolarHBondContact CG1-OG 3.3Å; I338-P351 HydrophobicContact CD1-CB 4.42Å; I338-P351 HydrophobicContact CD1-CG 4.08Å; I338-P351 HydrophobicContact CG2-CG 4.47Å
339	R	93	Very high	93.1	Very high	114 Å²	114	63.8 Å²	63.8	43%	0.43	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-62.1	144.1	179	-74.5	-178.8	154.7	-137.2	-6.7	111	M306 D308 I309 T337 T341	M306-R339 VanDerWaalsContact O-CD 3.22Å; M306-R339 WeakPolarHBondContact O-CD 3.48Å; D308-R339 CarbonylContact C-O 3.54Å; D308-R339 WeakPolarHBondContact CA-O 3.39Å; D308-R339 HydrophobicContact CB-CB 3.95Å; D308-R339 VanDerWaalsContact CB-O 3.31Å; D308-R339 WeakPolarHBondContact CB-O 3.48Å; I309-R339 PolarHBondContact N-O 3.29Å; T337-R339 PolarHBondContact O-N 2.95Å; R339-T341 PolarHBondContact O-N 3.32Å
340	G	91.5	Very high	93.1	Very high	69 Å²	69	63.8 Å²	63.8	71%	0.711	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	1.6	-173.6	0	0	0	0	0	114.2
341	T	92.3	Very high	92.9	Very high	26 Å²	26	64.4 Å²	64.4	16%	0.16	35%	0.345	C	S	.	.			trans	-115.6	149.7	167.8	75.5	0	0	0	0	108.9	I309 I338 R339 I344	I309-T341 HydrophobicContact CB-CG2 4.14Å; I309-T341 HydrophobicContact CD1-CG2 3.69Å; I309-T341 HydrophobicContact CG1-CG2 4.5Å; I309-T341 HydrophobicContact CG2-CG2 4.28Å; I338-T341 HydrophobicContact CB-CG2 4.14Å; I338-T341 HydrophobicContact CG2-CG2 4.2Å; I338-T341 PolarHBondContact O-N 3.04Å; I338-T341 VanDerWaalsContact O-N 3.15Å; I338-T341 PolarHBondContact O-OG1 3.48Å; R339-T341 PolarHBondContact O-N 3.32Å; T341-I344 HydrophobicContact CG2-CB 4.38Å; T341-I344 HydrophobicContact CG2-CD1 4.03Å; T341-I344 HydrophobicContact CG2-CG1 4.39Å; T341-I344 WeakPolarHBondContact OG1-CB 3.37Å
342	E	84.7	Confident	92.7	Very high	179 Å²	179	69.8 Å²	69.8	84%	0.836	37%	0.373	S	S	*	.	S	Bend	trans	-78.4	-45.1	-177.7	-64.2	-177.9	170	0	0	111.1
343	D	85.4	Confident	92.6	Very high	142 Å²	142	70.8 Å²	70.8	76%	0.759	38%	0.379	S	S	*	.	S	Bend	trans	-137.3	13.6	-169.6	-65.6	-49	0	0	0	115.2	I345	D343-I345 PolarHBondContact O-N 3.23Å; D343-I345 VanDerWaalsContact O-N 3.17Å
344	I	91.4	Very high	92.5	Very high	94 Å²	94	64.8 Å²	64.8	48%	0.482	36%	0.356	S	S	.	.			trans	-85.5	98.4	-178.9	-53	-178.1	0	0	0	109.8	T337 I338 T341	T337-I344 WeakPolarHBondContact CA-O 3.49Å; I338-I344 HydrophobicContact CD1-CB 4.48Å; I338-I344 HydrophobicContact CD1-CG2 3.84Å; I338-I344 PolarHBondContact N-O 3.5Å; T341-I344 HydrophobicContact CG2-CB 4.38Å; T341-I344 HydrophobicContact CG2-CD1 4.03Å; T341-I344 HydrophobicContact CG2-CG1 4.39Å; T341-I344 WeakPolarHBondContact OG1-CB 3.37Å
345	I	93.3	Very high	92.5	Very high	114 Å²	114	63.3 Å²	63.3	59%	0.585	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	121.2	172.4	-59.9	172.6	0	0	0	109.2	K335 D343	K335-I345 HydrophobicContact CB-CG2 3.94Å; D343-I345 PolarHBondContact O-N 3.23Å; D343-I345 VanDerWaalsContact O-N 3.17Å
346	S	94.3	Very high	92.3	Very high	4 Å²	4	61.9 Å²	61.9	3%	0.028	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	159.7	176.8	74.9	0	0	0	0	112.2	K335 C336 I338 H348 G349 I350	K335-S346 WeakPolarHBondContact CA-O 3.45Å; C336-S346 PolarHBondContact N-O 2.64Å; C336-S346 VanDerWaalsContact N-O 3.12Å; C336-S346 PolarHBondContact O-N 3.36Å; I338-S346 VanDerWaalsContact CG1-OG 3.28Å; I338-S346 WeakPolarHBondContact CG1-OG 3.3Å; S346-H348 PolarHBondContact O-N 2.91Å; S346-G349 PolarHBondContact O-N 3.04Å; S346-G349 WeakPolarHBondContact OG-CA 3.5Å; S346-I350 WeakPolarHBondContact CB-O 3.44Å; S346-I350 PolarHBondContact OG-N 3.37Å; S346-I350 PolarHBondContact OG-O 3.49Å
347	P	95.2	Very high	92	Very high	52 Å²	52	65.2 Å²	65.2	34%	0.338	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	131.2	167.3	-21	33.3	0	0	0	110.2	G349 I350 L355	P347-G349 PolarHBondContact O-N 3.36Å; P347-I350 PolarHBondContact O-N 3.29Å; P347-L355 HydrophobicContact CB-CD1 4.07Å; P347-L355 HydrophobicContact CG-CD1 4.29Å
348	H	95.5	Very high	92	Very high	36 Å²	36	62.9 Å²	62.9	17%	0.167	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	6.8	178.5	-52.1	-53.4	0	0	0	116	L67 H305 T331 R333 G334 S346 I350	L67-H348 HydrophobicContact CD2-CB 4.39Å; H305-H348 VanDerWaalsContact CB-O 3.31Å; H305-H348 WeakPolarHBondContact CB-O 2.99Å; T331-H348 HydrophobicContact CG2-CB 3.81Å; T331-H348 WeakPolarHBondContact CG2-ND1 3.42Å; R333-H348 PolarHBondContact O-ND1 2.87Å; G334-H348 WeakPolarHBondContact O-CA 3.48Å; G334-H348 PolarHBondContact O-N 2.92Å; S346-H348 PolarHBondContact O-N 2.91Å; H348-I350 HydrophobicContact CB-CD1 4.11Å; H348-I350 HydrophobicContact CB-CG1 4.16Å; H348-I350 PolarHBondContact O-N 3.36Å
349	G	93.6	Very high	91.9	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	23.3	-174	0	0	0	0	0	113.2	F312 C336 S346 P347	F312-G349 WeakPolarHBondContact CE2-O 3.4Å; C336-G349 WeakPolarHBondContact SG-CA 3.5Å; C336-G349 PolarHBondContact SG-N 2.82Å; S346-G349 PolarHBondContact O-N 3.04Å; S346-G349 WeakPolarHBondContact OG-CA 3.5Å; P347-G349 PolarHBondContact O-N 3.36Å
350	I	95.1	Very high	92.1	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.346	C	S	.	.			trans	-108.6	137.7	179.6	-56.5	177.1	0	0	0	108.9	L67 V304 F312 S346 P347 H348 L354 L355	L67-I350 HydrophobicContact CD1-CD1 3.9Å; L67-I350 HydrophobicContact CD2-CD1 3.91Å; V304-I350 HydrophobicContact CG1-CD1 3.83Å; V304-I350 HydrophobicContact CG1-CG1 4.19Å; F312-I350 HydrophobicContact CD1-CG2 4.45Å; F312-I350 HydrophobicContact CE1-CB 4.46Å; F312-I350 HydrophobicContact CE1-CG1 4.16Å; F312-I350 HydrophobicContact CE1-CG2 4.07Å; F312-I350 HydrophobicContact CZ-CB 4.44Å; F312-I350 HydrophobicContact CZ-CG1 4.07Å; S346-I350 WeakPolarHBondContact CB-O 3.44Å; S346-I350 PolarHBondContact OG-N 3.37Å; S346-I350 PolarHBondContact OG-O 3.49Å; P347-I350 PolarHBondContact O-N 3.29Å; H348-I350 HydrophobicContact CB-CD1 4.11Å; H348-I350 HydrophobicContact CB-CG1 4.16Å; H348-I350 PolarHBondContact O-N 3.36Å; I350-L354 HydrophobicContact CG2-CB 3.99Å; I350-L354 HydrophobicContact CG2-CD2 3.89Å; I350-L354 HydrophobicContact CG2-CG 4.05Å; I350-L355 HydrophobicContact CB-CD1 4.28Å; I350-L355 HydrophobicContact CB-CD2 3.91Å; I350-L355 HydrophobicContact CB-CG 3.83Å; I350-L355 HydrophobicContact CD1-CD2 4.09Å; I350-L355 HydrophobicContact CG2-CD2 4.08Å; I350-L355 HydrophobicContact CG2-CG 3.82Å; I350-L355 WeakPolarHBondContact O-CD1 3.39Å
351	P	94.3	Very high	92.3	Very high	13 Å²	13	61.3 Å²	61.3	8%	0.084	32%	0.315	C	S	.	.			trans	-53	142.6	170.4	-28.9	37.3	0	0	0	113.3	F312 I338 D353 L354 L355	F312-P351 HydrophobicContact CB-CG 3.76Å; F312-P351 VanDerWaalsContact CD2-CD 3.41Å; F312-P351 HydrophobicContact CD2-CG 3.82Å; F312-P351 HydrophobicContact CG-CG 3.83Å; I338-P351 HydrophobicContact CD1-CB 4.42Å; I338-P351 HydrophobicContact CD1-CG 4.08Å; I338-P351 HydrophobicContact CG2-CG 4.47Å; P351-D353 VanDerWaalsContact C-N 3.32Å; P351-D353 WeakPolarHBondContact CB-OD1 3.28Å; P351-D353 PolarHBondContact O-N 2.67Å; P351-L354 PolarHBondContact O-N 3.12Å; P351-L355 PolarHBondContact O-N 2.95Å
352	L	92.3	Very high	92.5	Very high	114 Å²	114	69 Å²	69	60%	0.597	34%	0.341	S	S	*	.	H	α-helix	trans	-62.9	-37	-174.3	-68.7	174.4	0	0	0	112.9	L354 L355 D356	L352-L354 PolarHBondContact O-N 3.36Å; L352-L355 HydrophobicContact CD2-CD1 4.19Å; L352-L355 WeakPolarHBondContact O-CB 3.43Å; L352-L355 PolarHBondContact O-N 2.97Å; L352-D356 PolarHBondContact O-N 2.88Å
353	D	90.2	Very high	93.1	Very high	88 Å²	88	60.5 Å²	60.5	47%	0.471	30%	0.301	S	S	.	.	H	α-helix	trans	-60.7	-40.1	175.7	59.9	-33.6	0	0	0	112.9	P351	P351-D353 VanDerWaalsContact C-N 3.32Å; P351-D353 WeakPolarHBondContact CB-OD1 3.28Å; P351-D353 PolarHBondContact O-N 2.67Å
354	L	91.7	Very high	93.5	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-74	-38.4	173.2	-176.7	60.3	0	0	0	111.2	F312 L319 F329 I350 P351 L352 D356 R357 V358	F312-L354 HydrophobicContact CD1-CD2 3.53Å; F312-L354 HydrophobicContact CE1-CD2 4.11Å; F312-L354 HydrophobicContact CG-CD2 4.48Å; L319-L354 HydrophobicContact CD1-CD1 3.77Å; F329-L354 HydrophobicContact CE2-CD2 4.46Å; F329-L354 HydrophobicContact CZ-CD2 4.4Å; I350-L354 HydrophobicContact CG2-CB 3.99Å; I350-L354 HydrophobicContact CG2-CD2 3.89Å; I350-L354 HydrophobicContact CG2-CG 4.05Å; P351-L354 PolarHBondContact O-N 3.12Å; L352-L354 PolarHBondContact O-N 3.36Å; L354-D356 VanDerWaalsContact C-N 3.26Å; L354-D356 PolarHBondContact O-N 3.27Å; L354-R357 WeakPolarHBondContact O-CB 3.37Å; L354-R357 PolarHBondContact O-N 3.25Å; L354-V358 HydrophobicContact CG-CG1 4.41Å; L354-V358 WeakPolarHBondContact O-CG1 3.44Å; L354-V358 PolarHBondContact O-N 3.33Å
355	L	92	Very high	93.5	Very high	20 Å²	20	57.6 Å²	57.6	11%	0.105	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-36.5	177.1	-79.1	171.1	0	0	0	112.6	L67 P347 I350 P351 L352 R357 V358	L67-L355 HydrophobicContact CD2-CD2 4.06Å; P347-L355 HydrophobicContact CB-CD1 4.07Å; P347-L355 HydrophobicContact CG-CD1 4.29Å; I350-L355 HydrophobicContact CB-CD1 4.28Å; I350-L355 HydrophobicContact CB-CD2 3.91Å; I350-L355 HydrophobicContact CB-CG 3.83Å; I350-L355 HydrophobicContact CD1-CD2 4.09Å; I350-L355 HydrophobicContact CG2-CD2 4.08Å; I350-L355 HydrophobicContact CG2-CG 3.82Å; I350-L355 WeakPolarHBondContact O-CD1 3.39Å; P351-L355 PolarHBondContact O-N 2.95Å; L352-L355 HydrophobicContact CD2-CD1 4.19Å; L352-L355 WeakPolarHBondContact O-CB 3.43Å; L352-L355 PolarHBondContact O-N 2.97Å; L355-R357 PolarHBondContact O-N 3.34Å; L355-V358 HydrophobicContact CD2-CG2 4.12Å; L355-V358 WeakPolarHBondContact O-CG2 3.29Å; L355-V358 PolarHBondContact O-N 3.03Å
