A0A077Z1F7_TRITR Loading...

AMP-binding and AMP-binding C domain containing p rotein

AlphaFold DB , UniProt , Accession A0A077Z1F7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 360 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.5	Very low	59	Low	201 Å²	201	107.5 Å²	107.5	99%	0.99	61%	0.608	S	S	*	*				0	-14.3	0	-77	-166.4	-177	0	0	116.1	A3	M1-A3 PolarHBondContact O-N 3.19Å
2	P	51.6	Low	59.7	Low	99 Å²	99	108.4 Å²	108.4	64%	0.643	61%	0.606	S	S	*	*	H	α-helix	trans	-60.6	-42.4	178	-19.3	29.5	0	0	0	113.5	V4 F5 S6	P2-V4 VanDerWaalsContact C-N 3.26Å; P2-V4 PolarHBondContact O-N 3.02Å; P2-F5 PolarHBondContact O-N 3.49Å; P2-S6 PolarHBondContact O-N 2.91Å; P2-S6 PolarHBondContact O-OG 3.13Å
3	A	50.9	Low	60.8	Low	34 Å²	34	101 Å²	101	28%	0.281	57%	0.566	S	S	.	*	H	α-helix	trans	-55.1	-32.4	-170.9	0	0	0	0	0	115.7	M1 G7 D8	M1-A3 PolarHBondContact O-N 3.19Å; A3-G7 PolarHBondContact O-N 3.47Å; A3-D8 WeakPolarHBondContact CA-OD2 3.35Å; A3-D8 HydrophobicContact CB-CB 4.36Å; A3-D8 WeakPolarHBondContact CB-OD2 3.45Å
4	V	53.6	Low	61.5	Low	86 Å²	86	98.1 Å²	98.1	52%	0.521	55%	0.548	S	S	.	.	H	α-helix	trans	-73.6	-30.3	-179.8	179.9	0	0	0	0	111.4	P2 L14	P2-V4 VanDerWaalsContact C-N 3.26Å; P2-V4 PolarHBondContact O-N 3.02Å; V4-L14 HydrophobicContact CG1-CB 4.35Å; V4-L14 WeakPolarHBondContact O-CB 3.38Å; V4-L14 PolarHBondContact O-N 2.76Å
5	F	54.7	Low	62.2	Low	142 Å²	142	104.8 Å²	104.8	62%	0.623	56%	0.561	S	S	*	*	H	α-helix	trans	-95.9	-32.8	-179.8	-69.6	-84.3	0	0	0	112.8	P2 L14	P2-F5 PolarHBondContact O-N 3.49Å; F5-L14 HydrophobicContact CD1-CB 4.45Å; F5-L14 HydrophobicContact CD1-CD2 4.01Å; F5-L14 HydrophobicContact CE1-CD2 3.45Å; F5-L14 VanDerWaalsContact CE1-CD2 3.45Å; F5-L14 HydrophobicContact CZ-CD2 4.01Å
6	S	62.3	Low	63	Low	68 Å²	68	103.5 Å²	103.5	48%	0.476	55%	0.554	S	S	.	*	H	α-helix	trans	-85.1	-20.8	-176.3	58.1	0	0	0	0	114.7	P2 D8	P2-S6 PolarHBondContact O-N 2.91Å; P2-S6 PolarHBondContact O-OG 3.13Å; S6-D8 PolarHBondContact OG-OD1 3.25Å
7	G	56	Low	63.5	Low	32 Å²	32	103.6 Å²	103.6	33%	0.33	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	69	52	-176.2	0	0	0	0	0	112.5	A3	A3-G7 PolarHBondContact O-N 3.47Å
8	D	66.5	Low	64	Low	78 Å²	78	105.3 Å²	105.3	42%	0.417	56%	0.563	S	S	.	*			trans	-61	153.7	176	-65.8	-15.6	0	0	0	111.2	A3 S6 G10 F11	A3-D8 WeakPolarHBondContact CA-OD2 3.35Å; A3-D8 HydrophobicContact CB-CB 4.36Å; A3-D8 WeakPolarHBondContact CB-OD2 3.45Å; S6-D8 PolarHBondContact OG-OD1 3.25Å; D8-G10 PolarHBondContact O-N 2.82Å; D8-G10 VanDerWaalsContact O-N 3.12Å; D8-F11 PolarHBondContact O-N 3.24Å
9	K	67.6	Low	64.5	Low	215 Å²	215	105.1 Å²	105.1	94%	0.935	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.6	119.6	-176.4	-99.1	-176.5	176	179	0	111.8
10	G	73.1	Confident	64.5	Low	80 Å²	80	106.3 Å²	106.3	83%	0.825	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.2	-6.9	-179.5	0	0	0	0	0	114.9	D8	D8-G10 PolarHBondContact O-N 2.82Å; D8-G10 VanDerWaalsContact O-N 3.12Å
11	F	65.8	Low	64.4	Low	147 Å²	147	106.4 Å²	106.4	65%	0.645	58%	0.582	S	S	*	*	S	Bend	trans	-126.9	139.2	-179.9	-60.1	-85.4	0	0	0	111.7	D8	D8-F11 PolarHBondContact O-N 3.24Å
12	M	67.3	Low	65.2	Low	119 Å²	119	102.6 Å²	102.6	59%	0.586	58%	0.576	S	S	*	*			trans	-75.8	132.4	172.3	-133.6	-170.2	-39.4	0	0	109.2	N16 L17	M12-N16 HydrophobicContact CG-CB 4.02Å; M12-N16 HydrophobicContact SD-CB 4.39Å; M12-L17 HydrophobicContact CB-CG 4.33Å; M12-L17 HydrophobicContact CE-CD2 3.81Å; M12-L17 HydrophobicContact CE-CG 4.21Å; M12-L17 HydrophobicContact SD-CD2 4.22Å; M12-L17 HydrophobicContact SD-CG 4.13Å
13	S	74.1	Confident	65.7	Low	12 Å²	12	104.6 Å²	104.6	8%	0.084	57%	0.574	C	S	.	*			trans	-65.5	148.8	173.5	72	0	0	0	0	110.4	R15 N16 L17	S13-R15 PolarHBondContact O-N 2.77Å; S13-N16 WeakPolarHBondContact O-CA 3.08Å; S13-N16 WeakPolarHBondContact O-CB 3.37Å; S13-N16 PolarHBondContact O-N 3.29Å; S13-N16 WeakPolarHBondContact OG-CB 3.48Å; S13-N16 PolarHBondContact OG-N 2.76Å; S13-N16 VanDerWaalsContact OG-N 3.12Å; S13-N16 PolarHBondContact OG-ND2 3.12Å; S13-N16 PolarHBondContact OG-OD1 3.33Å; S13-L17 PolarHBondContact O-N 2.78Å
14	L	70.7	Confident	66.3	Low	60 Å²	60	107.9 Å²	107.9	31%	0.314	60%	0.595	S	S	.	*	H	α-helix	trans	-54.8	-36.9	173.6	-177.2	66.2	0	0	0	111.2	V4 F5 N16 L17 L18	V4-L14 HydrophobicContact CG1-CB 4.35Å; V4-L14 WeakPolarHBondContact O-CB 3.38Å; V4-L14 PolarHBondContact O-N 2.76Å; F5-L14 HydrophobicContact CD1-CB 4.45Å; F5-L14 HydrophobicContact CD1-CD2 4.01Å; F5-L14 HydrophobicContact CE1-CD2 3.45Å; F5-L14 VanDerWaalsContact CE1-CD2 3.45Å; F5-L14 HydrophobicContact CZ-CD2 4.01Å; L14-N16 VanDerWaalsContact C-N 3.32Å; L14-N16 PolarHBondContact O-N 3.18Å; L14-L17 WeakPolarHBondContact O-CB 3.48Å; L14-L17 PolarHBondContact O-N 3.26Å; L14-L18 HydrophobicContact CD1-CG 4.49Å; L14-L18 HydrophobicContact CG-CD1 4.06Å; L14-L18 HydrophobicContact CG-CG 4.43Å; L14-L18 WeakPolarHBondContact O-CB 3.37Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.26Å; L14-L18 PolarHBondContact O-N 2.8Å
15	R	71.5	Confident	66.7	Low	199 Å²	199	109.9 Å²	109.9	75%	0.751	60%	0.603	S	S	*	*	H	α-helix	trans	-60.2	-42.6	175.3	-172.2	175.4	-175.9	157.6	1.1	111.6	S13 L18 L19	S13-R15 PolarHBondContact O-N 2.77Å; R15-L18 PolarHBondContact O-N 2.75Å; R15-L19 WeakPolarHBondContact O-CG 3.25Å; R15-L19 PolarHBondContact O-N 3.16Å; R15-L19 VanDerWaalsContact O-N 3.1Å
16	N	74.5	Confident	66.8	Low	84 Å²	84	107.8 Å²	107.8	45%	0.449	60%	0.603	S	S	.	*	H	α-helix	trans	-70.6	-33.6	177.3	-70.1	-6.4	0	0	0	112.3	M12 S13 L14 L18 L19	M12-N16 HydrophobicContact CG-CB 4.02Å; M12-N16 HydrophobicContact SD-CB 4.39Å; S13-N16 WeakPolarHBondContact O-CA 3.08Å; S13-N16 WeakPolarHBondContact O-CB 3.37Å; S13-N16 PolarHBondContact O-N 3.29Å; S13-N16 WeakPolarHBondContact OG-CB 3.48Å; S13-N16 PolarHBondContact OG-N 2.76Å; S13-N16 VanDerWaalsContact OG-N 3.12Å; S13-N16 PolarHBondContact OG-ND2 3.12Å; S13-N16 PolarHBondContact OG-OD1 3.33Å; L14-N16 VanDerWaalsContact C-N 3.32Å; L14-N16 PolarHBondContact O-N 3.18Å; N16-L18 VanDerWaalsContact C-N 3.26Å; N16-L18 PolarHBondContact O-N 3.29Å; N16-L19 PolarHBondContact O-N 2.8Å
17	L	72.5	Confident	67.2	Low	106 Å²	106	108.9 Å²	108.9	56%	0.555	61%	0.611	S	S	*	*	H	α-helix	trans	-65.3	-29.1	171.1	-82.7	159.7	0	0	0	112.9	M12 S13 L14	M12-L17 HydrophobicContact CB-CG 4.33Å; M12-L17 HydrophobicContact CE-CD2 3.81Å; M12-L17 HydrophobicContact CE-CG 4.21Å; M12-L17 HydrophobicContact SD-CD2 4.22Å; M12-L17 HydrophobicContact SD-CG 4.13Å; S13-L17 PolarHBondContact O-N 2.78Å; L14-L17 WeakPolarHBondContact O-CB 3.48Å; L14-L17 PolarHBondContact O-N 3.26Å
18	L	71.7	Confident	68.4	Low	134 Å²	134	113.3 Å²	113.3	70%	0.702	63%	0.633	S	S	*	*	H	α-helix	trans	-88.9	-10.1	178.3	-67.7	173.1	0	0	0	113.5	L14 R15 N16	L14-L18 HydrophobicContact CD1-CG 4.49Å; L14-L18 HydrophobicContact CG-CD1 4.06Å; L14-L18 HydrophobicContact CG-CG 4.43Å; L14-L18 WeakPolarHBondContact O-CB 3.37Å; L14-L18 VanDerWaalsContact O-CG 3.24Å; L14-L18 WeakPolarHBondContact O-CG 3.26Å; L14-L18 PolarHBondContact O-N 2.8Å; R15-L18 PolarHBondContact O-N 2.75Å; N16-L18 VanDerWaalsContact C-N 3.26Å; N16-L18 PolarHBondContact O-N 3.29Å
19	L	74.4	Confident	69.2	Low	100 Å²	100	113.7 Å²	113.7	52%	0.524	64%	0.638	S	S	.	*	S	Bend	trans	-65.3	140.5	172.6	-74	172.9	0	0	0	108.9	R15 N16 C21	R15-L19 WeakPolarHBondContact O-CG 3.25Å; R15-L19 PolarHBondContact O-N 3.16Å; R15-L19 VanDerWaalsContact O-N 3.1Å; N16-L19 PolarHBondContact O-N 2.8Å; L19-C21 PolarHBondContact O-N 3.19Å
20	P	63	Low	70.3	Confident	130 Å²	130	106 Å²	106	84%	0.844	61%	0.612	S	S	*	*			trans	-61.9	100.9	177.4	15.9	-19	0	0	0	108.9
21	C	62.8	Low	71.2	Confident	108 Å²	108	106.4 Å²	106.4	73%	0.73	60%	0.595	S	S	*	*			trans	-83.6	139	170.1	-161.5	0	0	0	0	107.4	L19 F23	L19-C21 PolarHBondContact O-N 3.19Å; C21-F23 PolarHBondContact O-N 2.7Å
22	S	64.1	Low	72.6	Confident	122 Å²	122	103.5 Å²	103.5	85%	0.853	59%	0.586	S	S	*	*			trans	-73.3	47.3	174.8	59	0	0	0	0	111.4	S24	S22-S24 PolarHBondContact O-N 2.88Å
23	F	63.1	Low	73.8	Confident	140 Å²	140	101 Å²	101	61%	0.614	58%	0.575	S	S	*	*			trans	-87.6	105.7	175	-173.4	-101.8	0	0	0	108.2	C21 L25 P26	C21-F23 PolarHBondContact O-N 2.7Å; F23-L25 HydrophobicContact CD1-CD2 4.44Å; F23-L25 HydrophobicContact CE1-CD2 4.26Å; F23-L25 PolarHBondContact O-N 3.12Å; F23-P26 HydrophobicContact CZ-CG 4.48Å
24	S	62.4	Low	74.7	Confident	104 Å²	104	104.2 Å²	104.2	73%	0.727	60%	0.595	S	S	*	*			trans	-65.3	117.6	161.4	26.4	0	0	0	0	108.1	S22	S22-S24 PolarHBondContact O-N 2.88Å
25	L	63.1	Low	75.7	Confident	128 Å²	128	103.1 Å²	103.1	67%	0.67	60%	0.595	S	S	*	*			trans	-53.2	133.5	172.4	-74.4	166.8	0	0	0	109.1	F23 S27	F23-L25 HydrophobicContact CD1-CD2 4.44Å; F23-L25 HydrophobicContact CE1-CD2 4.26Å; F23-L25 PolarHBondContact O-N 3.12Å; L25-S27 PolarHBondContact O-N 2.92Å
26	P	57.3	Low	76.6	Confident	98 Å²	98	95 Å²	95	64%	0.636	57%	0.567	S	S	*	*	S	Bend	trans	-70	106.1	-176.9	26.6	-31.7	0	0	0	109.5	F23	F23-P26 HydrophobicContact CZ-CG 4.48Å
27	S	70.6	Confident	77.4	Confident	91 Å²	91	95 Å²	95	64%	0.636	57%	0.567	S	S	*	*	S	Bend	trans	61.8	157.2	-177.3	92.6	0	0	0	0	114.6	L25 V29	L25-S27 PolarHBondContact O-N 2.92Å; S27-V29 PolarHBondContact O-N 2.85Å
28	P	79.6	Confident	78.1	Confident	124 Å²	124	90.1 Å²	90.1	81%	0.805	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-64.1	119.2	176.7	23.8	-30.5	0	0	0	110.6	S30	P28-S30 PolarHBondContact O-N 2.93Å
29	V	83.2	Confident	78.7	Confident	86 Å²	86	89.3 Å²	89.3	52%	0.521	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-70.4	123.8	173.1	178.9	0	0	0	0	109.2	S27 D33	S27-V29 PolarHBondContact O-N 2.85Å; V29-D33 HydrophobicContact CG1-CB 4.41Å
30	S	91.8	Very high	78.8	Confident	54 Å²	54	85.1 Å²	85.1	38%	0.378	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-83	150.6	173.2	179.5	0	0	0	0	111.2	P28 D32 D33	P28-S30 PolarHBondContact O-N 2.93Å; S30-D32 PolarHBondContact O-N 2.93Å; S30-D32 PolarHBondContact OG-N 3.47Å; S30-D33 PolarHBondContact N-OD2 3.4Å; S30-D33 WeakPolarHBondContact O-CB 3.23Å; S30-D33 PolarHBondContact O-N 2.87Å; S30-D33 VanDerWaalsContact O-N 3.12Å
31	L	92.8	Very high	78.8	Confident	89 Å²	89	82.4 Å²	82.4	47%	0.466	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.7	171.5	-75.6	177.1	0	0	0	112.8	S53 H54 R55	L31-S53 WeakPolarHBondContact O-CB 3.33Å; L31-H54 HydrophobicContact CD2-CB 4.17Å; L31-H54 PolarHBondContact O-N 3.46Å; L31-R55 HydrophobicContact CB-CB 4.2Å; L31-R55 WeakPolarHBondContact O-CB 3.48Å; L31-R55 PolarHBondContact O-N 3Å
32	D	93.8	Very high	78.4	Confident	85 Å²	85	78.3 Å²	78.3	46%	0.455	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-4.8	179.6	-62.4	-52.5	0	0	0	113.1	S30 R55	S30-D32 PolarHBondContact O-N 2.93Å; S30-D32 PolarHBondContact OG-N 3.47Å; D32-R55 IonicContact OD1-CZ 3.43Å; D32-R55 IonicContact OD1-NE 3.46Å; D32-R55 PolarHBondContact OD1-NE 3.4Å; D32-R55 IonicContact OD1-NH2 3.26Å; D32-R55 PolarHBondContact OD1-NH2 3.28Å; D32-R55 IonicContact OD2-CZ 3.75Å; D32-R55 IonicContact OD2-NE 2.8Å; D32-R55 IonicContact OD2-NH2 3.32Å; D32-R55 PolarHBondContact OD2-NH2 2.66Å
33	D	93.4	Very high	77.6	Confident	66 Å²	66	76.3 Å²	76.3	35%	0.353	46%	0.455	S	S	.	.	S	Bend	trans	-67.5	145.1	173.5	-66.3	-24.3	0	0	0	110.8	V29 S30 A35 S53 H54	V29-D33 HydrophobicContact CG1-CB 4.41Å; S30-D33 PolarHBondContact N-OD2 3.4Å; S30-D33 WeakPolarHBondContact O-CB 3.23Å; S30-D33 PolarHBondContact O-N 2.87Å; S30-D33 VanDerWaalsContact O-N 3.12Å; D33-A35 PolarHBondContact O-N 3.24Å; D33-S53 WeakPolarHBondContact O-CA 3.49Å; D33-S53 WeakPolarHBondContact O-CB 3.48Å; D33-H54 PolarHBondContact O-CD2 3.41Å; D33-H54 PolarHBondContact O-N 3.26Å; D33-H54 VanDerWaalsContact O-N 3.1Å
34	P	92.8	Very high	77.2	Confident	80 Å²	80	74.8 Å²	74.8	52%	0.519	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	123.2	175.2	-23	33.6	0	0	0	112.1	L51	P34-L51 HydrophobicContact CB-CD2 4.01Å; P34-L51 HydrophobicContact CG-CD2 4.38Å
35	A	91.4	Very high	77.4	Confident	37 Å²	37	72.3 Å²	72.3	31%	0.306	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-39	174.7	0	0	0	0	0	112.2	D33 L52 H54 V57	D33-A35 PolarHBondContact O-N 3.24Å; A35-L52 PolarHBondContact N-O 3.16Å; A35-H54 HydrophobicContact CB-CB 4.4Å; A35-V57 HydrophobicContact CB-CG2 4.4Å
36	T	89.7	Confident	77.9	Confident	28 Å²	28	73.6 Å²	73.6	17%	0.172	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	150	-176.9	74.3	0	0	0	0	111.8	L52 V57 Y91	T36-L52 PolarHBondContact N-O 3.32Å; T36-L52 VanDerWaalsContact N-O 3.14Å; T36-L52 PolarHBondContact O-N 3.44Å; T36-V57 HydrophobicContact CG2-CG2 4.49Å; T36-Y91 HydrophobicContact CG2-CE1 4.35Å; T36-Y91 PolarHBondContact OG1-OH 3.35Å
37	I	91.1	Very high	79.1	Confident	86 Å²	86	72.9 Å²	72.9	44%	0.441	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	114	165.1	-58.8	165.3	0	0	0	107	F39 L50 L51 L214	I37-F39 HydrophobicContact CG2-CE2 4.3Å; I37-F39 HydrophobicContact CG2-CZ 4.43Å; I37-L50 WeakPolarHBondContact CA-O 3.36Å; I37-L51 HydrophobicContact CD1-CD2 4.4Å; I37-L51 HydrophobicContact CG1-CD2 3.73Å; I37-L214 HydrophobicContact CD1-CD2 4.17Å; I37-L214 HydrophobicContact CG2-CD2 4.5Å
38	A	87.2	Confident	79.9	Confident	2 Å²	2	72 Å²	72	2%	0.017	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	152.3	173.9	0	0	0	0	0	110.3	G49 L50 L52 T156	A38-G49 CarbonylContact O-C 3.43Å; A38-G49 WeakPolarHBondContact O-CA 3.17Å; A38-L50 HydrophobicContact CB-CD1 4.06Å; A38-L50 HydrophobicContact CB-CD2 4.35Å; A38-L50 HydrophobicContact CB-CG 4.02Å; A38-L50 PolarHBondContact N-O 2.87Å; A38-L50 WeakPolarHBondContact O-CG 3.41Å; A38-L50 PolarHBondContact O-N 3.47Å; A38-L52 HydrophobicContact CB-CD1 4.38Å; A38-T156 HydrophobicContact CB-CG2 3.73Å
39	F	84.9	Confident	80.4	Confident	118 Å²	118	66.6 Å²	66.6	52%	0.518	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.1	175.4	-71.6	-90.1	0	0	0	110.3	I37 P47 K48	I37-F39 HydrophobicContact CG2-CE2 4.3Å; I37-F39 HydrophobicContact CG2-CZ 4.43Å; F39-P47 HydrophobicContact CD1-CB 4.3Å; F39-K48 WeakPolarHBondContact CA-O 3.26Å
40	S	76.9	Confident	80.8	Confident	11 Å²	11	62.5 Å²	62.5	8%	0.077	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137.3	168.7	77.6	0	0	0	0	109.5	G42 P47 K48 E157	S40-G42 PolarHBondContact O-N 3.2Å; S40-P47 VanDerWaalsContact O-CA 3.32Å; S40-P47 WeakPolarHBondContact O-CA 3.48Å; S40-K48 PolarHBondContact N-O 3.35Å; S40-K48 VanDerWaalsContact N-O 3.1Å; S40-K48 PolarHBondContact O-N 2.88Å; S40-E157 PolarHBondContact OG-OE1 3.26Å
41	S	63.4	Low	80.9	Confident	73 Å²	73	61.5 Å²	61.5	51%	0.51	37%	0.367	S	S	.	.			trans	-76.5	43.4	-175.8	69.6	0	0	0	0	112.3	T43	S41-T43 PolarHBondContact O-N 3.1Å
42	G	54.7	Low	81	Confident	22 Å²	22	57.5 Å²	57.5	23%	0.227	35%	0.346	C	S	.	.			trans	-10.1	112	-170.9	0	0	0	0	0	114.6	S40 T44 G45	S40-G42 PolarHBondContact O-N 3.2Å; G42-T44 PolarHBondContact O-N 3.26Å; G42-G45 PolarHBondContact O-N 2.84Å
43	T	46.9	Very low	81	Confident	81 Å²	81	53.8 Å²	53.8	50%	0.497	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-16	-170	46	0	0	0	0	115.4	S41	S41-T43 PolarHBondContact O-N 3.1Å
44	T	53.4	Low	81	Confident	108 Å²	108	54 Å²	54	66%	0.663	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.8	9	-176.2	56.7	0	0	0	0	113.7	G42 K251	G42-T44 PolarHBondContact O-N 3.26Å; T44-K251 HydrophobicContact CG2-CD 3.84Å; T44-K251 PolarHBondContact OG1-NZ 3.34Å
45	G	66.7	Low	81.2	Confident	52 Å²	52	54.6 Å²	54.6	54%	0.536	32%	0.317	S	S	.	.	S	Bend	trans	-159.9	-171.6	-172	0	0	0	0	0	114.1	G42	G42-G45 PolarHBondContact O-N 2.84Å
46	L	74.9	Confident	81.3	Confident	155 Å²	155	52.9 Å²	52.9	81%	0.812	30%	0.303	S	S	*	.	S	Bend	trans	-60	146.6	176.2	-68	172.6	0	0	0	110.9	K48	L46-K48 PolarHBondContact O-N 2.77Å
47	P	81.2	Confident	81.5	Confident	83 Å²	83	52.2 Å²	52.2	54%	0.539	30%	0.299	S	S	.	.			trans	-54.2	136.8	175.3	-24.8	33.8	0	0	0	111.7	F39 S40	F39-P47 HydrophobicContact CD1-CB 4.3Å; S40-P47 VanDerWaalsContact O-CA 3.32Å; S40-P47 WeakPolarHBondContact O-CA 3.48Å
48	K	87.5	Confident	81.6	Confident	72 Å²	72	51.2 Å²	51.2	31%	0.313	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.1	176.3	-59.5	-178.2	-175.2	-176.1	0	108.9	F39 S40 L46 Y213 A219	F39-K48 WeakPolarHBondContact CA-O 3.26Å; S40-K48 PolarHBondContact N-O 3.35Å; S40-K48 VanDerWaalsContact N-O 3.1Å; S40-K48 PolarHBondContact O-N 2.88Å; L46-K48 PolarHBondContact O-N 2.77Å; K48-Y213 HydrophobicContact CB-CD1 3.72Å; K48-Y213 HydrophobicContact CB-CE1 3.96Å; K48-Y213 HydrophobicContact CD-CD1 4.15Å; K48-Y213 HydrophobicContact CD-CE1 4.1Å; K48-Y213 HydrophobicContact CD-CE2 4.48Å; K48-Y213 HydrophobicContact CD-CG 4.39Å; K48-A219 HydrophobicContact CD-CB 4.39Å
49	G	90.1	Very high	82	Confident	11 Å²	11	52.3 Å²	52.3	11%	0.113	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	129.9	167.5	0	0	0	0	0	109.4	A38 Y213 L214	A38-G49 CarbonylContact O-C 3.43Å; A38-G49 WeakPolarHBondContact O-CA 3.17Å; G49-Y213 CarbonylContact O-C 3.56Å; G49-Y213 WeakPolarHBondContact O-CA 3.36Å; G49-L214 PolarHBondContact O-N 2.85Å
50	L	92.2	Very high	82.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.1	175.6	64	107.8	0	0	0	110.3	I37 A38 L52 T156 E157 M210 Y213	I37-L50 WeakPolarHBondContact CA-O 3.36Å; A38-L50 HydrophobicContact CB-CD1 4.06Å; A38-L50 HydrophobicContact CB-CD2 4.35Å; A38-L50 HydrophobicContact CB-CG 4.02Å; A38-L50 PolarHBondContact N-O 2.87Å; A38-L50 WeakPolarHBondContact O-CG 3.41Å; A38-L50 PolarHBondContact O-N 3.47Å; L50-L52 HydrophobicContact CD1-CD1 3.85Å; L50-L52 HydrophobicContact CD1-CD2 4.46Å; L50-L52 HydrophobicContact CD1-CG 3.8Å; L50-T156 HydrophobicContact CD1-CG2 4.16Å; L50-T156 WeakPolarHBondContact CD1-O 3.12Å; L50-T156 HydrophobicContact CD2-CG2 3.57Å; L50-T156 HydrophobicContact CG-CG2 4.34Å; L50-E157 HydrophobicContact CD2-CG 4.42Å; L50-M210 HydrophobicContact CB-SD 3.83Å; L50-M210 HydrophobicContact CD1-CB 4.02Å; L50-Y213 HydrophobicContact CB-CD1 3.93Å; L50-Y213 HydrophobicContact CB-CE1 4.17Å
51	L	94.4	Very high	83.2	Confident	32 Å²	32	47.2 Å²	47.2	17%	0.168	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	122.7	-179.4	-68	164	0	0	0	109.5	P34 I37 M210 T211 A212 L214	P34-L51 HydrophobicContact CB-CD2 4.01Å; P34-L51 HydrophobicContact CG-CD2 4.38Å; I37-L51 HydrophobicContact CD1-CD2 4.4Å; I37-L51 HydrophobicContact CG1-CD2 3.73Å; L51-M210 WeakPolarHBondContact O-CA 3.2Å; L51-M210 WeakPolarHBondContact O-CB 3.28Å; L51-T211 PolarHBondContact O-N 2.89Å; L51-A212 PolarHBondContact N-O 2.88Å; L51-L214 HydrophobicContact CD1-CD1 4.19Å; L51-L214 HydrophobicContact CD2-CD1 4.29Å; L51-L214 HydrophobicContact CG-CD1 4.42Å
52	L	93.6	Very high	84.7	Confident	6 Å²	6	46.9 Å²	46.9	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128	170.2	-76.8	159.6	0	0	0	109.1	A35 T36 A38 L50 A56 V57 Y91 M210	A35-L52 PolarHBondContact N-O 3.16Å; T36-L52 PolarHBondContact N-O 3.32Å; T36-L52 VanDerWaalsContact N-O 3.14Å; T36-L52 PolarHBondContact O-N 3.44Å; A38-L52 HydrophobicContact CB-CD1 4.38Å; L50-L52 HydrophobicContact CD1-CD1 3.85Å; L50-L52 HydrophobicContact CD1-CD2 4.46Å; L50-L52 HydrophobicContact CD1-CG 3.8Å; L52-A56 HydrophobicContact CB-CB 4.45Å; L52-A56 HydrophobicContact CD2-CB 3.68Å; L52-V57 HydrophobicContact CB-CG2 4.31Å; L52-Y91 HydrophobicContact CD1-CE2 3.4Å; L52-Y91 WeakPolarHBondContact CD1-OH 3.28Å; L52-M210 HydrophobicContact CD2-CB 4.21Å
53	S	95	Very high	86.5	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.042	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	166	175.2	65.7	0	0	0	0	112.1	L31 D33 R55 A56 V57	L31-S53 WeakPolarHBondContact O-CB 3.33Å; D33-S53 WeakPolarHBondContact O-CA 3.49Å; D33-S53 WeakPolarHBondContact O-CB 3.48Å; S53-R55 PolarHBondContact O-N 2.79Å; S53-A56 PolarHBondContact O-N 2.96Å; S53-A56 VanDerWaalsContact O-N 3.16Å; S53-A56 PolarHBondContact OG-N 2.86Å; S53-V57 PolarHBondContact O-N 2.8Å
54	H	94	Very high	88.5	Confident	71 Å²	71	43 Å²	43	33%	0.329	24%	0.243	S	C	.	.	H	α-helix	trans	-55.1	-41.4	169.9	-78.9	-85.8	0	0	0	111.5	L31 D33 A35 A56 V57 V58	L31-H54 HydrophobicContact CD2-CB 4.17Å; L31-H54 PolarHBondContact O-N 3.46Å; D33-H54 PolarHBondContact O-CD2 3.41Å; D33-H54 PolarHBondContact O-N 3.26Å; D33-H54 VanDerWaalsContact O-N 3.1Å; A35-H54 HydrophobicContact CB-CB 4.4Å; H54-A56 VanDerWaalsContact C-N 3.32Å; H54-A56 PolarHBondContact O-N 3.23Å; H54-V57 PolarHBondContact O-N 3.4Å; H54-V58 WeakPolarHBondContact O-CB 3.46Å; H54-V58 VanDerWaalsContact O-CG2 3.28Å; H54-V58 WeakPolarHBondContact O-CG2 3.19Å; H54-V58 PolarHBondContact O-N 2.86Å
55	R	95.5	Very high	90.3	Very high	93 Å²	93	42.5 Å²	42.5	35%	0.351	23%	0.229	S	C	.	.	H	α-helix	trans	-55.6	-46.9	175.8	-173.2	-176.7	-55	-75.8	-0.1	111.5	L31 D32 S53 S59 P207	L31-R55 HydrophobicContact CB-CB 4.2Å; L31-R55 WeakPolarHBondContact O-CB 3.48Å; L31-R55 PolarHBondContact O-N 3Å; D32-R55 IonicContact OD1-CZ 3.43Å; D32-R55 IonicContact OD1-NE 3.46Å; D32-R55 PolarHBondContact OD1-NE 3.4Å; D32-R55 IonicContact OD1-NH2 3.26Å; D32-R55 PolarHBondContact OD1-NH2 3.28Å; D32-R55 IonicContact OD2-CZ 3.75Å; D32-R55 IonicContact OD2-NE 2.8Å; D32-R55 IonicContact OD2-NH2 3.32Å; D32-R55 PolarHBondContact OD2-NH2 2.66Å; S53-R55 PolarHBondContact O-N 2.79Å; R55-S59 WeakPolarHBondContact O-CB 3.4Å; R55-S59 PolarHBondContact O-N 2.94Å; R55-S59 PolarHBondContact O-OG 2.97Å; R55-P207 HydrophobicContact CG-CB 4.48Å
56	A	94.7	Very high	91.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-51.2	-178.9	0	0	0	0	0	111.2	L52 S53 H54 S59 S60 P207 R209	L52-A56 HydrophobicContact CB-CB 4.45Å; L52-A56 HydrophobicContact CD2-CB 3.68Å; S53-A56 PolarHBondContact O-N 2.96Å; S53-A56 VanDerWaalsContact O-N 3.16Å; S53-A56 PolarHBondContact OG-N 2.86Å; H54-A56 VanDerWaalsContact C-N 3.32Å; H54-A56 PolarHBondContact O-N 3.23Å; A56-S59 PolarHBondContact O-N 3.23Å; A56-S60 PolarHBondContact O-N 3.3Å; A56-S60 PolarHBondContact O-OG 3.27Å; A56-P207 VanDerWaalsContact CA-O 3.23Å; A56-P207 WeakPolarHBondContact CA-O 3.23Å; A56-R209 WeakPolarHBondContact CB-O 3.49Å
57	V	92.9	Very high	92.2	Very high	13 Å²	13	46.9 Å²	46.9	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-47.7	-179.3	178.8	0	0	0	0	111.5	A35 T36 L52 S53 H54 S60 I61 Y91 H95	A35-V57 HydrophobicContact CB-CG2 4.4Å; T36-V57 HydrophobicContact CG2-CG2 4.49Å; L52-V57 HydrophobicContact CB-CG2 4.31Å; S53-V57 PolarHBondContact O-N 2.8Å; H54-V57 PolarHBondContact O-N 3.4Å; V57-S60 PolarHBondContact O-N 3.37Å; V57-I61 HydrophobicContact CG1-CD1 3.98Å; V57-I61 WeakPolarHBondContact O-CD1 3.49Å; V57-I61 VanDerWaalsContact O-CG1 3.32Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 3.49Å; V57-Y91 HydrophobicContact CG1-CD1 4.09Å; V57-Y91 HydrophobicContact CG2-CD1 4.38Å; V57-Y91 HydrophobicContact CG2-CE1 4.12Å; V57-H95 WeakPolarHBondContact CG1-ND1 3.49Å
58	V	94.1	Very high	92.7	Very high	66 Å²	66	45.8 Å²	45.8	40%	0.4	21%	0.211	S	C	.	.	H	α-helix	trans	-64.4	-43.7	-179.8	171.9	0	0	0	0	110.9	H54 S60 I61 E62	H54-V58 WeakPolarHBondContact O-CB 3.46Å; H54-V58 VanDerWaalsContact O-CG2 3.28Å; H54-V58 WeakPolarHBondContact O-CG2 3.19Å; H54-V58 PolarHBondContact O-N 2.86Å; V58-S60 VanDerWaalsContact C-N 3.31Å; V58-S60 PolarHBondContact O-N 3.01Å; V58-I61 PolarHBondContact O-N 3.46Å; V58-E62 HydrophobicContact CG1-CG 4.02Å; V58-E62 WeakPolarHBondContact O-CB 3.47Å; V58-E62 WeakPolarHBondContact O-CG 3.29Å; V58-E62 PolarHBondContact O-N 3.38Å
59	S	95.4	Very high	92.6	Very high	24 Å²	24	42.5 Å²	42.5	17%	0.168	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-40.3	179.9	-58.2	0	0	0	0	111.6	R55 A56 I61 E62 I63 P207	R55-S59 WeakPolarHBondContact O-CB 3.4Å; R55-S59 PolarHBondContact O-N 2.94Å; R55-S59 PolarHBondContact O-OG 2.97Å; A56-S59 PolarHBondContact O-N 3.23Å; S59-I61 VanDerWaalsContact C-N 3.34Å; S59-I61 PolarHBondContact O-N 3.4Å; S59-E62 PolarHBondContact O-N 3.33Å; S59-I63 WeakPolarHBondContact O-CB 3.32Å; S59-I63 VanDerWaalsContact O-CG1 3.29Å; S59-I63 WeakPolarHBondContact O-CG1 3.35Å; S59-I63 PolarHBondContact O-N 3.49Å; S59-P207 WeakPolarHBondContact OG-CB 3.49Å
60	S	93.3	Very high	92.3	Very high	4 Å²	4	43.8 Å²	43.8	3%	0.028	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-46.8	174.7	-58.7	0	0	0	0	111.5	A56 V57 V58 I63 M64 A159 T208	A56-S60 PolarHBondContact O-N 3.3Å; A56-S60 PolarHBondContact O-OG 3.27Å; V57-S60 PolarHBondContact O-N 3.37Å; V58-S60 VanDerWaalsContact C-N 3.31Å; V58-S60 PolarHBondContact O-N 3.01Å; S60-I63 PolarHBondContact O-N 2.79Å; S60-M64 WeakPolarHBondContact O-CE 3.45Å; S60-M64 WeakPolarHBondContact O-CG 3.24Å; S60-M64 PolarHBondContact O-N 2.93Å; S60-M64 VanDerWaalsContact O-N 3.08Å; S60-A159 VanDerWaalsContact CB-O 3.3Å; S60-A159 WeakPolarHBondContact CB-O 3.42Å; S60-A159 PolarHBondContact OG-O 3.08Å; S60-T208 WeakPolarHBondContact OG-CG2 3.36Å
61	I	92.9	Very high	91.9	Very high	19 Å²	19	45 Å²	45	10%	0.097	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-45.7	179.3	-62.6	159.3	0	0	0	110.9	V57 V58 S59 I63 M64 R65 H95 K99	V57-I61 HydrophobicContact CG1-CD1 3.98Å; V57-I61 WeakPolarHBondContact O-CD1 3.49Å; V57-I61 VanDerWaalsContact O-CG1 3.32Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 3.49Å; V58-I61 PolarHBondContact O-N 3.46Å; S59-I61 VanDerWaalsContact C-N 3.34Å; S59-I61 PolarHBondContact O-N 3.4Å; I61-I63 VanDerWaalsContact C-N 3.32Å; I61-I63 PolarHBondContact O-N 2.94Å; I61-M64 PolarHBondContact O-N 2.81Å; I61-R65 WeakPolarHBondContact O-CB 3.32Å; I61-R65 PolarHBondContact O-N 2.93Å; I61-H95 HydrophobicContact CD1-CB 3.58Å; I61-H95 HydrophobicContact CG1-CB 3.92Å; I61-K99 HydrophobicContact CG2-CB 3.8Å; I61-K99 HydrophobicContact CG2-CG 3.78Å
62	E	95.2	Very high	91.3	Very high	65 Å²	65	43.9 Å²	43.9	30%	0.304	21%	0.209	S	C	.	.	H	α-helix	trans	-64.9	-35	-179.2	-71.5	-61.6	129.7	0	0	112.2	V58 S59 R65 R66 K99	V58-E62 HydrophobicContact CG1-CG 4.02Å; V58-E62 WeakPolarHBondContact O-CB 3.47Å; V58-E62 WeakPolarHBondContact O-CG 3.29Å; V58-E62 PolarHBondContact O-N 3.38Å; S59-E62 PolarHBondContact O-N 3.33Å; E62-R65 IonicContact OE1-CZ 3.24Å; E62-R65 IonicContact OE1-NE 3.28Å; E62-R65 PolarHBondContact OE1-NE 3.23Å; E62-R65 VanDerWaalsContact OE1-NE 3.12Å; E62-R65 IonicContact OE2-CZ 3.92Å; E62-R65 VanDerWaalsContact OE2-CZ 3.23Å; E62-R65 IonicContact OE2-NE 3.73Å; E62-R65 PolarHBondContact OE2-NE 3.43Å; E62-R65 IonicContact OE2-NH2 2.98Å; E62-R65 PolarHBondContact OE2-NH2 2.86Å; E62-R66 WeakPolarHBondContact O-CG 3.48Å; E62-K99 WeakPolarHBondContact OE1-CE 3.47Å; E62-K99 IonicContact OE1-NZ 3.83Å
63	I	93.3	Very high	90.8	Very high	10 Å²	10	44.5 Å²	44.5	5%	0.051	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-54.5	170.3	-74.6	165.3	0	0	0	110.1	S59 S60 I61 R65 R66 Y69 P160 A178 P179 M181 T208	S59-I63 WeakPolarHBondContact O-CB 3.32Å; S59-I63 VanDerWaalsContact O-CG1 3.29Å; S59-I63 WeakPolarHBondContact O-CG1 3.35Å; S59-I63 PolarHBondContact O-N 3.49Å; S60-I63 PolarHBondContact O-N 2.79Å; I61-I63 VanDerWaalsContact C-N 3.32Å; I61-I63 PolarHBondContact O-N 2.94Å; I63-R65 VanDerWaalsContact C-N 3.3Å; I63-R65 PolarHBondContact O-N 2.87Å; I63-R66 WeakPolarHBondContact O-CB 3.34Å; I63-R66 WeakPolarHBondContact O-CG 3.25Å; I63-R66 PolarHBondContact O-N 2.86Å; I63-Y69 HydrophobicContact CG2-CE2 4.45Å; I63-Y69 VanDerWaalsContact O-CD2 3.29Å; I63-Y69 WeakPolarHBondContact O-CD2 3.28Å; I63-P160 HydrophobicContact CB-CG 4.42Å; I63-P160 HydrophobicContact CG2-CG 3.64Å; I63-A178 HydrophobicContact CD1-CB 4.28Å; I63-A178 HydrophobicContact CG2-CB 3.78Å; I63-P179 WeakPolarHBondContact CD1-O 3.44Å; I63-M181 HydrophobicContact CD1-CG 4.15Å; I63-M181 HydrophobicContact CD1-SD 4.4Å; I63-T208 HydrophobicContact CD1-CG2 3.73Å
64	M	88.8	Confident	90.4	Very high	13 Å²	13	49 Å²	49	6%	0.064	25%	0.245	C	C	.	.	H	α-helix	trans	-69.6	-25.1	-171.2	-70.5	-178	-74.1	0	0	113.5	S60 I61 R66 A92 L96 P160	S60-M64 WeakPolarHBondContact O-CE 3.45Å; S60-M64 WeakPolarHBondContact O-CG 3.24Å; S60-M64 PolarHBondContact O-N 2.93Å; S60-M64 VanDerWaalsContact O-N 3.08Å; I61-M64 PolarHBondContact O-N 2.81Å; M64-R66 VanDerWaalsContact C-N 3.26Å; M64-R66 PolarHBondContact O-N 3.17Å; M64-A92 VanDerWaalsContact CE-CA 3.48Å; M64-A92 HydrophobicContact CE-CB 3.79Å; M64-A92 HydrophobicContact SD-CB 3.39Å; M64-A92 WeakPolarHBondContact SD-CB 3.47Å; M64-L96 HydrophobicContact CB-CD1 4.2Å; M64-L96 HydrophobicContact CB-CD2 4.02Å; M64-P160 HydrophobicContact CG-CG 4.07Å
65	R	90.2	Very high	89.8	Confident	97 Å²	97	50.4 Å²	50.4	37%	0.366	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.5	177.2	79.5	176	-165	98.1	4	114.5	I61 E62 I63 K67 P71 L96	I61-R65 WeakPolarHBondContact O-CB 3.32Å; I61-R65 PolarHBondContact O-N 2.93Å; E62-R65 IonicContact OE1-CZ 3.24Å; E62-R65 IonicContact OE1-NE 3.28Å; E62-R65 PolarHBondContact OE1-NE 3.23Å; E62-R65 VanDerWaalsContact OE1-NE 3.12Å; E62-R65 IonicContact OE2-CZ 3.92Å; E62-R65 VanDerWaalsContact OE2-CZ 3.23Å; E62-R65 IonicContact OE2-NE 3.73Å; E62-R65 PolarHBondContact OE2-NE 3.43Å; E62-R65 IonicContact OE2-NH2 2.98Å; E62-R65 PolarHBondContact OE2-NH2 2.86Å; I63-R65 VanDerWaalsContact C-N 3.3Å; I63-R65 PolarHBondContact O-N 2.87Å; R65-K67 PolarHBondContact O-N 2.6Å; R65-P71 WeakPolarHBondContact O-CG 3.42Å; R65-L96 HydrophobicContact CB-CD1 3.82Å
66	R	92.2	Very high	89.1	Confident	106 Å²	106	49.4 Å²	49.4	40%	0.4	27%	0.265	S	S	.	.	S	Bend	trans	-68	135.3	179	-68.7	173.9	62.9	131.4	-1.2	109.8	E62 I63 M64 E68 Y69 P71	E62-R66 WeakPolarHBondContact O-CG 3.48Å; I63-R66 WeakPolarHBondContact O-CB 3.34Å; I63-R66 WeakPolarHBondContact O-CG 3.25Å; I63-R66 PolarHBondContact O-N 2.86Å; M64-R66 VanDerWaalsContact C-N 3.26Å; M64-R66 PolarHBondContact O-N 3.17Å; R66-E68 HydrophobicContact CB-CG 4.03Å; R66-E68 IonicContact CZ-OE1 2.57Å; R66-E68 IonicContact CZ-OE2 3.79Å; R66-E68 IonicContact NE-OE1 3.56Å; R66-E68 PolarHBondContact NE-OE1 3.21Å; R66-E68 IonicContact NE-OE2 3.54Å; R66-E68 PolarHBondContact NE-OE2 3.12Å; R66-E68 IonicContact NH2-OE1 2.73Å; R66-E68 PolarHBondContact NH2-OE1 3.41Å; R66-E68 IonicContact NH2-OE2 2.76Å; R66-E68 PolarHBondContact NH2-OE2 2.97Å; R66-E68 PolarHBondContact O-N 3.41Å; R66-E68 VanDerWaalsContact O-N 3.11Å; R66-Y69 HydrophobicContact CB-CD2 3.83Å; R66-Y69 HydrophobicContact CB-CE2 4.04Å; R66-Y69 PolarHBondContact O-N 2.79Å; R66-P71 WeakPolarHBondContact O-CD 3.37Å
67	K	90.2	Very high	88.2	Confident	192 Å²	192	53.4 Å²	53.4	84%	0.835	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-54.9	-33	-177.2	-67.1	-175.9	177.1	-178.5	0	113.6	R65 Y69 A70	R65-K67 PolarHBondContact O-N 2.6Å; K67-Y69 PolarHBondContact O-N 3.07Å; K67-Y69 VanDerWaalsContact O-N 3.1Å; K67-A70 PolarHBondContact O-N 3.39Å
68	E	90.6	Very high	87.5	Confident	61 Å²	61	52.9 Å²	52.9	29%	0.285	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-60.2	-16.8	176.4	69.3	-163.1	-140.8	0	0	113.8	R66 K165 Q166	R66-E68 HydrophobicContact CB-CG 4.03Å; R66-E68 IonicContact CZ-OE1 2.57Å; R66-E68 IonicContact CZ-OE2 3.79Å; R66-E68 IonicContact NE-OE1 3.56Å; R66-E68 PolarHBondContact NE-OE1 3.21Å; R66-E68 IonicContact NE-OE2 3.54Å; R66-E68 PolarHBondContact NE-OE2 3.12Å; R66-E68 IonicContact NH2-OE1 2.73Å; R66-E68 PolarHBondContact NH2-OE1 3.41Å; R66-E68 IonicContact NH2-OE2 2.76Å; R66-E68 PolarHBondContact NH2-OE2 2.97Å; R66-E68 PolarHBondContact O-N 3.41Å; R66-E68 VanDerWaalsContact O-N 3.11Å; E68-K165 HydrophobicContact CG-CG 4.45Å; E68-Q166 WeakPolarHBondContact O-CB 3.31Å; E68-Q166 PolarHBondContact O-N 3.17Å
69	Y	86.1	Confident	86.7	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.012	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-106.7	18.1	175.5	-52.9	-54	0	0	0	113	I63 R66 K67 L150 I163 T164 K165 P179	I63-Y69 HydrophobicContact CG2-CE2 4.45Å; I63-Y69 VanDerWaalsContact O-CD2 3.29Å; I63-Y69 WeakPolarHBondContact O-CD2 3.28Å; R66-Y69 HydrophobicContact CB-CD2 3.83Å; R66-Y69 HydrophobicContact CB-CE2 4.04Å; R66-Y69 PolarHBondContact O-N 2.79Å; K67-Y69 PolarHBondContact O-N 3.07Å; K67-Y69 VanDerWaalsContact O-N 3.1Å; Y69-L150 WeakPolarHBondContact O-CD1 3.43Å; Y69-I163 HydrophobicContact CD1-CB 4.35Å; Y69-I163 HydrophobicContact CD1-CD1 3.73Å; Y69-I163 HydrophobicContact CD1-CG1 3.62Å; Y69-I163 HydrophobicContact CD1-CG2 3.91Å; Y69-I163 HydrophobicContact CD2-CD1 4Å; Y69-I163 HydrophobicContact CD2-CG2 4.41Å; Y69-I163 HydrophobicContact CE1-CB 4.15Å; Y69-I163 HydrophobicContact CE1-CD1 4.29Å; Y69-I163 HydrophobicContact CE1-CG1 3.93Å; Y69-I163 HydrophobicContact CE1-CG2 3.31Å; Y69-I163 HydrophobicContact CE2-CG2 3.9Å; Y69-I163 HydrophobicContact CG-CD1 3.59Å; Y69-I163 HydrophobicContact CG-CG1 4.05Å; Y69-I163 HydrophobicContact CG-CG2 4.44Å; Y69-T164 WeakPolarHBondContact CD1-O 3.49Å; Y69-K165 HydrophobicContact CD1-CG 4.22Å; Y69-K165 HydrophobicContact CE1-CB 4.34Å; Y69-K165 HydrophobicContact CE1-CG 3.5Å; Y69-P179 HydrophobicContact CE2-CG 4.33Å; Y69-P179 VanDerWaalsContact OH-CD 3.32Å; Y69-P179 WeakPolarHBondContact OH-CD 3.32Å
70	A	84	Confident	86	Confident	38 Å²	38	48.6 Å²	48.6	31%	0.314	25%	0.25	S	S	.	.			trans	40.9	56.6	177.1	0	0	0	0	0	114	K67 L150 Q166	K67-A70 PolarHBondContact O-N 3.39Å; A70-L150 HydrophobicContact CB-CD1 4.29Å; A70-Q166 HydrophobicContact CB-CB 4.46Å; A70-Q166 HydrophobicContact CB-CG 4.32Å
71	P	84.5	Confident	85	Confident	26 Å²	26	49.2 Å²	49.2	17%	0.169	25%	0.254	C	S	.	.			trans	-65.4	157.3	-179.1	32.3	-38.8	0	0	0	110.5	R65 R66	R65-P71 WeakPolarHBondContact O-CG 3.42Å; R66-P71 WeakPolarHBondContact O-CD 3.37Å
72	P	80.6	Confident	84.1	Confident	8 Å²	8	51.1 Å²	51.1	5%	0.052	26%	0.264	C	S	.	.			trans	-63.1	146.4	174.7	31.8	-38.1	0	0	0	110.3	D76 I78 L96 Q100 S102	P72-D76 WeakPolarHBondContact CA-OD2 3.49Å; P72-D76 HydrophobicContact CB-CB 4.02Å; P72-I78 HydrophobicContact CB-CD1 3.94Å; P72-I78 HydrophobicContact CB-CG1 4.11Å; P72-I78 HydrophobicContact CG-CD1 3.54Å; P72-I78 HydrophobicContact CG-CG1 4.25Å; P72-L96 HydrophobicContact CG-CD2 4.37Å; P72-L96 HydrophobicContact CG-CG 4.42Å; P72-Q100 VanDerWaalsContact O-CB 3.26Å; P72-Q100 WeakPolarHBondContact O-CB 3.44Å; P72-Q100 WeakPolarHBondContact O-CG 3.45Å; P72-Q100 PolarHBondContact O-NE2 2.77Å; P72-S102 WeakPolarHBondContact CB-OG 3.4Å
73	G	83.3	Confident	83.4	Confident	18 Å²	18	50.7 Å²	50.7	19%	0.186	27%	0.268	C	S	.	.			trans	-101.5	-179.4	173.4	0	0	0	0	0	113	S75 D76 S102	G73-S75 VanDerWaalsContact C-N 3.28Å; G73-S75 PolarHBondContact O-N 2.73Å; G73-D76 PolarHBondContact N-OD2 2.92Å; G73-D76 WeakPolarHBondContact O-CB 3.38Å; G73-D76 PolarHBondContact O-N 2.95Å; G73-D76 VanDerWaalsContact O-N 3.08Å; G73-S102 WeakPolarHBondContact O-CB 3.29Å; G73-S102 PolarHBondContact O-OG 3.1Å
74	P	87.4	Confident	82.8	Confident	101 Å²	101	52.6 Å²	52.6	66%	0.656	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.6	-173.8	-23.3	32.7	0	0	0	115.1	D76 Q100 G101	P74-D76 VanDerWaalsContact C-N 3.34Å; P74-Q100 WeakPolarHBondContact CG-O 3.49Å; P74-G101 WeakPolarHBondContact CA-O 3.45Å
75	S	81	Confident	82.4	Confident	100 Å²	100	57.5 Å²	57.5	70%	0.699	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.1	177.7	52.6	0	0	0	0	113.6	G73	G73-S75 VanDerWaalsContact C-N 3.28Å; G73-S75 PolarHBondContact O-N 2.73Å
76	D	79.4	Confident	81.8	Confident	72 Å²	72	56.9 Å²	56.9	39%	0.385	30%	0.302	S	S	.	.			trans	-86.4	144.5	-172.4	-62.9	-27.5	0	0	0	111.3	P72 G73 P74 S102 T103	P72-D76 WeakPolarHBondContact CA-OD2 3.49Å; P72-D76 HydrophobicContact CB-CB 4.02Å; G73-D76 PolarHBondContact N-OD2 2.92Å; G73-D76 WeakPolarHBondContact O-CB 3.38Å; G73-D76 PolarHBondContact O-N 2.95Å; G73-D76 VanDerWaalsContact O-N 3.08Å; P74-D76 VanDerWaalsContact C-N 3.34Å; D76-S102 WeakPolarHBondContact O-CB 3.13Å; D76-T103 PolarHBondContact O-N 3.09Å
77	Y	77.5	Confident	81	Confident	85 Å²	85	52 Å²	52	33%	0.333	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	144.3	168.7	-61.9	-108.4	0	0	0	109.6	T103 V105 F122 V124	Y77-T103 CarbonylContact C-O 3.48Å; Y77-T103 VanDerWaalsContact CA-O 3.23Å; Y77-T103 WeakPolarHBondContact CA-O 3.41Å; Y77-T103 HydrophobicContact CD1-CG2 3.49Å; Y77-T103 VanDerWaalsContact CD1-CG2 3.49Å; Y77-T103 HydrophobicContact CE1-CG2 3.57Å; Y77-V105 HydrophobicContact CD1-CG2 3.78Å; Y77-V105 HydrophobicContact CG-CG2 4.48Å; Y77-F122 HydrophobicContact CD1-CD1 4.43Å; Y77-F122 HydrophobicContact CE1-CD1 4.25Å; Y77-F122 HydrophobicContact CG-CB 4.47Å; Y77-V124 HydrophobicContact CG-CG2 4.49Å; Y77-V124 WeakPolarHBondContact O-CG1 3.39Å
78	I	78.2	Confident	80.4	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	115.2	175	-50.5	171.9	0	0	0	107.9	P72 C80 I93 A97 T103 V104 V105 Y127	P72-I78 HydrophobicContact CB-CD1 3.94Å; P72-I78 HydrophobicContact CB-CG1 4.11Å; P72-I78 HydrophobicContact CG-CD1 3.54Å; P72-I78 HydrophobicContact CG-CG1 4.25Å; I78-C80 PolarHBondContact O-N 2.81Å; I78-I93 HydrophobicContact CB-CG2 4.32Å; I78-I93 HydrophobicContact CG2-CG2 3.63Å; I78-A97 HydrophobicContact CD1-CB 3.86Å; I78-T103 PolarHBondContact N-O 3.1Å; I78-V104 CarbonylContact O-C 3.49Å; I78-V104 WeakPolarHBondContact O-CA 3.46Å; I78-V105 PolarHBondContact O-N 3.21Å; I78-Y127 HydrophobicContact CG2-CD1 4.45Å
79	I	77.3	Confident	79.9	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	118.7	175.1	-57.1	176.1	0	0	0	108.5	P81 V105 M107 L115 A118 P126	I79-P81 WeakPolarHBondContact O-CD 3.4Å; I79-V105 WeakPolarHBondContact CA-O 3.3Å; I79-V105 HydrophobicContact CG1-CB 4.34Å; I79-M107 HydrophobicContact CG2-SD 4.03Å; I79-L115 HydrophobicContact CB-CD1 4.02Å; I79-L115 HydrophobicContact CD1-CD1 3.76Å; I79-L115 HydrophobicContact CG1-CD1 4.49Å; I79-L115 HydrophobicContact CG2-CD1 3.61Å; I79-A118 HydrophobicContact CD1-CB 3.75Å; I79-P126 HydrophobicContact CD1-CB 4.2Å
80	C	79.4	Confident	79.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	99.5	176.2	-173.9	0	0	0	0	110.3	I78 L82 I93 V104 V105 L106 M107	I78-C80 PolarHBondContact O-N 2.81Å; C80-L82 VanDerWaalsContact C-N 3.25Å; C80-L82 PolarHBondContact O-N 3.13Å; C80-L82 PolarHBondContact SG-O 3.28Å; C80-I93 HydrophobicContact CB-CD1 4.31Å; C80-I93 HydrophobicContact CB-CG2 4Å; C80-V104 HydrophobicContact CB-CG1 3.84Å; C80-V105 PolarHBondContact N-O 2.96Å; C80-L106 HydrophobicContact CB-CD2 4.04Å; C80-M107 PolarHBondContact O-N 2.98Å
81	P	73.7	Confident	79.7	Confident	17 Å²	17	44.5 Å²	44.5	11%	0.11	24%	0.243	C	C	.	.			trans	-83.8	-0.6	175.8	34.2	-35.9	0	0	0	113.4	I79 M107 F110 L128	I79-P81 WeakPolarHBondContact O-CD 3.4Å; P81-M107 HydrophobicContact CB-CE 3.95Å; P81-F110 HydrophobicContact CB-CD2 3.83Å; P81-F110 HydrophobicContact CG-CD2 4.5Å; P81-L128 HydrophobicContact CG-CD2 4.45Å
82	L	74.1	Confident	79.4	Confident	58 Å²	58	43.5 Å²	43.5	30%	0.304	24%	0.237	S	C	.	.	S	Bend	trans	-105	154.6	-173.9	-60.8	175.7	0	0	0	111	C80 L84 Y88 P89	C80-L82 VanDerWaalsContact C-N 3.25Å; C80-L82 PolarHBondContact O-N 3.13Å; C80-L82 PolarHBondContact SG-O 3.28Å; L82-L84 PolarHBondContact O-N 3.19Å; L82-Y88 HydrophobicContact CD1-CD1 4.3Å; L82-P89 HydrophobicContact CB-CB 4.09Å; L82-P89 HydrophobicContact CB-CG 3.35Å; L82-P89 HydrophobicContact CD1-CG 3.8Å; L82-P89 HydrophobicContact CG-CG 4.22Å
83	S	78.8	Confident	79.6	Confident	57 Å²	57	43.2 Å²	43.2	40%	0.399	24%	0.235	S	C	.	.			trans	-69.6	130.1	175.5	-174.1	0	0	0	0	111.2	I85 Y86 P89	S83-I85 PolarHBondContact O-N 2.87Å; S83-I85 VanDerWaalsContact O-N 3.15Å; S83-I85 WeakPolarHBondContact OG-CG1 3.32Å; S83-Y86 WeakPolarHBondContact O-CD2 3.41Å; S83-Y86 PolarHBondContact O-N 2.97Å; S83-P89 WeakPolarHBondContact O-CB 3.42Å; S83-P89 WeakPolarHBondContact O-CG 3.27Å
84	L	82	Confident	79.8	Confident	50 Å²	50	44.7 Å²	44.7	26%	0.262	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-6.7	178.5	-65.5	176.9	0	0	0	114.2	L82 Y86 P89 L94 L106	L82-L84 PolarHBondContact O-N 3.19Å; L84-Y86 PolarHBondContact O-N 2.97Å; L84-P89 HydrophobicContact CD2-CB 4.08Å; L84-L94 HydrophobicContact CD1-CD2 4.19Å; L84-L94 HydrophobicContact CD2-CB 4.05Å; L84-L94 HydrophobicContact CD2-CD2 4.48Å; L84-L106 HydrophobicContact CD1-CD1 4.09Å; L84-L106 HydrophobicContact CD1-CD2 3.76Å; L84-L106 HydrophobicContact CD2-CD2 4.32Å; L84-L106 HydrophobicContact CG-CD2 4.16Å
85	I	79.7	Confident	80	Confident	116 Å²	116	41.7 Å²	41.7	60%	0.595	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-15.3	175.1	74.4	-175.8	0	0	0	112.8	S83	S83-I85 PolarHBondContact O-N 2.87Å; S83-I85 VanDerWaalsContact O-N 3.15Å; S83-I85 WeakPolarHBondContact OG-CG1 3.32Å
86	Y	77.1	Confident	80.3	Confident	84 Å²	84	37 Å²	37	33%	0.329	18%	0.182	S	C	.	.	S	Bend	trans	-91.1	145	178.5	-62.7	-64.6	0	0	0	110.2	S83 L84 Y88 P89 Q90	S83-Y86 WeakPolarHBondContact O-CD2 3.41Å; S83-Y86 PolarHBondContact O-N 2.97Å; L84-Y86 PolarHBondContact O-N 2.97Å; Y86-Y88 VanDerWaalsContact C-N 3.29Å; Y86-Y88 PolarHBondContact O-N 3Å; Y86-P89 VanDerWaalsContact O-CD 3.28Å; Y86-P89 WeakPolarHBondContact O-CD 3.46Å; Y86-Q90 WeakPolarHBondContact O-CB 3.5Å; Y86-Q90 PolarHBondContact O-N 3.14Å; Y86-Q90 VanDerWaalsContact O-N 3.08Å
87	G	76.6	Confident	80.8	Confident	3 Å²	3	33.6 Å²	33.6	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-58	-38.8	-176.1	0	0	0	0	0	113.7	Q90 Y91	G87-Q90 PolarHBondContact O-N 2.83Å; G87-Y91 WeakPolarHBondContact O-CB 3.47Å; G87-Y91 WeakPolarHBondContact O-CD2 3.5Å; G87-Y91 WeakPolarHBondContact O-CE2 3.14Å; G87-Y91 PolarHBondContact O-N 2.95Å