356	D	89.2	Confident	93.6	Very high	147 Å²	147	54.3 Å²	54.3	79%	0.786	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.1	176.4	-72.1	-20.8	0	0	0	113.2	L352 L354	L352-D356 PolarHBondContact O-N 2.88Å; L354-D356 VanDerWaalsContact C-N 3.26Å; L354-D356 PolarHBondContact O-N 3.27Å
357	R	88.5	Confident	93.5	Very high	87 Å²	87	56.8 Å²	56.8	33%	0.328	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-5.4	178.2	-62.6	-177	175.1	-161.2	1	113.8	A65 H316 E320 L354 L355	A65-R357 PolarHBondContact N-O 3.02Å; H316-R357 PolarHBondContact CE1-NH1 3.16Å; H316-R357 PolarHBondContact CE1-NH2 2.88Å; H316-R357 PolarHBondContact NE2-NE 3.25Å; H316-R357 PolarHBondContact NE2-NH1 3.3Å; H316-R357 PolarHBondContact NE2-NH2 3.23Å; E320-R357 IonicContact OE1-CZ 3.72Å; E320-R357 IonicContact OE1-NH1 2.93Å; E320-R357 PolarHBondContact OE1-NH1 3.13Å; E320-R357 IonicContact OE1-NH2 3.05Å; E320-R357 PolarHBondContact OE1-NH2 3.42Å; L354-R357 WeakPolarHBondContact O-CB 3.37Å; L354-R357 PolarHBondContact O-N 3.25Å; L355-R357 PolarHBondContact O-N 3.34Å
358	V	93.1	Very high	93.4	Very high	15 Å²	15	57 Å²	57	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139.6	-179.4	-49.1	0	0	0	0	112.3	A65 L67 F329 L354 L355 I360	A65-V358 HydrophobicContact CB-CG1 4.04Å; A65-V358 CarbonylContact O-C 3.51Å; A65-V358 VanDerWaalsContact O-CA 3.3Å; A65-V358 WeakPolarHBondContact O-CA 3.4Å; L67-V358 HydrophobicContact CB-CB 4.19Å; L67-V358 HydrophobicContact CB-CG2 3.79Å; L67-V358 HydrophobicContact CD2-CG2 4.16Å; F329-V358 HydrophobicContact CD2-CG1 4.12Å; F329-V358 HydrophobicContact CE2-CG1 4.06Å; L354-V358 HydrophobicContact CG-CG1 4.41Å; L354-V358 WeakPolarHBondContact O-CG1 3.44Å; L354-V358 PolarHBondContact O-N 3.33Å; L355-V358 HydrophobicContact CD2-CG2 4.12Å; L355-V358 WeakPolarHBondContact O-CG2 3.29Å; L355-V358 PolarHBondContact O-N 3.03Å; V358-I360 HydrophobicContact CG2-CG1 3.96Å
359	M	94	Very high	93.4	Very high	52 Å²	52	62.3 Å²	62.3	26%	0.256	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	115.6	169.1	-65.7	-176.3	-64.5	0	0	109.2	V52 M55 M61 A65 V66 L67	V52-M359 HydrophobicContact CG2-CE 4.31Å; M55-M359 HydrophobicContact CE-CE 3.53Å; M55-M359 HydrophobicContact CE-SD 3.81Å; M55-M359 HydrophobicContact SD-CE 4.46Å; M55-M359 HydrophobicContact SD-SD 4.43Å; M61-M359 HydrophobicContact CE-CE 3.54Å; M61-M359 HydrophobicContact SD-CE 3.4Å; M61-M359 WeakPolarHBondContact SD-CE 3.47Å; A65-M359 PolarHBondContact O-N 3.33Å; V66-M359 CarbonylContact C-O 3.39Å; V66-M359 WeakPolarHBondContact CA-O 3.15Å; V66-M359 HydrophobicContact CG2-CE 4.27Å; L67-M359 PolarHBondContact N-O 2.97Å
360	I	95.8	Very high	93.4	Very high	93 Å²	93	64.6 Å²	64.6	48%	0.477	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.5	-174.6	-51.8	-178.4	0	0	0	110.1	L67 A69 V358	L67-I360 HydrophobicContact CB-CG1 4.27Å; L67-I360 HydrophobicContact CD2-CD1 4.23Å; L67-I360 HydrophobicContact CD2-CG1 4.08Å; L67-I360 HydrophobicContact CD2-CG2 4.45Å; L67-I360 CarbonylContact O-C 3.58Å; L67-I360 WeakPolarHBondContact O-CA 3.05Å; A69-I360 HydrophobicContact CB-CG2 3.94Å; V358-I360 HydrophobicContact CG2-CG1 3.96Å
361	I	97	Very high	93.4	Very high	11 Å²	11	64.8 Å²	64.8	6%	0.056	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	115.5	170.9	-58.8	179.1	0	0	0	108.1	A45 A48 V52 V66 L67 M68 A69	A45-I361 HydrophobicContact CB-CG2 3.76Å; A48-I361 HydrophobicContact CB-CD1 3.9Å; A48-I361 HydrophobicContact CB-CG1 4Å; A48-I361 HydrophobicContact CB-CG2 4.18Å; V52-I361 HydrophobicContact CG2-CD1 4.23Å; V66-I361 HydrophobicContact CG1-CD1 3.69Å; V66-I361 HydrophobicContact CG1-CG1 4.04Å; L67-I361 PolarHBondContact O-N 3.32Å; M68-I361 WeakPolarHBondContact CA-O 3.38Å; M68-I361 HydrophobicContact CE-CB 4.29Å; M68-I361 HydrophobicContact CE-CG2 3.92Å; M68-I361 HydrophobicContact SD-CB 3.67Å; M68-I361 HydrophobicContact SD-CD1 4.01Å; M68-I361 HydrophobicContact SD-CG1 4.32Å; M68-I361 HydrophobicContact SD-CG2 3.96Å; A69-I361 PolarHBondContact N-O 3.01Å
362	R	96.6	Very high	93.5	Very high	187 Å²	187	65.2 Å²	65.2	71%	0.706	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	136.3	178	-175.5	176.8	175.5	-171.1	-4.1	110.5	A69 L364	A69-R362 CarbonylContact O-C 3.53Å; A69-R362 WeakPolarHBondContact O-CA 3.49Å; R362-L364 HydrophobicContact CG-CD2 4.23Å
363	T	95.8	Very high	93.6	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.006	32%	0.315	C	S	.	.			trans	-109.9	138.6	169.5	55.9	0	0	0	0	109.7	A45 M68 A69 G70 T74 K76 I79	A45-T363 HydrophobicContact CB-CG2 4.26Å; M68-T363 HydrophobicContact CE-CG2 3.9Å; A69-T363 PolarHBondContact O-N 3.21Å; A69-T363 PolarHBondContact O-OG1 3.4Å; G70-T363 WeakPolarHBondContact CA-OG1 3.4Å; T74-T363 WeakPolarHBondContact OG1-CB 3.44Å; T74-T363 PolarHBondContact OG1-OG1 3.26Å; K76-T363 HydrophobicContact CG-CG2 4.02Å; I79-T363 HydrophobicContact CD1-CG2 4.08Å
364	L	94.3	Very high	93.8	Very high	80 Å²	80	59.8 Å²	59.8	42%	0.419	30%	0.299	S	S	.	.			trans	-105.6	158.4	-177.9	-61.5	178.1	0	0	0	111.9	Q42 T74 R362	Q42-L364 PolarHBondContact NE2-O 3.4Å; T74-L364 VanDerWaalsContact CG2-O 3.32Å; T74-L364 WeakPolarHBondContact CG2-O 3.28Å; R362-L364 HydrophobicContact CG-CD2 4.23Å
365	P	92.7	Very high	93.9	Very high	94 Å²	94	59.8 Å²	59.8	61%	0.61	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-58	143.4	167	-21.3	33.4	0	0	0	111.2	P71	P71-P365 HydrophobicContact CG-CG 4.37Å
366	Y	93.7	Very high	94.1	Very high	46 Å²	46	63.2 Å²	63.2	18%	0.18	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-75.5	148.5	176.6	-67.7	-72.9	0	0	0	111.8	V40 Q42 G73 T74 E370 I374 L403	V40-Y366 WeakPolarHBondContact O-CE1 3.42Å; Q42-Y366 HydrophobicContact CG-CD1 4.48Å; Q42-Y366 HydrophobicContact CG-CE1 3.57Å; G73-Y366 WeakPolarHBondContact O-CE2 3.49Å; T74-Y366 PolarHBondContact O-OH 3.47Å; Y366-E370 VanDerWaalsContact CA-OE2 3.25Å; Y366-E370 WeakPolarHBondContact CA-OE2 3.46Å; Y366-E370 HydrophobicContact CD1-CB 4.02Å; Y366-E370 WeakPolarHBondContact CD1-OE2 3.37Å; Y366-I374 HydrophobicContact CD1-CD1 3.81Å; Y366-I374 HydrophobicContact CD2-CD1 4.02Å; Y366-I374 HydrophobicContact CE1-CD1 3.75Å; Y366-I374 HydrophobicContact CE2-CD1 3.97Å; Y366-I374 HydrophobicContact CG-CD1 3.94Å; Y366-L403 HydrophobicContact CD2-CD2 3.94Å; Y366-L403 HydrophobicContact CE2-CD2 3.92Å
367	S	93.5	Very high	94.3	Very high	55 Å²	55	57.5 Å²	57.5	39%	0.385	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-71.7	162.3	167.6	82.1	0	0	0	0	111.2	E369 E370 V371	S367-E369 PolarHBondContact O-N 3.06Å; S367-E369 PolarHBondContact OG-N 3.23Å; S367-E370 PolarHBondContact N-OE2 3.33Å; S367-E370 PolarHBondContact O-N 3.04Å; S367-E370 WeakPolarHBondContact OG-CG 3.4Å; S367-E370 PolarHBondContact OG-N 3.03Å; S367-V371 VanDerWaalsContact O-CG2 3.31Å; S367-V371 WeakPolarHBondContact O-CG2 3.33Å; S367-V371 PolarHBondContact O-N 3.5Å
368	C	93.2	Very high	94.4	Very high	57 Å²	57	54.4 Å²	54.4	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-57.9	-40.4	176.6	-169.9	0	0	0	0	111.6	V371 I372	C368-V371 PolarHBondContact O-N 2.96Å; C368-I372 WeakPolarHBondContact O-CG1 3.45Å; C368-I372 PolarHBondContact O-N 3.48Å
369	E	93.8	Very high	94.5	Very high	147 Å²	147	53.8 Å²	53.8	69%	0.687	26%	0.264	S	S	*	.	H	α-helix	trans	-65.1	-43.5	179	-63.4	178.8	-177	0	0	112	S367 V371 I372 Q373	S367-E369 PolarHBondContact O-N 3.06Å; S367-E369 PolarHBondContact OG-N 3.23Å; E369-V371 VanDerWaalsContact C-N 3.35Å; E369-I372 PolarHBondContact O-N 3.45Å; E369-Q373 WeakPolarHBondContact O-CG 3.29Å; E369-Q373 PolarHBondContact O-N 3.29Å; E369-Q373 VanDerWaalsContact O-N 3.1Å
370	E	94.4	Very high	94.4	Very high	48 Å²	48	58.9 Å²	58.9	22%	0.224	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-42.8	175.1	-70.1	172.7	146.7	0	0	110.9	V40 G41 Y366 S367 I372 Q373 I374	V40-E370 HydrophobicContact CG1-CB 4.12Å; V40-E370 HydrophobicContact CG1-CG 4.3Å; G41-E370 VanDerWaalsContact CA-OE1 3.25Å; G41-E370 WeakPolarHBondContact CA-OE1 3.46Å; Y366-E370 VanDerWaalsContact CA-OE2 3.25Å; Y366-E370 WeakPolarHBondContact CA-OE2 3.46Å; Y366-E370 HydrophobicContact CD1-CB 4.02Å; Y366-E370 WeakPolarHBondContact CD1-OE2 3.37Å; S367-E370 PolarHBondContact N-OE2 3.33Å; S367-E370 PolarHBondContact O-N 3.04Å; S367-E370 WeakPolarHBondContact OG-CG 3.4Å; S367-E370 PolarHBondContact OG-N 3.03Å; E370-I372 PolarHBondContact O-N 3.27Å; E370-Q373 PolarHBondContact O-N 3.06Å; E370-I374 VanDerWaalsContact O-CG1 3.24Å; E370-I374 WeakPolarHBondContact O-CG1 3.42Å; E370-I374 PolarHBondContact O-N 3.42Å
371	V	95.1	Very high	94.1	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-59.8	-45.5	177	169.5	0	0	0	0	111.2	S367 C368 E369 Q373 I374 L375 A395 L403	S367-V371 VanDerWaalsContact O-CG2 3.31Å; S367-V371 WeakPolarHBondContact O-CG2 3.33Å; S367-V371 PolarHBondContact O-N 3.5Å; C368-V371 PolarHBondContact O-N 2.96Å; E369-V371 VanDerWaalsContact C-N 3.35Å; V371-Q373 VanDerWaalsContact C-N 3.31Å; V371-Q373 PolarHBondContact O-N 3.02Å; V371-I374 PolarHBondContact O-N 3.24Å; V371-L375 HydrophobicContact CG1-CD1 3.79Å; V371-L375 HydrophobicContact CG1-CG 4.28Å; V371-L375 WeakPolarHBondContact O-CB 3.4Å; V371-L375 VanDerWaalsContact O-CG 3.28Å; V371-L375 WeakPolarHBondContact O-CG 3.34Å; V371-L375 PolarHBondContact O-N 2.94Å; V371-A395 HydrophobicContact CB-CB 4.38Å; V371-A395 HydrophobicContact CG1-CB 3.87Å; V371-L403 HydrophobicContact CG1-CD1 4.01Å