88	Y	77.8	Confident	81.5	Confident	77 Å²	77	35.5 Å²	35.5	30%	0.302	18%	0.178	S	C	.	.	I	π-helix	trans	-62.7	-58.1	-179.6	178.8	-85.5	0	0	0	112.9	L82 Y86 Q90 Y91 A92 I93 P129	L82-Y88 HydrophobicContact CD1-CD1 4.3Å; Y86-Y88 VanDerWaalsContact C-N 3.29Å; Y86-Y88 PolarHBondContact O-N 3Å; Y88-Q90 VanDerWaalsContact C-N 3.25Å; Y88-Q90 PolarHBondContact O-N 3.44Å; Y88-Y91 PolarHBondContact O-N 3.45Å; Y88-A92 HydrophobicContact CD2-CB 3.86Å; Y88-A92 HydrophobicContact CE1-CB 4.2Å; Y88-A92 HydrophobicContact CE2-CB 3.39Å; Y88-A92 HydrophobicContact CG-CB 4.43Å; Y88-A92 WeakPolarHBondContact O-CA 3.49Å; Y88-A92 VanDerWaalsContact O-CB 3.23Å; Y88-A92 WeakPolarHBondContact O-CB 3.44Å; Y88-A92 PolarHBondContact O-N 3.23Å; Y88-I93 HydrophobicContact CE1-CD1 4.19Å; Y88-I93 HydrophobicContact CE1-CG1 4.31Å; Y88-P129 HydrophobicContact CE1-CB 3.52Å; Y88-P129 HydrophobicContact CE1-CG 3.33Å; Y88-P129 HydrophobicContact CE2-CB 4.47Å; Y88-P129 WeakPolarHBondContact OH-CB 3.29Å; Y88-P129 WeakPolarHBondContact OH-CG 3.48Å
89	P	79.8	Confident	82.1	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.019	20%	0.2	C	C	.	.	I	π-helix	trans	-59.1	-33.4	174.8	-26.4	36.3	0	0	0	114.1	L82 S83 L84 Y86 I93 L94	L82-P89 HydrophobicContact CB-CB 4.09Å; L82-P89 HydrophobicContact CB-CG 3.35Å; L82-P89 HydrophobicContact CD1-CG 3.8Å; L82-P89 HydrophobicContact CG-CG 4.22Å; S83-P89 WeakPolarHBondContact O-CB 3.42Å; S83-P89 WeakPolarHBondContact O-CG 3.27Å; L84-P89 HydrophobicContact CD2-CB 4.08Å; Y86-P89 VanDerWaalsContact O-CD 3.28Å; Y86-P89 WeakPolarHBondContact O-CD 3.46Å; P89-I93 HydrophobicContact CB-CD1 4.47Å; P89-I93 WeakPolarHBondContact O-CB 3.45Å; P89-I93 PolarHBondContact O-N 3.43Å; P89-L94 PolarHBondContact O-N 3.11Å
90	Q	84.1	Confident	82.7	Confident	43 Å²	43	42.7 Å²	42.7	20%	0.201	21%	0.21	C	C	.	.	I	π-helix	trans	-67	-54.3	178.2	-168.8	178.2	1.9	0	0	111.8	Y86 G87 Y88 L94 H95	Y86-Q90 WeakPolarHBondContact O-CB 3.5Å; Y86-Q90 PolarHBondContact O-N 3.14Å; Y86-Q90 VanDerWaalsContact O-N 3.08Å; G87-Q90 PolarHBondContact O-N 2.83Å; Y88-Q90 VanDerWaalsContact C-N 3.25Å; Y88-Q90 PolarHBondContact O-N 3.44Å; Q90-L94 WeakPolarHBondContact O-CB 3.4Å; Q90-L94 PolarHBondContact O-N 3.23Å; Q90-H95 PolarHBondContact O-CD2 3.26Å; Q90-H95 PolarHBondContact O-N 2.8Å
91	Y	82.3	Confident	83.1	Confident	14 Å²	14	45 Å²	45	6%	0.055	23%	0.233	C	C	.	.	I	π-helix	trans	-88.2	-40.3	-170.3	-44.1	-42.4	0	0	0	112.7	T36 L52 V57 G87 Y88 H95 L96	T36-Y91 HydrophobicContact CG2-CE1 4.35Å; T36-Y91 PolarHBondContact OG1-OH 3.35Å; L52-Y91 HydrophobicContact CD1-CE2 3.4Å; L52-Y91 WeakPolarHBondContact CD1-OH 3.28Å; V57-Y91 HydrophobicContact CG1-CD1 4.09Å; V57-Y91 HydrophobicContact CG2-CD1 4.38Å; V57-Y91 HydrophobicContact CG2-CE1 4.12Å; G87-Y91 WeakPolarHBondContact O-CB 3.47Å; G87-Y91 WeakPolarHBondContact O-CD2 3.5Å; G87-Y91 WeakPolarHBondContact O-CE2 3.14Å; G87-Y91 PolarHBondContact O-N 2.95Å; Y88-Y91 PolarHBondContact O-N 3.45Å; Y91-H95 AromaticContact CD1-CE1 3.81Å; Y91-H95 AromaticContact CD1-ND1 3.7Å; Y91-L96 PolarHBondContact O-N 3.25Å
92	A	78.1	Confident	83.7	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	23%	0.232	C	C	.	.	I	π-helix	trans	-86.7	-18.6	-174.8	0	0	0	0	0	114.3	M64 Y88 L96	M64-A92 VanDerWaalsContact CE-CA 3.48Å; M64-A92 HydrophobicContact CE-CB 3.79Å; M64-A92 HydrophobicContact SD-CB 3.39Å; M64-A92 WeakPolarHBondContact SD-CB 3.47Å; Y88-A92 HydrophobicContact CD2-CB 3.86Å; Y88-A92 HydrophobicContact CE1-CB 4.2Å; Y88-A92 HydrophobicContact CE2-CB 3.39Å; Y88-A92 HydrophobicContact CG-CB 4.43Å; Y88-A92 WeakPolarHBondContact O-CA 3.49Å; Y88-A92 VanDerWaalsContact O-CB 3.23Å; Y88-A92 WeakPolarHBondContact O-CB 3.44Å; Y88-A92 PolarHBondContact O-N 3.23Å; A92-L96 WeakPolarHBondContact O-CD2 3.16Å
93	I	83.3	Confident	84.3	Confident	1 Å²	1	45 Å²	45	1%	0.005	24%	0.236	C	C	.	.	I	π-helix	trans	-112.2	-66.6	177.2	-57.3	173.9	0	0	0	109.8	I78 C80 Y88 P89 A97 V104 P129	I78-I93 HydrophobicContact CB-CG2 4.32Å; I78-I93 HydrophobicContact CG2-CG2 3.63Å; C80-I93 HydrophobicContact CB-CD1 4.31Å; C80-I93 HydrophobicContact CB-CG2 4Å; Y88-I93 HydrophobicContact CE1-CD1 4.19Å; Y88-I93 HydrophobicContact CE1-CG1 4.31Å; P89-I93 HydrophobicContact CB-CD1 4.47Å; P89-I93 WeakPolarHBondContact O-CB 3.45Å; P89-I93 PolarHBondContact O-N 3.43Å; I93-A97 WeakPolarHBondContact O-CB 3.36Å; I93-A97 PolarHBondContact O-N 3.47Å; I93-V104 HydrophobicContact CG2-CG1 4.02Å; I93-V104 HydrophobicContact CG2-CG2 4.23Å; I93-P129 HydrophobicContact CD1-CG 3.85Å; I93-P129 HydrophobicContact CG1-CG 4.19Å
94	L	88.7	Confident	84.6	Confident	50 Å²	50	43.9 Å²	43.9	26%	0.262	23%	0.227	S	C	.	.	I	π-helix	trans	-65.3	-53.4	-171.9	178.4	66	0	0	0	112.4	L84 P89 Q90 A97 M98 V104	L84-L94 HydrophobicContact CD1-CD2 4.19Å; L84-L94 HydrophobicContact CD2-CB 4.05Å; L84-L94 HydrophobicContact CD2-CD2 4.48Å; P89-L94 PolarHBondContact O-N 3.11Å; Q90-L94 WeakPolarHBondContact O-CB 3.4Å; Q90-L94 PolarHBondContact O-N 3.23Å; L94-A97 PolarHBondContact O-N 3.42Å; L94-M98 HydrophobicContact CG-CE 4.03Å; L94-M98 WeakPolarHBondContact O-CG 3.34Å; L94-M98 PolarHBondContact O-N 2.95Å; L94-V104 HydrophobicContact CD1-CG2 4.45Å
95	H	90.6	Very high	84.6	Confident	38 Å²	38	42.9 Å²	42.9	18%	0.176	22%	0.222	C	C	.	.	I	π-helix	trans	-68.9	-37.3	-177.5	-65.4	-174.7	0	0	0	112.6	V57 I61 Q90 Y91 M98 K99	V57-H95 WeakPolarHBondContact CG1-ND1 3.49Å; I61-H95 HydrophobicContact CD1-CB 3.58Å; I61-H95 HydrophobicContact CG1-CB 3.92Å; Q90-H95 PolarHBondContact O-CD2 3.26Å; Q90-H95 PolarHBondContact O-N 2.8Å; Y91-H95 AromaticContact CD1-CE1 3.81Å; Y91-H95 AromaticContact CD1-ND1 3.7Å; H95-M98 HydrophobicContact CB-CE 4.39Å; H95-M98 WeakPolarHBondContact CD2-CE 3.24Å; H95-M98 PolarHBondContact O-N 3.1Å; H95-K99 WeakPolarHBondContact O-CB 3.48Å; H95-K99 PolarHBondContact O-N 2.98Å
96	L	88.8	Confident	84.8	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-45.7	173.8	-179.3	61.5	0	0	0	111.4	M64 R65 P72 Y91 A92 M98 K99 Q100	M64-L96 HydrophobicContact CB-CD1 4.2Å; M64-L96 HydrophobicContact CB-CD2 4.02Å; R65-L96 HydrophobicContact CB-CD1 3.82Å; P72-L96 HydrophobicContact CG-CD2 4.37Å; P72-L96 HydrophobicContact CG-CG 4.42Å; Y91-L96 PolarHBondContact O-N 3.25Å; A92-L96 WeakPolarHBondContact O-CD2 3.16Å; L96-M98 PolarHBondContact O-N 3.36Å; L96-K99 WeakPolarHBondContact O-CB 3.46Å; L96-K99 PolarHBondContact O-N 2.98Å; L96-Q100 HydrophobicContact CD1-CG 3.98Å; L96-Q100 HydrophobicContact CG-CG 4.42Å; L96-Q100 WeakPolarHBondContact O-CB 3.49Å; L96-Q100 VanDerWaalsContact O-CG 3.31Å; L96-Q100 WeakPolarHBondContact O-CG 3.45Å; L96-Q100 PolarHBondContact O-N 2.96Å
97	A	88.3	Confident	84.9	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-46.4	176.8	0	0	0	0	0	111.7	I78 I93 L94 K99 Q100 G101 S102 V104	I78-A97 HydrophobicContact CD1-CB 3.86Å; I93-A97 WeakPolarHBondContact O-CB 3.36Å; I93-A97 PolarHBondContact O-N 3.47Å; L94-A97 PolarHBondContact O-N 3.42Å; A97-K99 VanDerWaalsContact C-N 3.28Å; A97-K99 PolarHBondContact O-N 3.04Å; A97-Q100 CarbonylContact O-C 3.54Å; A97-Q100 PolarHBondContact O-N 3.11Å; A97-Q100 VanDerWaalsContact O-N 3.15Å; A97-G101 PolarHBondContact O-N 2.96Å; A97-S102 PolarHBondContact O-N 3.12Å; A97-V104 HydrophobicContact CB-CG2 3.28Å
98	M	91.9	Very high	84.9	Confident	124 Å²	124	50 Å²	50	61%	0.611	26%	0.255	S	S	*	.	H	α-helix	trans	-59.6	-39.3	175.8	-71.1	-171.6	-61.6	0	0	112.1	L94 H95 L96	L94-M98 HydrophobicContact CG-CE 4.03Å; L94-M98 WeakPolarHBondContact O-CG 3.34Å; L94-M98 PolarHBondContact O-N 2.95Å; H95-M98 HydrophobicContact CB-CE 4.39Å; H95-M98 WeakPolarHBondContact CD2-CE 3.24Å; H95-M98 PolarHBondContact O-N 3.1Å; L96-M98 PolarHBondContact O-N 3.36Å
99	K	92.3	Very high	84.7	Confident	109 Å²	109	54.7 Å²	54.7	47%	0.474	28%	0.277	S	S	.	.	H	α-helix	trans	-66.9	-36.2	177	179.7	62.8	173.8	-169.1	0	112.6	I61 E62 H95 L96 A97	I61-K99 HydrophobicContact CG2-CB 3.8Å; I61-K99 HydrophobicContact CG2-CG 3.78Å; E62-K99 WeakPolarHBondContact OE1-CE 3.47Å; E62-K99 IonicContact OE1-NZ 3.83Å; H95-K99 WeakPolarHBondContact O-CB 3.48Å; H95-K99 PolarHBondContact O-N 2.98Å; L96-K99 WeakPolarHBondContact O-CB 3.46Å; L96-K99 PolarHBondContact O-N 2.98Å; A97-K99 VanDerWaalsContact C-N 3.28Å; A97-K99 PolarHBondContact O-N 3.04Å
100	Q	89.1	Confident	84.4	Confident	46 Å²	46	58.7 Å²	58.7	22%	0.215	30%	0.295	C	S	.	.	H	α-helix	trans	-91.6	-11.4	-176	-66.7	-72.6	83.3	0	0	113.8	P72 P74 L96 A97 S102	P72-Q100 VanDerWaalsContact O-CB 3.26Å; P72-Q100 WeakPolarHBondContact O-CB 3.44Å; P72-Q100 WeakPolarHBondContact O-CG 3.45Å; P72-Q100 PolarHBondContact O-NE2 2.77Å; P74-Q100 WeakPolarHBondContact CG-O 3.49Å; L96-Q100 HydrophobicContact CD1-CG 3.98Å; L96-Q100 HydrophobicContact CG-CG 4.42Å; L96-Q100 WeakPolarHBondContact O-CB 3.49Å; L96-Q100 VanDerWaalsContact O-CG 3.31Å; L96-Q100 WeakPolarHBondContact O-CG 3.45Å; L96-Q100 PolarHBondContact O-N 2.96Å; A97-Q100 CarbonylContact O-C 3.54Å; A97-Q100 PolarHBondContact O-N 3.11Å; A97-Q100 VanDerWaalsContact O-N 3.15Å; Q100-S102 VanDerWaalsContact C-N 3.33Å
101	G	88.8	Confident	84	Confident	48 Å²	48	58.2 Å²	58.2	50%	0.495	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	15	-173.3	0	0	0	0	0	114.1	P74 A97	P74-G101 WeakPolarHBondContact CA-O 3.45Å; A97-G101 PolarHBondContact O-N 2.96Å
102	S	86.2	Confident	83.5	Confident	12 Å²	12	61.1 Å²	61.1	8%	0.084	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-79.2	159.9	179.4	-45.5	0	0	0	0	111.8	P72 G73 D76 A97 Q100	P72-S102 WeakPolarHBondContact CB-OG 3.4Å; G73-S102 WeakPolarHBondContact O-CB 3.29Å; G73-S102 PolarHBondContact O-OG 3.1Å; D76-S102 WeakPolarHBondContact O-CB 3.13Å; A97-S102 PolarHBondContact O-N 3.12Å; Q100-S102 VanDerWaalsContact C-N 3.33Å
103	T	85.6	Confident	83.5	Confident	63 Å²	63	68 Å²	68	39%	0.387	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.5	178.1	-62.1	0	0	0	0	111.5	D76 Y77 I78	D76-T103 PolarHBondContact O-N 3.09Å; Y77-T103 CarbonylContact C-O 3.48Å; Y77-T103 VanDerWaalsContact CA-O 3.23Å; Y77-T103 WeakPolarHBondContact CA-O 3.41Å; Y77-T103 HydrophobicContact CD1-CG2 3.49Å; Y77-T103 VanDerWaalsContact CD1-CG2 3.49Å; Y77-T103 HydrophobicContact CE1-CG2 3.57Å; I78-T103 PolarHBondContact N-O 3.1Å
104	V	84.9	Confident	83.3	Confident	33 Å²	33	74.5 Å²	74.5	20%	0.2	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.4	173.1	-176	0	0	0	0	110.4	I78 C80 I93 L94 A97 L106	I78-V104 CarbonylContact O-C 3.49Å; I78-V104 WeakPolarHBondContact O-CA 3.46Å; C80-V104 HydrophobicContact CB-CG1 3.84Å; I93-V104 HydrophobicContact CG2-CG1 4.02Å; I93-V104 HydrophobicContact CG2-CG2 4.23Å; L94-V104 HydrophobicContact CD1-CG2 4.45Å; A97-V104 HydrophobicContact CB-CG2 3.28Å; V104-L106 HydrophobicContact CG1-CD2 3.73Å; V104-L106 HydrophobicContact CG1-CG 4.48Å
105	V	82.9	Confident	82.6	Confident	29 Å²	29	72.2 Å²	72.2	18%	0.176	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	109.2	173.2	-176.6	0	0	0	0	108.7	Y77 I78 I79 C80 F122	Y77-V105 HydrophobicContact CD1-CG2 3.78Å; Y77-V105 HydrophobicContact CG-CG2 4.48Å; I78-V105 PolarHBondContact O-N 3.21Å; I79-V105 WeakPolarHBondContact CA-O 3.3Å; I79-V105 HydrophobicContact CG1-CB 4.34Å; C80-V105 PolarHBondContact N-O 2.96Å; V105-F122 HydrophobicContact CG1-CE2 4.16Å; V105-F122 HydrophobicContact CG2-CD2 4.45Å; V105-F122 HydrophobicContact CG2-CE2 4.42Å
106	L	84.1	Confident	81.8	Confident	107 Å²	107	72.8 Å²	72.8	56%	0.56	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	126	-178.4	-60.4	179.2	0	0	0	111.4	C80 L84 V104	C80-L106 HydrophobicContact CB-CD2 4.04Å; L84-L106 HydrophobicContact CD1-CD1 4.09Å; L84-L106 HydrophobicContact CD1-CD2 3.76Å; L84-L106 HydrophobicContact CD2-CD2 4.32Å; L84-L106 HydrophobicContact CG-CD2 4.16Å; V104-L106 HydrophobicContact CG1-CD2 3.73Å; V104-L106 HydrophobicContact CG1-CG 4.48Å
107	M	78.4	Confident	81.4	Confident	25 Å²	25	76.4 Å²	76.4	12%	0.123	39%	0.386	C	S	.	.			trans	-102.3	110.5	171.2	-117.3	171.7	54.5	0	0	109.6	I79 C80 P81 K109 F110 S111 K114 L115	I79-M107 HydrophobicContact CG2-SD 4.03Å; C80-M107 PolarHBondContact O-N 2.98Å; P81-M107 HydrophobicContact CB-CE 3.95Å; M107-K109 PolarHBondContact O-N 2.85Å; M107-K109 VanDerWaalsContact O-N 3.15Å; M107-F110 VanDerWaalsContact CE-CA 3.48Å; M107-F110 HydrophobicContact CE-CB 4.42Å; M107-F110 HydrophobicContact CE-CD2 4Å; M107-F110 HydrophobicContact CE-CG 4.47Å; M107-S111 VanDerWaalsContact CE-N 3.3Å; M107-K114 HydrophobicContact SD-CB 4.31Å; M107-L115 HydrophobicContact CE-CB 4.43Å; M107-L115 HydrophobicContact SD-CB 4.22Å
108	K	77.7	Confident	80.6	Confident	221 Å²	221	76.9 Å²	76.9	96%	0.961	39%	0.39	S	S	*	.	S	Bend	trans	-55	-35.6	-178.8	-174.3	177.8	-179.2	179.5	0	113.1
109	K	73.3	Confident	79.6	Confident	175 Å²	175	72 Å²	72	76%	0.761	37%	0.367	S	S	*	.	S	Bend	trans	-144.9	139.8	175.5	-173.7	177.3	179.3	-179.3	0	108.2	M107 S111	M107-K109 PolarHBondContact O-N 2.85Å; M107-K109 VanDerWaalsContact O-N 3.15Å; K109-S111 PolarHBondContact O-N 2.77Å
110	F	73.2	Confident	78.6	Confident	88 Å²	88	72.9 Å²	72.9	39%	0.386	38%	0.377	S	S	.	.			trans	-57.4	129.6	174.2	-178.6	-97.8	0	0	0	111.1	P81 M107 L112 L115 M130	P81-F110 HydrophobicContact CB-CD2 3.83Å; P81-F110 HydrophobicContact CG-CD2 4.5Å; M107-F110 VanDerWaalsContact CE-CA 3.48Å; M107-F110 HydrophobicContact CE-CB 4.42Å; M107-F110 HydrophobicContact CE-CD2 4Å; M107-F110 HydrophobicContact CE-CG 4.47Å; F110-L112 HydrophobicContact CE1-CB 4.42Å; F110-L112 HydrophobicContact CZ-CB 4.36Å; F110-L115 HydrophobicContact CE2-CD2 4.09Å; F110-M130 HydrophobicContact CE2-CE 4.25Å; F110-M130 HydrophobicContact CE2-SD 4.27Å
111	S	75.9	Confident	77.8	Confident	32 Å²	32	77.2 Å²	77.2	22%	0.224	40%	0.397	C	S	.	.			trans	-145.8	122.7	168.5	162.3	0	0	0	0	106.6	M107 K109 E113 K114 L115	M107-S111 VanDerWaalsContact CE-N 3.3Å; K109-S111 PolarHBondContact O-N 2.77Å; S111-E113 VanDerWaalsContact C-N 3.28Å; S111-E113 PolarHBondContact O-N 2.82Å; S111-E113 PolarHBondContact OG-N 3.1Å; S111-K114 PolarHBondContact O-N 3.11Å; S111-K114 PolarHBondContact OG-N 3.34Å; S111-L115 WeakPolarHBondContact O-CB 3.4Å; S111-L115 PolarHBondContact O-N 2.97Å
112	L	72.4	Confident	76.8	Confident	76 Å²	76	78.6 Å²	78.6	40%	0.398	39%	0.39	S	S	.	.	H	α-helix	trans	-60.6	-42.5	177.6	177.3	61.1	0	0	0	110.8	F110 L115 L116 L139	F110-L112 HydrophobicContact CE1-CB 4.42Å; F110-L112 HydrophobicContact CZ-CB 4.36Å; L112-L115 WeakPolarHBondContact O-CB 3.46Å; L112-L115 PolarHBondContact O-N 2.84Å; L112-L116 HydrophobicContact CD1-CD1 4.19Å; L112-L116 HydrophobicContact CD1-CG 4.21Å; L112-L116 HydrophobicContact CG-CD1 4.07Å; L112-L116 HydrophobicContact CG-CG 4.5Å; L112-L116 VanDerWaalsContact O-CG 3.26Å; L112-L116 WeakPolarHBondContact O-CG 3.4Å; L112-L116 PolarHBondContact O-N 3.35Å; L112-L139 HydrophobicContact CD1-CD2 3.86Å
113	E	77.7	Confident	75.5	Confident	148 Å²	148	86.3 Å²	86.3	69%	0.692	42%	0.424	S	S	*	.	H	α-helix	trans	-58.8	-51.3	177.4	-173.7	-171.8	169.5	0	0	111.2	S111 L115 L116 T117	S111-E113 VanDerWaalsContact C-N 3.28Å; S111-E113 PolarHBondContact O-N 2.82Å; S111-E113 PolarHBondContact OG-N 3.1Å; E113-L115 VanDerWaalsContact C-N 3.3Å; E113-L115 PolarHBondContact O-N 3.2Å; E113-L116 PolarHBondContact O-N 2.75Å; E113-L116 VanDerWaalsContact O-N 3.15Å; E113-T117 PolarHBondContact O-N 3.39Å; E113-T117 PolarHBondContact O-OG1 2.93Å; E113-T117 VanDerWaalsContact O-OG1 3.07Å
114	K	78.5	Confident	74.2	Confident	139 Å²	139	83.9 Å²	83.9	60%	0.604	41%	0.409	S	S	*	.	H	α-helix	trans	-64.3	-36.1	178.8	-66.6	-174.5	178.5	-173.1	0	112.7	M107 S111 L116 T117 A118	M107-K114 HydrophobicContact SD-CB 4.31Å; S111-K114 PolarHBondContact O-N 3.11Å; S111-K114 PolarHBondContact OG-N 3.34Å; K114-L116 VanDerWaalsContact C-N 3.34Å; K114-T117 PolarHBondContact O-N 2.92Å; K114-A118 WeakPolarHBondContact O-CB 3.37Å; K114-A118 PolarHBondContact O-N 2.99Å
115	L	74.5	Confident	72.5	Confident	2 Å²	2	88.3 Å²	88.3	1%	0.01	43%	0.428	C	S	.	.	H	α-helix	trans	-61.1	-45.5	174.8	178.2	69.7	0	0	0	110.7	I79 M107 F110 S111 L112 E113 T119 L128	I79-L115 HydrophobicContact CB-CD1 4.02Å; I79-L115 HydrophobicContact CD1-CD1 3.76Å; I79-L115 HydrophobicContact CG1-CD1 4.49Å; I79-L115 HydrophobicContact CG2-CD1 3.61Å; M107-L115 HydrophobicContact CE-CB 4.43Å; M107-L115 HydrophobicContact SD-CB 4.22Å; F110-L115 HydrophobicContact CE2-CD2 4.09Å; S111-L115 WeakPolarHBondContact O-CB 3.4Å; S111-L115 PolarHBondContact O-N 2.97Å; L112-L115 WeakPolarHBondContact O-CB 3.46Å; L112-L115 PolarHBondContact O-N 2.84Å; E113-L115 VanDerWaalsContact C-N 3.3Å; E113-L115 PolarHBondContact O-N 3.2Å; L115-T119 WeakPolarHBondContact O-CB 3.45Å; L115-T119 PolarHBondContact O-N 2.89Å; L115-T119 PolarHBondContact O-OG1 2.82Å; L115-L128 HydrophobicContact CD1-CD1 4.41Å; L115-L128 HydrophobicContact CD1-CD2 3.84Å; L115-L128 HydrophobicContact CD2-CD1 3.94Å; L115-L128 HydrophobicContact CD2-CD2 4.12Å
116	L	74.5	Confident	70.9	Confident	50 Å²	50	87.4 Å²	87.4	26%	0.262	42%	0.423	S	S	.	.	H	α-helix	trans	-67	-43.3	178	-67.5	171.8	0	0	0	111.7	L112 E113 K114 T119 N120 L139 F143	L112-L116 HydrophobicContact CD1-CD1 4.19Å; L112-L116 HydrophobicContact CD1-CG 4.21Å; L112-L116 HydrophobicContact CG-CD1 4.07Å; L112-L116 HydrophobicContact CG-CG 4.5Å; L112-L116 VanDerWaalsContact O-CG 3.26Å; L112-L116 WeakPolarHBondContact O-CG 3.4Å; L112-L116 PolarHBondContact O-N 3.35Å; E113-L116 PolarHBondContact O-N 2.75Å; E113-L116 VanDerWaalsContact O-N 3.15Å; K114-L116 VanDerWaalsContact C-N 3.34Å; L116-T119 WeakPolarHBondContact O-CB 3.28Å; L116-T119 PolarHBondContact O-N 2.84Å; L116-N120 PolarHBondContact O-N 3.03Å; L116-L139 HydrophobicContact CD2-CD2 4.25Å; L116-F143 HydrophobicContact CD1-CE2 4.01Å; L116-F143 HydrophobicContact CD1-CZ 4.12Å; L116-F143 HydrophobicContact CD2-CD2 3.98Å; L116-F143 HydrophobicContact CD2-CE2 3.58Å; L116-F143 HydrophobicContact CD2-CZ 3.89Å; L116-F143 HydrophobicContact CG-CE2 4.47Å
117	T	78.9	Confident	69.3	Low	76 Å²	76	85 Å²	85	47%	0.466	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-48.4	175.6	-55.5	0	0	0	0	111.3	E113 K114 T119 N120 E121	E113-T117 PolarHBondContact O-N 3.39Å; E113-T117 PolarHBondContact O-OG1 2.93Å; E113-T117 VanDerWaalsContact O-OG1 3.07Å; K114-T117 PolarHBondContact O-N 2.92Å; T117-T119 VanDerWaalsContact C-N 3.32Å; T117-T119 PolarHBondContact O-N 3.49Å; T117-N120 PolarHBondContact O-N 3.29Å; T117-N120 VanDerWaalsContact O-N 3.16Å; T117-E121 VanDerWaalsContact O-CB 3.31Å; T117-E121 WeakPolarHBondContact O-CB 3.46Å; T117-E121 PolarHBondContact O-N 2.95Å
118	A	72.5	Confident	68	Low	12 Å²	12	84.9 Å²	84.9	10%	0.099	41%	0.406	C	S	.	.	H	α-helix	trans	-62.5	-39.7	177.8	0	0	0	0	0	111.9	I79 K114 N120 E121 F122	I79-A118 HydrophobicContact CD1-CB 3.75Å; K114-A118 WeakPolarHBondContact O-CB 3.37Å; K114-A118 PolarHBondContact O-N 2.99Å; A118-N120 VanDerWaalsContact C-N 3.27Å; A118-N120 PolarHBondContact O-N 2.81Å; A118-E121 PolarHBondContact O-N 2.82Å; A118-F122 HydrophobicContact CB-CD2 3.98Å; A118-F122 HydrophobicContact CB-CE2 4.1Å; A118-F122 WeakPolarHBondContact O-CB 3.36Å; A118-F122 VanDerWaalsContact O-CD2 3.22Å; A118-F122 WeakPolarHBondContact O-CD2 3.11Å; A118-F122 PolarHBondContact O-N 3.09Å
119	T	71	Confident	66.5	Low	22 Å²	22	75.9 Å²	75.9	14%	0.135	37%	0.37	C	S	.	.	H	α-helix	trans	-56.8	-44	174.8	-62.8	0	0	0	0	111.1	L115 L116 T117 Q123 V124 P126	L115-T119 WeakPolarHBondContact O-CB 3.45Å; L115-T119 PolarHBondContact O-N 2.89Å; L115-T119 PolarHBondContact O-OG1 2.82Å; L116-T119 WeakPolarHBondContact O-CB 3.28Å; L116-T119 PolarHBondContact O-N 2.84Å; T117-T119 VanDerWaalsContact C-N 3.32Å; T117-T119 PolarHBondContact O-N 3.49Å; T119-Q123 WeakPolarHBondContact O-CA 3.06Å; T119-Q123 PolarHBondContact O-N 2.64Å; T119-V124 WeakPolarHBondContact CG2-O 3.37Å; T119-V124 PolarHBondContact O-N 3.45Å; T119-P126 HydrophobicContact CG2-CG 4.13Å
120	N	71.6	Confident	65	Low	126 Å²	126	69 Å²	69	67%	0.674	34%	0.341	S	S	*	.	H	α-helix	trans	-74.2	-44.9	179.5	-167.2	51.9	0	0	0	112.9	L116 T117 A118 Q123	L116-N120 PolarHBondContact O-N 3.03Å; T117-N120 PolarHBondContact O-N 3.29Å; T117-N120 VanDerWaalsContact O-N 3.16Å; A118-N120 VanDerWaalsContact C-N 3.27Å; A118-N120 PolarHBondContact O-N 2.81Å; N120-Q123 PolarHBondContact O-N 3.05Å
121	E	72.3	Confident	63.3	Low	138 Å²	138	72.5 Å²	72.5	65%	0.645	35%	0.352	S	S	*	.	H	α-helix	trans	-65.9	-44.2	-176.4	-175.3	178.9	174.8	0	0	112.3	T117 A118 Q123	T117-E121 VanDerWaalsContact O-CB 3.31Å; T117-E121 WeakPolarHBondContact O-CB 3.46Å; T117-E121 PolarHBondContact O-N 2.95Å; A118-E121 PolarHBondContact O-N 2.82Å; E121-Q123 VanDerWaalsContact C-N 3.31Å