372	I	96	Very high	93.8	Very high	23 Å²	23	58.3 Å²	58.3	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-57.8	-47	176.6	-70.4	169.6	0	0	0	110.2	C368 E369 E370 I374 L375 R376 F391 A395	C368-I372 WeakPolarHBondContact O-CG1 3.45Å; C368-I372 PolarHBondContact O-N 3.48Å; E369-I372 PolarHBondContact O-N 3.45Å; E370-I372 PolarHBondContact O-N 3.27Å; I372-I374 PolarHBondContact O-N 3.49Å; I372-L375 PolarHBondContact O-N 2.9Å; I372-R376 WeakPolarHBondContact O-CG 3.34Å; I372-R376 PolarHBondContact O-N 3.04Å; I372-F391 HydrophobicContact CG2-CB 4.2Å; I372-A395 HydrophobicContact CD1-CB 4.21Å; I372-A395 HydrophobicContact CG1-CB 3.53Å
373	Q	94.7	Very high	93.5	Very high	63 Å²	63	52.5 Å²	52.5	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-42	178.5	-70.8	-179.6	15.8	0	0	112.3	V40 E369 E370 V371 L375 R376 I377	V40-Q373 HydrophobicContact CG1-CB 3.83Å; V40-Q373 HydrophobicContact CG2-CB 4.13Å; E369-Q373 WeakPolarHBondContact O-CG 3.29Å; E369-Q373 PolarHBondContact O-N 3.29Å; E369-Q373 VanDerWaalsContact O-N 3.1Å; E370-Q373 PolarHBondContact O-N 3.06Å; V371-Q373 VanDerWaalsContact C-N 3.31Å; V371-Q373 PolarHBondContact O-N 3.02Å; Q373-L375 PolarHBondContact O-N 2.91Å; Q373-R376 PolarHBondContact O-N 2.95Å; Q373-I377 WeakPolarHBondContact O-CG1 3.36Å; Q373-I377 PolarHBondContact O-N 3.44Å
374	I	94.1	Very high	93.4	Very high	25 Å²	25	53.3 Å²	53.3	13%	0.128	29%	0.288	C	S	.	.	H	α-helix	trans	-61.3	-45.2	175.9	-66.1	162.7	0	0	0	110.7	V40 Y366 E370 V371 I372 R376 I377 R378 L403	V40-I374 HydrophobicContact CB-CD1 4.41Å; V40-I374 HydrophobicContact CB-CG1 3.7Å; V40-I374 HydrophobicContact CG1-CG1 4.18Å; V40-I374 HydrophobicContact CG2-CG1 4.07Å; Y366-I374 HydrophobicContact CD1-CD1 3.81Å; Y366-I374 HydrophobicContact CD2-CD1 4.02Å; Y366-I374 HydrophobicContact CE1-CD1 3.75Å; Y366-I374 HydrophobicContact CE2-CD1 3.97Å; Y366-I374 HydrophobicContact CG-CD1 3.94Å; E370-I374 VanDerWaalsContact O-CG1 3.24Å; E370-I374 WeakPolarHBondContact O-CG1 3.42Å; E370-I374 PolarHBondContact O-N 3.42Å; V371-I374 PolarHBondContact O-N 3.24Å; I372-I374 PolarHBondContact O-N 3.49Å; I374-R376 VanDerWaalsContact C-N 3.34Å; I374-R376 PolarHBondContact O-N 3.25Å; I374-I377 PolarHBondContact O-N 3.32Å; I374-R378 WeakPolarHBondContact O-CB 3.21Å; I374-R378 PolarHBondContact O-N 3.08Å; I374-L403 HydrophobicContact CD1-CD2 4Å; I374-L403 HydrophobicContact CG2-CD1 4.33Å; I374-L403 HydrophobicContact CG2-CD2 4.12Å
375	L	94.7	Very high	93.5	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-39.2	177.9	-70.4	169.2	0	0	0	111.6	V371 I372 Q373 R378 A379 F391 L394 A406 V407 L410	V371-L375 HydrophobicContact CG1-CD1 3.79Å; V371-L375 HydrophobicContact CG1-CG 4.28Å; V371-L375 WeakPolarHBondContact O-CB 3.4Å; V371-L375 VanDerWaalsContact O-CG 3.28Å; V371-L375 WeakPolarHBondContact O-CG 3.34Å; V371-L375 PolarHBondContact O-N 2.94Å; I372-L375 PolarHBondContact O-N 2.9Å; Q373-L375 PolarHBondContact O-N 2.91Å; L375-R378 PolarHBondContact O-N 3.22Å; L375-A379 VanDerWaalsContact O-CB 3.29Å; L375-A379 WeakPolarHBondContact O-CB 3.45Å; L375-A379 PolarHBondContact O-N 3.27Å; L375-F391 HydrophobicContact CB-CD1 3.85Å; L375-F391 HydrophobicContact CB-CE1 4Å; L375-L394 HydrophobicContact CD1-CB 3.53Å; L375-A406 HydrophobicContact CD2-CB 4.4Å; L375-V407 HydrophobicContact CD2-CG2 3.85Å; L375-L410 HydrophobicContact CD2-CD1 4.28Å
376	R	95.3	Very high	93.6	Very high	93 Å²	93	52.2 Å²	52.2	35%	0.351	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-48.5	174.5	-76.2	-176.9	-172.9	131.4	1.2	111.9	I372 Q373 I374 R378 A379 Q380 E388 F391	I372-R376 WeakPolarHBondContact O-CG 3.34Å; I372-R376 PolarHBondContact O-N 3.04Å; Q373-R376 PolarHBondContact O-N 2.95Å; I374-R376 VanDerWaalsContact C-N 3.34Å; I374-R376 PolarHBondContact O-N 3.25Å; R376-R378 VanDerWaalsContact C-N 3.27Å; R376-R378 PolarHBondContact O-N 2.89Å; R376-A379 PolarHBondContact O-N 2.99Å; R376-Q380 WeakPolarHBondContact O-CB 3.36Å; R376-Q380 PolarHBondContact O-N 3.08Å; R376-E388 IonicContact CZ-OE1 3.82Å; R376-E388 IonicContact CZ-OE2 3.67Å; R376-E388 IonicContact NE-OE1 3.4Å; R376-E388 PolarHBondContact NE-OE1 2.98Å; R376-E388 IonicContact NE-OE2 3.93Å; R376-E388 IonicContact NH2-OE1 3.46Å; R376-E388 PolarHBondContact NH2-OE1 2.88Å; R376-E388 IonicContact NH2-OE2 2.65Å; R376-E388 PolarHBondContact NH2-OE2 2.78Å; R376-F391 HydrophobicContact CB-CE1 4.35Å; R376-F391 HydrophobicContact CB-CZ 4.17Å; R376-F391 HydrophobicContact CG-CD1 4.13Å; R376-F391 HydrophobicContact CG-CD2 3.99Å; R376-F391 HydrophobicContact CG-CE1 3.81Å; R376-F391 HydrophobicContact CG-CE2 3.64Å; R376-F391 HydrophobicContact CG-CG 4.22Å; R376-F391 HydrophobicContact CG-CZ 3.54Å
377	I	93.3	Very high	93.7	Very high	26 Å²	26	50.8 Å²	50.8	13%	0.133	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-42.3	177.1	-67.1	168.5	0	0	0	110.3	H20 V40 Q373 I374 Q380 T381	H20-I377 HydrophobicContact CB-CG2 4.01Å; V40-I377 HydrophobicContact CG2-CD1 3.37Å; Q373-I377 WeakPolarHBondContact O-CG1 3.36Å; Q373-I377 PolarHBondContact O-N 3.44Å; I374-I377 PolarHBondContact O-N 3.32Å; I377-Q380 PolarHBondContact O-N 2.92Å; I377-T381 WeakPolarHBondContact O-CB 3.42Å; I377-T381 PolarHBondContact O-N 2.8Å; I377-T381 PolarHBondContact O-OG1 3.04Å
378	R	92.4	Very high	93.8	Very high	22 Å²	22	53.3 Å²	53.3	8%	0.083	27%	0.274	C	S	.	.	H	α-helix	trans	-66.7	-46.7	179.9	-173.6	64.4	-173.3	175.6	13	112.2	A16 A17 I374 L375 R376 Q380 T381 E382 V407 L410	A16-R378 PolarHBondContact O-NH1 3.38Å; A17-R378 PolarHBondContact O-NH1 2.96Å; I374-R378 WeakPolarHBondContact O-CB 3.21Å; I374-R378 PolarHBondContact O-N 3.08Å; L375-R378 PolarHBondContact O-N 3.22Å; R376-R378 VanDerWaalsContact C-N 3.27Å; R376-R378 PolarHBondContact O-N 2.89Å; R378-Q380 VanDerWaalsContact C-N 3.33Å; R378-Q380 PolarHBondContact O-N 3.42Å; R378-T381 WeakPolarHBondContact O-CB 3.28Å; R378-T381 PolarHBondContact O-N 2.87Å; R378-E382 IonicContact CZ-OE1 3.89Å; R378-E382 IonicContact NE-OE1 3.73Å; R378-E382 PolarHBondContact NE-OE1 3.25Å; R378-E382 IonicContact NH2-OE1 2.72Å; R378-E382 PolarHBondContact NH2-OE1 2.97Å; R378-E382 PolarHBondContact O-N 2.82Å; R378-V407 HydrophobicContact CG-CG1 3.85Å; R378-L410 HydrophobicContact CB-CD1 4.24Å; R378-L410 HydrophobicContact CG-CD1 3.93Å
379	A	93.7	Very high	93.9	Very high	2 Å²	2	57.5 Å²	57.5	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-44.1	176.5	0	0	0	0	0	111.1	L375 R376 T381 E382 G383 I384 V386 F391	L375-A379 VanDerWaalsContact O-CB 3.29Å; L375-A379 WeakPolarHBondContact O-CB 3.45Å; L375-A379 PolarHBondContact O-N 3.27Å; R376-A379 PolarHBondContact O-N 2.99Å; A379-T381 PolarHBondContact O-N 3.14Å; A379-E382 CarbonylContact O-C 3.56Å; A379-E382 PolarHBondContact O-N 3.48Å; A379-G383 PolarHBondContact O-N 3.3Å; A379-I384 HydrophobicContact CB-CB 4.47Å; A379-I384 PolarHBondContact O-N 3.39Å; A379-V386 HydrophobicContact CB-CG2 3.99Å; A379-F391 HydrophobicContact CB-CE1 4.12Å; A379-F391 HydrophobicContact CB-CZ 4.01Å
380	Q	92.7	Very high	94	Very high	159 Å²	159	50.5 Å²	50.5	74%	0.743	26%	0.256	S	S	*	.	H	α-helix	trans	-62	-41.8	175.1	-174.1	-179.6	5.2	0	0	112.2	R376 I377 R378 E382 G383	R376-Q380 WeakPolarHBondContact O-CB 3.36Å; R376-Q380 PolarHBondContact O-N 3.08Å; I377-Q380 PolarHBondContact O-N 2.92Å; R378-Q380 VanDerWaalsContact C-N 3.33Å; R378-Q380 PolarHBondContact O-N 3.42Å; Q380-E382 VanDerWaalsContact C-N 3.3Å; Q380-E382 PolarHBondContact O-N 2.79Å; Q380-G383 PolarHBondContact O-N 3.31Å; Q380-G383 VanDerWaalsContact O-N 3.16Å
381	T	89.4	Confident	94.1	Very high	48 Å²	48	48.8 Å²	48.8	29%	0.294	25%	0.247	S	C	.	.	H	α-helix	trans	-63.5	-38.1	177.8	-55.4	0	0	0	0	111.5	I15 H20 I377 R378 A379 G383	I15-T381 VanDerWaalsContact CD1-O 3.29Å; I15-T381 WeakPolarHBondContact CD1-O 3.22Å; I15-T381 HydrophobicContact CG2-CG2 3.9Å; H20-T381 HydrophobicContact CB-CG2 4.45Å; I377-T381 WeakPolarHBondContact O-CB 3.42Å; I377-T381 PolarHBondContact O-N 2.8Å; I377-T381 PolarHBondContact O-OG1 3.04Å; R378-T381 WeakPolarHBondContact O-CB 3.28Å; R378-T381 PolarHBondContact O-N 2.87Å; A379-T381 PolarHBondContact O-N 3.14Å; T381-G383 VanDerWaalsContact C-N 3.32Å
382	E	89.5	Confident	94.2	Very high	44 Å²	44	52 Å²	52	21%	0.206	27%	0.267	C	S	.	.	H	α-helix	trans	-82.5	-6	176.5	-68.4	-174	-164.3	0	0	113.9	I15 R378 A379 Q380 I384 T411	I15-E382 HydrophobicContact CD1-CG 4.29Å; I15-E382 HydrophobicContact CG2-CG 4.17Å; R378-E382 IonicContact CZ-OE1 3.89Å; R378-E382 IonicContact NE-OE1 3.73Å; R378-E382 PolarHBondContact NE-OE1 3.25Å; R378-E382 IonicContact NH2-OE1 2.72Å; R378-E382 PolarHBondContact NH2-OE1 2.97Å; R378-E382 PolarHBondContact O-N 2.82Å; A379-E382 CarbonylContact O-C 3.56Å; A379-E382 PolarHBondContact O-N 3.48Å; Q380-E382 VanDerWaalsContact C-N 3.3Å; Q380-E382 PolarHBondContact O-N 2.79Å; E382-I384 VanDerWaalsContact C-N 3.31Å; E382-I384 HydrophobicContact CB-CD1 3.77Å; E382-I384 HydrophobicContact CB-CG1 3.85Å; E382-I384 VanDerWaalsContact OE2-CD1 3.25Å; E382-I384 WeakPolarHBondContact OE2-CD1 3.46Å; E382-T411 PolarHBondContact OE2-OG1 3.32Å; E382-T411 VanDerWaalsContact OE2-OG1 3.13Å
383	G	91.3	Very high	94.1	Very high	66 Å²	66	52.2 Å²	52.2	68%	0.68	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	26	-176.3	0	0	0	0	0	113.9	A379 Q380 T381	A379-G383 PolarHBondContact O-N 3.3Å; Q380-G383 PolarHBondContact O-N 3.31Å; Q380-G383 VanDerWaalsContact O-N 3.16Å; T381-G383 VanDerWaalsContact C-N 3.32Å
384	I	93.8	Very high	94.2	Very high	18 Å²	18	49.3 Å²	49.3	9%	0.092	26%	0.257	C	S	.	.			trans	-95.3	125.8	-178.6	-56.6	174.5	0	0	0	109.4	A379 E382 V386 L410 C414 V425	A379-I384 HydrophobicContact CB-CB 4.47Å; A379-I384 PolarHBondContact O-N 3.39Å; E382-I384 VanDerWaalsContact C-N 3.31Å; E382-I384 HydrophobicContact CB-CD1 3.77Å; E382-I384 HydrophobicContact CB-CG1 3.85Å; E382-I384 VanDerWaalsContact OE2-CD1 3.25Å; E382-I384 WeakPolarHBondContact OE2-CD1 3.46Å; I384-V386 HydrophobicContact CG2-CG2 3.73Å; I384-L410 HydrophobicContact CD1-CB 4.06Å; I384-C414 HydrophobicContact CD1-CB 4.11Å; I384-C414 HydrophobicContact CG1-CB 4.21Å; I384-C414 HydrophobicContact CG2-CB 3.73Å; I384-V425 HydrophobicContact CG2-CG2 4.01Å
385	K	95.4	Very high	94.2	Very high	136 Å²	136	48.1 Å²	48.1	59%	0.591	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	128	171.2	-62.2	177.6	-177.8	174.1	0	109.2	E424 V425	K385-E424 HydrophobicContact CB-CB 4.4Å; K385-E424 HydrophobicContact CB-CG 4.43Å; K385-V425 PolarHBondContact O-N 3.43Å
386	V	96.1	Very high	94.2	Very high	14 Å²	14	51.6 Å²	51.6	9%	0.085	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	132.4	-176.1	-176.7	0	0	0	0	108.1	A379 I384 A390 F391 L410 V425	A379-V386 HydrophobicContact CB-CG2 3.99Å; I384-V386 HydrophobicContact CG2-CG2 3.73Å; V386-A390 HydrophobicContact CG1-CB 3.53Å; V386-F391 HydrophobicContact CB-CD2 4.28Å; V386-F391 HydrophobicContact CB-CE1 3.95Å; V386-F391 HydrophobicContact CB-CE2 3.72Å; V386-F391 HydrophobicContact CB-CZ 3.53Å; V386-F391 HydrophobicContact CG1-CD1 4.05Å; V386-F391 HydrophobicContact CG1-CD2 4.1Å; V386-F391 HydrophobicContact CG1-CE1 3.98Å; V386-F391 HydrophobicContact CG1-CE2 4.03Å; V386-F391 HydrophobicContact CG1-CG 4.1Å; V386-F391 HydrophobicContact CG1-CZ 3.98Å; V386-F391 HydrophobicContact CG2-CE1 4.33Å; V386-F391 HydrophobicContact CG2-CZ 4.13Å; V386-F391 VanDerWaalsContact O-CE2 3.3Å; V386-F391 WeakPolarHBondContact O-CE2 3.33Å; V386-L410 HydrophobicContact CG2-CD2 3.97Å; V386-V425 HydrophobicContact CB-CB 4.43Å; V386-V425 HydrophobicContact CG1-CB 4.29Å; V386-V425 HydrophobicContact CG2-CB 4.21Å; V386-V425 HydrophobicContact CG2-CG2 4.41Å
387	S	96.1	Very high	94.1	Very high	17 Å²	17	47.2 Å²	47.2	12%	0.119	26%	0.256	C	S	.	.			trans	-69.4	154.4	178	62.4	0	0	0	0	112.3	Q389 A390 F391 E424 V425	S387-Q389 PolarHBondContact O-N 3.21Å; S387-A390 WeakPolarHBondContact O-CA 3.46Å; S387-A390 WeakPolarHBondContact O-CB 3.41Å; S387-A390 PolarHBondContact O-N 3.21Å; S387-A390 WeakPolarHBondContact OG-CB 3.47Å; S387-A390 PolarHBondContact OG-N 2.91Å; S387-F391 WeakPolarHBondContact O-CD2 3.16Å; S387-F391 PolarHBondContact O-N 2.99Å; S387-E424 WeakPolarHBondContact CA-OE1 3.42Å; S387-E424 WeakPolarHBondContact CB-OE1 3.15Å; S387-E424 PolarHBondContact N-OE1 2.73Å; S387-V425 WeakPolarHBondContact CB-O 3.38Å; S387-V425 PolarHBondContact N-O 2.94Å; S387-V425 PolarHBondContact OG-O 3.15Å
388	E	95.2	Very high	94.1	Very high	108 Å²	108	46.6 Å²	46.6	51%	0.505	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-34.3	179.2	-74.2	-62.6	132.8	0	0	113.1	R376 F391 T392	R376-E388 IonicContact CZ-OE1 3.82Å; R376-E388 IonicContact CZ-OE2 3.67Å; R376-E388 IonicContact NE-OE1 3.4Å; R376-E388 PolarHBondContact NE-OE1 2.98Å; R376-E388 IonicContact NE-OE2 3.93Å; R376-E388 IonicContact NH2-OE1 3.46Å; R376-E388 PolarHBondContact NH2-OE1 2.88Å; R376-E388 IonicContact NH2-OE2 2.65Å; R376-E388 PolarHBondContact NH2-OE2 2.78Å; E388-F391 PolarHBondContact O-N 3.48Å; E388-T392 PolarHBondContact O-N 2.8Å; E388-T392 VanDerWaalsContact O-N 3.17Å; E388-T392 PolarHBondContact O-OG1 3.16Å
389	Q	95.6	Very high	93.9	Very high	145 Å²	145	50.1 Å²	50.1	68%	0.678	28%	0.277	S	S	*	.	H	α-helix	trans	-68.8	-38.7	174	-62.8	-179.6	9.4	0	0	111.5	S387 T392 C393 P427	S387-Q389 PolarHBondContact O-N 3.21Å; Q389-T392 PolarHBondContact O-N 2.7Å; Q389-C393 WeakPolarHBondContact O-CB 3.48Å; Q389-C393 PolarHBondContact O-N 2.99Å; Q389-P427 HydrophobicContact CB-CG 3.67Å
390	A	96.1	Very high	93.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-39.1	176	0	0	0	0	0	111.9	V386 S387 T392 C393 L394 V425 P427 I430	V386-A390 HydrophobicContact CG1-CB 3.53Å; S387-A390 WeakPolarHBondContact O-CA 3.46Å; S387-A390 WeakPolarHBondContact O-CB 3.41Å; S387-A390 PolarHBondContact O-N 3.21Å; S387-A390 WeakPolarHBondContact OG-CB 3.47Å; S387-A390 PolarHBondContact OG-N 2.91Å; A390-T392 VanDerWaalsContact C-N 3.35Å; A390-T392 PolarHBondContact O-N 2.82Å; A390-C393 WeakPolarHBondContact O-CB 3.16Å; A390-C393 PolarHBondContact O-N 2.83Å; A390-L394 WeakPolarHBondContact O-CG 3.16Å; A390-L394 PolarHBondContact O-N 3.12Å; A390-V425 HydrophobicContact CB-CG1 4.46Å; A390-V425 WeakPolarHBondContact CB-O 3.49Å; A390-P427 HydrophobicContact CB-CG 4.5Å; A390-I430 HydrophobicContact CB-CD1 3.49Å; A390-I430 VanDerWaalsContact CB-CD1 3.49Å; A390-I430 VanDerWaalsContact O-CD1 3.32Å; A390-I430 WeakPolarHBondContact O-CD1 3.4Å
391	F	96.8	Very high	93.5	Very high	12 Å²	12	47.7 Å²	47.7	5%	0.053	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-43.5	172.4	-78.9	-57.3	0	0	0	112.6	I372 L375 R376 A379 V386 S387 E388 C393 L394 A395	I372-F391 HydrophobicContact CG2-CB 4.2Å; L375-F391 HydrophobicContact CB-CD1 3.85Å; L375-F391 HydrophobicContact CB-CE1 4Å; R376-F391 HydrophobicContact CB-CE1 4.35Å; R376-F391 HydrophobicContact CB-CZ 4.17Å; R376-F391 HydrophobicContact CG-CD1 4.13Å; R376-F391 HydrophobicContact CG-CD2 3.99Å; R376-F391 HydrophobicContact CG-CE1 3.81Å; R376-F391 HydrophobicContact CG-CE2 3.64Å; R376-F391 HydrophobicContact CG-CG 4.22Å; R376-F391 HydrophobicContact CG-CZ 3.54Å; A379-F391 HydrophobicContact CB-CE1 4.12Å; A379-F391 HydrophobicContact CB-CZ 4.01Å; V386-F391 HydrophobicContact CB-CD2 4.28Å; V386-F391 HydrophobicContact CB-CE1 3.95Å; V386-F391 HydrophobicContact CB-CE2 3.72Å; V386-F391 HydrophobicContact CB-CZ 3.53Å; V386-F391 HydrophobicContact CG1-CD1 4.05Å; V386-F391 HydrophobicContact CG1-CD2 4.1Å; V386-F391 HydrophobicContact CG1-CE1 3.98Å; V386-F391 HydrophobicContact CG1-CE2 4.03Å; V386-F391 HydrophobicContact CG1-CG 4.1Å; V386-F391 HydrophobicContact CG1-CZ 3.98Å; V386-F391 HydrophobicContact CG2-CE1 4.33Å; V386-F391 HydrophobicContact CG2-CZ 4.13Å; V386-F391 VanDerWaalsContact O-CE2 3.3Å; V386-F391 WeakPolarHBondContact O-CE2 3.33Å; S387-F391 WeakPolarHBondContact O-CD2 3.16Å; S387-F391 PolarHBondContact O-N 2.99Å; E388-F391 PolarHBondContact O-N 3.48Å; F391-C393 VanDerWaalsContact C-N 3.34Å; F391-C393 PolarHBondContact O-N 3.34Å; F391-L394 PolarHBondContact O-N 3.34Å; F391-A395 WeakPolarHBondContact O-CB 3.37Å; F391-A395 PolarHBondContact O-N 3.32Å
392	T	95.8	Very high	93.5	Very high	70 Å²	70	47.8 Å²	47.8	43%	0.429	27%	0.271	S	S	.	.	H	α-helix	trans	-62	-44.3	177.3	-55.2	0	0	0	0	110.6	E388 Q389 A390 A395 T396	E388-T392 PolarHBondContact O-N 2.8Å; E388-T392 VanDerWaalsContact O-N 3.17Å; E388-T392 PolarHBondContact O-OG1 3.16Å; Q389-T392 PolarHBondContact O-N 2.7Å; A390-T392 VanDerWaalsContact C-N 3.35Å; A390-T392 PolarHBondContact O-N 2.82Å; T392-A395 PolarHBondContact O-N 3.18Å; T392-T396 PolarHBondContact O-N 3.2Å; T392-T396 PolarHBondContact O-OG1 3.17Å
393	C	95	Very high	93.6	Very high	29 Å²	29	46.8 Å²	46.8	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-58.4	-49.7	174.9	-177.9	0	0	0	0	111.9	Q389 A390 F391 A395 T396 V397 I430	Q389-C393 WeakPolarHBondContact O-CB 3.48Å; Q389-C393 PolarHBondContact O-N 2.99Å; A390-C393 WeakPolarHBondContact O-CB 3.16Å; A390-C393 PolarHBondContact O-N 2.83Å; F391-C393 VanDerWaalsContact C-N 3.34Å; F391-C393 PolarHBondContact O-N 3.34Å; C393-A395 VanDerWaalsContact C-N 3.28Å; C393-A395 PolarHBondContact O-N 3.19Å; C393-T396 WeakPolarHBondContact O-CB 3.37Å; C393-T396 PolarHBondContact O-N 2.98Å; C393-V397 WeakPolarHBondContact O-CG2 3.45Å; C393-V397 PolarHBondContact O-N 3Å; C393-I430 HydrophobicContact CB-CD1 4.29Å
394	L	95.9	Very high	93.6	Very high	1 Å²	1	51 Å²	51	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-35.1	176.9	-73.2	167.6	0	0	0	112.7	L375 A390 F391 V397 S398 L409 L410 I430	L375-L394 HydrophobicContact CD1-CB 3.53Å; A390-L394 WeakPolarHBondContact O-CG 3.16Å; A390-L394 PolarHBondContact O-N 3.12Å; F391-L394 PolarHBondContact O-N 3.34Å; L394-V397 WeakPolarHBondContact O-CB 3.3Å; L394-V397 PolarHBondContact O-N 2.67Å; L394-S398 PolarHBondContact O-N 3.06Å; L394-L409 HydrophobicContact CD2-CB 3.99Å; L394-L409 HydrophobicContact CD2-CD1 4.14Å; L394-L410 HydrophobicContact CD1-CD2 3.58Å; L394-L410 HydrophobicContact CD1-CG 4.41Å; L394-I430 HydrophobicContact CD1-CD1 4.03Å; L394-I430 HydrophobicContact CD2-CD1 4.11Å; L394-I430 HydrophobicContact CD2-CG1 4.09Å; L394-I430 HydrophobicContact CD2-CG2 3.84Å; L394-I430 HydrophobicContact CG-CD1 3.63Å; L394-I430 HydrophobicContact CG-CG1 4.16Å; L394-I430 HydrophobicContact CG-CG2 4.39Å