122	F	66.9	Low	61.4	Low	77 Å²	77	72.8 Å²	72.8	34%	0.338	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	6	179.5	-60.8	-69.7	0	0	0	112.5	Y77 V105 A118 V124	Y77-F122 HydrophobicContact CD1-CD1 4.43Å; Y77-F122 HydrophobicContact CE1-CD1 4.25Å; Y77-F122 HydrophobicContact CG-CB 4.47Å; V105-F122 HydrophobicContact CG1-CE2 4.16Å; V105-F122 HydrophobicContact CG2-CD2 4.45Å; V105-F122 HydrophobicContact CG2-CE2 4.42Å; A118-F122 HydrophobicContact CB-CD2 3.98Å; A118-F122 HydrophobicContact CB-CE2 4.1Å; A118-F122 WeakPolarHBondContact O-CB 3.36Å; A118-F122 VanDerWaalsContact O-CD2 3.22Å; A118-F122 WeakPolarHBondContact O-CD2 3.11Å; A118-F122 PolarHBondContact O-N 3.09Å; F122-V124 HydrophobicContact CB-CG2 3.15Å; F122-V124 HydrophobicContact CG-CG2 4.3Å; F122-V124 WeakPolarHBondContact O-CG2 3.33Å; F122-V124 PolarHBondContact O-N 3.23Å
123	Q	58.9	Low	59.6	Low	174 Å²	174	72.2 Å²	72.2	81%	0.813	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	41.1	-176.2	-67	-111.6	-47.3	0	0	113	T119 N120 E121	T119-Q123 WeakPolarHBondContact O-CA 3.06Å; T119-Q123 PolarHBondContact O-N 2.64Å; N120-Q123 PolarHBondContact O-N 3.05Å; E121-Q123 VanDerWaalsContact C-N 3.31Å
124	V	57.9	Low	57.5	Low	12 Å²	12	68.3 Å²	68.3	7%	0.073	34%	0.342	C	S	.	.			trans	-94	144.4	-168.5	-148	0	0	0	0	111	Y77 T119 F122 P126	Y77-V124 HydrophobicContact CG-CG2 4.49Å; Y77-V124 WeakPolarHBondContact O-CG1 3.39Å; T119-V124 WeakPolarHBondContact CG2-O 3.37Å; T119-V124 PolarHBondContact O-N 3.45Å; F122-V124 HydrophobicContact CB-CG2 3.15Å; F122-V124 HydrophobicContact CG-CG2 4.3Å; F122-V124 WeakPolarHBondContact O-CG2 3.33Å; F122-V124 PolarHBondContact O-N 3.23Å; V124-P126 VanDerWaalsContact O-CD 3.27Å; V124-P126 WeakPolarHBondContact O-CD 3.47Å
125	Q	49.4	Very low	55.5	Low	126 Å²	126	63.3 Å²	63.3	59%	0.589	32%	0.323	S	S	*	.			trans	-81.8	107.8	149.2	-110.2	-177.1	-5	0	0	108	Y127 I145	Q125-Y127 PolarHBondContact O-N 2.89Å; Q125-I145 PolarHBondContact NE2-O 2.9Å
126	P	49	Very low	53.8	Low	10 Å²	10	65.3 Å²	65.3	7%	0.065	33%	0.333	C	S	.	.			trans	-68.7	107.5	-177.3	30.9	-35.1	0	0	0	107.7	I79 T119 V124 L128 I146	I79-P126 HydrophobicContact CD1-CB 4.2Å; T119-P126 HydrophobicContact CG2-CG 4.13Å; V124-P126 VanDerWaalsContact O-CD 3.27Å; V124-P126 WeakPolarHBondContact O-CD 3.47Å; P126-L128 HydrophobicContact CB-CD1 3.78Å; P126-L128 HydrophobicContact CB-CG 3.85Å; P126-L128 HydrophobicContact CG-CD1 3.78Å; P126-L128 HydrophobicContact CG-CG 4.35Å; P126-L128 PolarHBondContact O-N 3.41Å; P126-I146 HydrophobicContact CG-CG1 4.47Å
127	Y	51.2	Low	52	Low	57 Å²	57	64.3 Å²	64.3	22%	0.224	34%	0.335	C	S	.	.			trans	-67	92.6	167.5	-171.3	-93.6	0	0	0	106.9	I78 Q125 P129 L150	I78-Y127 HydrophobicContact CG2-CD1 4.45Å; Q125-Y127 PolarHBondContact O-N 2.89Å; Y127-P129 VanDerWaalsContact C-CD 3.43Å; Y127-P129 HydrophobicContact CD1-CG 4.4Å; Y127-P129 HydrophobicContact CE1-CB 4.4Å; Y127-P129 HydrophobicContact CE1-CG 4.38Å; Y127-P129 WeakPolarHBondContact O-CD 3.46Å; Y127-L150 HydrophobicContact CE2-CD1 4.27Å
128	L	50.2	Low	50	Low	21 Å²	21	64.7 Å²	64.7	11%	0.11	34%	0.337	C	S	.	.			trans	-104.7	91.2	-176.2	-73	160.7	0	0	0	109.3	P81 L115 P126 M130 L139	P81-L128 HydrophobicContact CG-CD2 4.45Å; L115-L128 HydrophobicContact CD1-CD1 4.41Å; L115-L128 HydrophobicContact CD1-CD2 3.84Å; L115-L128 HydrophobicContact CD2-CD1 3.94Å; L115-L128 HydrophobicContact CD2-CD2 4.12Å; P126-L128 HydrophobicContact CB-CD1 3.78Å; P126-L128 HydrophobicContact CB-CG 3.85Å; P126-L128 HydrophobicContact CG-CD1 3.78Å; P126-L128 HydrophobicContact CG-CG 4.35Å; P126-L128 PolarHBondContact O-N 3.41Å; L128-M130 HydrophobicContact CB-CE 4.2Å; L128-M130 HydrophobicContact CD1-CE 4.34Å; L128-M130 HydrophobicContact CD2-CE 3.7Å; L128-M130 HydrophobicContact CG-CE 4.28Å; L128-M130 PolarHBondContact O-N 3.2Å; L128-L139 HydrophobicContact CD1-CD1 4.11Å
129	P	46.4	Very low	48.4	Very low	32 Å²	32	64.5 Å²	64.5	21%	0.208	33%	0.334	C	S	.	.			trans	-79.1	66.9	170.5	33.9	-38.2	0	0	0	110.5	Y88 I93 Y127	Y88-P129 HydrophobicContact CE1-CB 3.52Å; Y88-P129 HydrophobicContact CE1-CG 3.33Å; Y88-P129 HydrophobicContact CE2-CB 4.47Å; Y88-P129 WeakPolarHBondContact OH-CB 3.29Å; Y88-P129 WeakPolarHBondContact OH-CG 3.48Å; I93-P129 HydrophobicContact CD1-CG 3.85Å; I93-P129 HydrophobicContact CG1-CG 4.19Å; Y127-P129 VanDerWaalsContact C-CD 3.43Å; Y127-P129 HydrophobicContact CD1-CG 4.4Å; Y127-P129 HydrophobicContact CE1-CB 4.4Å; Y127-P129 HydrophobicContact CE1-CG 4.38Å; Y127-P129 WeakPolarHBondContact O-CD 3.46Å
130	M	41.2	Very low	46.9	Very low	32 Å²	32	65.9 Å²	65.9	16%	0.158	35%	0.345	C	S	.	.			trans	-99.9	129.9	174.7	-94	-174	-65.1	0	0	110.4	F110 L128 S132 V135 I136	F110-M130 HydrophobicContact CE2-CE 4.25Å; F110-M130 HydrophobicContact CE2-SD 4.27Å; L128-M130 HydrophobicContact CB-CE 4.2Å; L128-M130 HydrophobicContact CD1-CE 4.34Å; L128-M130 HydrophobicContact CD2-CE 3.7Å; L128-M130 HydrophobicContact CG-CE 4.28Å; L128-M130 PolarHBondContact O-N 3.2Å; M130-S132 VanDerWaalsContact C-N 3.34Å; M130-V135 HydrophobicContact CE-CB 4.44Å; M130-V135 HydrophobicContact CE-CG1 3.55Å; M130-V135 HydrophobicContact SD-CB 4.48Å; M130-V135 HydrophobicContact SD-CG1 4.1Å; M130-I136 VanDerWaalsContact O-CD1 3.29Å; M130-I136 WeakPolarHBondContact O-CD1 3.39Å
131	R	38.2	Very low	45.1	Very low	161 Å²	161	67 Å²	67	61%	0.608	35%	0.35	S	S	*	.			trans	-77.2	-13.3	177.3	-79.7	-166.6	174.3	177.7	5	114.6	A133 G154	R131-A133 PolarHBondContact O-N 3.35Å; R131-A133 VanDerWaalsContact O-N 3.11Å; R131-G154 PolarHBondContact NH2-O 2.93Å
132	S	36.2	Very low	43.4	Very low	38 Å²	38	69.8 Å²	69.8	27%	0.266	35%	0.354	S	S	.	.			trans	-79	102.8	-177.8	45.7	0	0	0	0	109.6	M130 Q134 V135 I136	M130-S132 VanDerWaalsContact C-N 3.34Å; S132-Q134 PolarHBondContact O-N 3.37Å; S132-V135 PolarHBondContact O-N 3.42Å; S132-V135 WeakPolarHBondContact OG-CG2 3.45Å; S132-I136 PolarHBondContact O-N 2.94Å; S132-I136 VanDerWaalsContact O-N 3.16Å
133	A	33.8	Very low	42.1	Very low	64 Å²	64	70 Å²	70	53%	0.529	36%	0.355	S	S	.	.	H	α-helix	trans	-48.2	-29	169.2	0	0	0	0	0	112.1	R131 G137	R131-A133 PolarHBondContact O-N 3.35Å; R131-A133 VanDerWaalsContact O-N 3.11Å; A133-G137 PolarHBondContact O-N 2.93Å
134	Q	33.6	Very low	40.8	Very low	66 Å²	66	66.7 Å²	66.7	31%	0.308	36%	0.357	S	S	.	.	H	α-helix	trans	-59.5	-43	172.5	-77.1	175.3	-24.6	0	0	113.7	S132 T138 L271 D278	S132-Q134 PolarHBondContact O-N 3.37Å; Q134-T138 VanDerWaalsContact O-CB 3.32Å; Q134-T138 WeakPolarHBondContact O-CB 3.28Å; Q134-T138 PolarHBondContact O-N 3.15Å; Q134-T138 VanDerWaalsContact O-N 3.13Å; Q134-T138 PolarHBondContact O-OG1 2.94Å; Q134-L271 HydrophobicContact CG-CD1 4.2Å; Q134-D278 PolarHBondContact NE2-OD1 3.5Å
135	V	37.5	Very low	39.6	Very low	34 Å²	34	71.6 Å²	71.6	21%	0.206	38%	0.382	C	S	.	.	H	α-helix	trans	-78.7	-39.6	-179.9	179.1	0	0	0	0	110.2	M130 S132 T138 L139	M130-V135 HydrophobicContact CE-CB 4.44Å; M130-V135 HydrophobicContact CE-CG1 3.55Å; M130-V135 HydrophobicContact SD-CB 4.48Å; M130-V135 HydrophobicContact SD-CG1 4.1Å; S132-V135 PolarHBondContact O-N 3.42Å; S132-V135 WeakPolarHBondContact OG-CG2 3.45Å; V135-T138 PolarHBondContact O-N 3Å; V135-L139 HydrophobicContact CG1-CD1 3.48Å; V135-L139 VanDerWaalsContact CG1-CD1 3.48Å; V135-L139 HydrophobicContact CG1-CG 4.21Å; V135-L139 VanDerWaalsContact O-CB 3.27Å; V135-L139 WeakPolarHBondContact O-CB 3.48Å; V135-L139 VanDerWaalsContact O-CG 3.31Å; V135-L139 WeakPolarHBondContact O-CG 3.39Å; V135-L139 PolarHBondContact O-N 3.16Å
136	I	39.3	Very low	39.1	Very low	44 Å²	44	66.2 Å²	66.2	23%	0.226	36%	0.357	C	S	.	.	H	α-helix	trans	-58.6	-54.2	173.9	-64.4	169.4	0	0	0	110	M130 S132 T138 L139 S140 V148	M130-I136 VanDerWaalsContact O-CD1 3.29Å; M130-I136 WeakPolarHBondContact O-CD1 3.39Å; S132-I136 PolarHBondContact O-N 2.94Å; S132-I136 VanDerWaalsContact O-N 3.16Å; I136-T138 VanDerWaalsContact C-N 3.34Å; I136-T138 PolarHBondContact O-N 2.83Å; I136-L139 PolarHBondContact O-N 3.49Å; I136-S140 VanDerWaalsContact O-CB 3.29Å; I136-S140 WeakPolarHBondContact O-CB 3.31Å; I136-S140 PolarHBondContact O-N 2.89Å; I136-S140 PolarHBondContact O-OG 3.44Å; I136-V148 HydrophobicContact CD1-CG1 3.87Å; I136-V148 HydrophobicContact CG1-CG1 3.98Å; I136-V148 HydrophobicContact CG1-CG2 4.32Å; I136-V148 HydrophobicContact CG2-CB 3.92Å; I136-V148 HydrophobicContact CG2-CG1 3.94Å; I136-V148 HydrophobicContact CG2-CG2 3.92Å
137	G	36.5	Very low	38.6	Very low	29 Å²	29	68.6 Å²	68.6	30%	0.299	37%	0.374	S	S	.	.	H	α-helix	trans	-60.3	-41.9	-179.6	0	0	0	0	0	112.6	A133 I141	A133-G137 PolarHBondContact O-N 2.93Å; G137-I141 WeakPolarHBondContact O-CB 3.34Å; G137-I141 VanDerWaalsContact O-CD1 3.32Å; G137-I141 WeakPolarHBondContact O-CD1 3.26Å; G137-I141 WeakPolarHBondContact O-CG1 3.48Å; G137-I141 PolarHBondContact O-N 3.32Å; G137-I141 VanDerWaalsContact O-N 3.14Å
138	T	37	Very low	38.4	Very low	83 Å²	83	68.2 Å²	68.2	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-68	-38.1	178.8	-53.1	0	0	0	0	112.3	Q134 V135 I136 R142	Q134-T138 VanDerWaalsContact O-CB 3.32Å; Q134-T138 WeakPolarHBondContact O-CB 3.28Å; Q134-T138 PolarHBondContact O-N 3.15Å; Q134-T138 VanDerWaalsContact O-N 3.13Å; Q134-T138 PolarHBondContact O-OG1 2.94Å; V135-T138 PolarHBondContact O-N 3Å; I136-T138 VanDerWaalsContact C-N 3.34Å; I136-T138 PolarHBondContact O-N 2.83Å; T138-R142 PolarHBondContact O-N 2.97Å
139	L	37.5	Very low	38.5	Very low	8 Å²	8	74 Å²	74	4%	0.042	40%	0.398	C	S	.	.	H	α-helix	trans	-75.7	-42.3	178.8	-75.5	168.6	0	0	0	112.2	L112 L116 L128 V135 I136 I141 R142 F143 I146	L112-L139 HydrophobicContact CD1-CD2 3.86Å; L116-L139 HydrophobicContact CD2-CD2 4.25Å; L128-L139 HydrophobicContact CD1-CD1 4.11Å; V135-L139 HydrophobicContact CG1-CD1 3.48Å; V135-L139 VanDerWaalsContact CG1-CD1 3.48Å; V135-L139 HydrophobicContact CG1-CG 4.21Å; V135-L139 VanDerWaalsContact O-CB 3.27Å; V135-L139 WeakPolarHBondContact O-CB 3.48Å; V135-L139 VanDerWaalsContact O-CG 3.31Å; V135-L139 WeakPolarHBondContact O-CG 3.39Å; V135-L139 PolarHBondContact O-N 3.16Å; I136-L139 PolarHBondContact O-N 3.49Å; L139-I141 VanDerWaalsContact C-N 3.34Å; L139-I141 PolarHBondContact O-N 2.93Å; L139-R142 PolarHBondContact O-N 2.97Å; L139-F143 HydrophobicContact CD2-CD2 4.45Å; L139-F143 PolarHBondContact O-N 3.44Å; L139-I146 HydrophobicContact CB-CD1 3.85Å; L139-I146 HydrophobicContact CD1-CD1 4.33Å; L139-I146 HydrophobicContact CD2-CD1 3.6Å; L139-I146 HydrophobicContact CG-CD1 4.12Å
140	S	39.4	Very low	39.4	Very low	52 Å²	52	74.1 Å²	74.1	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-65.9	-34.5	179.5	-60.2	0	0	0	0	112.8	I136	I136-S140 VanDerWaalsContact O-CB 3.29Å; I136-S140 WeakPolarHBondContact O-CB 3.31Å; I136-S140 PolarHBondContact O-N 2.89Å; I136-S140 PolarHBondContact O-OG 3.44Å
141	I	35	Very low	41.1	Very low	149 Å²	149	75 Å²	75	76%	0.764	40%	0.404	S	S	*	.	H	α-helix	trans	-74.9	-36.5	178	-66.3	167.7	0	0	0	111.5	G137 L139	G137-I141 WeakPolarHBondContact O-CB 3.34Å; G137-I141 VanDerWaalsContact O-CD1 3.32Å; G137-I141 WeakPolarHBondContact O-CD1 3.26Å; G137-I141 WeakPolarHBondContact O-CG1 3.48Å; G137-I141 PolarHBondContact O-N 3.32Å; G137-I141 VanDerWaalsContact O-N 3.14Å; L139-I141 VanDerWaalsContact C-N 3.34Å; L139-I141 PolarHBondContact O-N 2.93Å
142	R	36.6	Very low	43.3	Very low	197 Å²	197	69.4 Å²	69.4	74%	0.743	39%	0.392	S	S	*	.	H	α-helix	trans	-89.6	-26.3	-176.5	-81.2	-172.2	169.7	-166.6	-3.2	114.5	T138 L139	T138-R142 PolarHBondContact O-N 2.97Å; L139-R142 PolarHBondContact O-N 2.97Å
143	F	38.6	Very low	45.8	Very low	82 Å²	82	67.8 Å²	67.8	36%	0.36	38%	0.38	S	S	.	.			trans	-135	99.3	-175.8	-62.4	-79.8	0	0	0	109.6	L116 L139 I145 I146	L116-F143 HydrophobicContact CD1-CE2 4.01Å; L116-F143 HydrophobicContact CD1-CZ 4.12Å; L116-F143 HydrophobicContact CD2-CD2 3.98Å; L116-F143 HydrophobicContact CD2-CE2 3.58Å; L116-F143 HydrophobicContact CD2-CZ 3.89Å; L116-F143 HydrophobicContact CG-CE2 4.47Å; L139-F143 HydrophobicContact CD2-CD2 4.45Å; L139-F143 PolarHBondContact O-N 3.44Å; F143-I145 PolarHBondContact O-N 3.46Å; F143-I146 HydrophobicContact CB-CD1 4.06Å; F143-I146 HydrophobicContact CB-CG1 4.2Å; F143-I146 PolarHBondContact O-N 2.71Å; F143-I146 VanDerWaalsContact O-N 3.09Å
144	A	33	Very low	48.4	Very low	103 Å²	103	65 Å²	65	85%	0.851	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-10.6	174	0	0	0	0	0	114
145	I	32.8	Very low	51	Low	115 Å²	115	63.3 Å²	63.3	59%	0.59	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-22	-178	-46.6	175.8	0	0	0	111.8	Q125 F143 S147	Q125-I145 PolarHBondContact NE2-O 2.9Å; F143-I145 PolarHBondContact O-N 3.46Å; I145-S147 PolarHBondContact O-N 2.82Å; I145-S147 VanDerWaalsContact O-N 3.15Å
146	I	39	Very low	53.3	Low	14 Å²	14	63.5 Å²	63.5	7%	0.072	35%	0.351	C	S	.	.			trans	-92.2	82.8	-175.5	-54.4	175	0	0	0	109.4	P126 L139 F143 V148	P126-I146 HydrophobicContact CG-CG1 4.47Å; L139-I146 HydrophobicContact CB-CD1 3.85Å; L139-I146 HydrophobicContact CD1-CD1 4.33Å; L139-I146 HydrophobicContact CD2-CD1 3.6Å; L139-I146 HydrophobicContact CG-CD1 4.12Å; F143-I146 HydrophobicContact CB-CD1 4.06Å; F143-I146 HydrophobicContact CB-CG1 4.2Å; F143-I146 PolarHBondContact O-N 2.71Å; F143-I146 VanDerWaalsContact O-N 3.09Å; I146-V148 VanDerWaalsContact C-N 3.32Å; I146-V148 HydrophobicContact CG2-CG2 3.82Å; I146-V148 PolarHBondContact O-N 3.2Å
147	S	38.4	Very low	55.8	Low	60 Å²	60	62 Å²	62	42%	0.42	34%	0.344	S	S	.	.			trans	-71.5	83.4	170.9	-77.9	0	0	0	0	110.4	I145 R149	I145-S147 PolarHBondContact O-N 2.82Å; I145-S147 VanDerWaalsContact O-N 3.15Å; S147-R149 PolarHBondContact O-N 2.8Å
148	V	47.1	Very low	58.4	Low	48 Å²	48	60.7 Å²	60.7	29%	0.291	33%	0.329	S	S	.	.			trans	-73.1	80.3	167.5	-173	0	0	0	0	108.2	I136 I146	I136-V148 HydrophobicContact CD1-CG1 3.87Å; I136-V148 HydrophobicContact CG1-CG1 3.98Å; I136-V148 HydrophobicContact CG1-CG2 4.32Å; I136-V148 HydrophobicContact CG2-CB 3.92Å; I136-V148 HydrophobicContact CG2-CG1 3.94Å; I136-V148 HydrophobicContact CG2-CG2 3.92Å; I146-V148 VanDerWaalsContact C-N 3.32Å; I146-V148 HydrophobicContact CG2-CG2 3.82Å; I146-V148 PolarHBondContact O-N 3.2Å
149	R	51.4	Low	60.8	Low	142 Å²	142	58 Å²	58	54%	0.536	32%	0.316	S	S	.	.			trans	-96.5	-11.3	-173.5	-78.4	-176.8	-179	-172.7	1.1	114.7	S147	S147-R149 PolarHBondContact O-N 2.8Å
150	L	65.6	Low	63.3	Low	35 Å²	35	58 Å²	58	18%	0.183	32%	0.316	C	S	.	.			trans	-129.5	110.9	-170.2	-55.8	168.8	0	0	0	110.1	Y69 A70 Y127 T164	Y69-L150 WeakPolarHBondContact O-CD1 3.43Å; A70-L150 HydrophobicContact CB-CD1 4.29Å; Y127-L150 HydrophobicContact CE2-CD1 4.27Å; L150-T164 WeakPolarHBondContact CD2-O 2.94Å
151	T	76.3	Confident	65.9	Low	52 Å²	52	55.5 Å²	55.5	32%	0.319	30%	0.299	S	S	.	.			trans	-96.6	144.4	167.8	53	0	0	0	0	108.8	T164 S173	T151-T164 WeakPolarHBondContact O-CB 3.49Å; T151-T164 PolarHBondContact O-N 3.46Å; T151-T164 PolarHBondContact O-OG1 3.48Å; T151-T164 PolarHBondContact OG1-OG1 3Å; T151-S173 PolarHBondContact OG1-O 2.86Å
152	A	84.9	Confident	68.7	Low	42 Å²	42	48.4 Å²	48.4	35%	0.347	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	145.8	174.9	0	0	0	0	0	109.8	T162 I163	A152-T162 VanDerWaalsContact CA-O 3.28Å; A152-T162 WeakPolarHBondContact CA-O 3.09Å; A152-T162 WeakPolarHBondContact CB-O 3.37Å; A152-I163 HydrophobicContact CB-CB 4.32Å; A152-I163 HydrophobicContact CB-CG1 4.28Å
153	Y	89.1	Confident	71.3	Confident	5 Å²	5	39.3 Å²	39.3	2%	0.02	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	152.6	174.3	171.2	-95.4	0	0	0	111.3	A161 T162 V174 I202 T232 D234 L244 V246	Y153-A161 HydrophobicContact CD1-CB 4.28Å; Y153-A161 PolarHBondContact O-N 3.01Å; Y153-T162 WeakPolarHBondContact CB-OG1 3.44Å; Y153-T162 PolarHBondContact N-O 2.98Å; Y153-T162 PolarHBondContact N-OG1 2.93Å; Y153-T162 PolarHBondContact O-N 2.86Å; Y153-V174 HydrophobicContact CG-CG2 4.23Å; Y153-I202 HydrophobicContact CE1-CG2 4.18Å; Y153-T232 HydrophobicContact CE1-CG2 4.35Å; Y153-T232 VanDerWaalsContact OH-CB 3.25Å; Y153-T232 WeakPolarHBondContact OH-CB 3.38Å; Y153-T232 WeakPolarHBondContact OH-CG2 3.38Å; Y153-T232 PolarHBondContact OH-OG1 3.46Å; Y153-D234 WeakPolarHBondContact CE2-OD2 3.5Å; Y153-D234 WeakPolarHBondContact OH-CB 3.49Å; Y153-D234 PolarHBondContact OH-OD2 2.98Å; Y153-L244 HydrophobicContact CD1-CD2 3.75Å; Y153-L244 HydrophobicContact CE1-CD2 4.3Å; Y153-L244 HydrophobicContact CG-CD2 4.25Å; Y153-V246 HydrophobicContact CD2-CG2 3.72Å; Y153-V246 HydrophobicContact CE2-CG2 4.01Å; Y153-V246 HydrophobicContact CG-CG2 4.18Å
154	G	88.3	Confident	73.7	Confident	6 Å²	6	35.4 Å²	35.4	6%	0.062	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.2	176.4	-175.4	0	0	0	0	0	111.3	R131 C158	R131-G154 PolarHBondContact NH2-O 2.93Å; G154-C158 WeakPolarHBondContact CA-O 3.33Å
155	M	87.6	Confident	76.4	Confident	29 Å²	29	33.7 Å²	33.7	14%	0.143	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	170.4	176.5	58	-165.9	-69.7	0	0	109.1	E157 C158 I204 I230 T232	M155-E157 HydrophobicContact CE-CB 3.86Å; M155-E157 HydrophobicContact CE-CG 3.88Å; M155-E157 WeakPolarHBondContact CE-OE2 3.25Å; M155-E157 HydrophobicContact CG-CB 3.95Å; M155-E157 PolarHBondContact O-N 2.66Å; M155-E157 VanDerWaalsContact O-N 3.16Å; M155-E157 HydrophobicContact SD-CB 4.32Å; M155-C158 PolarHBondContact N-O 2.66Å; M155-C158 CarbonylContact O-C 3.57Å; M155-C158 PolarHBondContact O-N 3.01Å; M155-I204 HydrophobicContact CG-CD1 4.3Å; M155-I204 HydrophobicContact SD-CD1 4.22Å; M155-I230 HydrophobicContact CE-CG2 4.22Å; M155-I230 HydrophobicContact SD-CG2 3.73Å; M155-T232 HydrophobicContact SD-CG2 3.94Å
156	T	86	Confident	78.8	Confident	39 Å²	39	33.1 Å²	33.1	24%	0.239	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-29.8	179.6	-43.9	0	0	0	0	111.1	A38 L50 C158	A38-T156 HydrophobicContact CB-CG2 3.73Å; L50-T156 HydrophobicContact CD1-CG2 4.16Å; L50-T156 WeakPolarHBondContact CD1-O 3.12Å; L50-T156 HydrophobicContact CD2-CG2 3.57Å; L50-T156 HydrophobicContact CG-CG2 4.34Å; T156-C158 VanDerWaalsContact C-N 3.32Å; T156-C158 PolarHBondContact O-N 3.4Å
157	E	91.3	Very high	80.8	Confident	13 Å²	13	35.8 Å²	35.8	6%	0.061	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.1	176.4	-59.7	83.1	168	0	0	113.9	S40 L50 M155 R209 M210 Y213 I230	S40-E157 PolarHBondContact OG-OE1 3.26Å; L50-E157 HydrophobicContact CD2-CG 4.42Å; M155-E157 HydrophobicContact CE-CB 3.86Å; M155-E157 HydrophobicContact CE-CG 3.88Å; M155-E157 WeakPolarHBondContact CE-OE2 3.25Å; M155-E157 HydrophobicContact CG-CB 3.95Å; M155-E157 PolarHBondContact O-N 2.66Å; M155-E157 VanDerWaalsContact O-N 3.16Å; M155-E157 HydrophobicContact SD-CB 4.32Å; E157-R209 CarbonylContact O-C 3.48Å; E157-R209 WeakPolarHBondContact O-CA 3.43Å; E157-M210 HydrophobicContact CB-CB 4.48Å; E157-M210 HydrophobicContact CB-CE 4.16Å; E157-M210 HydrophobicContact CB-CG 3.94Å; E157-M210 HydrophobicContact CB-SD 3.69Å; E157-M210 HydrophobicContact CG-CE 3.8Å; E157-M210 HydrophobicContact CG-CG 4.3Å; E157-M210 HydrophobicContact CG-SD 3.37Å; E157-M210 WeakPolarHBondContact CG-SD 3.3Å; E157-M210 PolarHBondContact O-N 2.88Å; E157-Y213 HydrophobicContact CG-CE1 4.21Å; E157-Y213 PolarHBondContact OE1-OH 2.88Å; E157-I230 HydrophobicContact CB-CD1 4.22Å; E157-I230 VanDerWaalsContact O-CD1 3.27Å; E157-I230 WeakPolarHBondContact O-CD1 3.41Å
158	C	91.5	Very high	83	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	113.1	177.9	179.7	0	0	0	0	111.1	G154 M155 T156 M181 I204 T208 R209 I230	G154-C158 WeakPolarHBondContact CA-O 3.33Å; M155-C158 PolarHBondContact N-O 2.66Å; M155-C158 CarbonylContact O-C 3.57Å; M155-C158 PolarHBondContact O-N 3.01Å; T156-C158 VanDerWaalsContact C-N 3.32Å; T156-C158 PolarHBondContact O-N 3.4Å; C158-M181 WeakPolarHBondContact SG-CE 3.27Å; C158-I204 HydrophobicContact CB-CD1 3.55Å; C158-I204 HydrophobicContact CB-CG1 4.19Å; C158-T208 PolarHBondContact SG-OG1 3.21Å; C158-R209 HydrophobicContact CB-CB 4.46Å; C158-I230 HydrophobicContact CB-CD1 3.79Å
159	A	87.5	Confident	84.6	Confident	27 Å²	27	39.2 Å²	39.2	22%	0.223	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	144.7	179.8	0	0	0	0	0	113.8	S60	S60-A159 VanDerWaalsContact CB-O 3.3Å; S60-A159 WeakPolarHBondContact CB-O 3.42Å; S60-A159 PolarHBondContact OG-O 3.08Å
160	P	90.9	Very high	86.2	Confident	7 Å²	7	35.5 Å²	35.5	5%	0.045	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-70.7	148.2	-16.4	32.9	-34.8	0	0	0	110.3	I63 M64 A178	I63-P160 HydrophobicContact CB-CG 4.42Å; I63-P160 HydrophobicContact CG2-CG 3.64Å; M64-P160 HydrophobicContact CG-CG 4.07Å; P160-A178 HydrophobicContact CG-CB 4.47Å