395	A	94.9	Very high	93.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-38.7	176.7	0	0	0	0	0	112.4	V371 I372 F391 T392 C393 S398 T399	V371-A395 HydrophobicContact CB-CB 4.38Å; V371-A395 HydrophobicContact CG1-CB 3.87Å; I372-A395 HydrophobicContact CD1-CB 4.21Å; I372-A395 HydrophobicContact CG1-CB 3.53Å; F391-A395 WeakPolarHBondContact O-CB 3.37Å; F391-A395 PolarHBondContact O-N 3.32Å; T392-A395 PolarHBondContact O-N 3.18Å; C393-A395 VanDerWaalsContact C-N 3.28Å; C393-A395 PolarHBondContact O-N 3.19Å; A395-S398 WeakPolarHBondContact O-CB 3.48Å; A395-S398 PolarHBondContact O-N 2.68Å; A395-T399 PolarHBondContact O-N 3.39Å; A395-T399 VanDerWaalsContact O-N 3.1Å; A395-T399 PolarHBondContact O-OG1 3.42Å
396	T	94	Very high	93.5	Very high	74 Å²	74	44.6 Å²	44.6	45%	0.454	23%	0.233	S	C	.	.	H	α-helix	trans	-60.2	-46.9	169.2	-51.6	0	0	0	0	110.7	T392 C393 S398 T399 D400	T392-T396 PolarHBondContact O-N 3.2Å; T392-T396 PolarHBondContact O-OG1 3.17Å; C393-T396 WeakPolarHBondContact O-CB 3.37Å; C393-T396 PolarHBondContact O-N 2.98Å; T396-S398 VanDerWaalsContact C-N 3.31Å; T396-S398 PolarHBondContact O-N 2.96Å; T396-T399 WeakPolarHBondContact O-CB 3.23Å; T396-T399 PolarHBondContact O-N 3.08Å; T396-T399 VanDerWaalsContact O-N 3.11Å; T396-D400 PolarHBondContact O-N 3.19Å; T396-D400 VanDerWaalsContact O-N 3.12Å
397	V	93.1	Very high	93.4	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-58.1	-42.7	177	175	0	0	0	0	111.8	C393 L394 T399 D400 T401 Y405 L409	C393-V397 WeakPolarHBondContact O-CG2 3.45Å; C393-V397 PolarHBondContact O-N 3Å; L394-V397 WeakPolarHBondContact O-CB 3.3Å; L394-V397 PolarHBondContact O-N 2.67Å; V397-T399 VanDerWaalsContact C-N 3.32Å; V397-T399 PolarHBondContact O-N 2.72Å; V397-D400 PolarHBondContact O-N 3.15Å; V397-T401 WeakPolarHBondContact O-CB 3.32Å; V397-T401 PolarHBondContact O-N 3.11Å; V397-T401 PolarHBondContact O-OG1 3.45Å; V397-Y405 HydrophobicContact CG1-CD1 3.81Å; V397-Y405 HydrophobicContact CG1-CE1 3.73Å; V397-L409 HydrophobicContact CG1-CD1 3.95Å
398	S	92.3	Very high	93.2	Very high	12 Å²	12	50.3 Å²	50.3	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-40.8	177.4	177.3	0	0	0	0	112.1	L394 A395 T396 T401 T402 L403	L394-S398 PolarHBondContact O-N 3.06Å; A395-S398 WeakPolarHBondContact O-CB 3.48Å; A395-S398 PolarHBondContact O-N 2.68Å; T396-S398 VanDerWaalsContact C-N 3.31Å; T396-S398 PolarHBondContact O-N 2.96Å; S398-T401 CarbonylContact O-C 3.37Å; S398-T401 PolarHBondContact O-N 3.38Å; S398-T402 PolarHBondContact O-N 3.02Å; S398-L403 VanDerWaalsContact OG-CA 3.31Å; S398-L403 WeakPolarHBondContact OG-CA 3.41Å; S398-L403 PolarHBondContact OG-N 2.88Å
399	T	89.3	Confident	93.2	Very high	96 Å²	96	45.3 Å²	45.3	59%	0.589	24%	0.236	S	C	*	.	H	α-helix	trans	-62.9	-43.3	177.8	-54.6	0	0	0	0	111.5	A395 T396 V397 T401	A395-T399 PolarHBondContact O-N 3.39Å; A395-T399 VanDerWaalsContact O-N 3.1Å; A395-T399 PolarHBondContact O-OG1 3.42Å; T396-T399 WeakPolarHBondContact O-CB 3.23Å; T396-T399 PolarHBondContact O-N 3.08Å; T396-T399 VanDerWaalsContact O-N 3.11Å; V397-T399 VanDerWaalsContact C-N 3.32Å; V397-T399 PolarHBondContact O-N 2.72Å; T399-T401 VanDerWaalsContact C-N 3.34Å
400	D	87.7	Confident	93.2	Very high	90 Å²	90	38.5 Å²	38.5	48%	0.481	20%	0.204	S	C	.	.	H	α-helix	trans	-72.3	-29.3	179.2	-66.3	-23.8	0	0	0	112.8	T396 V397 K441	T396-D400 PolarHBondContact O-N 3.19Å; T396-D400 VanDerWaalsContact O-N 3.12Å; V397-D400 PolarHBondContact O-N 3.15Å; D400-K441 PolarHBondContact O-NZ 3.32Å
401	T	89.6	Confident	93	Very high	20 Å²	20	41.6 Å²	41.6	12%	0.123	22%	0.223	C	C	.	.	S	Bend	trans	-119.6	-105.2	-171	65.9	0	0	0	0	111.8	V397 S398 T399 Y405 N439	V397-T401 WeakPolarHBondContact O-CB 3.32Å; V397-T401 PolarHBondContact O-N 3.11Å; V397-T401 PolarHBondContact O-OG1 3.45Å; S398-T401 CarbonylContact O-C 3.37Å; S398-T401 PolarHBondContact O-N 3.38Å; T399-T401 VanDerWaalsContact C-N 3.34Å; T401-Y405 HydrophobicContact CG2-CD1 4.19Å; T401-Y405 HydrophobicContact CG2-CE1 4.42Å; T401-Y405 VanDerWaalsContact OG1-CD1 3.3Å; T401-Y405 WeakPolarHBondContact OG1-CD1 3.47Å; T401-N439 HydrophobicContact CG2-CB 4.02Å; T401-N439 WeakPolarHBondContact CG2-ND2 3.5Å
402	T	90.5	Very high	93	Very high	51 Å²	51	42.9 Å²	42.9	31%	0.313	23%	0.233	S	C	.	.			trans	-150.7	153	173.8	64.9	0	0	0	0	109.1	S398 R404 Y405 A406	S398-T402 PolarHBondContact O-N 3.02Å; T402-R404 PolarHBondContact O-N 2.98Å; T402-Y405 PolarHBondContact O-N 3.32Å; T402-Y405 VanDerWaalsContact O-N 3.13Å; T402-Y405 PolarHBondContact OG1-N 2.97Å; T402-A406 PolarHBondContact O-N 3.27Å; T402-A406 VanDerWaalsContact O-N 3.16Å
403	L	92.1	Very high	93	Very high	23 Å²	23	39.6 Å²	39.6	12%	0.12	21%	0.212	C	C	.	.	H	α-helix	trans	-57.4	-35.7	172.4	180	61.7	0	0	0	112.6	Y366 V371 I374 S398 Y405 A406 V407	Y366-L403 HydrophobicContact CD2-CD2 3.94Å; Y366-L403 HydrophobicContact CE2-CD2 3.92Å; V371-L403 HydrophobicContact CG1-CD1 4.01Å; I374-L403 HydrophobicContact CD1-CD2 4Å; I374-L403 HydrophobicContact CG2-CD1 4.33Å; I374-L403 HydrophobicContact CG2-CD2 4.12Å; S398-L403 VanDerWaalsContact OG-CA 3.31Å; S398-L403 WeakPolarHBondContact OG-CA 3.41Å; S398-L403 PolarHBondContact OG-N 2.88Å; L403-Y405 VanDerWaalsContact C-N 3.3Å; L403-Y405 PolarHBondContact O-N 3.02Å; L403-A406 PolarHBondContact O-N 2.77Å; L403-V407 HydrophobicContact CD1-CG2 4.23Å; L403-V407 HydrophobicContact CG-CG2 4.42Å; L403-V407 WeakPolarHBondContact O-CG2 3.4Å; L403-V407 PolarHBondContact O-N 3.17Å
404	R	91	Very high	93	Very high	155 Å²	155	39 Å²	39	59%	0.585	21%	0.208	S	C	*	.	H	α-helix	trans	-58.3	-44.2	177.3	-177.9	-179	-68.3	171.9	-3.4	111.4	T402 Q408	T402-R404 PolarHBondContact O-N 2.98Å; R404-Q408 WeakPolarHBondContact O-CG 3.47Å; R404-Q408 PolarHBondContact O-N 2.91Å
405	Y	93.2	Very high	93	Very high	18 Å²	18	46.2 Å²	46.2	7%	0.071	24%	0.236	C	C	.	.	H	α-helix	trans	-67.4	-46.6	178.1	177.9	-104.5	0	0	0	111.3	V397 T401 T402 L403 V407 Q408 L409 F437 N439	V397-Y405 HydrophobicContact CG1-CD1 3.81Å; V397-Y405 HydrophobicContact CG1-CE1 3.73Å; T401-Y405 HydrophobicContact CG2-CD1 4.19Å; T401-Y405 HydrophobicContact CG2-CE1 4.42Å; T401-Y405 VanDerWaalsContact OG1-CD1 3.3Å; T401-Y405 WeakPolarHBondContact OG1-CD1 3.47Å; T402-Y405 PolarHBondContact O-N 3.32Å; T402-Y405 VanDerWaalsContact O-N 3.13Å; T402-Y405 PolarHBondContact OG1-N 2.97Å; L403-Y405 VanDerWaalsContact C-N 3.3Å; L403-Y405 PolarHBondContact O-N 3.02Å; Y405-V407 VanDerWaalsContact C-N 3.32Å; Y405-V407 PolarHBondContact O-N 3.31Å; Y405-Q408 WeakPolarHBondContact O-CB 3.33Å; Y405-Q408 PolarHBondContact O-N 3.34Å; Y405-Q408 VanDerWaalsContact O-N 3.07Å; Y405-L409 HydrophobicContact CD1-CD1 4.22Å; Y405-L409 HydrophobicContact CE1-CD1 3.75Å; Y405-L409 HydrophobicContact CE1-CD2 4.35Å; Y405-L409 HydrophobicContact CE1-CG 4.27Å; Y405-L409 HydrophobicContact CE2-CD2 4.29Å; Y405-L409 WeakPolarHBondContact O-CG 3.28Å; Y405-L409 PolarHBondContact O-N 2.91Å; Y405-F437 PolarHBondContact OH-O 3.19Å; Y405-N439 HydrophobicContact CD1-CB 4.04Å; Y405-N439 HydrophobicContact CD2-CB 3.84Å; Y405-N439 HydrophobicContact CE1-CB 3.87Å; Y405-N439 HydrophobicContact CE2-CB 3.66Å; Y405-N439 HydrophobicContact CG-CB 4.01Å
406	A	93.8	Very high	93	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.3	-41.4	177.6	0	0	0	0	0	112.9	L375 T402 L403 Q408 L409	L375-A406 HydrophobicContact CD2-CB 4.4Å; T402-A406 PolarHBondContact O-N 3.27Å; T402-A406 VanDerWaalsContact O-N 3.16Å; L403-A406 PolarHBondContact O-N 2.77Å; A406-Q408 VanDerWaalsContact C-N 3.35Å; A406-Q408 PolarHBondContact O-N 3.32Å; A406-L409 PolarHBondContact O-N 3.48Å
407	V	93.1	Very high	93	Very high	31 Å²	31	43.9 Å²	43.9	19%	0.188	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-40.3	175	167.1	0	0	0	0	111.9	L375 R378 L403 Y405 L409 L410	L375-V407 HydrophobicContact CD2-CG2 3.85Å; R378-V407 HydrophobicContact CG-CG1 3.85Å; L403-V407 HydrophobicContact CD1-CG2 4.23Å; L403-V407 HydrophobicContact CG-CG2 4.42Å; L403-V407 WeakPolarHBondContact O-CG2 3.4Å; L403-V407 PolarHBondContact O-N 3.17Å; Y405-V407 VanDerWaalsContact C-N 3.32Å; Y405-V407 PolarHBondContact O-N 3.31Å; V407-L409 PolarHBondContact O-N 3.11Å; V407-L410 WeakPolarHBondContact O-CB 3.47Å; V407-L410 PolarHBondContact O-N 3.29Å
408	Q	92.9	Very high	93.1	Very high	121 Å²	121	47.9 Å²	47.9	57%	0.565	24%	0.239	S	C	*	.	H	α-helix	trans	-65.4	-23.9	179.1	-75.5	173.4	-24.3	0	0	113.2	R404 Y405 A406 L410 P412	R404-Q408 WeakPolarHBondContact O-CG 3.47Å; R404-Q408 PolarHBondContact O-N 2.91Å; Y405-Q408 WeakPolarHBondContact O-CB 3.33Å; Y405-Q408 PolarHBondContact O-N 3.34Å; Y405-Q408 VanDerWaalsContact O-N 3.07Å; A406-Q408 VanDerWaalsContact C-N 3.35Å; A406-Q408 PolarHBondContact O-N 3.32Å; Q408-L410 VanDerWaalsContact C-N 3.31Å; Q408-L410 PolarHBondContact O-N 2.91Å; Q408-P412 WeakPolarHBondContact O-CD 3.4Å
409	L	95.1	Very high	93.2	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-73.3	-20.4	177.6	-62.4	176.7	0	0	0	113.2	L394 V397 Y405 A406 V407 T411 P412 A413 I430 V433 R434	L394-L409 HydrophobicContact CD2-CB 3.99Å; L394-L409 HydrophobicContact CD2-CD1 4.14Å; V397-L409 HydrophobicContact CG1-CD1 3.95Å; Y405-L409 HydrophobicContact CD1-CD1 4.22Å; Y405-L409 HydrophobicContact CE1-CD1 3.75Å; Y405-L409 HydrophobicContact CE1-CD2 4.35Å; Y405-L409 HydrophobicContact CE1-CG 4.27Å; Y405-L409 HydrophobicContact CE2-CD2 4.29Å; Y405-L409 WeakPolarHBondContact O-CG 3.28Å; Y405-L409 PolarHBondContact O-N 2.91Å; A406-L409 PolarHBondContact O-N 3.48Å; V407-L409 PolarHBondContact O-N 3.11Å; L409-T411 PolarHBondContact O-N 3.48Å; L409-P412 WeakPolarHBondContact O-CD 3.48Å; L409-A413 WeakPolarHBondContact O-CB 3.49Å; L409-A413 PolarHBondContact O-N 3.3Å; L409-I430 HydrophobicContact CD1-CG2 4.48Å; L409-V433 HydrophobicContact CD2-CG1 3.58Å; L409-R434 HydrophobicContact CD1-CG 3.9Å