161	A	93.4	Very high	86.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	-44.6	168.8	0	0	0	0	0	110.6	Y153 A178 M181 I204	Y153-A161 HydrophobicContact CD1-CB 4.28Å; Y153-A161 PolarHBondContact O-N 3.01Å; A161-A178 PolarHBondContact O-N 2.79Å; A161-M181 WeakPolarHBondContact O-CB 3.34Å; A161-I204 HydrophobicContact CB-CB 4.16Å; A161-I204 HydrophobicContact CB-CD1 3.94Å; A161-I204 HydrophobicContact CB-CG2 3.8Å
162	T	93.9	Very high	87.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	154.7	170.8	68.8	0	0	0	0	110.7	A152 Y153 V174 Q176 V183 L244	A152-T162 VanDerWaalsContact CA-O 3.28Å; A152-T162 WeakPolarHBondContact CA-O 3.09Å; A152-T162 WeakPolarHBondContact CB-O 3.37Å; Y153-T162 WeakPolarHBondContact CB-OG1 3.44Å; Y153-T162 PolarHBondContact N-O 2.98Å; Y153-T162 PolarHBondContact N-OG1 2.93Å; Y153-T162 PolarHBondContact O-N 2.86Å; T162-V174 PolarHBondContact OG1-O 2.95Å; T162-Q176 CarbonylContact C-O 3.54Å; T162-Q176 WeakPolarHBondContact CA-O 3.39Å; T162-Q176 WeakPolarHBondContact CB-O 3.39Å; T162-V183 HydrophobicContact CG2-CG2 3.86Å; T162-L244 HydrophobicContact CG2-CB 3.99Å; T162-L244 HydrophobicContact CG2-CD2 3.56Å; T162-L244 HydrophobicContact CG2-CG 4.43Å
163	I	91.2	Very high	87.3	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	138	177.5	-174.8	163.9	0	0	0	109.7	Y69 A152 Q176 A178	Y69-I163 HydrophobicContact CD1-CB 4.35Å; Y69-I163 HydrophobicContact CD1-CD1 3.73Å; Y69-I163 HydrophobicContact CD1-CG1 3.62Å; Y69-I163 HydrophobicContact CD1-CG2 3.91Å; Y69-I163 HydrophobicContact CD2-CD1 4Å; Y69-I163 HydrophobicContact CD2-CG2 4.41Å; Y69-I163 HydrophobicContact CE1-CB 4.15Å; Y69-I163 HydrophobicContact CE1-CD1 4.29Å; Y69-I163 HydrophobicContact CE1-CG1 3.93Å; Y69-I163 HydrophobicContact CE1-CG2 3.31Å; Y69-I163 HydrophobicContact CE2-CG2 3.9Å; Y69-I163 HydrophobicContact CG-CD1 3.59Å; Y69-I163 HydrophobicContact CG-CG1 4.05Å; Y69-I163 HydrophobicContact CG-CG2 4.44Å; A152-I163 HydrophobicContact CB-CB 4.32Å; A152-I163 HydrophobicContact CB-CG1 4.28Å; I163-Q176 PolarHBondContact N-O 3.41Å; I163-Q176 PolarHBondContact O-N 3.43Å; I163-A178 HydrophobicContact CG2-CB 3.74Å
164	T	88.7	Confident	87.3	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-77.4	132.8	175.3	-68	0	0	0	0	109.3	Y69 L150 T151 G175	Y69-T164 WeakPolarHBondContact CD1-O 3.49Å; L150-T164 WeakPolarHBondContact CD2-O 2.94Å; T151-T164 WeakPolarHBondContact O-CB 3.49Å; T151-T164 PolarHBondContact O-N 3.46Å; T151-T164 PolarHBondContact O-OG1 3.48Å; T151-T164 PolarHBondContact OG1-OG1 3Å; T164-G175 VanDerWaalsContact OG1-CA 3.22Å; T164-G175 WeakPolarHBondContact OG1-CA 3.39Å; T164-G175 PolarHBondContact OG1-N 2.72Å
165	K	88.8	Confident	87.5	Confident	66 Å²	66	41.5 Å²	41.5	29%	0.287	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-77.4	150	171.2	-67.7	169.7	-174.4	153.9	0	110.4	E68 Y69 G167 Q168	E68-K165 HydrophobicContact CG-CG 4.45Å; Y69-K165 HydrophobicContact CD1-CG 4.22Å; Y69-K165 HydrophobicContact CE1-CB 4.34Å; Y69-K165 HydrophobicContact CE1-CG 3.5Å; K165-G167 PolarHBondContact O-N 3.06Å; K165-Q168 HydrophobicContact CB-CB 4.15Å; K165-Q168 HydrophobicContact CB-CG 4.29Å; K165-Q168 PolarHBondContact O-N 2.9Å
166	Q	83.5	Confident	87.9	Confident	103 Å²	103	42.1 Å²	42.1	48%	0.481	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	125.3	175.4	-168.5	-177.4	29.2	0	0	110.2	E68 A70 Q168	E68-Q166 WeakPolarHBondContact O-CB 3.31Å; E68-Q166 PolarHBondContact O-N 3.17Å; A70-Q166 HydrophobicContact CB-CB 4.46Å; A70-Q166 HydrophobicContact CB-CG 4.32Å; Q166-Q168 VanDerWaalsContact C-N 3.27Å; Q166-Q168 PolarHBondContact O-N 2.87Å
167	G	81.3	Confident	88.4	Confident	70 Å²	70	42.2 Å²	42.2	72%	0.722	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-0.7	-179.7	0	0	0	0	0	115.4	K165	K165-G167 PolarHBondContact O-N 3.06Å
168	Q	85	Confident	88.5	Confident	103 Å²	103	41.7 Å²	41.7	48%	0.481	25%	0.253	S	S	.	.			trans	-116.5	33.5	179.4	-57.9	-173.3	1.2	0	0	112.2	K165 Q166 K170 H243	K165-Q168 HydrophobicContact CB-CB 4.15Å; K165-Q168 HydrophobicContact CB-CG 4.29Å; K165-Q168 PolarHBondContact O-N 2.9Å; Q166-Q168 VanDerWaalsContact C-N 3.27Å; Q166-Q168 PolarHBondContact O-N 2.87Å; Q168-K170 PolarHBondContact O-N 3.34Å; Q168-H243 PolarHBondContact O-NE2 2.81Å
169	S	80.5	Confident	88.8	Confident	78 Å²	78	43 Å²	43	55%	0.545	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-76.8	123.4	177.5	59.9	0	0	0	0	111.2
170	K	84.6	Confident	89.2	Confident	63 Å²	63	46.5 Å²	46.5	27%	0.274	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-94.8	136	163.4	-69.4	-168.4	-175.7	-175.8	0	110.7	Q168 G172 S173 D239 D241 H243 F245	Q168-K170 PolarHBondContact O-N 3.34Å; K170-G172 PolarHBondContact O-N 2.72Å; K170-S173 WeakPolarHBondContact O-CB 3.42Å; K170-S173 PolarHBondContact O-N 3.36Å; K170-D239 VanDerWaalsContact CD-OD2 3.32Å; K170-D239 WeakPolarHBondContact CD-OD2 3.35Å; K170-D239 IonicContact NZ-OD1 2.88Å; K170-D239 IonicContact NZ-OD2 2.73Å; K170-D239 PolarHBondContact NZ-OD2 3.17Å; K170-D241 IonicContact NZ-OD2 2.83Å; K170-D241 PolarHBondContact NZ-OD2 3.15Å; K170-H243 HydrophobicContact CD-CB 4.14Å; K170-F245 HydrophobicContact CB-CZ 4.41Å
171	L	80.9	Confident	89.5	Confident	176 Å²	176	46.7 Å²	46.7	92%	0.921	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	123.7	179.9	-178.7	65.3	0	0	0	110.5	S173 F245	L171-S173 VanDerWaalsContact C-N 3.28Å; L171-S173 PolarHBondContact O-N 2.78Å; L171-F245 WeakPolarHBondContact O-CE1 3.38Å
172	G	80.1	Confident	89.7	Confident	60 Å²	60	50.7 Å²	50.7	62%	0.619	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	-11.9	-178.9	0	0	0	0	0	115.1	K170	K170-G172 PolarHBondContact O-N 2.72Å
173	S	88.7	Confident	89.9	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.028	31%	0.308	C	S	.	.			trans	-79.2	147.9	176.9	178.8	0	0	0	0	112.4	T151 K170 L171 G175 H243 L244	T151-S173 PolarHBondContact OG1-O 2.86Å; K170-S173 WeakPolarHBondContact O-CB 3.42Å; K170-S173 PolarHBondContact O-N 3.36Å; L171-S173 VanDerWaalsContact C-N 3.28Å; L171-S173 PolarHBondContact O-N 2.78Å; S173-G175 VanDerWaalsContact C-N 3.34Å; S173-G175 PolarHBondContact OG-N 3.48Å; S173-H243 WeakPolarHBondContact OG-CB 3.25Å; S173-L244 CarbonylContact C-O 3.57Å; S173-L244 VanDerWaalsContact CA-O 3.32Å; S173-L244 WeakPolarHBondContact CA-O 3.49Å; S173-L244 PolarHBondContact OG-O 2.73Å
174	V	89.6	Confident	90.2	Very high	27 Å²	27	53.5 Å²	53.5	16%	0.164	32%	0.316	C	S	.	.			trans	-96.9	16.9	168.7	-62.9	0	0	0	0	112.8	Y153 T162 L244 V246	Y153-V174 HydrophobicContact CG-CG2 4.23Å; T162-V174 PolarHBondContact OG1-O 2.95Å; V174-L244 HydrophobicContact CG2-CB 3.75Å; V174-L244 HydrophobicContact CG2-CD2 3.68Å; V174-L244 HydrophobicContact CG2-CG 3.66Å; V174-L244 WeakPolarHBondContact CG2-O 3.47Å; V174-L244 PolarHBondContact N-O 2.73Å; V174-V246 HydrophobicContact CG1-CG2 4.09Å; V174-V246 HydrophobicContact CG2-CG2 3.84Å
175	G	92.2	Very high	90.7	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.318	C	S	.	.			trans	90.7	-169.8	177.6	0	0	0	0	0	113.8	T164 S173 L244	T164-G175 VanDerWaalsContact OG1-CA 3.22Å; T164-G175 WeakPolarHBondContact OG1-CA 3.39Å; T164-G175 PolarHBondContact OG1-N 2.72Å; S173-G175 VanDerWaalsContact C-N 3.34Å; S173-G175 PolarHBondContact OG-N 3.48Å; G175-L244 PolarHBondContact O-N 3.09Å
176	Q	95.6	Very high	91.1	Very high	41 Å²	41	50.9 Å²	50.9	19%	0.192	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	164.1	179.6	-65.7	-179.4	-57.3	0	0	110.5	T162 I163 A178 D241	T162-Q176 CarbonylContact C-O 3.54Å; T162-Q176 WeakPolarHBondContact CA-O 3.39Å; T162-Q176 WeakPolarHBondContact CB-O 3.39Å; I163-Q176 PolarHBondContact N-O 3.41Å; I163-Q176 PolarHBondContact O-N 3.43Å; Q176-A178 PolarHBondContact O-N 2.65Å; Q176-D241 PolarHBondContact NE2-O 3.12Å
177	P	96.7	Very high	91.8	Very high	42 Å²	42	48.5 Å²	48.5	27%	0.273	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-46.2	127.9	170.7	-28.1	35.5	0	0	0	111.7	V183	P177-V183 HydrophobicContact CB-CG2 4.05Å; P177-V183 HydrophobicContact CG-CB 3.99Å; P177-V183 HydrophobicContact CG-CG2 3.86Å
178	A	95.1	Very high	92.2	Very high	2 Å²	2	48.2 Å²	48.2	2%	0.017	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-67	162.2	177.5	0	0	0	0	0	110.4	I63 P160 A161 I163 Q176 S180 M181	I63-A178 HydrophobicContact CD1-CB 4.28Å; I63-A178 HydrophobicContact CG2-CB 3.78Å; P160-A178 HydrophobicContact CG-CB 4.47Å; A161-A178 PolarHBondContact O-N 2.79Å; I163-A178 HydrophobicContact CG2-CB 3.74Å; Q176-A178 PolarHBondContact O-N 2.65Å; A178-S180 PolarHBondContact O-N 3.08Å; A178-M181 HydrophobicContact CB-CB 4.25Å; A178-M181 HydrophobicContact CB-CG 3.76Å; A178-M181 WeakPolarHBondContact O-CA 3.5Å; A178-M181 VanDerWaalsContact O-CB 3.24Å; A178-M181 WeakPolarHBondContact O-CB 3.42Å; A178-M181 PolarHBondContact O-N 2.94Å
179	P	96.1	Very high	92.4	Very high	27 Å²	27	51.3 Å²	51.3	18%	0.175	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	132.9	178.9	-27.8	37.5	0	0	0	111.7	I63 Y69 M181	I63-P179 WeakPolarHBondContact CD1-O 3.44Å; Y69-P179 HydrophobicContact CE2-CG 4.33Å; Y69-P179 VanDerWaalsContact OH-CD 3.32Å; Y69-P179 WeakPolarHBondContact OH-CD 3.32Å; P179-M181 PolarHBondContact O-N 3.25Å
180	S	96.2	Very high	93	Very high	100 Å²	100	50.7 Å²	50.7	70%	0.699	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	10	-174.6	-48.9	0	0	0	0	115.3	A178 P207	A178-S180 PolarHBondContact O-N 3.08Å; S180-P207 WeakPolarHBondContact O-CD 3.07Å
181	M	97.5	Very high	93.4	Very high	12 Å²	12	50.3 Å²	50.3	6%	0.059	30%	0.302	C	S	.	.			trans	-99.6	144.8	169.3	-58.5	-57.2	-58.7	0	0	110	I63 C158 A161 A178 P179 R205 T208	I63-M181 HydrophobicContact CD1-CG 4.15Å; I63-M181 HydrophobicContact CD1-SD 4.4Å; C158-M181 WeakPolarHBondContact SG-CE 3.27Å; A161-M181 WeakPolarHBondContact O-CB 3.34Å; A178-M181 HydrophobicContact CB-CB 4.25Å; A178-M181 HydrophobicContact CB-CG 3.76Å; A178-M181 WeakPolarHBondContact O-CA 3.5Å; A178-M181 VanDerWaalsContact O-CB 3.24Å; A178-M181 WeakPolarHBondContact O-CB 3.42Å; A178-M181 PolarHBondContact O-N 2.94Å; P179-M181 PolarHBondContact O-N 3.25Å; M181-R205 WeakPolarHBondContact CA-O 3.44Å; M181-R205 WeakPolarHBondContact CE-O 3.07Å; M181-T208 VanDerWaalsContact CE-OG1 3.25Å; M181-T208 WeakPolarHBondContact CE-OG1 3.48Å; M181-T208 HydrophobicContact SD-CG2 3.88Å; M181-T208 PolarHBondContact SD-OG1 2.91Å
182	E	97.9	Very high	94.2	Very high	83 Å²	83	48.4 Å²	48.4	39%	0.388	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	138.6	173.1	-61.1	170.6	-90.6	0	0	108.4	I204 R205 W229	E182-I204 WeakPolarHBondContact O-CA 3.36Å; E182-R205 HydrophobicContact CB-CB 4.41Å; E182-R205 PolarHBondContact N-O 2.82Å; E182-R205 PolarHBondContact O-N 2.98Å; E182-R205 IonicContact OE1-CZ 2.82Å; E182-R205 VanDerWaalsContact OE1-CZ 3.27Å; E182-R205 IonicContact OE1-NE 3.83Å; E182-R205 PolarHBondContact OE1-NE 2.91Å; E182-R205 IonicContact OE1-NH2 2.91Å; E182-R205 PolarHBondContact OE1-NH2 3.44Å; E182-R205 IonicContact OE2-CZ 2.66Å; E182-R205 IonicContact OE2-NE 2.66Å; E182-R205 IonicContact OE2-NH2 3.61Å; E182-R205 PolarHBondContact OE2-NH2 2.98Å; E182-W229 HydrophobicContact CB-CH2 3.67Å; E182-W229 HydrophobicContact CB-CZ2 4.46Å; E182-W229 HydrophobicContact CB-CZ3 4.09Å
183	V	98.1	Very high	95	Very high	19 Å²	19	51.5 Å²	51.5	12%	0.115	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.1	176.3	-177	0	0	0	0	107.9	T162 P177 I202 W203 I204 L244	T162-V183 HydrophobicContact CG2-CG2 3.86Å; P177-V183 HydrophobicContact CB-CG2 4.05Å; P177-V183 HydrophobicContact CG-CB 3.99Å; P177-V183 HydrophobicContact CG-CG2 3.86Å; V183-I202 HydrophobicContact CG1-CG2 3.92Å; V183-W203 WeakPolarHBondContact CA-O 3.39Å; V183-I204 HydrophobicContact CG1-CG2 4.41Å; V183-I204 HydrophobicContact CG2-CG2 4.17Å; V183-L244 HydrophobicContact CG1-CD1 4.47Å; V183-L244 HydrophobicContact CG1-CD2 4.46Å
184	K	97.9	Very high	95.5	Very high	46 Å²	46	52 Å²	52	20%	0.2	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	158.8	169.5	72.3	-179.1	178.9	-174.6	0	110.2	V186 L193 W203 W229	K184-V186 HydrophobicContact CD-CG2 4.21Å; K184-V186 HydrophobicContact CG-CG2 4.09Å; K184-L193 HydrophobicContact CB-CD1 3.72Å; K184-L193 HydrophobicContact CD-CD1 4.25Å; K184-L193 HydrophobicContact CG-CD1 4.35Å; K184-W203 HydrophobicContact CG-CB 3.85Å; K184-W203 PolarHBondContact N-O 3.28Å; K184-W203 PolarHBondContact O-N 2.94Å; K184-W229 HydrophobicContact CB-CH2 4.04Å; K184-W229 HydrophobicContact CB-CZ3 4.13Å; K184-W229 HydrophobicContact CD-CD2 4.12Å; K184-W229 HydrophobicContact CD-CE3 4.18Å; K184-W229 HydrophobicContact CD-CH2 3.8Å; K184-W229 HydrophobicContact CD-CZ2 3.74Å; K184-W229 HydrophobicContact CD-CZ3 4.03Å; K184-W229 HydrophobicContact CG-CD2 4.41Å; K184-W229 HydrophobicContact CG-CE3 3.97Å; K184-W229 HydrophobicContact CG-CH2 3.8Å; K184-W229 HydrophobicContact CG-CZ2 4.27Å; K184-W229 HydrophobicContact CG-CZ3 3.64Å
185	V	98.5	Very high	95.8	Very high	7 Å²	7	58.2 Å²	58.2	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.8	176.8	-178.3	0	0	0	0	108.1	C194 G200 E201 G236 L238	V185-C194 HydrophobicContact CB-CB 4.07Å; V185-C194 HydrophobicContact CG1-CB 3.83Å; V185-C194 WeakPolarHBondContact O-CB 3.44Å; V185-C194 PolarHBondContact O-N 3.08Å; V185-G200 VanDerWaalsContact CG1-CA 3.45Å; V185-G200 VanDerWaalsContact CG1-N 3.29Å; V185-E201 CarbonylContact C-O 3.59Å; V185-E201 WeakPolarHBondContact CA-O 3.4Å; V185-G236 VanDerWaalsContact CG1-O 3.28Å; V185-G236 WeakPolarHBondContact CG1-O 3.5Å; V185-L238 HydrophobicContact CG2-CD1 4.38Å; V185-L238 HydrophobicContact CG2-CG 4.16Å
186	V	98.1	Very high	96.1	Very high	6 Å²	6	62.4 Å²	62.4	4%	0.036	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132	-173.1	-177.3	0	0	0	0	109.9	K184 L188 G191 E192 G200 E201 W203	K184-V186 HydrophobicContact CD-CG2 4.21Å; K184-V186 HydrophobicContact CG-CG2 4.09Å; V186-L188 PolarHBondContact O-N 2.64Å; V186-G191 VanDerWaalsContact CG1-C 3.45Å; V186-G191 VanDerWaalsContact CG1-O 3.28Å; V186-G191 WeakPolarHBondContact CG1-O 3.36Å; V186-E192 CarbonylContact C-O 3.55Å; V186-E192 WeakPolarHBondContact CA-O 2.95Å; V186-G200 CarbonylContact O-C 3.56Å; V186-G200 VanDerWaalsContact O-CA 3.29Å; V186-G200 WeakPolarHBondContact O-CA 3.24Å; V186-E201 PolarHBondContact N-O 3.31Å; V186-E201 PolarHBondContact O-N 2.69Å; V186-W203 HydrophobicContact CB-CZ2 4.48Å; V186-W203 HydrophobicContact CG1-CZ2 4.31Å; V186-W203 HydrophobicContact CG2-CD2 3.77Å; V186-W203 HydrophobicContact CG2-CE3 4.17Å; V186-W203 HydrophobicContact CG2-CG 3.96Å; V186-W203 HydrophobicContact CG2-CZ2 4.37Å
187	N	96.3	Very high	96.1	Very high	53 Å²	53	63.9 Å²	63.9	28%	0.283	35%	0.352	S	S	.	.			trans	-62.7	128.9	178.3	-174.9	-69	0	0	0	110.5	Q189 S190 G191 E192 C194	N187-Q189 PolarHBondContact O-N 3.29Å; N187-Q189 WeakPolarHBondContact OD1-CA 3.41Å; N187-Q189 WeakPolarHBondContact OD1-CB 2.96Å; N187-Q189 PolarHBondContact OD1-N 3.49Å; N187-S190 VanDerWaalsContact CB-OG 3.32Å; N187-S190 WeakPolarHBondContact CB-OG 3.34Å; N187-S190 PolarHBondContact OD1-N 2.73Å; N187-G191 WeakPolarHBondContact O-CA 3.22Å; N187-G191 PolarHBondContact O-N 3.23Å; N187-E192 PolarHBondContact N-O 3.39Å; N187-C194 PolarHBondContact N-SG 3.07Å; N187-C194 VanDerWaalsContact N-SG 3.39Å
188	L	91.4	Very high	96.1	Very high	64 Å²	64	66 Å²	66	34%	0.335	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-21	-176	-70.1	166	0	0	0	114.4	V186 E201 T235 I250	V186-L188 PolarHBondContact O-N 2.64Å; L188-E201 HydrophobicContact CD2-CB 3.85Å; L188-T235 HydrophobicContact CD1-CG2 4.01Å; L188-I250 HydrophobicContact CD2-CD1 3.42Å; L188-I250 VanDerWaalsContact CD2-CD1 3.42Å; L188-I250 HydrophobicContact CD2-CG1 3.93Å
189	Q	88	Confident	96	Very high	167 Å²	167	69.5 Å²	69.5	78%	0.78	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-52.1	-177.1	-65.9	175.8	0.6	0	0	111.5	N187	N187-Q189 PolarHBondContact O-N 3.29Å; N187-Q189 WeakPolarHBondContact OD1-CA 3.41Å; N187-Q189 WeakPolarHBondContact OD1-CB 2.96Å; N187-Q189 PolarHBondContact OD1-N 3.49Å
190	S	93.8	Very high	96	Very high	66 Å²	66	68.2 Å²	68.2	46%	0.462	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-23.1	-176.9	65.7	0	0	0	0	113.5	N187 E192	N187-S190 VanDerWaalsContact CB-OG 3.32Å; N187-S190 WeakPolarHBondContact CB-OG 3.34Å; N187-S190 PolarHBondContact OD1-N 2.73Å; S190-E192 PolarHBondContact O-N 3.48Å; S190-E192 WeakPolarHBondContact OG-CB 3.02Å; S190-E192 PolarHBondContact OG-N 3.29Å
191	G	93.3	Very high	96.1	Very high	54 Å²	54	64.9 Å²	64.9	56%	0.557	34%	0.344	S	S	*	.			trans	72.8	7	-171.4	0	0	0	0	0	113.9	V186 N187	V186-G191 VanDerWaalsContact CG1-C 3.45Å; V186-G191 VanDerWaalsContact CG1-O 3.28Å; V186-G191 WeakPolarHBondContact CG1-O 3.36Å; N187-G191 WeakPolarHBondContact O-CA 3.22Å; N187-G191 PolarHBondContact O-N 3.23Å
192	E	96.5	Very high	96.1	Very high	137 Å²	137	64.3 Å²	64.3	64%	0.64	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-85.6	161.9	178.6	-63.1	-177.8	155.8	0	0	112	V186 N187 S190 C194	V186-E192 CarbonylContact C-O 3.55Å; V186-E192 WeakPolarHBondContact CA-O 2.95Å; N187-E192 PolarHBondContact N-O 3.39Å; S190-E192 PolarHBondContact O-N 3.48Å; S190-E192 WeakPolarHBondContact OG-CB 3.02Å; S190-E192 PolarHBondContact OG-N 3.29Å; E192-C194 PolarHBondContact O-N 3.03Å
193	L	97.8	Very high	96.1	Very high	125 Å²	125	62.1 Å²	62.1	65%	0.654	33%	0.33	S	S	*	.	B	Isolated β-bridge	trans	-65.6	127.1	174.7	-172.4	72	0	0	0	110.2	K184	K184-L193 HydrophobicContact CB-CD1 3.72Å; K184-L193 HydrophobicContact CD-CD1 4.25Å; K184-L193 HydrophobicContact CG-CD1 4.35Å
194	C	97.9	Very high	96.1	Very high	14 Å²	14	61.2 Å²	61.2	10%	0.095	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-70.5	147.8	171.7	-75.8	0	0	0	0	111	V185 N187 E192 E198	V185-C194 HydrophobicContact CB-CB 4.07Å; V185-C194 HydrophobicContact CG1-CB 3.83Å; V185-C194 WeakPolarHBondContact O-CB 3.44Å; V185-C194 PolarHBondContact O-N 3.08Å; N187-C194 PolarHBondContact N-SG 3.07Å; N187-C194 VanDerWaalsContact N-SG 3.39Å; E192-C194 PolarHBondContact O-N 3.03Å; C194-E198 HydrophobicContact CB-CB 3.99Å
195	K	97.5	Very high	96.1	Very high	157 Å²	157	62.5 Å²	62.5	68%	0.683	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-71.2	165.1	166.4	-61	176.7	-177.2	172.3	0	110.1	E198	K195-E198 HydrophobicContact CB-CG 4.12Å; K195-E198 PolarHBondContact N-OE2 3.1Å; K195-E198 WeakPolarHBondContact O-CB 3.14Å; K195-E198 PolarHBondContact O-N 2.84Å; K195-E198 VanDerWaalsContact O-N 3.1Å
196	H	97.1	Very high	96	Very high	89 Å²	89	62.8 Å²	62.8	41%	0.412	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	144.9	167.3	-69.8	95.2	0	0	0	111	E198 L238 D239 D240 D242	H196-E198 PolarHBondContact O-N 3.35Å; H196-E198 VanDerWaalsContact O-N 3.1Å; H196-L238 CarbonylContact C-O 3.52Å; H196-L238 WeakPolarHBondContact CA-O 3.45Å; H196-D239 PolarHBondContact CD2-O 2.82Å; H196-D240 WeakPolarHBondContact CB-OD1 3.48Å; H196-D242 IonicContact CD2-OD1 3.2Å; H196-D242 IonicContact CE1-OD1 3.67Å; H196-D242 IonicContact NE2-OD1 2.64Å; H196-D242 PolarHBondContact NE2-OD1 2.87Å
197	C	96.3	Very high	95.9	Very high	72 Å²	72	64.4 Å²	64.4	49%	0.486	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	4.3	-173.5	-57.8	0	0	0	0	116.1	L238	C197-L238 PolarHBondContact N-O 2.88Å
198	E	95.9	Very high	95.9	Very high	85 Å²	85	61.9 Å²	61.9	40%	0.397	33%	0.33	S	S	.	.			trans	-92	134.2	171.2	-66.7	-179.4	168.2	0	0	111.3	C194 K195 H196 Y237	C194-E198 HydrophobicContact CB-CB 3.99Å; K195-E198 HydrophobicContact CB-CG 4.12Å; K195-E198 PolarHBondContact N-OE2 3.1Å; K195-E198 WeakPolarHBondContact O-CB 3.14Å; K195-E198 PolarHBondContact O-N 2.84Å; K195-E198 VanDerWaalsContact O-N 3.1Å; H196-E198 PolarHBondContact O-N 3.35Å; H196-E198 VanDerWaalsContact O-N 3.1Å; E198-Y237 VanDerWaalsContact O-CB 3.24Å; E198-Y237 WeakPolarHBondContact O-CB 3.45Å
199	V	94.4	Very high	96	Very high	77 Å²	77	63.5 Å²	63.5	47%	0.467	33%	0.331	S	S	.	.			trans	-81.9	129	-179.2	-179.2	0	0	0	0	110.6	G236 Y237 V247	V199-G236 WeakPolarHBondContact CA-O 3.39Å; V199-Y237 HydrophobicContact CG2-CD1 4.06Å; V199-V247 HydrophobicContact CG1-CG2 4.26Å; V199-V247 HydrophobicContact CG2-CG2 4.2Å
200	G	96.4	Very high	96.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	-168.8	173	0	0	0	0	0	111.9	V185 V186 T235 G236	V185-G200 VanDerWaalsContact CG1-CA 3.45Å; V185-G200 VanDerWaalsContact CG1-N 3.29Å; V186-G200 CarbonylContact O-C 3.56Å; V186-G200 VanDerWaalsContact O-CA 3.29Å; V186-G200 WeakPolarHBondContact O-CA 3.24Å; G200-T235 CarbonylContact O-C 3.59Å; G200-T235 WeakPolarHBondContact O-CA 3.49Å; G200-G236 PolarHBondContact N-O 2.73Å; G200-G236 PolarHBondContact O-N 2.83Å