410	L	94.5	Very high	93.3	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-48.8	-177.9	-72.3	169.9	0	0	0	112.3	L375 R378 I384 V386 L394 V407 Q408 A413 C414	L375-L410 HydrophobicContact CD2-CD1 4.28Å; R378-L410 HydrophobicContact CB-CD1 4.24Å; R378-L410 HydrophobicContact CG-CD1 3.93Å; I384-L410 HydrophobicContact CD1-CB 4.06Å; V386-L410 HydrophobicContact CG2-CD2 3.97Å; L394-L410 HydrophobicContact CD1-CD2 3.58Å; L394-L410 HydrophobicContact CD1-CG 4.41Å; V407-L410 WeakPolarHBondContact O-CB 3.47Å; V407-L410 PolarHBondContact O-N 3.29Å; Q408-L410 VanDerWaalsContact C-N 3.31Å; Q408-L410 PolarHBondContact O-N 2.91Å; L410-A413 PolarHBondContact O-N 2.9Å; L410-C414 VanDerWaalsContact O-CB 3.31Å; L410-C414 WeakPolarHBondContact O-CB 3.14Å; L410-C414 PolarHBondContact O-N 3.48Å
411	T	93.3	Very high	93.5	Very high	66 Å²	66	52.6 Å²	52.6	41%	0.405	28%	0.282	S	S	.	.	H	α-helix	trans	-67.5	-48.3	-175.9	-41.6	0	0	0	0	112.2	E382 L409 C414 R415	E382-T411 PolarHBondContact OE2-OG1 3.32Å; E382-T411 VanDerWaalsContact OE2-OG1 3.13Å; L409-T411 PolarHBondContact O-N 3.48Å; T411-C414 WeakPolarHBondContact O-CB 3.41Å; T411-C414 PolarHBondContact O-N 3.26Å; T411-R415 WeakPolarHBondContact O-CG 3.5Å; T411-R415 PolarHBondContact O-N 2.89Å; T411-R415 VanDerWaalsContact O-N 3.14Å
412	P	95.5	Very high	93.7	Very high	39 Å²	39	54.8 Å²	54.8	25%	0.253	29%	0.287	S	S	.	.	H	α-helix	trans	-62.3	-40	174.1	-23.3	35	0	0	0	113.3	Q408 L409 C414 R415 L416 V433 F437	Q408-P412 WeakPolarHBondContact O-CD 3.4Å; L409-P412 WeakPolarHBondContact O-CD 3.48Å; P412-C414 VanDerWaalsContact C-N 3.33Å; P412-C414 PolarHBondContact O-N 2.88Å; P412-R415 PolarHBondContact O-N 3.49Å; P412-R415 VanDerWaalsContact O-N 3.13Å; P412-L416 PolarHBondContact O-N 3.09Å; P412-V433 HydrophobicContact CB-CG1 3.69Å; P412-V433 HydrophobicContact CB-CG2 4.08Å; P412-V433 HydrophobicContact CG-CG1 4.37Å; P412-F437 HydrophobicContact CB-CE2 4.12Å; P412-F437 HydrophobicContact CG-CE2 4.44Å
413	A	96.3	Very high	93.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-38.7	178.6	0	0	0	0	0	111.8	L409 L410 R415 L416 A417 V425 D429 I430 V433	L409-A413 WeakPolarHBondContact O-CB 3.49Å; L409-A413 PolarHBondContact O-N 3.3Å; L410-A413 PolarHBondContact O-N 2.9Å; A413-R415 VanDerWaalsContact C-N 3.34Å; A413-R415 PolarHBondContact O-N 3.43Å; A413-L416 PolarHBondContact O-N 2.62Å; A413-A417 WeakPolarHBondContact O-CB 3.31Å; A413-A417 PolarHBondContact O-N 3.34Å; A413-V425 HydrophobicContact CB-CG1 3.68Å; A413-V425 HydrophobicContact CB-CG2 4.38Å; A413-D429 HydrophobicContact CB-CB 4.36Å; A413-I430 HydrophobicContact CB-CG1 4.34Å; A413-V433 HydrophobicContact CB-CG2 4.21Å
414	C	95	Very high	93.9	Very high	17 Å²	17	61.6 Å²	61.6	12%	0.115	32%	0.319	C	S	.	.	H	α-helix	trans	-59.9	-42.4	171.6	-178.7	0	0	0	0	112.2	I384 L410 T411 P412 A417 Q418 V425	I384-C414 HydrophobicContact CD1-CB 4.11Å; I384-C414 HydrophobicContact CG1-CB 4.21Å; I384-C414 HydrophobicContact CG2-CB 3.73Å; L410-C414 VanDerWaalsContact O-CB 3.31Å; L410-C414 WeakPolarHBondContact O-CB 3.14Å; L410-C414 PolarHBondContact O-N 3.48Å; T411-C414 WeakPolarHBondContact O-CB 3.41Å; T411-C414 PolarHBondContact O-N 3.26Å; P412-C414 VanDerWaalsContact C-N 3.33Å; P412-C414 PolarHBondContact O-N 2.88Å; C414-A417 PolarHBondContact O-N 3.37Å; C414-Q418 VanDerWaalsContact O-CG 3.28Å; C414-Q418 WeakPolarHBondContact O-CG 3.38Å; C414-Q418 PolarHBondContact O-N 3.33Å; C414-V425 HydrophobicContact CB-CG2 4.16Å
415	R	95.1	Very high	94.2	Very high	153 Å²	153	54.3 Å²	54.3	58%	0.577	29%	0.292	S	S	*	.	H	α-helix	trans	-66	-39.7	176.4	-66.4	-55.5	-177.6	-166.4	0.4	112.5	T411 P412 A413 Q418 L419	T411-R415 WeakPolarHBondContact O-CG 3.5Å; T411-R415 PolarHBondContact O-N 2.89Å; T411-R415 VanDerWaalsContact O-N 3.14Å; P412-R415 PolarHBondContact O-N 3.49Å; P412-R415 VanDerWaalsContact O-N 3.13Å; A413-R415 VanDerWaalsContact C-N 3.34Å; A413-R415 PolarHBondContact O-N 3.43Å; R415-Q418 PolarHBondContact O-N 3.35Å; R415-L419 VanDerWaalsContact O-CG 3.31Å; R415-L419 WeakPolarHBondContact O-CG 2.89Å; R415-L419 PolarHBondContact O-N 2.98Å
416	L	95	Very high	94.3	Very high	24 Å²	24	57.3 Å²	57.3	13%	0.126	31%	0.307	C	S	.	.	H	α-helix	trans	-65.6	-42.9	177.2	-162.8	95.6	0	0	0	112	P412 A413 Q418 L419 S420 D429 E432 V433	P412-L416 PolarHBondContact O-N 3.09Å; A413-L416 PolarHBondContact O-N 2.62Å; L416-Q418 VanDerWaalsContact C-N 3.34Å; L416-Q418 PolarHBondContact O-N 3.34Å; L416-L419 PolarHBondContact O-N 2.76Å; L416-S420 PolarHBondContact O-N 2.72Å; L416-S420 PolarHBondContact O-OG 3.37Å; L416-S420 VanDerWaalsContact O-OG 3.08Å; L416-D429 HydrophobicContact CD2-CB 3.78Å; L416-E432 HydrophobicContact CD1-CG 4.3Å; L416-E432 HydrophobicContact CD2-CB 3.86Å; L416-E432 HydrophobicContact CD2-CG 4.04Å; L416-V433 HydrophobicContact CB-CG2 4.46Å
417	A	94.9	Very high	94.4	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.008	32%	0.319	C	S	.	.	H	α-helix	trans	-58.4	-46.3	174.6	0	0	0	0	0	111.1	A413 C414 L419 S420 G421 R422 V425	A413-A417 WeakPolarHBondContact O-CB 3.31Å; A413-A417 PolarHBondContact O-N 3.34Å; C414-A417 PolarHBondContact O-N 3.37Å; A417-L419 PolarHBondContact O-N 2.98Å; A417-S420 CarbonylContact O-C 3.53Å; A417-S420 WeakPolarHBondContact O-CA 3.39Å; A417-S420 WeakPolarHBondContact O-CB 3.43Å; A417-S420 PolarHBondContact O-N 2.74Å; A417-G421 PolarHBondContact O-N 3.49Å; A417-R422 CarbonylContact C-O 3.58Å; A417-R422 HydrophobicContact CB-CB 4.39Å; A417-R422 PolarHBondContact O-N 2.82Å; A417-R422 VanDerWaalsContact O-O 3.06Å; A417-V425 HydrophobicContact CB-CG2 4.36Å
418	Q	94.6	Very high	94.5	Very high	85 Å²	85	60.7 Å²	60.7	40%	0.397	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-40.7	176.9	-74.3	172.2	-5.9	0	0	112.8	C414 R415 L416 S420 G421 R422	C414-Q418 VanDerWaalsContact O-CG 3.28Å; C414-Q418 WeakPolarHBondContact O-CG 3.38Å; C414-Q418 PolarHBondContact O-N 3.33Å; R415-Q418 PolarHBondContact O-N 3.35Å; L416-Q418 VanDerWaalsContact C-N 3.34Å; L416-Q418 PolarHBondContact O-N 3.34Å; Q418-S420 PolarHBondContact O-N 3.08Å; Q418-G421 PolarHBondContact O-N 3.19Å; Q418-R422 WeakPolarHBondContact CA-O 3.39Å; Q418-R422 PolarHBondContact N-O 3.46Å
419	L	94	Very high	94.6	Very high	152 Å²	152	55 Å²	55	80%	0.796	30%	0.304	S	S	*	.	H	α-helix	trans	-63.7	-31.3	174.8	-72.3	172	0	0	0	112.1	R415 L416 A417 G421	R415-L419 VanDerWaalsContact O-CG 3.31Å; R415-L419 WeakPolarHBondContact O-CG 2.89Å; R415-L419 PolarHBondContact O-N 2.98Å; L416-L419 PolarHBondContact O-N 2.76Å; A417-L419 PolarHBondContact O-N 2.98Å; L419-G421 PolarHBondContact O-N 2.95Å
420	S	92.2	Very high	94.7	Very high	74 Å²	74	54.9 Å²	54.9	52%	0.517	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.9	174.2	-55.4	0	0	0	0	113.4	L416 A417 Q418	L416-S420 PolarHBondContact O-N 2.72Å; L416-S420 PolarHBondContact O-OG 3.37Å; L416-S420 VanDerWaalsContact O-OG 3.08Å; A417-S420 CarbonylContact O-C 3.53Å; A417-S420 WeakPolarHBondContact O-CA 3.39Å; A417-S420 WeakPolarHBondContact O-CB 3.43Å; A417-S420 PolarHBondContact O-N 2.74Å; Q418-S420 PolarHBondContact O-N 3.08Å
421	G	92.4	Very high	94.6	Very high	71 Å²	71	59.7 Å²	59.7	73%	0.732	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	17.2	-178.5	0	0	0	0	0	114.6	A417 Q418 L419	A417-G421 PolarHBondContact O-N 3.49Å; Q418-G421 PolarHBondContact O-N 3.19Å; L419-G421 PolarHBondContact O-N 2.95Å
422	R	93.6	Very high	94.7	Very high	65 Å²	65	61.3 Å²	61.3	25%	0.245	33%	0.329	C	S	.	.			trans	-107.7	143.5	178.3	-59.6	-173.2	-68.4	-174.5	-2.5	111.1	A417 Q418 E426 S428 D429	A417-R422 CarbonylContact C-O 3.58Å; A417-R422 HydrophobicContact CB-CB 4.39Å; A417-R422 PolarHBondContact O-N 2.82Å; A417-R422 VanDerWaalsContact O-O 3.06Å; Q418-R422 WeakPolarHBondContact CA-O 3.39Å; Q418-R422 PolarHBondContact N-O 3.46Å; R422-E426 IonicContact CZ-OE1 2.75Å; R422-E426 IonicContact CZ-OE2 2.68Å; R422-E426 IonicContact NH1-OE1 3.65Å; R422-E426 PolarHBondContact NH1-OE1 3.26Å; R422-E426 IonicContact NH1-OE2 2.96Å; R422-E426 PolarHBondContact NH1-OE2 3.2Å; R422-S428 PolarHBondContact NH2-OG 2.99Å; R422-S428 VanDerWaalsContact NH2-OG 3.15Å; R422-D429 IonicContact CZ-OD1 3.22Å; R422-D429 IonicContact CZ-OD2 2.79Å; R422-D429 IonicContact NH2-OD1 2.8Å; R422-D429 PolarHBondContact NH2-OD1 2.72Å; R422-D429 IonicContact NH2-OD2 2.89Å; R422-D429 PolarHBondContact NH2-OD2 3.25Å; R422-D429 VanDerWaalsContact NH2-OD2 3.11Å
423	D	92.1	Very high	94.7	Very high	125 Å²	125	59.6 Å²	59.6	67%	0.668	32%	0.318	S	S	*	.	S	Bend	trans	-92.9	-10.9	175.3	-74.4	-24.7	0	0	0	113.3
424	E	95.4	Very high	94.6	Very high	93 Å²	93	61.9 Å²	61.9	44%	0.435	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.7	-175.3	-174.9	173.4	-169.6	0	0	110.4	K385 S387	K385-E424 HydrophobicContact CB-CB 4.4Å; K385-E424 HydrophobicContact CB-CG 4.43Å; S387-E424 WeakPolarHBondContact CA-OE1 3.42Å; S387-E424 WeakPolarHBondContact CB-OE1 3.15Å; S387-E424 PolarHBondContact N-OE1 2.73Å