201	E	97.1	Very high	96.4	Very high	30 Å²	30	56 Å²	56	14%	0.14	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	131.8	171.2	-172.6	176.6	-158.5	0	0	110.8	V185 V186 L188 W203 G233 D234 I250	V185-E201 CarbonylContact C-O 3.59Å; V185-E201 WeakPolarHBondContact CA-O 3.4Å; V186-E201 PolarHBondContact N-O 3.31Å; V186-E201 PolarHBondContact O-N 2.69Å; L188-E201 HydrophobicContact CD2-CB 3.85Å; E201-W203 VanDerWaalsContact CD-NE1 3.27Å; E201-W203 PolarHBondContact O-N 3.41Å; E201-W203 PolarHBondContact OE2-NE1 3.06Å; E201-G233 WeakPolarHBondContact OE1-CA 3.43Å; E201-G233 PolarHBondContact OE1-N 3.15Å; E201-G233 VanDerWaalsContact OE1-N 3.09Å; E201-D234 WeakPolarHBondContact CA-O 3.42Å; E201-I250 HydrophobicContact CB-CD1 3.98Å; E201-I250 HydrophobicContact CG-CD1 3.64Å
202	I	98	Very high	96.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.8	175.8	-54.7	164.5	0	0	0	108.3	Y153 V183 I204 T232 D234 L244 V246	Y153-I202 HydrophobicContact CE1-CG2 4.18Å; V183-I202 HydrophobicContact CG1-CG2 3.92Å; I202-I204 HydrophobicContact CG2-CG2 4.03Å; I202-T232 HydrophobicContact CB-CG2 4.42Å; I202-T232 HydrophobicContact CG2-CG2 4.34Å; I202-T232 VanDerWaalsContact O-CB 3.3Å; I202-T232 WeakPolarHBondContact O-CB 3.48Å; I202-T232 WeakPolarHBondContact O-CG2 3.25Å; I202-T232 PolarHBondContact O-N 3.35Å; I202-T232 PolarHBondContact O-OG1 3.23Å; I202-D234 HydrophobicContact CD1-CB 4.18Å; I202-D234 PolarHBondContact N-O 3.44Å; I202-L244 HydrophobicContact CD1-CD1 3.99Å; I202-L244 HydrophobicContact CD1-CD2 4.3Å; I202-L244 HydrophobicContact CD1-CG 4.49Å; I202-L244 HydrophobicContact CG1-CD1 4.09Å; I202-L244 HydrophobicContact CG2-CD1 4.33Å; I202-L244 HydrophobicContact CG2-CD2 4.2Å; I202-V246 HydrophobicContact CD1-CG2 4.04Å
203	W	97.9	Very high	96.5	Very high	37 Å²	37	48.8 Å²	48.8	14%	0.14	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.8	172.6	-72.1	25.8	0	0	0	109.1	V183 K184 V186 E201 T225 W229 I230 K231	V183-W203 WeakPolarHBondContact CA-O 3.39Å; K184-W203 HydrophobicContact CG-CB 3.85Å; K184-W203 PolarHBondContact N-O 3.28Å; K184-W203 PolarHBondContact O-N 2.94Å; V186-W203 HydrophobicContact CB-CZ2 4.48Å; V186-W203 HydrophobicContact CG1-CZ2 4.31Å; V186-W203 HydrophobicContact CG2-CD2 3.77Å; V186-W203 HydrophobicContact CG2-CE3 4.17Å; V186-W203 HydrophobicContact CG2-CG 3.96Å; V186-W203 HydrophobicContact CG2-CZ2 4.37Å; E201-W203 VanDerWaalsContact CD-NE1 3.27Å; E201-W203 PolarHBondContact O-N 3.41Å; E201-W203 PolarHBondContact OE2-NE1 3.06Å; W203-T225 HydrophobicContact CE3-CG2 4.09Å; W203-T225 HydrophobicContact CH2-CG2 3.89Å; W203-T225 HydrophobicContact CZ3-CG2 3.54Å; W203-W229 HydrophobicContact CB-CB 4.41Å; W203-W229 HydrophobicContact CB-CD2 4.46Å; W203-W229 HydrophobicContact CB-CE3 3.84Å; W203-W229 HydrophobicContact CD2-CB 4.47Å; W203-W229 HydrophobicContact CE3-CB 3.72Å; W203-W229 HydrophobicContact CE3-CG 4.05Å; W203-W229 HydrophobicContact CZ3-CB 4.5Å; W203-W229 WeakPolarHBondContact O-CZ3 3.5Å; W203-I230 WeakPolarHBondContact CA-O 3.47Å; W203-K231 HydrophobicContact CD2-CG 4.09Å; W203-K231 HydrophobicContact CH2-CD 4.44Å; W203-K231 HydrophobicContact CH2-CG 4.47Å; W203-K231 HydrophobicContact CZ2-CD 3.81Å; W203-K231 HydrophobicContact CZ2-CG 3.86Å
204	I	97.8	Very high	96.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.4	-175	62.6	-174.4	0	0	0	110.9	M155 C158 A161 E182 V183 I202 I230 T232	M155-I204 HydrophobicContact CG-CD1 4.3Å; M155-I204 HydrophobicContact SD-CD1 4.22Å; C158-I204 HydrophobicContact CB-CD1 3.55Å; C158-I204 HydrophobicContact CB-CG1 4.19Å; A161-I204 HydrophobicContact CB-CB 4.16Å; A161-I204 HydrophobicContact CB-CD1 3.94Å; A161-I204 HydrophobicContact CB-CG2 3.8Å; E182-I204 WeakPolarHBondContact O-CA 3.36Å; V183-I204 HydrophobicContact CG1-CG2 4.41Å; V183-I204 HydrophobicContact CG2-CG2 4.17Å; I202-I204 HydrophobicContact CG2-CG2 4.03Å; I204-I230 HydrophobicContact CD1-CG2 4.46Å; I204-I230 HydrophobicContact CG1-CB 3.93Å; I204-I230 HydrophobicContact CG1-CG2 4.17Å; I204-I230 PolarHBondContact N-O 3.31Å; I204-I230 PolarHBondContact O-N 2.84Å; I204-T232 HydrophobicContact CD1-CG2 3.74Å; I204-T232 HydrophobicContact CG1-CG2 3.9Å; I204-T232 HydrophobicContact CG2-CG2 4.06Å
205	R	97.4	Very high	96.1	Very high	72 Å²	72	53.7 Å²	53.7	27%	0.272	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147	176.9	-172.6	173	72.2	179.2	-1.1	109.6	M181 E182 D227 W229	M181-R205 WeakPolarHBondContact CA-O 3.44Å; M181-R205 WeakPolarHBondContact CE-O 3.07Å; E182-R205 HydrophobicContact CB-CB 4.41Å; E182-R205 PolarHBondContact N-O 2.82Å; E182-R205 PolarHBondContact O-N 2.98Å; E182-R205 IonicContact OE1-CZ 2.82Å; E182-R205 VanDerWaalsContact OE1-CZ 3.27Å; E182-R205 IonicContact OE1-NE 3.83Å; E182-R205 PolarHBondContact OE1-NE 2.91Å; E182-R205 IonicContact OE1-NH2 2.91Å; E182-R205 PolarHBondContact OE1-NH2 3.44Å; E182-R205 IonicContact OE2-CZ 2.66Å; E182-R205 IonicContact OE2-NE 2.66Å; E182-R205 IonicContact OE2-NH2 3.61Å; E182-R205 PolarHBondContact OE2-NH2 2.98Å; R205-D227 WeakPolarHBondContact CD-O 3.38Å; R205-D227 PolarHBondContact NH1-O 3.12Å; R205-D227 VanDerWaalsContact NH1-O 3.13Å; R205-W229 HydrophobicContact CB-CD2 3.79Å; R205-W229 HydrophobicContact CB-CE3 3.65Å; R205-W229 HydrophobicContact CB-CG 4.32Å; R205-W229 HydrophobicContact CB-CH2 4.36Å; R205-W229 HydrophobicContact CB-CZ2 4.48Å; R205-W229 HydrophobicContact CB-CZ3 3.95Å
206	G	97	Very high	96	Very high	13 Å²	13	48.9 Å²	48.9	13%	0.134	25%	0.251	C	S	.	.	S	Bend	trans	156.5	-177.3	176.6	0	0	0	0	0	111.9	T208 R209	G206-T208 PolarHBondContact O-N 3.03Å; G206-R209 VanDerWaalsContact O-CG 3.26Å; G206-R209 WeakPolarHBondContact O-CG 3.39Å; G206-R209 PolarHBondContact O-N 3.23Å
207	P	96.3	Very high	95.9	Very high	40 Å²	40	49.5 Å²	49.5	26%	0.26	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.2	-171.5	31.1	-37.8	0	0	0	113.6	R55 A56 S59 S180 R209	R55-P207 HydrophobicContact CG-CB 4.48Å; A56-P207 VanDerWaalsContact CA-O 3.23Å; A56-P207 WeakPolarHBondContact CA-O 3.23Å; S59-P207 WeakPolarHBondContact OG-CB 3.49Å; S180-P207 WeakPolarHBondContact O-CD 3.07Å; P207-R209 VanDerWaalsContact C-N 3.27Å; P207-R209 PolarHBondContact O-N 2.86Å
208	T	95	Very high	95.8	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	0.2	179	66.2	0	0	0	0	113.8	S60 I63 C158 M181 G206	S60-T208 WeakPolarHBondContact OG-CG2 3.36Å; I63-T208 HydrophobicContact CD1-CG2 3.73Å; C158-T208 PolarHBondContact SG-OG1 3.21Å; M181-T208 VanDerWaalsContact CE-OG1 3.25Å; M181-T208 WeakPolarHBondContact CE-OG1 3.48Å; M181-T208 HydrophobicContact SD-CG2 3.88Å; M181-T208 PolarHBondContact SD-OG1 2.91Å; G206-T208 PolarHBondContact O-N 3.03Å
209	R	94.9	Very high	95.7	Very high	98 Å²	98	49.3 Å²	49.3	37%	0.37	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-70.2	148.2	-178.3	73.8	-178.3	-175.5	137.6	6.3	112.2	A56 E157 C158 G206 P207 G228 I230	A56-R209 WeakPolarHBondContact CB-O 3.49Å; E157-R209 CarbonylContact O-C 3.48Å; E157-R209 WeakPolarHBondContact O-CA 3.43Å; C158-R209 HydrophobicContact CB-CB 4.46Å; G206-R209 VanDerWaalsContact O-CG 3.26Å; G206-R209 WeakPolarHBondContact O-CG 3.39Å; G206-R209 PolarHBondContact O-N 3.23Å; P207-R209 VanDerWaalsContact C-N 3.27Å; P207-R209 PolarHBondContact O-N 2.86Å; R209-G228 PolarHBondContact NH1-O 2.85Å; R209-I230 HydrophobicContact CB-CD1 3.62Å
210	M	94.9	Very high	95.7	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.24	C	C	.	.			trans	-61.1	156.5	167.6	72.4	170.6	-176.9	0	0	111.2	L50 L51 L52 E157 Y213 T223 I224 I230	L50-M210 HydrophobicContact CB-SD 3.83Å; L50-M210 HydrophobicContact CD1-CB 4.02Å; L51-M210 WeakPolarHBondContact O-CA 3.2Å; L51-M210 WeakPolarHBondContact O-CB 3.28Å; L52-M210 HydrophobicContact CD2-CB 4.21Å; E157-M210 HydrophobicContact CB-CB 4.48Å; E157-M210 HydrophobicContact CB-CE 4.16Å; E157-M210 HydrophobicContact CB-CG 3.94Å; E157-M210 HydrophobicContact CB-SD 3.69Å; E157-M210 HydrophobicContact CG-CE 3.8Å; E157-M210 HydrophobicContact CG-CG 4.3Å; E157-M210 HydrophobicContact CG-SD 3.37Å; E157-M210 WeakPolarHBondContact CG-SD 3.3Å; E157-M210 PolarHBondContact O-N 2.88Å; M210-Y213 HydrophobicContact CE-CD2 4Å; M210-Y213 HydrophobicContact CE-CE1 4.24Å; M210-Y213 HydrophobicContact CE-CE2 3.66Å; M210-Y213 HydrophobicContact CE-CG 4.46Å; M210-Y213 HydrophobicContact SD-CD1 4.34Å; M210-Y213 HydrophobicContact SD-CE1 4.12Å; M210-T223 HydrophobicContact CE-CG2 3.86Å; M210-I224 HydrophobicContact CE-CD1 3.75Å; M210-I224 HydrophobicContact CE-CG1 3.89Å; M210-I224 HydrophobicContact CG-CD1 4.2Å; M210-I230 HydrophobicContact CG-CD1 4.42Å
211	T	95.5	Very high	95.7	Very high	75 Å²	75	55 Å²	55	46%	0.46	28%	0.275	S	S	.	.			trans	-79.5	-51.5	174	-49.7	0	0	0	0	110.9	L51	L51-T211 PolarHBondContact O-N 2.89Å
212	A	95.3	Very high	95.6	Very high	24 Å²	24	60 Å²	60	20%	0.198	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	166.5	-178.6	0	0	0	0	0	111.3	L51 T220	L51-A212 PolarHBondContact N-O 2.88Å; A212-T220 HydrophobicContact CB-CG2 3.8Å
213	Y	95	Very high	95.4	Very high	15 Å²	15	61 Å²	61	6%	0.059	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	134.2	160.3	-66.9	-66.5	0	0	0	110.3	K48 G49 L50 E157 M210 H215 N216 A219 T220 T223	K48-Y213 HydrophobicContact CB-CD1 3.72Å; K48-Y213 HydrophobicContact CB-CE1 3.96Å; K48-Y213 HydrophobicContact CD-CD1 4.15Å; K48-Y213 HydrophobicContact CD-CE1 4.1Å; K48-Y213 HydrophobicContact CD-CE2 4.48Å; K48-Y213 HydrophobicContact CD-CG 4.39Å; G49-Y213 CarbonylContact O-C 3.56Å; G49-Y213 WeakPolarHBondContact O-CA 3.36Å; L50-Y213 HydrophobicContact CB-CD1 3.93Å; L50-Y213 HydrophobicContact CB-CE1 4.17Å; E157-Y213 HydrophobicContact CG-CE1 4.21Å; E157-Y213 PolarHBondContact OE1-OH 2.88Å; M210-Y213 HydrophobicContact CE-CD2 4Å; M210-Y213 HydrophobicContact CE-CE1 4.24Å; M210-Y213 HydrophobicContact CE-CE2 3.66Å; M210-Y213 HydrophobicContact CE-CG 4.46Å; M210-Y213 HydrophobicContact SD-CD1 4.34Å; M210-Y213 HydrophobicContact SD-CE1 4.12Å; Y213-H215 PolarHBondContact O-N 3.34Å; Y213-N216 PolarHBondContact O-N 2.91Å; Y213-A219 HydrophobicContact CD2-CB 3.62Å; Y213-A219 HydrophobicContact CE2-CB 4.06Å; Y213-A219 HydrophobicContact CG-CB 4.39Å; Y213-T220 PolarHBondContact N-OG1 2.83Å; Y213-T223 HydrophobicContact CE2-CG2 4.4Å
214	L	94.8	Very high	95.3	Very high	62 Å²	62	60.2 Å²	60.2	33%	0.325	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	122.4	-179.6	-177.6	67.8	0	0	0	110.3	I37 G49 L51 N216	I37-L214 HydrophobicContact CD1-CD2 4.17Å; I37-L214 HydrophobicContact CG2-CD2 4.5Å; G49-L214 PolarHBondContact O-N 2.85Å; L51-L214 HydrophobicContact CD1-CD1 4.19Å; L51-L214 HydrophobicContact CD2-CD1 4.29Å; L51-L214 HydrophobicContact CG-CD1 4.42Å; L214-N216 PolarHBondContact O-N 3.19Å; L214-N216 VanDerWaalsContact O-N 3.11Å
215	H	94.1	Very high	95.3	Very high	180 Å²	180	61.3 Å²	61.3	83%	0.833	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	29.6	-179.8	-50.8	157.5	0	0	0	114	Y213	Y213-H215 PolarHBondContact O-N 3.34Å
216	N	94.4	Very high	95.2	Very high	56 Å²	56	63.5 Å²	63.5	30%	0.299	34%	0.344	S	S	.	.			trans	-139.2	74.8	-178.7	-162.8	-28.1	0	0	0	111.9	Y213 L214 E218 A219 T220	Y213-N216 PolarHBondContact O-N 2.91Å; L214-N216 PolarHBondContact O-N 3.19Å; L214-N216 VanDerWaalsContact O-N 3.11Å; N216-E218 VanDerWaalsContact C-N 3.31Å; N216-E218 PolarHBondContact O-N 3.26Å; N216-A219 HydrophobicContact CB-CB 4.33Å; N216-A219 VanDerWaalsContact CG-CB 3.47Å; N216-A219 WeakPolarHBondContact OD1-CB 3.48Å; N216-A219 PolarHBondContact OD1-N 2.9Å; N216-T220 PolarHBondContact O-N 3.4Å; N216-T220 VanDerWaalsContact O-N 3.13Å; N216-T220 PolarHBondContact O-OG1 2.77Å
217	P	95.6	Very high	95.1	Very high	102 Å²	102	67.1 Å²	67.1	66%	0.662	36%	0.36	S	S	*	.	H	α-helix	trans	-65.8	-32	-178.4	26.3	-34.1	0	0	0	112.9	T220 K221	P217-T220 WeakPolarHBondContact O-CB 3.32Å; P217-T220 PolarHBondContact O-N 2.88Å; P217-K221 WeakPolarHBondContact O-CB 3.41Å; P217-K221 PolarHBondContact O-N 3.3Å
218	E	94.9	Very high	95	Very high	149 Å²	149	65.5 Å²	65.5	70%	0.696	35%	0.351	S	S	*	.	H	α-helix	trans	-64	-53.5	178.1	-66.5	-178.9	174.6	0	0	111.3	N216 T220 K221 E222	N216-E218 VanDerWaalsContact C-N 3.31Å; N216-E218 PolarHBondContact O-N 3.26Å; E218-T220 PolarHBondContact O-N 3.19Å; E218-K221 PolarHBondContact O-N 3.47Å; E218-K221 VanDerWaalsContact O-N 3.09Å; E218-E222 WeakPolarHBondContact O-CG 3.42Å; E218-E222 PolarHBondContact O-N 2.83Å
219	A	92.6	Very high	95.2	Very high	3 Å²	3	66.3 Å²	66.3	3%	0.025	35%	0.353	C	S	.	.	H	α-helix	trans	-60.8	-31.8	175.6	0	0	0	0	0	111.9	K48 Y213 N216 T223	K48-A219 HydrophobicContact CD-CB 4.39Å; Y213-A219 HydrophobicContact CD2-CB 3.62Å; Y213-A219 HydrophobicContact CE2-CB 4.06Å; Y213-A219 HydrophobicContact CG-CB 4.39Å; N216-A219 HydrophobicContact CB-CB 4.33Å; N216-A219 VanDerWaalsContact CG-CB 3.47Å; N216-A219 WeakPolarHBondContact OD1-CB 3.48Å; N216-A219 PolarHBondContact OD1-N 2.9Å; A219-T223 WeakPolarHBondContact O-CB 3.43Å; A219-T223 PolarHBondContact O-N 3.31Å; A219-T223 VanDerWaalsContact O-N 3.12Å; A219-T223 PolarHBondContact O-OG1 3.21Å
220	T	95	Very high	95.3	Very high	24 Å²	24	61.6 Å²	61.6	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-66.4	-44.5	176.4	-57.9	0	0	0	0	110.7	A212 Y213 N216 P217 E218 T223 I224	A212-T220 HydrophobicContact CB-CG2 3.8Å; Y213-T220 PolarHBondContact N-OG1 2.83Å; N216-T220 PolarHBondContact O-N 3.4Å; N216-T220 VanDerWaalsContact O-N 3.13Å; N216-T220 PolarHBondContact O-OG1 2.77Å; P217-T220 WeakPolarHBondContact O-CB 3.32Å; P217-T220 PolarHBondContact O-N 2.88Å; E218-T220 PolarHBondContact O-N 3.19Å; T220-T223 PolarHBondContact O-N 3.24Å; T220-I224 HydrophobicContact CG2-CD1 4.06Å; T220-I224 HydrophobicContact CG2-CG1 4.42Å; T220-I224 WeakPolarHBondContact O-CA 3.32Å; T220-I224 WeakPolarHBondContact O-CB 3.46Å; T220-I224 PolarHBondContact O-N 3.42Å
221	K	96.1	Very high	95.4	Very high	173 Å²	173	65 Å²	65	75%	0.752	35%	0.351	S	S	*	.	H	α-helix	trans	-68.7	-32.1	177.9	-172.4	180	178.8	-177	0	113	P217 E218	P217-K221 WeakPolarHBondContact O-CB 3.41Å; P217-K221 PolarHBondContact O-N 3.3Å; E218-K221 PolarHBondContact O-N 3.47Å; E218-K221 VanDerWaalsContact O-N 3.09Å
222	E	94	Very high	95.3	Very high	136 Å²	136	61.8 Å²	61.8	64%	0.636	33%	0.331	S	S	*	.	H	α-helix	trans	-68.5	-41.4	174.8	-72.8	178.5	169.6	0	0	112.1	E218	E218-E222 WeakPolarHBondContact O-CG 3.42Å; E218-E222 PolarHBondContact O-N 2.83Å
223	T	94.8	Very high	95.2	Very high	21 Å²	21	61.7 Å²	61.7	13%	0.129	33%	0.332	C	S	.	.	H	α-helix	trans	-84	-40.9	-176.9	-64	0	0	0	0	112.8	M210 Y213 A219 T220 I230 K231	M210-T223 HydrophobicContact CE-CG2 3.86Å; Y213-T223 HydrophobicContact CE2-CG2 4.4Å; A219-T223 WeakPolarHBondContact O-CB 3.43Å; A219-T223 PolarHBondContact O-N 3.31Å; A219-T223 VanDerWaalsContact O-N 3.12Å; A219-T223 PolarHBondContact O-OG1 3.21Å; T220-T223 PolarHBondContact O-N 3.24Å; T223-I230 HydrophobicContact CG2-CG2 4.02Å; T223-I230 WeakPolarHBondContact O-CA 3.2Å; T223-K231 PolarHBondContact O-N 2.89Å
224	I	96.5	Very high	95.2	Very high	20 Å²	20	61.3 Å²	61.3	10%	0.103	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-107.3	118	-176.5	-46.4	-175.7	0	0	0	109.3	M210 T220 W229 I230	M210-I224 HydrophobicContact CE-CD1 3.75Å; M210-I224 HydrophobicContact CE-CG1 3.89Å; M210-I224 HydrophobicContact CG-CD1 4.2Å; T220-I224 HydrophobicContact CG2-CD1 4.06Å; T220-I224 HydrophobicContact CG2-CG1 4.42Å; T220-I224 WeakPolarHBondContact O-CA 3.32Å; T220-I224 WeakPolarHBondContact O-CB 3.46Å; T220-I224 PolarHBondContact O-N 3.42Å; I224-W229 WeakPolarHBondContact CA-O 3.47Å; I224-I230 HydrophobicContact CG1-CG1 4.09Å
225	T	96.4	Very high	95.1	Very high	23 Å²	23	58.4 Å²	58.4	14%	0.141	32%	0.316	C	S	.	.			trans	-68	160.7	173.6	56.3	0	0	0	0	112.2	W203 D227 G228 W229 K231	W203-T225 HydrophobicContact CE3-CG2 4.09Å; W203-T225 HydrophobicContact CH2-CG2 3.89Å; W203-T225 HydrophobicContact CZ3-CG2 3.54Å; T225-D227 VanDerWaalsContact CB-OD1 3.26Å; T225-D227 WeakPolarHBondContact CB-OD1 2.91Å; T225-D227 PolarHBondContact O-N 2.98Å; T225-D227 PolarHBondContact OG1-OD1 3.15Å; T225-G228 WeakPolarHBondContact O-CA 3.23Å; T225-G228 PolarHBondContact O-N 3.35Å; T225-G228 PolarHBondContact OG1-N 3.43Å; T225-W229 HydrophobicContact CG2-CB 4.35Å; T225-W229 PolarHBondContact N-O 2.94Å; T225-W229 WeakPolarHBondContact OG1-CA 2.75Å; T225-W229 VanDerWaalsContact OG1-CB 3.25Å; T225-W229 WeakPolarHBondContact OG1-CB 2.99Å; T225-W229 PolarHBondContact OG1-N 2.73Å; T225-W229 PolarHBondContact OG1-O 2.57Å; T225-K231 VanDerWaalsContact CG2-CE 3.46Å; T225-K231 HydrophobicContact CG2-CG 4.24Å
226	A	95.6	Very high	95.2	Very high	118 Å²	118	49.9 Å²	49.9	98%	0.975	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-32	179.7	0	0	0	0	0	113.1	G228	A226-G228 VanDerWaalsContact C-N 3.29Å
227	D	95.2	Very high	95.3	Very high	88 Å²	88	50.3 Å²	50.3	47%	0.471	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	11.5	175.7	65.7	-34.4	0	0	0	113.5	R205 T225 W229	R205-D227 WeakPolarHBondContact CD-O 3.38Å; R205-D227 PolarHBondContact NH1-O 3.12Å; R205-D227 VanDerWaalsContact NH1-O 3.13Å; T225-D227 VanDerWaalsContact CB-OD1 3.26Å; T225-D227 WeakPolarHBondContact CB-OD1 2.91Å; T225-D227 PolarHBondContact O-N 2.98Å; T225-D227 PolarHBondContact OG1-OD1 3.15Å; D227-W229 VanDerWaalsContact CG-CD1 3.44Å; D227-W229 PolarHBondContact OD2-NE1 2.92Å; D227-W229 VanDerWaalsContact OD2-NE1 3.16Å
228	G	95.3	Very high	95.4	Very high	7 Å²	7	46.4 Å²	46.4	7%	0.072	25%	0.248	C	C	.	.	S	Bend	trans	90.2	3.6	162.9	0	0	0	0	0	116.8	R209 T225 A226	R209-G228 PolarHBondContact NH1-O 2.85Å; T225-G228 WeakPolarHBondContact O-CA 3.23Å; T225-G228 PolarHBondContact O-N 3.35Å; T225-G228 PolarHBondContact OG1-N 3.43Å; A226-G228 VanDerWaalsContact C-N 3.29Å
229	W	97.7	Very high	95.5	Very high	17 Å²	17	40.1 Å²	40.1	6%	0.064	22%	0.219	C	C	.	.			trans	-70.7	137.1	171.6	-62.3	85.9	0	0	0	111.8	E182 K184 W203 R205 I224 T225 D227	E182-W229 HydrophobicContact CB-CH2 3.67Å; E182-W229 HydrophobicContact CB-CZ2 4.46Å; E182-W229 HydrophobicContact CB-CZ3 4.09Å; K184-W229 HydrophobicContact CB-CH2 4.04Å; K184-W229 HydrophobicContact CB-CZ3 4.13Å; K184-W229 HydrophobicContact CD-CD2 4.12Å; K184-W229 HydrophobicContact CD-CE3 4.18Å; K184-W229 HydrophobicContact CD-CH2 3.8Å; K184-W229 HydrophobicContact CD-CZ2 3.74Å; K184-W229 HydrophobicContact CD-CZ3 4.03Å; K184-W229 HydrophobicContact CG-CD2 4.41Å; K184-W229 HydrophobicContact CG-CE3 3.97Å; K184-W229 HydrophobicContact CG-CH2 3.8Å; K184-W229 HydrophobicContact CG-CZ2 4.27Å; K184-W229 HydrophobicContact CG-CZ3 3.64Å; W203-W229 HydrophobicContact CB-CB 4.41Å; W203-W229 HydrophobicContact CB-CD2 4.46Å; W203-W229 HydrophobicContact CB-CE3 3.84Å; W203-W229 HydrophobicContact CD2-CB 4.47Å; W203-W229 HydrophobicContact CE3-CB 3.72Å; W203-W229 HydrophobicContact CE3-CG 4.05Å; W203-W229 HydrophobicContact CZ3-CB 4.5Å; W203-W229 WeakPolarHBondContact O-CZ3 3.5Å; R205-W229 HydrophobicContact CB-CD2 3.79Å; R205-W229 HydrophobicContact CB-CE3 3.65Å; R205-W229 HydrophobicContact CB-CG 4.32Å; R205-W229 HydrophobicContact CB-CH2 4.36Å; R205-W229 HydrophobicContact CB-CZ2 4.48Å; R205-W229 HydrophobicContact CB-CZ3 3.95Å; I224-W229 WeakPolarHBondContact CA-O 3.47Å; T225-W229 HydrophobicContact CG2-CB 4.35Å; T225-W229 PolarHBondContact N-O 2.94Å; T225-W229 WeakPolarHBondContact OG1-CA 2.75Å; T225-W229 VanDerWaalsContact OG1-CB 3.25Å; T225-W229 WeakPolarHBondContact OG1-CB 2.99Å; T225-W229 PolarHBondContact OG1-N 2.73Å; T225-W229 PolarHBondContact OG1-O 2.57Å; D227-W229 VanDerWaalsContact CG-CD1 3.44Å; D227-W229 PolarHBondContact OD2-NE1 2.92Å; D227-W229 VanDerWaalsContact OD2-NE1 3.16Å
230	I	96.9	Very high	95.7	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.3	165.5	-73	170	0	0	0	108.9	M155 E157 C158 W203 I204 R209 M210 T223 I224	M155-I230 HydrophobicContact CE-CG2 4.22Å; M155-I230 HydrophobicContact SD-CG2 3.73Å; E157-I230 HydrophobicContact CB-CD1 4.22Å; E157-I230 VanDerWaalsContact O-CD1 3.27Å; E157-I230 WeakPolarHBondContact O-CD1 3.41Å; C158-I230 HydrophobicContact CB-CD1 3.79Å; W203-I230 WeakPolarHBondContact CA-O 3.47Å; I204-I230 HydrophobicContact CD1-CG2 4.46Å; I204-I230 HydrophobicContact CG1-CB 3.93Å; I204-I230 HydrophobicContact CG1-CG2 4.17Å; I204-I230 PolarHBondContact N-O 3.31Å; I204-I230 PolarHBondContact O-N 2.84Å; R209-I230 HydrophobicContact CB-CD1 3.62Å; M210-I230 HydrophobicContact CG-CD1 4.42Å; T223-I230 HydrophobicContact CG2-CG2 4.02Å; T223-I230 WeakPolarHBondContact O-CA 3.2Å; I224-I230 HydrophobicContact CG1-CG1 4.09Å