425	V	96.2	Very high	94.4	Very high	2 Å²	2	65 Å²	65	1%	0.012	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	127	177.6	178.1	0	0	0	0	110.5	I384 K385 V386 S387 A390 A413 C414 A417 D429 I430	I384-V425 HydrophobicContact CG2-CG2 4.01Å; K385-V425 PolarHBondContact O-N 3.43Å; V386-V425 HydrophobicContact CB-CB 4.43Å; V386-V425 HydrophobicContact CG1-CB 4.29Å; V386-V425 HydrophobicContact CG2-CB 4.21Å; V386-V425 HydrophobicContact CG2-CG2 4.41Å; S387-V425 WeakPolarHBondContact CB-O 3.38Å; S387-V425 PolarHBondContact N-O 2.94Å; S387-V425 PolarHBondContact OG-O 3.15Å; A390-V425 HydrophobicContact CB-CG1 4.46Å; A390-V425 WeakPolarHBondContact CB-O 3.49Å; A413-V425 HydrophobicContact CB-CG1 3.68Å; A413-V425 HydrophobicContact CB-CG2 4.38Å; C414-V425 HydrophobicContact CB-CG2 4.16Å; A417-V425 HydrophobicContact CB-CG2 4.36Å; V425-D429 HydrophobicContact CG1-CB 4.27Å; V425-I430 HydrophobicContact CG1-CD1 4.32Å; V425-I430 HydrophobicContact CG1-CG1 4.09Å
426	E	95.9	Very high	94.4	Very high	81 Å²	81	63 Å²	63	38%	0.379	35%	0.348	S	S	.	.			trans	-108.4	164.2	176.5	-80.7	-175.3	-144.3	0	0	112.4	R422 S428 D429 I430	R422-E426 IonicContact CZ-OE1 2.75Å; R422-E426 IonicContact CZ-OE2 2.68Å; R422-E426 IonicContact NH1-OE1 3.65Å; R422-E426 PolarHBondContact NH1-OE1 3.26Å; R422-E426 IonicContact NH1-OE2 2.96Å; R422-E426 PolarHBondContact NH1-OE2 3.2Å; E426-S428 PolarHBondContact O-N 2.77Å; E426-D429 PolarHBondContact N-OD2 3.05Å; E426-D429 WeakPolarHBondContact O-CB 3.32Å; E426-D429 PolarHBondContact O-N 3Å; E426-D429 VanDerWaalsContact O-N 3.08Å; E426-I430 PolarHBondContact O-N 3.07Å
427	P	95.6	Very high	94.4	Very high	39 Å²	39	67.2 Å²	67.2	25%	0.253	37%	0.366	S	S	.	.	H	α-helix	trans	-55.4	-32.7	177.3	-26.1	34.6	0	0	0	114.1	Q389 A390 D429 I430 E431	Q389-P427 HydrophobicContact CB-CG 3.67Å; A390-P427 HydrophobicContact CB-CG 4.5Å; P427-D429 VanDerWaalsContact C-N 3.29Å; P427-D429 PolarHBondContact O-N 3.37Å; P427-I430 PolarHBondContact O-N 2.98Å; P427-E431 PolarHBondContact O-N 3.01Å; P427-E431 VanDerWaalsContact O-N 3.11Å
428	S	95	Very high	94.3	Very high	63 Å²	63	71.1 Å²	71.1	44%	0.441	39%	0.386	S	S	.	.	H	α-helix	trans	-61.3	-39.6	177.7	65.2	0	0	0	0	111.9	R422 E426 I430 E431 E432	R422-S428 PolarHBondContact NH2-OG 2.99Å; R422-S428 VanDerWaalsContact NH2-OG 3.15Å; E426-S428 PolarHBondContact O-N 2.77Å; S428-I430 VanDerWaalsContact C-N 3.34Å; S428-E431 PolarHBondContact O-N 3.22Å; S428-E432 PolarHBondContact O-N 2.81Å
429	D	96	Very high	94.1	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.011	37%	0.37	C	S	.	.	H	α-helix	trans	-67.7	-39.7	-178.6	-54.9	-50	0	0	0	110.7	A413 L416 R422 V425 E426 P427 E432 V433	A413-D429 HydrophobicContact CB-CB 4.36Å; L416-D429 HydrophobicContact CD2-CB 3.78Å; R422-D429 IonicContact CZ-OD1 3.22Å; R422-D429 IonicContact CZ-OD2 2.79Å; R422-D429 IonicContact NH2-OD1 2.8Å; R422-D429 PolarHBondContact NH2-OD1 2.72Å; R422-D429 IonicContact NH2-OD2 2.89Å; R422-D429 PolarHBondContact NH2-OD2 3.25Å; R422-D429 VanDerWaalsContact NH2-OD2 3.11Å; V425-D429 HydrophobicContact CG1-CB 4.27Å; E426-D429 PolarHBondContact N-OD2 3.05Å; E426-D429 WeakPolarHBondContact O-CB 3.32Å; E426-D429 PolarHBondContact O-N 3Å; E426-D429 VanDerWaalsContact O-N 3.08Å; P427-D429 VanDerWaalsContact C-N 3.29Å; P427-D429 PolarHBondContact O-N 3.37Å; D429-E432 PolarHBondContact O-N 3.22Å; D429-V433 WeakPolarHBondContact O-CB 3.29Å; D429-V433 WeakPolarHBondContact O-CG2 3.46Å; D429-V433 PolarHBondContact O-N 3.5Å
430	I	95.2	Very high	94	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-64	-44.6	177.8	-65.1	157	0	0	0	110.3	A390 C393 L394 L409 A413 V425 E426 P427 S428 V433 R434	A390-I430 HydrophobicContact CB-CD1 3.49Å; A390-I430 VanDerWaalsContact CB-CD1 3.49Å; A390-I430 VanDerWaalsContact O-CD1 3.32Å; A390-I430 WeakPolarHBondContact O-CD1 3.4Å; C393-I430 HydrophobicContact CB-CD1 4.29Å; L394-I430 HydrophobicContact CD1-CD1 4.03Å; L394-I430 HydrophobicContact CD2-CD1 4.11Å; L394-I430 HydrophobicContact CD2-CG1 4.09Å; L394-I430 HydrophobicContact CD2-CG2 3.84Å; L394-I430 HydrophobicContact CG-CD1 3.63Å; L394-I430 HydrophobicContact CG-CG1 4.16Å; L394-I430 HydrophobicContact CG-CG2 4.39Å; L409-I430 HydrophobicContact CD1-CG2 4.48Å; A413-I430 HydrophobicContact CB-CG1 4.34Å; V425-I430 HydrophobicContact CG1-CD1 4.32Å; V425-I430 HydrophobicContact CG1-CG1 4.09Å; E426-I430 PolarHBondContact O-N 3.07Å; P427-I430 PolarHBondContact O-N 2.98Å; S428-I430 VanDerWaalsContact C-N 3.34Å; I430-V433 PolarHBondContact O-N 3.29Å; I430-R434 HydrophobicContact CG2-CG 4.44Å; I430-R434 VanDerWaalsContact O-CG 3.23Å; I430-R434 WeakPolarHBondContact O-CG 3.42Å; I430-R434 PolarHBondContact O-N 3.35Å
431	E	94.4	Very high	93.9	Very high	102 Å²	102	67.5 Å²	67.5	48%	0.477	37%	0.37	S	S	.	.	H	α-helix	trans	-67.3	-38.9	-179.3	-164.7	60.3	-162.1	0	0	111.9	P427 S428 R434 S435	P427-E431 PolarHBondContact O-N 3.01Å; P427-E431 VanDerWaalsContact O-N 3.11Å; S428-E431 PolarHBondContact O-N 3.22Å; E431-R434 PolarHBondContact O-N 3.17Å; E431-R434 IonicContact OE1-NH1 3.84Å; E431-R434 IonicContact OE2-CZ 3.64Å; E431-R434 IonicContact OE2-NE 3.88Å; E431-R434 IonicContact OE2-NH1 2.77Å; E431-R434 PolarHBondContact OE2-NH1 2.65Å; E431-S435 PolarHBondContact O-N 3.49Å; E431-S435 VanDerWaalsContact O-N 3.17Å
432	E	94.6	Very high	93.8	Very high	99 Å²	99	67.3 Å²	67.3	46%	0.463	35%	0.35	S	S	.	.	H	α-helix	trans	-62.5	-47.1	173	-174.6	170	165.1	0	0	111.3	L416 S428 D429 R434 S435 L436	L416-E432 HydrophobicContact CD1-CG 4.3Å; L416-E432 HydrophobicContact CD2-CB 3.86Å; L416-E432 HydrophobicContact CD2-CG 4.04Å; S428-E432 PolarHBondContact O-N 2.81Å; D429-E432 PolarHBondContact O-N 3.22Å; E432-R434 VanDerWaalsContact C-N 3.28Å; E432-R434 PolarHBondContact O-N 3.46Å; E432-S435 WeakPolarHBondContact O-CB 3.35Å; E432-S435 PolarHBondContact O-N 3.4Å; E432-S435 PolarHBondContact O-OG 3.34Å; E432-L436 PolarHBondContact O-N 2.95Å
433	V	95.2	Very high	93.7	Very high	3 Å²	3	67.4 Å²	67.4	2%	0.018	36%	0.361	C	S	.	.	H	α-helix	trans	-61.2	-37.2	176.9	173.2	0	0	0	0	111.7	L409 P412 A413 L416 D429 I430 S435 L436 F437	L409-V433 HydrophobicContact CD2-CG1 3.58Å; P412-V433 HydrophobicContact CB-CG1 3.69Å; P412-V433 HydrophobicContact CB-CG2 4.08Å; P412-V433 HydrophobicContact CG-CG1 4.37Å; A413-V433 HydrophobicContact CB-CG2 4.21Å; L416-V433 HydrophobicContact CB-CG2 4.46Å; D429-V433 WeakPolarHBondContact O-CB 3.29Å; D429-V433 WeakPolarHBondContact O-CG2 3.46Å; D429-V433 PolarHBondContact O-N 3.5Å; I430-V433 PolarHBondContact O-N 3.29Å; V433-S435 PolarHBondContact O-N 2.92Å; V433-L436 PolarHBondContact O-N 2.97Å; V433-L436 VanDerWaalsContact O-N 3.12Å; V433-F437 HydrophobicContact CG1-CD2 3.71Å; V433-F437 HydrophobicContact CG1-CE2 4.32Å; V433-F437 PolarHBondContact O-N 3.14Å
434	R	93.6	Very high	93.6	Very high	49 Å²	49	63.9 Å²	63.9	19%	0.185	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-28.5	175.5	-74.9	174	73.7	-169.5	10.5	113.2	L409 I430 E431 E432 L436	L409-R434 HydrophobicContact CD1-CG 3.9Å; I430-R434 HydrophobicContact CG2-CG 4.44Å; I430-R434 VanDerWaalsContact O-CG 3.23Å; I430-R434 WeakPolarHBondContact O-CG 3.42Å; I430-R434 PolarHBondContact O-N 3.35Å; E431-R434 PolarHBondContact O-N 3.17Å; E431-R434 IonicContact OE1-NH1 3.84Å; E431-R434 IonicContact OE2-CZ 3.64Å; E431-R434 IonicContact OE2-NE 3.88Å; E431-R434 IonicContact OE2-NH1 2.77Å; E431-R434 PolarHBondContact OE2-NH1 2.65Å; E432-R434 VanDerWaalsContact C-N 3.28Å; E432-R434 PolarHBondContact O-N 3.46Å; R434-L436 VanDerWaalsContact C-N 3.34Å
435	S	92.2	Very high	93.5	Very high	83 Å²	83	65.6 Å²	65.6	58%	0.58	36%	0.355	S	S	*	.	H	α-helix	trans	-72.4	-30.9	174.2	79.5	0	0	0	0	112.1	E431 E432 V433	E431-S435 PolarHBondContact O-N 3.49Å; E431-S435 VanDerWaalsContact O-N 3.17Å; E432-S435 WeakPolarHBondContact O-CB 3.35Å; E432-S435 PolarHBondContact O-N 3.4Å; E432-S435 PolarHBondContact O-OG 3.34Å; V433-S435 PolarHBondContact O-N 2.92Å
436	L	94.3	Very high	93.2	Very high	110 Å²	110	68.7 Å²	68.7	58%	0.576	37%	0.371	S	S	*	.	H	α-helix	trans	-84.9	-40.4	-178.8	-62.8	175.9	0	0	0	112.7	E432 V433 R434	E432-L436 PolarHBondContact O-N 2.95Å; V433-L436 PolarHBondContact O-N 2.97Å; V433-L436 VanDerWaalsContact O-N 3.12Å; R434-L436 VanDerWaalsContact C-N 3.34Å
437	F	94.9	Very high	93	Very high	112 Å²	112	69.3 Å²	69.3	49%	0.491	38%	0.376	S	S	.	.	S	Bend	trans	-114	108	-177.4	-62	-81.9	0	0	0	109.2	Y405 P412 V433	Y405-F437 PolarHBondContact OH-O 3.19Å; P412-F437 HydrophobicContact CB-CE2 4.12Å; P412-F437 HydrophobicContact CG-CE2 4.44Å; V433-F437 HydrophobicContact CG1-CD2 3.71Å; V433-F437 HydrophobicContact CG1-CE2 4.32Å; V433-F437 PolarHBondContact O-N 3.14Å
438	L	92.2	Very high	92.7	Very high	84 Å²	84	72.4 Å²	72.4	44%	0.44	40%	0.395	S	S	.	.			trans	-79.9	146.1	179.9	-58.2	177.3	0	0	0	111.5	Q442 I446	L438-Q442 HydrophobicContact CB-CB 4.36Å; L438-I446 HydrophobicContact CD1-CD1 3.47Å; L438-I446 VanDerWaalsContact CD1-CD1 3.47Å