231	K	96.6	Very high	95.7	Very high	73 Å²	73	49.4 Å²	49.4	32%	0.317	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	114.9	167.6	-52.9	-173.7	-171.6	167.2	0	108.7	W203 T223 T225 G233	W203-K231 HydrophobicContact CD2-CG 4.09Å; W203-K231 HydrophobicContact CH2-CD 4.44Å; W203-K231 HydrophobicContact CH2-CG 4.47Å; W203-K231 HydrophobicContact CZ2-CD 3.81Å; W203-K231 HydrophobicContact CZ2-CG 3.86Å; T223-K231 PolarHBondContact O-N 2.89Å; T225-K231 VanDerWaalsContact CG2-CE 3.46Å; T225-K231 HydrophobicContact CG2-CG 4.24Å; K231-G233 VanDerWaalsContact C-N 3.35Å; K231-G233 PolarHBondContact O-N 3.11Å
232	T	94.6	Very high	95.7	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.037	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-20.9	-170.2	64.1	0	0	0	0	113.4	Y153 M155 I202 I204 D234	Y153-T232 HydrophobicContact CE1-CG2 4.35Å; Y153-T232 VanDerWaalsContact OH-CB 3.25Å; Y153-T232 WeakPolarHBondContact OH-CB 3.38Å; Y153-T232 WeakPolarHBondContact OH-CG2 3.38Å; Y153-T232 PolarHBondContact OH-OG1 3.46Å; M155-T232 HydrophobicContact SD-CG2 3.94Å; I202-T232 HydrophobicContact CB-CG2 4.42Å; I202-T232 HydrophobicContact CG2-CG2 4.34Å; I202-T232 VanDerWaalsContact O-CB 3.3Å; I202-T232 WeakPolarHBondContact O-CB 3.48Å; I202-T232 WeakPolarHBondContact O-CG2 3.25Å; I202-T232 PolarHBondContact O-N 3.35Å; I202-T232 PolarHBondContact O-OG1 3.23Å; I204-T232 HydrophobicContact CD1-CG2 3.74Å; I204-T232 HydrophobicContact CG1-CG2 3.9Å; I204-T232 HydrophobicContact CG2-CG2 4.06Å; T232-D234 PolarHBondContact O-N 3.18Å; T232-D234 PolarHBondContact OG1-N 3.23Å; T232-D234 PolarHBondContact OG1-O 3.33Å
233	G	93.1	Very high	95.8	Very high	23 Å²	23	38.8 Å²	38.8	24%	0.237	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.9	6.7	-167.3	0	0	0	0	0	113.9	E201 K231 I250	E201-G233 WeakPolarHBondContact OE1-CA 3.43Å; E201-G233 PolarHBondContact OE1-N 3.15Å; E201-G233 VanDerWaalsContact OE1-N 3.09Å; K231-G233 VanDerWaalsContact C-N 3.35Å; K231-G233 PolarHBondContact O-N 3.11Å; G233-I250 PolarHBondContact O-N 2.96Å
234	D	93.9	Very high	95.8	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.032	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	146.3	174.5	-68.2	-46.1	0	0	0	109.7	Y153 E201 I202 T232 G248 R249	Y153-D234 WeakPolarHBondContact CE2-OD2 3.5Å; Y153-D234 WeakPolarHBondContact OH-CB 3.49Å; Y153-D234 PolarHBondContact OH-OD2 2.98Å; E201-D234 WeakPolarHBondContact CA-O 3.42Å; I202-D234 HydrophobicContact CD1-CB 4.18Å; I202-D234 PolarHBondContact N-O 3.44Å; T232-D234 PolarHBondContact O-N 3.18Å; T232-D234 PolarHBondContact OG1-N 3.23Å; T232-D234 PolarHBondContact OG1-O 3.33Å; D234-G248 CarbonylContact C-O 3.51Å; D234-G248 WeakPolarHBondContact CA-O 3.49Å; D234-R249 WeakPolarHBondContact OD1-CD 3.39Å; D234-R249 WeakPolarHBondContact OD1-CG 3.41Å; D234-R249 IonicContact OD1-CZ 3.1Å; D234-R249 IonicContact OD1-NE 3.96Å; D234-R249 PolarHBondContact OD1-NE 3.3Å; D234-R249 IonicContact OD1-NH2 3.83Å; D234-R249 PolarHBondContact OD1-NH2 3.43Å; D234-R249 IonicContact OD2-CZ 3.53Å; D234-R249 IonicContact OD2-NE 3.86Å; D234-R249 IonicContact OD2-NH2 3.69Å; D234-R249 PolarHBondContact OD2-NH2 3.17Å
235	T	94	Very high	95.6	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	147.4	174.7	53.8	0	0	0	0	111	L188 G200 V247 G248 I250 L253	L188-T235 HydrophobicContact CD1-CG2 4.01Å; G200-T235 CarbonylContact O-C 3.59Å; G200-T235 WeakPolarHBondContact O-CA 3.49Å; T235-V247 PolarHBondContact O-N 3.3Å; T235-G248 PolarHBondContact N-O 3.34Å; T235-G248 PolarHBondContact O-N 2.85Å; T235-G248 PolarHBondContact OG1-N 3.06Å; T235-G248 PolarHBondContact OG1-O 3.33Å; T235-I250 HydrophobicContact CG2-CD1 4.44Å; T235-I250 HydrophobicContact CG2-CG1 3.55Å; T235-L253 HydrophobicContact CG2-CD1 3.91Å
236	G	95.2	Very high	95.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-173.8	179.4	0	0	0	0	0	112.2	V185 V199 G200 F245	V185-G236 VanDerWaalsContact CG1-O 3.28Å; V185-G236 WeakPolarHBondContact CG1-O 3.5Å; V199-G236 WeakPolarHBondContact CA-O 3.39Å; G200-G236 PolarHBondContact N-O 2.73Å; G200-G236 PolarHBondContact O-N 2.83Å; G236-F245 CarbonylContact C-O 3.58Å; G236-F245 WeakPolarHBondContact CA-O 3.22Å
237	Y	96.8	Very high	95	Very high	65 Å²	65	35.7 Å²	35.7	26%	0.255	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	157.5	174.9	64.8	-88.6	0	0	0	110.2	E198 V199 F245 V247	E198-Y237 VanDerWaalsContact O-CB 3.24Å; E198-Y237 WeakPolarHBondContact O-CB 3.45Å; V199-Y237 HydrophobicContact CG2-CD1 4.06Å; Y237-F245 HydrophobicContact CD1-CB 3.95Å; Y237-F245 HydrophobicContact CD2-CB 4.3Å; Y237-F245 HydrophobicContact CD2-CD2 4.12Å; Y237-F245 HydrophobicContact CE1-CB 3.51Å; Y237-F245 HydrophobicContact CE1-CG 4.15Å; Y237-F245 HydrophobicContact CE2-CB 3.89Å; Y237-F245 AromaticContact CE2-CD2 3.51Å; Y237-F245 HydrophobicContact CE2-CD2 3.51Å; Y237-F245 HydrophobicContact CE2-CE2 4.21Å; Y237-F245 AromaticContact CE2-CG 3.77Å; Y237-F245 HydrophobicContact CE2-CG 3.77Å; Y237-F245 HydrophobicContact CG-CB 4.34Å; Y237-F245 VanDerWaalsContact CZ-CB 3.48Å; Y237-F245 AromaticContact CZ-CD2 3.84Å; Y237-F245 AromaticContact CZ-CG 3.57Å; Y237-F245 PolarHBondContact N-O 3.43Å; Y237-F245 PolarHBondContact O-N 2.81Å; Y237-V247 HydrophobicContact CD1-CG2 4.13Å; Y237-V247 HydrophobicContact CE1-CG2 4.33Å
238	L	97.8	Very high	94.5	Very high	20 Å²	20	31.9 Å²	31.9	11%	0.105	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.2	166.7	-68.4	166	0	0	0	108.2	V185 H196 C197 H243 L244	V185-L238 HydrophobicContact CG2-CD1 4.38Å; V185-L238 HydrophobicContact CG2-CG 4.16Å; H196-L238 CarbonylContact C-O 3.52Å; H196-L238 WeakPolarHBondContact CA-O 3.45Å; C197-L238 PolarHBondContact N-O 2.88Å; L238-H243 WeakPolarHBondContact CA-O 3.29Å; L238-L244 HydrophobicContact CD2-CB 3.98Å; L238-L244 HydrophobicContact CD2-CD1 4.14Å
239	D	97.1	Very high	94.2	Very high	18 Å²	18	34.4 Å²	34.4	10%	0.096	18%	0.179	C	C	.	.			trans	-80.3	174.6	168.4	77	3.7	0	0	0	111.7	K170 H196 D241 D242 H243 F245	K170-D239 VanDerWaalsContact CD-OD2 3.32Å; K170-D239 WeakPolarHBondContact CD-OD2 3.35Å; K170-D239 IonicContact NZ-OD1 2.88Å; K170-D239 IonicContact NZ-OD2 2.73Å; K170-D239 PolarHBondContact NZ-OD2 3.17Å; H196-D239 PolarHBondContact CD2-O 2.82Å; D239-D241 PolarHBondContact O-N 2.54Å; D239-D241 VanDerWaalsContact OD1-C 3.32Å; D239-D241 WeakPolarHBondContact OD1-CA 3.42Å; D239-D241 PolarHBondContact OD1-N 2.88Å; D239-D242 WeakPolarHBondContact O-CA 3.27Å; D239-D242 PolarHBondContact O-N 3.49Å; D239-D242 PolarHBondContact OD1-N 3.09Å; D239-H243 PolarHBondContact N-O 3.26Å; D239-H243 WeakPolarHBondContact OD1-CB 3.48Å; D239-H243 IonicContact OD1-CG 3.49Å; D239-H243 PolarHBondContact OD1-N 3.45Å; D239-H243 IonicContact OD1-ND1 2.82Å; D239-F245 HydrophobicContact CB-CD2 4.48Å; D239-F245 HydrophobicContact CB-CE2 3.89Å
240	D	96.7	Very high	93.8	Very high	126 Å²	126	36 Å²	36	67%	0.674	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-13.4	-175.8	-57.3	-31.6	0	0	0	114.4	H196	H196-D240 WeakPolarHBondContact CB-OD1 3.48Å
241	D	95.4	Very high	93.3	Very high	96 Å²	96	42.5 Å²	42.5	51%	0.513	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	23.5	173.3	-59	-57.5	0	0	0	111.8	K170 Q176 D239 H243	K170-D241 IonicContact NZ-OD2 2.83Å; K170-D241 PolarHBondContact NZ-OD2 3.15Å; Q176-D241 PolarHBondContact NE2-O 3.12Å; D239-D241 PolarHBondContact O-N 2.54Å; D239-D241 VanDerWaalsContact OD1-C 3.32Å; D239-D241 WeakPolarHBondContact OD1-CA 3.42Å; D239-D241 PolarHBondContact OD1-N 2.88Å; D241-H243 PolarHBondContact O-N 3.49Å; D241-H243 VanDerWaalsContact O-N 3.11Å; D241-H243 PolarHBondContact O-ND1 3Å
242	D	95.7	Very high	92.8	Very high	72 Å²	72	42.1 Å²	42.1	39%	0.385	22%	0.216	S	C	.	.			trans	56.2	25.2	180	-63.3	-43	0	0	0	115.3	H196 D239	H196-D242 IonicContact CD2-OD1 3.2Å; H196-D242 IonicContact CE1-OD1 3.67Å; H196-D242 IonicContact NE2-OD1 2.64Å; H196-D242 PolarHBondContact NE2-OD1 2.87Å; D239-D242 WeakPolarHBondContact O-CA 3.27Å; D239-D242 PolarHBondContact O-N 3.49Å; D239-D242 PolarHBondContact OD1-N 3.09Å
243	H	95.6	Very high	92.6	Very high	13 Å²	13	42.5 Å²	42.5	6%	0.06	22%	0.218	C	C	.	.			trans	-78.7	127.7	170.6	-72.6	69.3	0	0	0	109.7	Q168 K170 S173 L238 D239 D241 F245	Q168-H243 PolarHBondContact O-NE2 2.81Å; K170-H243 HydrophobicContact CD-CB 4.14Å; S173-H243 WeakPolarHBondContact OG-CB 3.25Å; L238-H243 WeakPolarHBondContact CA-O 3.29Å; D239-H243 PolarHBondContact N-O 3.26Å; D239-H243 WeakPolarHBondContact OD1-CB 3.48Å; D239-H243 IonicContact OD1-CG 3.49Å; D239-H243 PolarHBondContact OD1-N 3.45Å; D239-H243 IonicContact OD1-ND1 2.82Å; D241-H243 PolarHBondContact O-N 3.49Å; D241-H243 VanDerWaalsContact O-N 3.11Å; D241-H243 PolarHBondContact O-ND1 3Å; H243-F245 HydrophobicContact CB-CE2 3.86Å; H243-F245 VanDerWaalsContact O-CD2 3.27Å; H243-F245 WeakPolarHBondContact O-CD2 3.42Å; H243-F245 WeakPolarHBondContact O-CE2 3.12Å
244	L	95.8	Very high	92.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.6	178.5	-179.5	66	0	0	0	110.6	Y153 T162 S173 V174 G175 V183 I202 L238	Y153-L244 HydrophobicContact CD1-CD2 3.75Å; Y153-L244 HydrophobicContact CE1-CD2 4.3Å; Y153-L244 HydrophobicContact CG-CD2 4.25Å; T162-L244 HydrophobicContact CG2-CB 3.99Å; T162-L244 HydrophobicContact CG2-CD2 3.56Å; T162-L244 HydrophobicContact CG2-CG 4.43Å; S173-L244 CarbonylContact C-O 3.57Å; S173-L244 VanDerWaalsContact CA-O 3.32Å; S173-L244 WeakPolarHBondContact CA-O 3.49Å; S173-L244 PolarHBondContact OG-O 2.73Å; V174-L244 HydrophobicContact CG2-CB 3.75Å; V174-L244 HydrophobicContact CG2-CD2 3.68Å; V174-L244 HydrophobicContact CG2-CG 3.66Å; V174-L244 WeakPolarHBondContact CG2-O 3.47Å; V174-L244 PolarHBondContact N-O 2.73Å; G175-L244 PolarHBondContact O-N 3.09Å; V183-L244 HydrophobicContact CG1-CD1 4.47Å; V183-L244 HydrophobicContact CG1-CD2 4.46Å; I202-L244 HydrophobicContact CD1-CD1 3.99Å; I202-L244 HydrophobicContact CD1-CD2 4.3Å; I202-L244 HydrophobicContact CD1-CG 4.49Å; I202-L244 HydrophobicContact CG1-CD1 4.09Å; I202-L244 HydrophobicContact CG2-CD1 4.33Å; I202-L244 HydrophobicContact CG2-CD2 4.2Å; L238-L244 HydrophobicContact CD2-CB 3.98Å; L238-L244 HydrophobicContact CD2-CD1 4.14Å
245	F	92	Very high	92.5	Very high	28 Å²	28	48 Å²	48	12%	0.123	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	117.7	172.4	-67.3	-99	0	0	0	109.2	K170 L171 G236 Y237 D239 H243	K170-F245 HydrophobicContact CB-CZ 4.41Å; L171-F245 WeakPolarHBondContact O-CE1 3.38Å; G236-F245 CarbonylContact C-O 3.58Å; G236-F245 WeakPolarHBondContact CA-O 3.22Å; Y237-F245 HydrophobicContact CD1-CB 3.95Å; Y237-F245 HydrophobicContact CD2-CB 4.3Å; Y237-F245 HydrophobicContact CD2-CD2 4.12Å; Y237-F245 HydrophobicContact CE1-CB 3.51Å; Y237-F245 HydrophobicContact CE1-CG 4.15Å; Y237-F245 HydrophobicContact CE2-CB 3.89Å; Y237-F245 AromaticContact CE2-CD2 3.51Å; Y237-F245 HydrophobicContact CE2-CD2 3.51Å; Y237-F245 HydrophobicContact CE2-CE2 4.21Å; Y237-F245 AromaticContact CE2-CG 3.77Å; Y237-F245 HydrophobicContact CE2-CG 3.77Å; Y237-F245 HydrophobicContact CG-CB 4.34Å; Y237-F245 VanDerWaalsContact CZ-CB 3.48Å; Y237-F245 AromaticContact CZ-CD2 3.84Å; Y237-F245 AromaticContact CZ-CG 3.57Å; Y237-F245 PolarHBondContact N-O 3.43Å; Y237-F245 PolarHBondContact O-N 2.81Å; D239-F245 HydrophobicContact CB-CD2 4.48Å; D239-F245 HydrophobicContact CB-CE2 3.89Å; H243-F245 HydrophobicContact CB-CE2 3.86Å; H243-F245 VanDerWaalsContact O-CD2 3.27Å; H243-F245 WeakPolarHBondContact O-CD2 3.42Å; H243-F245 WeakPolarHBondContact O-CE2 3.12Å
246	V	90.6	Very high	92.4	Very high	56 Å²	56	49 Å²	49	34%	0.339	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.7	179	-177.6	0	0	0	0	109.3	Y153 V174 I202	Y153-V246 HydrophobicContact CD2-CG2 3.72Å; Y153-V246 HydrophobicContact CE2-CG2 4.01Å; Y153-V246 HydrophobicContact CG-CG2 4.18Å; V174-V246 HydrophobicContact CG1-CG2 4.09Å; V174-V246 HydrophobicContact CG2-CG2 3.84Å; I202-V246 HydrophobicContact CD1-CG2 4.04Å
247	V	88.9	Confident	92.2	Very high	34 Å²	34	55.5 Å²	55.5	21%	0.206	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-42	-177.6	171.1	0	0	0	0	111.5	V199 T235 Y237 A262	V199-V247 HydrophobicContact CG1-CG2 4.26Å; V199-V247 HydrophobicContact CG2-CG2 4.2Å; T235-V247 PolarHBondContact O-N 3.3Å; Y237-V247 HydrophobicContact CD1-CG2 4.13Å; Y237-V247 HydrophobicContact CE1-CG2 4.33Å; V247-A262 HydrophobicContact CG1-CB 3.63Å
248	G	85.8	Confident	91.7	Very high	8 Å²	8	57.8 Å²	57.8	8%	0.082	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167	-175.7	-179.1	0	0	0	0	0	113.5	D234 T235	D234-G248 CarbonylContact C-O 3.51Å; D234-G248 WeakPolarHBondContact CA-O 3.49Å; T235-G248 PolarHBondContact N-O 3.34Å; T235-G248 PolarHBondContact O-N 2.85Å; T235-G248 PolarHBondContact OG1-N 3.06Å; T235-G248 PolarHBondContact OG1-O 3.33Å
249	R	87.9	Confident	91.2	Very high	59 Å²	59	61.8 Å²	61.8	22%	0.223	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	133.3	177.8	-75	-97	163.6	178.3	-20.6	110.8	D234 K251 E252 L253	D234-R249 WeakPolarHBondContact OD1-CD 3.39Å; D234-R249 WeakPolarHBondContact OD1-CG 3.41Å; D234-R249 IonicContact OD1-CZ 3.1Å; D234-R249 IonicContact OD1-NE 3.96Å; D234-R249 PolarHBondContact OD1-NE 3.3Å; D234-R249 IonicContact OD1-NH2 3.83Å; D234-R249 PolarHBondContact OD1-NH2 3.43Å; D234-R249 IonicContact OD2-CZ 3.53Å; D234-R249 IonicContact OD2-NE 3.86Å; D234-R249 IonicContact OD2-NH2 3.69Å; D234-R249 PolarHBondContact OD2-NH2 3.17Å; R249-K251 PolarHBondContact O-N 3.36Å; R249-E252 HydrophobicContact CB-CB 4Å; R249-E252 HydrophobicContact CB-CG 3.76Å; R249-E252 WeakPolarHBondContact O-CA 3.49Å; R249-E252 PolarHBondContact O-N 3.13Å; R249-L253 WeakPolarHBondContact O-CG 3.16Å; R249-L253 PolarHBondContact O-N 2.79Å
250	I	90.4	Very high	90.8	Very high	50 Å²	50	65.2 Å²	65.2	26%	0.256	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-52.4	-45.5	177.4	-67.3	173	0	0	0	111.3	L188 E201 G233 T235 E252 L253	L188-I250 HydrophobicContact CD2-CD1 3.42Å; L188-I250 VanDerWaalsContact CD2-CD1 3.42Å; L188-I250 HydrophobicContact CD2-CG1 3.93Å; E201-I250 HydrophobicContact CB-CD1 3.98Å; E201-I250 HydrophobicContact CG-CD1 3.64Å; G233-I250 PolarHBondContact O-N 2.96Å; T235-I250 HydrophobicContact CG2-CD1 4.44Å; T235-I250 HydrophobicContact CG2-CG1 3.55Å; I250-E252 PolarHBondContact O-N 3.47Å; I250-L253 PolarHBondContact O-N 3.35Å
251	K	86.1	Confident	90.5	Very high	138 Å²	138	59.2 Å²	59.2	60%	0.6	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-67.1	-15.5	-179.3	-64.7	-174.9	176.1	-177.4	0	114	T44 R249	T44-K251 HydrophobicContact CG2-CD 3.84Å; T44-K251 PolarHBondContact OG1-NZ 3.34Å; R249-K251 PolarHBondContact O-N 3.36Å
252	E	86.5	Confident	90.3	Very high	64 Å²	64	54.8 Å²	54.8	30%	0.299	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-103.8	-8	-180	-59.5	-175.1	143.5	0	0	112.8	R249 I250 I254 P263 R340	R249-E252 HydrophobicContact CB-CB 4Å; R249-E252 HydrophobicContact CB-CG 3.76Å; R249-E252 WeakPolarHBondContact O-CA 3.49Å; R249-E252 PolarHBondContact O-N 3.13Å; I250-E252 PolarHBondContact O-N 3.47Å; E252-I254 PolarHBondContact O-N 2.94Å; E252-P263 HydrophobicContact CB-CG 4.44Å; E252-P263 VanDerWaalsContact O-CD 3.25Å; E252-P263 WeakPolarHBondContact O-CD 3.22Å; E252-P263 WeakPolarHBondContact O-CG 3.21Å; E252-R340 IonicContact OE1-CZ 3.23Å; E252-R340 IonicContact OE1-NH1 3.5Å; E252-R340 PolarHBondContact OE1-NH1 2.97Å; E252-R340 IonicContact OE2-CZ 2.8Å; E252-R340 IonicContact OE2-NH1 3.12Å; E252-R340 PolarHBondContact OE2-NH1 3.19Å
253	L	89.3	Confident	90.1	Very high	15 Å²	15	51.4 Å²	51.4	8%	0.079	25%	0.251	C	S	.	.			trans	-61.3	128.7	179	-64.4	178.1	0	0	0	110.6	T235 R249 I250 Q260 A262	T235-L253 HydrophobicContact CG2-CD1 3.91Å; R249-L253 WeakPolarHBondContact O-CG 3.16Å; R249-L253 PolarHBondContact O-N 2.79Å; I250-L253 PolarHBondContact O-N 3.35Å; L253-Q260 HydrophobicContact CB-CB 4.38Å; L253-Q260 HydrophobicContact CD1-CB 4.22Å; L253-A262 HydrophobicContact CD2-CB 3.79Å
254	I	92.4	Very high	89.7	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.1	177.3	-57.1	174.6	0	0	0	107.9	E252 Y256 Q260 V261 P263 V281 E291 P293	E252-I254 PolarHBondContact O-N 2.94Å; I254-Y256 PolarHBondContact O-N 2.92Å; I254-Q260 WeakPolarHBondContact O-CA 3.27Å; I254-V261 HydrophobicContact CB-CB 4.22Å; I254-V261 WeakPolarHBondContact CB-O 3.32Å; I254-V261 PolarHBondContact N-O 3.42Å; I254-V261 PolarHBondContact O-N 3.47Å; I254-P263 HydrophobicContact CD1-CG 4.04Å; I254-P263 HydrophobicContact CG1-CG 3.97Å; I254-V281 HydrophobicContact CD1-CG1 3.82Å; I254-E291 WeakPolarHBondContact CA-OE2 3.37Å; I254-E291 HydrophobicContact CG2-CB 3.7Å; I254-P293 HydrophobicContact CD1-CB 3.86Å; I254-P293 HydrophobicContact CD1-CG 4.09Å; I254-P293 HydrophobicContact CG2-CG 4.25Å
255	K	91.7	Very high	89.3	Confident	142 Å²	142	55.8 Å²	55.8	62%	0.617	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	86.8	-177.4	-62	179	-176.9	179.5	0	110.3	E291	K255-E291 PolarHBondContact N-OE2 2.8Å; K255-E291 PolarHBondContact O-N 3.24Å
256	Y	92.5	Very high	89.3	Confident	23 Å²	23	54.4 Å²	54.4	9%	0.09	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	107	179.1	178.3	-112.1	0	0	0	111.2	I254 S258 K259 V289 E291 V292 H317 R321	I254-Y256 PolarHBondContact O-N 2.92Å; Y256-S258 PolarHBondContact O-N 2.87Å; Y256-K259 CarbonylContact C-O 3.45Å; Y256-K259 PolarHBondContact N-O 3.17Å; Y256-K259 WeakPolarHBondContact O-CA 3.29Å; Y256-K259 PolarHBondContact O-N 3.39Å; Y256-K259 VanDerWaalsContact O-O 3.09Å; Y256-V289 HydrophobicContact CD2-CB 4.12Å; Y256-V289 HydrophobicContact CD2-CG2 4.25Å; Y256-V289 HydrophobicContact CE2-CB 3.87Å; Y256-V289 HydrophobicContact CE2-CG1 4.23Å; Y256-V289 HydrophobicContact CE2-CG2 4.04Å; Y256-E291 WeakPolarHBondContact CA-O 3.4Å; Y256-E291 WeakPolarHBondContact CB-O 3.41Å; Y256-E291 WeakPolarHBondContact CD2-O 3.46Å; Y256-V292 HydrophobicContact CD2-CG1 4Å; Y256-V292 HydrophobicContact CE2-CG1 4Å; Y256-H317 HydrophobicContact CD1-CB 4.5Å; Y256-R321 PolarHBondContact OH-NE 3.36Å
257	K	90.9	Very high	89.3	Confident	137 Å²	137	52.7 Å²	52.7	60%	0.596	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	-127.6	-170.7	-58.5	-175.6	172.7	-171.6	0	110.1	K259 V289	K257-K259 VanDerWaalsContact C-N 3.31Å; K257-V289 HydrophobicContact CG-CB 4.09Å; K257-V289 HydrophobicContact CG-CG1 4.08Å; K257-V289 PolarHBondContact N-O 3.09Å
258	S	86.6	Confident	89.1	Confident	113 Å²	113	55.3 Å²	55.3	79%	0.79	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	2.4	174.9	56.5	0	0	0	0	114	Y256	Y256-S258 PolarHBondContact O-N 2.87Å
259	K	87.6	Confident	89.2	Confident	105 Å²	105	56.8 Å²	56.8	46%	0.457	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	146.2	-175.5	-62.6	-171.1	175.7	-169.4	0	111.4	Y256 K257 H317	Y256-K259 CarbonylContact C-O 3.45Å; Y256-K259 PolarHBondContact N-O 3.17Å; Y256-K259 WeakPolarHBondContact O-CA 3.29Å; Y256-K259 PolarHBondContact O-N 3.39Å; Y256-K259 VanDerWaalsContact O-O 3.09Å; K257-K259 VanDerWaalsContact C-N 3.31Å; K259-H317 HydrophobicContact CD-CB 3.69Å
260	Q	88.5	Confident	89.3	Confident	89 Å²	89	54.2 Å²	54.2	42%	0.416	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.4	172.6	-62.4	180	14	0	0	108.6	L253 I254	L253-Q260 HydrophobicContact CB-CB 4.38Å; L253-Q260 HydrophobicContact CD1-CB 4.22Å; I254-Q260 WeakPolarHBondContact O-CA 3.27Å
261	V	90.1	Very high	89.3	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.9	179.9	178.4	0	0	0	0	108.7	I254 P263 L266 P293 K318	I254-V261 HydrophobicContact CB-CB 4.22Å; I254-V261 WeakPolarHBondContact CB-O 3.32Å; I254-V261 PolarHBondContact N-O 3.42Å; I254-V261 PolarHBondContact O-N 3.47Å; V261-P263 WeakPolarHBondContact O-CD 3.24Å; V261-L266 HydrophobicContact CG1-CD1 3.62Å; V261-L266 HydrophobicContact CG1-CG 4.16Å; V261-P293 HydrophobicContact CG1-CG 4.4Å; V261-K318 HydrophobicContact CG1-CG 4.07Å; V261-K318 HydrophobicContact CG2-CG 4.37Å
262	A	90.3	Very high	89.2	Confident	3 Å²	3	54 Å²	54	3%	0.025	27%	0.27	C	S	.	.			trans	-80	121.6	178.1	0	0	0	0	0	110.7	V247 L253 A264 E265 L266	V247-A262 HydrophobicContact CG1-CB 3.63Å; L253-A262 HydrophobicContact CD2-CB 3.79Å; A262-A264 VanDerWaalsContact C-N 3.3Å; A262-A264 PolarHBondContact O-N 2.87Å; A262-E265 HydrophobicContact CB-CB 4.19Å; A262-E265 WeakPolarHBondContact O-CB 3.31Å; A262-E265 PolarHBondContact O-N 3.08Å; A262-L266 PolarHBondContact O-N 2.86Å