439	N	92.4	Very high	92.6	Very high	11 Å²	11	75.2 Å²	75.2	6%	0.059	40%	0.401	C	S	.	.			trans	-79.3	166	168.2	69.1	64.6	0	0	0	111.8	T401 Y405 K441 Q442 S443	T401-N439 HydrophobicContact CG2-CB 4.02Å; T401-N439 WeakPolarHBondContact CG2-ND2 3.5Å; Y405-N439 HydrophobicContact CD1-CB 4.04Å; Y405-N439 HydrophobicContact CD2-CB 3.84Å; Y405-N439 HydrophobicContact CE1-CB 3.87Å; Y405-N439 HydrophobicContact CE2-CB 3.66Å; Y405-N439 HydrophobicContact CG-CB 4.01Å; N439-K441 VanDerWaalsContact C-N 3.3Å; N439-K441 PolarHBondContact O-N 3.03Å; N439-K441 WeakPolarHBondContact OD1-CA 3.35Å; N439-K441 WeakPolarHBondContact OD1-CB 3.41Å; N439-K441 PolarHBondContact OD1-N 3.33Å; N439-Q442 WeakPolarHBondContact ND2-CG 3.4Å; N439-Q442 PolarHBondContact ND2-OE1 3.37Å; N439-Q442 PolarHBondContact O-N 2.99Å; N439-Q442 PolarHBondContact OD1-N 3.22Å; N439-S443 WeakPolarHBondContact O-CB 3.31Å; N439-S443 PolarHBondContact O-N 3.13Å
440	A	90.2	Very high	92.3	Very high	86 Å²	86	78.7 Å²	78.7	71%	0.711	42%	0.417	S	S	*	.	H	α-helix	trans	-58.6	-35.8	-178.1	0	0	0	0	0	114	A444	A440-A444 VanDerWaalsContact O-CB 3.28Å; A440-A444 WeakPolarHBondContact O-CB 3.43Å; A440-A444 PolarHBondContact O-N 2.96Å
441	K	89.7	Confident	91.8	Very high	137 Å²	137	83.3 Å²	83.3	60%	0.596	44%	0.438	S	S	*	.	H	α-helix	trans	-69.5	-43.6	178.7	-63.3	-179.5	-176.7	171.2	0	111.2	D400 N439 K445	D400-K441 PolarHBondContact O-NZ 3.32Å; N439-K441 VanDerWaalsContact C-N 3.3Å; N439-K441 PolarHBondContact O-N 3.03Å; N439-K441 WeakPolarHBondContact OD1-CA 3.35Å; N439-K441 WeakPolarHBondContact OD1-CB 3.41Å; N439-K441 PolarHBondContact OD1-N 3.33Å; K441-K445 WeakPolarHBondContact O-CB 3.24Å; K441-K445 PolarHBondContact O-N 3.23Å
442	Q	90.3	Very high	91.5	Very high	68 Å²	68	86.3 Å²	86.3	32%	0.318	46%	0.458	S	S	.	.	H	α-helix	trans	-63.6	-46.1	175.7	-74	172	-38	0	0	111.2	L438 N439 A444 K445 I446	L438-Q442 HydrophobicContact CB-CB 4.36Å; N439-Q442 WeakPolarHBondContact ND2-CG 3.4Å; N439-Q442 PolarHBondContact ND2-OE1 3.37Å; N439-Q442 PolarHBondContact O-N 2.99Å; N439-Q442 PolarHBondContact OD1-N 3.22Å; Q442-A444 PolarHBondContact O-N 3.1Å; Q442-K445 WeakPolarHBondContact O-CB 3.43Å; Q442-K445 PolarHBondContact O-N 3.45Å; Q442-I446 WeakPolarHBondContact O-CG1 3.25Å; Q442-I446 PolarHBondContact O-N 3.11Å
443	S	91.9	Very high	91.3	Very high	66 Å²	66	88.8 Å²	88.8	46%	0.462	47%	0.469	S	S	.	.	H	α-helix	trans	-60.7	-45.1	177.1	174.2	0	0	0	0	111.9	N439 K445 I446 L447	N439-S443 WeakPolarHBondContact O-CB 3.31Å; N439-S443 PolarHBondContact O-N 3.13Å; S443-K445 VanDerWaalsContact C-N 3.33Å; S443-K445 PolarHBondContact O-N 3.12Å; S443-I446 PolarHBondContact O-N 3.1Å; S443-L447 PolarHBondContact O-N 3.18Å
444	A	91	Very high	90.9	Very high	51 Å²	51	93.4 Å²	93.4	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-61.2	-40.6	176.1	0	0	0	0	0	112.1	A440 Q442 L447 T448	A440-A444 VanDerWaalsContact O-CB 3.28Å; A440-A444 WeakPolarHBondContact O-CB 3.43Å; A440-A444 PolarHBondContact O-N 2.96Å; Q442-A444 PolarHBondContact O-N 3.1Å; A444-L447 WeakPolarHBondContact O-CB 3.49Å; A444-L447 PolarHBondContact O-N 2.92Å; A444-T448 PolarHBondContact O-N 3.35Å; A444-T448 PolarHBondContact O-OG1 3.06Å; A444-T448 VanDerWaalsContact O-OG1 3.08Å
445	K	91.9	Very high	90.5	Very high	130 Å²	130	100.2 Å²	100.2	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-60.8	-45.2	176.5	-176.3	178	171.5	-178.5	0	112.1	K441 Q442 S443 L447 T448 E449	K441-K445 WeakPolarHBondContact O-CB 3.24Å; K441-K445 PolarHBondContact O-N 3.23Å; Q442-K445 WeakPolarHBondContact O-CB 3.43Å; Q442-K445 PolarHBondContact O-N 3.45Å; S443-K445 VanDerWaalsContact C-N 3.33Å; S443-K445 PolarHBondContact O-N 3.12Å; K445-L447 VanDerWaalsContact C-N 3.31Å; K445-L447 PolarHBondContact O-N 3.48Å; K445-T448 PolarHBondContact O-N 2.85Å; K445-E449 WeakPolarHBondContact CE-OE1 3.25Å; K445-E449 IonicContact NZ-OE1 3.89Å; K445-E449 WeakPolarHBondContact O-CG 3.34Å; K445-E449 PolarHBondContact O-N 3.18Å
446	I	91.2	Very high	89.8	Confident	66 Å²	66	109.9 Å²	109.9	34%	0.338	55%	0.549	S	S	.	.	H	α-helix	trans	-62.4	-40.8	177.1	-66	169.8	0	0	0	110.9	L438 Q442 S443 T448 E449 H450	L438-I446 HydrophobicContact CD1-CD1 3.47Å; L438-I446 VanDerWaalsContact CD1-CD1 3.47Å; Q442-I446 WeakPolarHBondContact O-CG1 3.25Å; Q442-I446 PolarHBondContact O-N 3.11Å; S443-I446 PolarHBondContact O-N 3.1Å; I446-T448 VanDerWaalsContact C-N 3.34Å; I446-T448 PolarHBondContact O-N 2.95Å; I446-E449 PolarHBondContact O-N 2.78Å; I446-H450 PolarHBondContact O-N 3.28Å; I446-H450 PolarHBondContact O-ND1 3.48Å
447	L	90.5	Very high	89.6	Confident	94 Å²	94	109.9 Å²	109.9	49%	0.492	55%	0.548	S	S	.	.	H	α-helix	trans	-61.4	-42.5	177.3	-165.9	78.8	0	0	0	111.4	S443 A444 K445 H450 E451 F454	S443-L447 PolarHBondContact O-N 3.18Å; A444-L447 WeakPolarHBondContact O-CB 3.49Å; A444-L447 PolarHBondContact O-N 2.92Å; K445-L447 VanDerWaalsContact C-N 3.31Å; K445-L447 PolarHBondContact O-N 3.48Å; L447-H450 CarbonylContact O-C 3.55Å; L447-E451 WeakPolarHBondContact O-CA 3.43Å; L447-E451 PolarHBondContact O-N 2.96Å; L447-E451 VanDerWaalsContact O-N 3.08Å; L447-F454 HydrophobicContact CD1-CB 4.21Å; L447-F454 HydrophobicContact CD1-CD1 4.07Å; L447-F454 HydrophobicContact CD1-CD2 3.48Å; L447-F454 VanDerWaalsContact CD1-CD2 3.48Å; L447-F454 HydrophobicContact CD1-CE1 4.32Å; L447-F454 HydrophobicContact CD1-CE2 3.74Å; L447-F454 HydrophobicContact CD1-CG 3.65Å; L447-F454 HydrophobicContact CD1-CZ 4.17Å; L447-F454 HydrophobicContact CG-CD2 4.27Å
448	T	90.4	Very high	89.3	Confident	105 Å²	105	109.8 Å²	109.8	64%	0.644	55%	0.551	S	S	*	*	H	α-helix	trans	-66.8	-41.8	175.7	-53	0	0	0	0	112.1	A444 K445 I446 H450	A444-T448 PolarHBondContact O-N 3.35Å; A444-T448 PolarHBondContact O-OG1 3.06Å; A444-T448 VanDerWaalsContact O-OG1 3.08Å; K445-T448 PolarHBondContact O-N 2.85Å; I446-T448 VanDerWaalsContact C-N 3.34Å; I446-T448 PolarHBondContact O-N 2.95Å; T448-H450 VanDerWaalsContact C-N 3.3Å; T448-H450 PolarHBondContact O-N 3.21Å
449	E	91.8	Very high	89.2	Confident	121 Å²	121	111.2 Å²	111.2	57%	0.565	56%	0.557	S	S	*	*	H	α-helix	trans	-67.6	-29.5	-179.5	-74.3	172.8	177.6	0	0	112.8	K445 I446	K445-E449 WeakPolarHBondContact CE-OE1 3.25Å; K445-E449 IonicContact NZ-OE1 3.89Å; K445-E449 WeakPolarHBondContact O-CG 3.34Å; K445-E449 PolarHBondContact O-N 3.18Å; I446-E449 PolarHBondContact O-N 2.78Å
450	H	89.9	Confident	89	Confident	75 Å²	75	117.1 Å²	117.1	35%	0.347	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.5	28.5	-178.8	-55.8	81.7	0	0	0	112.5	I446 L447 T448 N452 Q453 F454	I446-H450 PolarHBondContact O-N 3.28Å; I446-H450 PolarHBondContact O-ND1 3.48Å; L447-H450 CarbonylContact O-C 3.55Å; T448-H450 VanDerWaalsContact C-N 3.3Å; T448-H450 PolarHBondContact O-N 3.21Å; H450-N452 PolarHBondContact O-N 2.65Å; H450-Q453 WeakPolarHBondContact O-CB 3.32Å; H450-Q453 PolarHBondContact O-N 2.84Å; H450-F454 HydrophobicContact CB-CD2 4.25Å; H450-F454 HydrophobicContact CB-CE2 3.79Å; H450-F454 VanDerWaalsContact O-CD2 3.23Å; H450-F454 WeakPolarHBondContact O-CD2 3.32Å
451	E	86.3	Confident	88.9	Confident	97 Å²	97	119.1 Å²	119.1	45%	0.453	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-49.1	-40.5	-176	-170.6	-170.6	155.1	0	0	112.1	L447 Q453 F454 R456	L447-E451 WeakPolarHBondContact O-CA 3.43Å; L447-E451 PolarHBondContact O-N 2.96Å; L447-E451 VanDerWaalsContact O-N 3.08Å; E451-Q453 PolarHBondContact O-N 3.48Å; E451-Q453 VanDerWaalsContact O-N 3.11Å; E451-F454 PolarHBondContact O-N 3.33Å; E451-F454 VanDerWaalsContact O-N 3.1Å; E451-R456 IonicContact OE1-CZ 3.78Å; E451-R456 IonicContact OE1-NE 3.97Å; E451-R456 IonicContact OE1-NH2 3.11Å; E451-R456 PolarHBondContact OE1-NH2 3.01Å
452	N	88	Confident	88.8	Confident	166 Å²	166	117.9 Å²	117.9	89%	0.888	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-63.9	-16.5	-179.3	-64.1	-28	0	0	0	114.7	H450	H450-N452 PolarHBondContact O-N 2.65Å
453	Q	89.3	Confident	88.7	Confident	150 Å²	150	121.4 Å²	121.4	70%	0.701	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-96.6	-15.5	178.8	-59.1	-177.6	8	0	0	112.4	H450 E451	H450-Q453 WeakPolarHBondContact O-CB 3.32Å; H450-Q453 PolarHBondContact O-N 2.84Å; E451-Q453 PolarHBondContact O-N 3.48Å; E451-Q453 VanDerWaalsContact O-N 3.11Å
454	F	87.1	Confident	88.5	Confident	100 Å²	100	125.7 Å²	125.7	44%	0.439	61%	0.606	S	S	.	*	S	Bend	trans	-99.7	143.8	-177.8	-66	-67.7	0	0	0	111.2	L447 H450 E451	L447-F454 HydrophobicContact CD1-CB 4.21Å; L447-F454 HydrophobicContact CD1-CD1 4.07Å; L447-F454 HydrophobicContact CD1-CD2 3.48Å; L447-F454 VanDerWaalsContact CD1-CD2 3.48Å; L447-F454 HydrophobicContact CD1-CE1 4.32Å; L447-F454 HydrophobicContact CD1-CE2 3.74Å; L447-F454 HydrophobicContact CD1-CG 3.65Å; L447-F454 HydrophobicContact CD1-CZ 4.17Å; L447-F454 HydrophobicContact CG-CD2 4.27Å; H450-F454 HydrophobicContact CB-CD2 4.25Å; H450-F454 HydrophobicContact CB-CE2 3.79Å; H450-F454 VanDerWaalsContact O-CD2 3.23Å; H450-F454 WeakPolarHBondContact O-CD2 3.32Å; E451-F454 PolarHBondContact O-N 3.33Å; E451-F454 VanDerWaalsContact O-N 3.1Å
455	M	85	Confident	88.3	Confident	192 Å²	192	131.9 Å²	131.9	95%	0.946	62%	0.622	S	S	*	*			trans	-70.2	141.7	170.6	-69.6	-173.7	-75.4	0	0	109.6
456	R	78.1	Confident	88	Confident	287 Å²	287	132.1 Å²	132.1	100%	1.083	63%	0.627	S	S	*	*			trans	-75.8	0	176.3	-74.8	-174.1	170	179.2	-4.1	112.7	E451	E451-R456 IonicContact OE1-CZ 3.78Å; E451-R456 IonicContact OE1-NE 3.97Å; E451-R456 IonicContact OE1-NH2 3.11Å; E451-R456 PolarHBondContact OE1-NH2 3.01Å

Retrieved 456 of 456 residues in 99.2 ms (Link to these results)

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