263	P	92.5	Very high	89.3	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.013	27%	0.266	C	S	.	.	H	α-helix	trans	-57	-42.5	176.5	-26.1	33.7	0	0	0	113.2	E252 I254 V261 E265 L266 E267 V281	E252-P263 HydrophobicContact CB-CG 4.44Å; E252-P263 VanDerWaalsContact O-CD 3.25Å; E252-P263 WeakPolarHBondContact O-CD 3.22Å; E252-P263 WeakPolarHBondContact O-CG 3.21Å; I254-P263 HydrophobicContact CD1-CG 4.04Å; I254-P263 HydrophobicContact CG1-CG 3.97Å; V261-P263 WeakPolarHBondContact O-CD 3.24Å; P263-E265 PolarHBondContact O-N 2.67Å; P263-L266 WeakPolarHBondContact O-CB 3.42Å; P263-L266 PolarHBondContact O-N 3.16Å; P263-L266 VanDerWaalsContact O-N 3.08Å; P263-E267 WeakPolarHBondContact O-CG 3.46Å; P263-E267 PolarHBondContact O-N 2.98Å; P263-V281 HydrophobicContact CB-CB 4.03Å; P263-V281 HydrophobicContact CB-CG1 4.29Å; P263-V281 WeakPolarHBondContact CB-O 3.4Å
264	A	87.6	Confident	89.3	Confident	31 Å²	31	57.3 Å²	57.3	26%	0.256	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-33	-178.8	0	0	0	0	0	112.9	A262 E267 N268	A262-A264 VanDerWaalsContact C-N 3.3Å; A262-A264 PolarHBondContact O-N 2.87Å; A264-E267 WeakPolarHBondContact CA-OE2 3.32Å; A264-N268 WeakPolarHBondContact O-CB 3.4Å; A264-N268 PolarHBondContact O-N 3.06Å
265	E	86.9	Confident	89.3	Confident	73 Å²	73	57.7 Å²	57.7	34%	0.341	30%	0.296	S	S	.	.	H	α-helix	trans	-67.2	-46.5	175.9	-167.3	-169.3	165.9	0	0	111.1	A262 P263 N268 I269 K318	A262-E265 HydrophobicContact CB-CB 4.19Å; A262-E265 WeakPolarHBondContact O-CB 3.31Å; A262-E265 PolarHBondContact O-N 3.08Å; P263-E265 PolarHBondContact O-N 2.67Å; E265-N268 PolarHBondContact O-N 3.01Å; E265-I269 WeakPolarHBondContact O-CG1 3.36Å; E265-I269 PolarHBondContact O-N 3.33Å; E265-I269 VanDerWaalsContact O-N 3.13Å; E265-K318 IonicContact OE1-NZ 3.27Å; E265-K318 PolarHBondContact OE1-NZ 3.07Å; E265-K318 VanDerWaalsContact OE2-CE 3.25Å; E265-K318 WeakPolarHBondContact OE2-CE 3.45Å; E265-K318 IonicContact OE2-NZ 2.75Å; E265-K318 PolarHBondContact OE2-NZ 2.86Å
266	L	91.2	Very high	89.3	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-44.7	175.9	-74.1	176.1	0	0	0	111.5	V261 A262 P263 N268 I269 L270 V281 P293 L314 K318 L320	V261-L266 HydrophobicContact CG1-CD1 3.62Å; V261-L266 HydrophobicContact CG1-CG 4.16Å; A262-L266 PolarHBondContact O-N 2.86Å; P263-L266 WeakPolarHBondContact O-CB 3.42Å; P263-L266 PolarHBondContact O-N 3.16Å; P263-L266 VanDerWaalsContact O-N 3.08Å; L266-N268 VanDerWaalsContact C-N 3.33Å; L266-N268 PolarHBondContact O-N 2.68Å; L266-I269 PolarHBondContact O-N 3.42Å; L266-I269 VanDerWaalsContact O-N 3.17Å; L266-L270 VanDerWaalsContact O-CG 3.24Å; L266-L270 WeakPolarHBondContact O-CG 3.32Å; L266-L270 PolarHBondContact O-N 2.82Å; L266-V281 HydrophobicContact CB-CB 4.35Å; L266-V281 HydrophobicContact CB-CG1 4.28Å; L266-V281 HydrophobicContact CB-CG2 3.85Å; L266-V281 HydrophobicContact CD1-CG1 3.78Å; L266-P293 HydrophobicContact CD1-CB 3.82Å; L266-P293 HydrophobicContact CD1-CG 4.11Å; L266-L314 HydrophobicContact CD2-CD1 3.94Å; L266-L314 HydrophobicContact CD2-CD2 3.5Å; L266-L314 HydrophobicContact CD2-CG 4.31Å; L266-K318 HydrophobicContact CD2-CB 3.87Å; L266-L320 HydrophobicContact CD1-CD2 4.14Å
267	E	91.4	Very high	89.2	Confident	19 Å²	19	55.9 Å²	55.9	9%	0.089	29%	0.289	C	S	.	.	H	α-helix	trans	-56.6	-45.8	176.2	-69.1	159.9	-169.2	0	0	111.3	P263 A264 I269 L270 L271 V281 R340	P263-E267 WeakPolarHBondContact O-CG 3.46Å; P263-E267 PolarHBondContact O-N 2.98Å; A264-E267 WeakPolarHBondContact CA-OE2 3.32Å; E267-I269 VanDerWaalsContact C-N 3.35Å; E267-I269 PolarHBondContact O-N 2.93Å; E267-L270 PolarHBondContact O-N 3.06Å; E267-L271 WeakPolarHBondContact O-CB 3.46Å; E267-L271 WeakPolarHBondContact O-CG 3.23Å; E267-L271 PolarHBondContact O-N 3.38Å; E267-V281 HydrophobicContact CG-CB 4.01Å; E267-V281 HydrophobicContact CG-CG2 3.81Å; E267-V281 PolarHBondContact OE1-N 2.93Å; E267-R340 IonicContact OE1-CZ 2.7Å; E267-R340 IonicContact OE1-NE 3.83Å; E267-R340 IonicContact OE1-NH2 3.94Å; E267-R340 PolarHBondContact OE1-NH2 3.12Å; E267-R340 IonicContact OE2-NH2 2.88Å; E267-R340 PolarHBondContact OE2-NH2 3.4Å
268	N	85.1	Confident	89.3	Confident	90 Å²	90	50.5 Å²	50.5	48%	0.481	27%	0.267	S	S	.	.	H	α-helix	trans	-61.6	-40.5	176.6	-86.6	-11.9	0	0	0	112.7	A264 E265 L266 L271 Q272	A264-N268 WeakPolarHBondContact O-CB 3.4Å; A264-N268 PolarHBondContact O-N 3.06Å; E265-N268 PolarHBondContact O-N 3.01Å; L266-N268 VanDerWaalsContact C-N 3.33Å; L266-N268 PolarHBondContact O-N 2.68Å; N268-L271 PolarHBondContact O-N 3.37Å; N268-Q272 WeakPolarHBondContact O-CG 3.31Å; N268-Q272 PolarHBondContact O-N 3.16Å
269	I	87.7	Confident	89.6	Confident	38 Å²	38	45.2 Å²	45.2	20%	0.195	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-43.5	176.2	-63.8	164.7	0	0	0	110.5	E265 L266 E267 L271 Q272 K313 L314	E265-I269 WeakPolarHBondContact O-CG1 3.36Å; E265-I269 PolarHBondContact O-N 3.33Å; E265-I269 VanDerWaalsContact O-N 3.13Å; L266-I269 PolarHBondContact O-N 3.42Å; L266-I269 VanDerWaalsContact O-N 3.17Å; E267-I269 VanDerWaalsContact C-N 3.35Å; E267-I269 PolarHBondContact O-N 2.93Å; I269-L271 PolarHBondContact O-N 2.85Å; I269-Q272 WeakPolarHBondContact O-CB 3.21Å; I269-Q272 PolarHBondContact O-N 3.45Å; I269-K313 HydrophobicContact CG2-CB 4.21Å; I269-L314 HydrophobicContact CB-CD2 4.18Å; I269-L314 HydrophobicContact CD1-CD2 3.75Å; I269-L314 HydrophobicContact CG2-CD2 3.76Å
270	L	90.6	Very high	89.9	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-43.9	177.8	-67.4	172.9	0	0	0	111.7	L266 E267 Q272 H273 I276 A279 V281 A295 I310 L320	L266-L270 VanDerWaalsContact O-CG 3.24Å; L266-L270 WeakPolarHBondContact O-CG 3.32Å; L266-L270 PolarHBondContact O-N 2.82Å; E267-L270 PolarHBondContact O-N 3.06Å; L270-Q272 PolarHBondContact O-N 3.2Å; L270-H273 VanDerWaalsContact O-CB 3.32Å; L270-H273 WeakPolarHBondContact O-CB 3.35Å; L270-H273 PolarHBondContact O-N 3.45Å; L270-I276 HydrophobicContact CB-CD1 4.27Å; L270-I276 HydrophobicContact CD2-CD1 4.38Å; L270-I276 WeakPolarHBondContact O-CD1 3.33Å; L270-A279 HydrophobicContact CB-CB 3.74Å; L270-A279 HydrophobicContact CD1-CB 3.94Å; L270-A279 HydrophobicContact CG-CB 4.5Å; L270-V281 HydrophobicContact CD1-CG2 3.82Å; L270-A295 HydrophobicContact CD1-CB 3.77Å; L270-I310 HydrophobicContact CD2-CG2 3.21Å; L270-L320 HydrophobicContact CD2-CD1 4.29Å
271	L	89	Confident	90.3	Very high	47 Å²	47	36 Å²	36	25%	0.246	19%	0.189	C	C	.	.	H	α-helix	trans	-67	-16.1	-179.6	-70.7	171.4	0	0	0	113.7	Q134 E267 N268 I269 H273 I276 A279	Q134-L271 HydrophobicContact CG-CD1 4.2Å; E267-L271 WeakPolarHBondContact O-CB 3.46Å; E267-L271 WeakPolarHBondContact O-CG 3.23Å; E267-L271 PolarHBondContact O-N 3.38Å; N268-L271 PolarHBondContact O-N 3.37Å; I269-L271 PolarHBondContact O-N 2.85Å; L271-H273 PolarHBondContact O-N 2.88Å; L271-I276 HydrophobicContact CD2-CG2 4.33Å; L271-A279 HydrophobicContact CD2-CB 4.21Å; L271-A279 HydrophobicContact CG-CB 4.24Å
272	Q	85.2	Confident	90.5	Very high	138 Å²	138	36 Å²	36	65%	0.645	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-14.9	171.3	-68.5	171.6	13.8	0	0	112.7	N268 I269 L270	N268-Q272 WeakPolarHBondContact O-CG 3.31Å; N268-Q272 PolarHBondContact O-N 3.16Å; I269-Q272 WeakPolarHBondContact O-CB 3.21Å; I269-Q272 PolarHBondContact O-N 3.45Å; L270-Q272 PolarHBondContact O-N 3.2Å
273	H	88.8	Confident	90.7	Very high	48 Å²	48	36 Å²	36	22%	0.222	19%	0.189	C	C	.	.	S	Bend	trans	-75.5	126.6	178.1	-166.1	-75.1	0	0	0	110.9	L270 L271 A275 I276 I305	L270-H273 VanDerWaalsContact O-CB 3.32Å; L270-H273 WeakPolarHBondContact O-CB 3.35Å; L270-H273 PolarHBondContact O-N 3.45Å; L271-H273 PolarHBondContact O-N 2.88Å; H273-A275 VanDerWaalsContact C-N 3.26Å; H273-A275 WeakPolarHBondContact ND1-CB 3.43Å; H273-A275 PolarHBondContact ND1-N 2.96Å; H273-A275 PolarHBondContact O-N 2.86Å; H273-A275 VanDerWaalsContact O-N 3.12Å; H273-I276 HydrophobicContact CB-CB 4.39Å; H273-I276 HydrophobicContact CB-CD1 3.99Å; H273-I276 HydrophobicContact CB-CG1 4.02Å; H273-I276 PolarHBondContact O-N 2.84Å; H273-I305 WeakPolarHBondContact CE1-CD1 3.26Å; H273-I305 WeakPolarHBondContact NE2-CD1 3.42Å
274	P	88.8	Confident	90.7	Very high	99 Å²	99	36.7 Å²	36.7	64%	0.643	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-33.9	-174	-26.6	33.8	0	0	0	115	I276 R300	P274-I276 VanDerWaalsContact C-N 3.31Å; P274-I276 PolarHBondContact O-N 3.39Å; P274-R300 WeakPolarHBondContact O-CD 3.44Å; P274-R300 PolarHBondContact O-NE 3.36Å
275	A	92.5	Very high	90.9	Very high	9 Å²	9	39.4 Å²	39.4	7%	0.074	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-19.6	178.7	0	0	0	0	0	114.2	H273 L299 R300 C303	H273-A275 VanDerWaalsContact C-N 3.26Å; H273-A275 WeakPolarHBondContact ND1-CB 3.43Å; H273-A275 PolarHBondContact ND1-N 2.96Å; H273-A275 PolarHBondContact O-N 2.86Å; H273-A275 VanDerWaalsContact O-N 3.12Å; A275-L299 WeakPolarHBondContact O-CA 3.23Å; A275-R300 PolarHBondContact O-N 3Å; A275-C303 HydrophobicContact CB-CB 3.8Å
276	I	91	Very high	91.1	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.015	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	127.4	-173.7	-61.7	-174.2	0	0	0	109.2	L270 L271 H273 P274 D278 A279 V297 L299 R300 I310	L270-I276 HydrophobicContact CB-CD1 4.27Å; L270-I276 HydrophobicContact CD2-CD1 4.38Å; L270-I276 WeakPolarHBondContact O-CD1 3.33Å; L271-I276 HydrophobicContact CD2-CG2 4.33Å; H273-I276 HydrophobicContact CB-CB 4.39Å; H273-I276 HydrophobicContact CB-CD1 3.99Å; H273-I276 HydrophobicContact CB-CG1 4.02Å; H273-I276 PolarHBondContact O-N 2.84Å; P274-I276 VanDerWaalsContact C-N 3.31Å; P274-I276 PolarHBondContact O-N 3.39Å; I276-D278 WeakPolarHBondContact CG2-O 3.23Å; I276-A279 HydrophobicContact CG2-CB 4.23Å; I276-V297 HydrophobicContact CB-CG1 4.47Å; I276-V297 HydrophobicContact CD1-CG1 3.83Å; I276-V297 HydrophobicContact CG1-CG1 3.84Å; I276-V297 HydrophobicContact CG2-CG1 3.99Å; I276-L299 HydrophobicContact CG1-CD2 4.31Å; I276-R300 PolarHBondContact O-NE 3.14Å; I276-I310 HydrophobicContact CD1-CD1 4.38Å; I276-I310 HydrophobicContact CD1-CG1 4.46Å
277	K	91.5	Very high	90.8	Very high	124 Å²	124	45.1 Å²	45.1	54%	0.539	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-45	174.9	179.1	-172.6	170.6	-169.2	0	110.6	C298 R300	K277-C298 HydrophobicContact CB-CB 4.48Å; K277-C298 WeakPolarHBondContact CB-O 3.38Å; K277-C298 PolarHBondContact N-O 3.08Å; K277-R300 HydrophobicContact CB-CG 3.83Å
278	D	92.2	Very high	90.7	Very high	24 Å²	24	53.7 Å²	53.7	13%	0.128	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	149.7	-174.3	-157	-1.8	0	0	0	110.1	Q134 I276 C298 I330 H332	Q134-D278 PolarHBondContact NE2-OD1 3.5Å; I276-D278 WeakPolarHBondContact CG2-O 3.23Å; D278-C298 HydrophobicContact CB-CB 3.9Å; D278-C298 PolarHBondContact N-O 3.47Å; D278-C298 PolarHBondContact O-N 3.34Å; D278-I330 HydrophobicContact CB-CD1 3.93Å; D278-H332 IonicContact OD1-NE2 3.39Å; D278-H332 IonicContact OD2-CD2 3.96Å; D278-H332 IonicContact OD2-CE1 3.44Å; D278-H332 IonicContact OD2-NE2 3.98Å; D278-H332 PolarHBondContact OD2-NE2 3.47Å; D278-H332 VanDerWaalsContact OD2-NE2 3.1Å
279	A	93.3	Very high	91	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	141.2	-177.4	0	0	0	0	0	111.5	L270 L271 I276 Y296 I330	L270-A279 HydrophobicContact CB-CB 3.74Å; L270-A279 HydrophobicContact CD1-CB 3.94Å; L270-A279 HydrophobicContact CG-CB 4.5Å; L271-A279 HydrophobicContact CD2-CB 4.21Å; L271-A279 HydrophobicContact CG-CB 4.24Å; I276-A279 HydrophobicContact CG2-CB 4.23Å; A279-Y296 WeakPolarHBondContact CA-O 3.32Å; A279-I330 VanDerWaalsContact CA-CD1 3.41Å; A279-I330 VanDerWaalsContact N-CD1 3.33Å
280	A	94.8	Very high	91.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138.8	174.9	0	0	0	0	0	109.7	A295 Y296 I330 V338 L343	A280-A295 CarbonylContact O-C 3.54Å; A280-A295 WeakPolarHBondContact O-CA 3.39Å; A280-Y296 PolarHBondContact N-O 3.21Å; A280-Y296 PolarHBondContact O-N 3.32Å; A280-I330 HydrophobicContact CB-CD1 3.88Å; A280-I330 HydrophobicContact CB-CG1 4.2Å; A280-I330 HydrophobicContact CB-CG2 3.73Å; A280-V338 HydrophobicContact CB-CG1 3.64Å; A280-V338 HydrophobicContact CB-CG2 4.26Å; A280-L343 HydrophobicContact CB-CD1 3.41Å; A280-L343 VanDerWaalsContact CB-CD1 3.41Å
281	V	95	Very high	91.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	138.1	-179.2	177.4	0	0	0	0	110	I254 P263 L266 E267 L270 P293 R294 A295 R340	I254-V281 HydrophobicContact CD1-CG1 3.82Å; P263-V281 HydrophobicContact CB-CB 4.03Å; P263-V281 HydrophobicContact CB-CG1 4.29Å; P263-V281 WeakPolarHBondContact CB-O 3.4Å; L266-V281 HydrophobicContact CB-CB 4.35Å; L266-V281 HydrophobicContact CB-CG1 4.28Å; L266-V281 HydrophobicContact CB-CG2 3.85Å; L266-V281 HydrophobicContact CD1-CG1 3.78Å; E267-V281 HydrophobicContact CG-CB 4.01Å; E267-V281 HydrophobicContact CG-CG2 3.81Å; E267-V281 PolarHBondContact OE1-N 2.93Å; L270-V281 HydrophobicContact CD1-CG2 3.82Å; V281-P293 HydrophobicContact CG1-CB 4.1Å; V281-R294 WeakPolarHBondContact CA-O 3.49Å; V281-A295 HydrophobicContact CG2-CB 4.07Å; V281-R340 PolarHBondContact O-NE 3.15Å
282	V	94.9	Very high	91.6	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	148.4	176.6	-64.3	0	0	0	0	110.9	I284 R294 Y296 R340 L343 K344	V282-I284 HydrophobicContact CG2-CG1 4.35Å; V282-R294 HydrophobicContact CG2-CB 4.4Å; V282-R294 PolarHBondContact N-O 2.94Å; V282-R294 PolarHBondContact O-N 3.36Å; V282-Y296 HydrophobicContact CG2-CD2 4.32Å; V282-Y296 HydrophobicContact CG2-CE2 3.89Å; V282-R340 HydrophobicContact CG1-CB 4.05Å; V282-R340 HydrophobicContact CG1-CG 4.13Å; V282-L343 HydrophobicContact CG1-CB 3.78Å; V282-L343 HydrophobicContact CG1-CD1 4.36Å; V282-K344 HydrophobicContact CB-CG 3.95Å; V282-K344 HydrophobicContact CG1-CG 4.12Å; V282-K344 HydrophobicContact CG2-CG 4.48Å
283	G	94.2	Very high	92.1	Very high	2 Å²	2	43.8 Å²	43.8	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	129.7	167.3	0	0	0	0	0	110.3	K344	G283-K344 WeakPolarHBondContact O-CE 3.33Å
284	I	93.4	Very high	92.4	Very high	17 Å²	17	42.5 Å²	42.5	9%	0.087	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.3	173.6	-59.1	-169.4	0	0	0	108.9	V282 K286 E291 V292 R294 A347	V282-I284 HydrophobicContact CG2-CG1 4.35Å; I284-K286 PolarHBondContact O-N 3.31Å; I284-E291 CarbonylContact O-C 3.17Å; I284-E291 VanDerWaalsContact O-CA 3.23Å; I284-E291 WeakPolarHBondContact O-CA 3.42Å; I284-V292 HydrophobicContact CB-CG2 4.5Å; I284-V292 PolarHBondContact N-O 2.8Å; I284-V292 PolarHBondContact O-N 3.38Å; I284-R294 HydrophobicContact CD1-CB 3.37Å; I284-R294 VanDerWaalsContact CD1-CD 3.45Å; I284-R294 HydrophobicContact CD1-CG 3.93Å; I284-R294 HydrophobicContact CG1-CB 3.86Å; I284-A347 HydrophobicContact CD1-CB 3.46Å; I284-A347 VanDerWaalsContact CD1-CB 3.46Å; I284-A347 HydrophobicContact CG1-CB 4.06Å
285	P	92.1	Very high	92.7	Very high	87 Å²	87	37.8 Å²	37.8	57%	0.565	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-53.9	130.9	174.1	-24.8	34.2	0	0	0	111.6	G290	P285-G290 WeakPolarHBondContact CA-O 3.45Å
286	K	91.3	Very high	92.8	Very high	110 Å²	110	37.4 Å²	37.4	48%	0.478	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	127	172.2	-171.7	163.9	-173.2	169.1	0	108.7	I284 V289 G290 V292	I284-K286 PolarHBondContact O-N 3.31Å; K286-V289 HydrophobicContact CB-CG2 3.89Å; K286-V289 HydrophobicContact CD-CG2 4.36Å; K286-V289 HydrophobicContact CG-CG2 4.07Å; K286-V289 PolarHBondContact O-N 2.87Å; K286-G290 PolarHBondContact N-O 3.07Å; K286-G290 PolarHBondContact O-N 3.34Å; K286-G290 VanDerWaalsContact O-O 3.12Å; K286-V292 HydrophobicContact CB-CG1 4.17Å; K286-V292 HydrophobicContact CB-CG2 3.97Å; K286-V292 HydrophobicContact CD-CG1 3.86Å; K286-V292 HydrophobicContact CD-CG2 3.93Å
287	A	85.3	Confident	93	Very high	83 Å²	83	37.2 Å²	37.2	69%	0.686	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.1	145.9	176.9	0	0	0	0	0	110.4	V289	A287-V289 PolarHBondContact O-N 3.49Å
288	E	87.4	Confident	93.2	Very high	200 Å²	200	31.5 Å²	31.5	94%	0.935	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	74	-29.4	-179.9	-49.7	170.3	-177.3	0	0	117
289	V	91.4	Very high	93.3	Very high	24 Å²	24	32.7 Å²	32.7	15%	0.145	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-0.8	-173.1	-60.6	0	0	0	0	114.6	Y256 K257 K286 A287 E291 V292	Y256-V289 HydrophobicContact CD2-CB 4.12Å; Y256-V289 HydrophobicContact CD2-CG2 4.25Å; Y256-V289 HydrophobicContact CE2-CB 3.87Å; Y256-V289 HydrophobicContact CE2-CG1 4.23Å; Y256-V289 HydrophobicContact CE2-CG2 4.04Å; K257-V289 HydrophobicContact CG-CB 4.09Å; K257-V289 HydrophobicContact CG-CG1 4.08Å; K257-V289 PolarHBondContact N-O 3.09Å; K286-V289 HydrophobicContact CB-CG2 3.89Å; K286-V289 HydrophobicContact CD-CG2 4.36Å; K286-V289 HydrophobicContact CG-CG2 4.07Å; K286-V289 PolarHBondContact O-N 2.87Å; A287-V289 PolarHBondContact O-N 3.49Å; V289-E291 PolarHBondContact O-N 2.84Å; V289-V292 HydrophobicContact CG2-CG1 3.78Å
290	G	92.5	Very high	93.2	Very high	44 Å²	44	39.3 Å²	39.3	45%	0.454	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	84.8	-96.2	-177.3	0	0	0	0	0	110.6	P285 K286	P285-G290 WeakPolarHBondContact CA-O 3.45Å; K286-G290 PolarHBondContact N-O 3.07Å; K286-G290 PolarHBondContact O-N 3.34Å; K286-G290 VanDerWaalsContact O-O 3.12Å
291	E	94.3	Very high	92.9	Very high	37 Å²	37	44.7 Å²	44.7	17%	0.173	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.5	176.4	-64	-178.6	136.2	0	0	111.6	I254 K255 Y256 I284 V289 K344	I254-E291 WeakPolarHBondContact CA-OE2 3.37Å; I254-E291 HydrophobicContact CG2-CB 3.7Å; K255-E291 PolarHBondContact N-OE2 2.8Å; K255-E291 PolarHBondContact O-N 3.24Å; Y256-E291 WeakPolarHBondContact CA-O 3.4Å; Y256-E291 WeakPolarHBondContact CB-O 3.41Å; Y256-E291 WeakPolarHBondContact CD2-O 3.46Å; I284-E291 CarbonylContact O-C 3.17Å; I284-E291 VanDerWaalsContact O-CA 3.23Å; I284-E291 WeakPolarHBondContact O-CA 3.42Å; V289-E291 PolarHBondContact O-N 2.84Å; E291-K344 IonicContact OE1-NZ 3.84Å; E291-K344 PolarHBondContact OE1-NZ 2.86Å
292	V	94.5	Very high	92.5	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143.4	168.9	-70.8	0	0	0	0	111.1	Y256 I284 K286 V289 R294 R321	Y256-V292 HydrophobicContact CD2-CG1 4Å; Y256-V292 HydrophobicContact CE2-CG1 4Å; I284-V292 HydrophobicContact CB-CG2 4.5Å; I284-V292 PolarHBondContact N-O 2.8Å; I284-V292 PolarHBondContact O-N 3.38Å; K286-V292 HydrophobicContact CB-CG1 4.17Å; K286-V292 HydrophobicContact CB-CG2 3.97Å; K286-V292 HydrophobicContact CD-CG1 3.86Å; K286-V292 HydrophobicContact CD-CG2 3.93Å; V289-V292 HydrophobicContact CG2-CG1 3.78Å; V292-R294 PolarHBondContact O-N 2.83Å; V292-R321 HydrophobicContact CB-CB 3.83Å; V292-R321 HydrophobicContact CG1-CB 3.77Å; V292-R321 HydrophobicContact CG2-CB 4.5Å
293	P	95.1	Very high	92.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	129.7	175.5	-17.1	30	0	0	0	112	I254 V261 L266 V281 L320 R321 G322	I254-P293 HydrophobicContact CD1-CB 3.86Å; I254-P293 HydrophobicContact CD1-CG 4.09Å; I254-P293 HydrophobicContact CG2-CG 4.25Å; V261-P293 HydrophobicContact CG1-CG 4.4Å; L266-P293 HydrophobicContact CD1-CB 3.82Å; L266-P293 HydrophobicContact CD1-CG 4.11Å; V281-P293 HydrophobicContact CG1-CB 4.1Å; P293-L320 HydrophobicContact CB-CD2 4.08Å; P293-L320 CarbonylContact O-C 3.58Å; P293-L320 VanDerWaalsContact O-CA 3.23Å; P293-L320 WeakPolarHBondContact O-CA 3.36Å; P293-R321 PolarHBondContact O-N 3.16Å; P293-G322 VanDerWaalsContact O-CA 3.32Å; P293-G322 WeakPolarHBondContact O-CA 3.34Å; P293-G322 PolarHBondContact O-N 3.19Å
294	R	94.7	Very high	91.9	Very high	22 Å²	22	63 Å²	63	8%	0.083	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.2	161.8	170.7	167.7	-61.4	162.4	12.2	108.9	V281 V282 I284 V292 Y296 G322 G323 E350	V281-R294 WeakPolarHBondContact CA-O 3.49Å; V282-R294 HydrophobicContact CG2-CB 4.4Å; V282-R294 PolarHBondContact N-O 2.94Å; V282-R294 PolarHBondContact O-N 3.36Å; I284-R294 HydrophobicContact CD1-CB 3.37Å; I284-R294 VanDerWaalsContact CD1-CD 3.45Å; I284-R294 HydrophobicContact CD1-CG 3.93Å; I284-R294 HydrophobicContact CG1-CB 3.86Å; V292-R294 PolarHBondContact O-N 2.83Å; R294-Y296 HydrophobicContact CG-CD2 4.48Å; R294-Y296 HydrophobicContact CG-CE2 4.1Å; R294-G322 VanDerWaalsContact CZ-O 3.24Å; R294-G322 PolarHBondContact NE-O 3.03Å; R294-G322 PolarHBondContact NH2-O 3.4Å; R294-G323 WeakPolarHBondContact CA-O 3.32Å; R294-G323 WeakPolarHBondContact CG-O 3.16Å; R294-E350 IonicContact CZ-OE2 2.81Å; R294-E350 IonicContact NH1-OE2 3.99Å; R294-E350 PolarHBondContact NH1-OE2 2.66Å
295	A	95.5	Very high	91.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	138.9	170.9	0	0	0	0	0	111.5	L270 A280 V281 V297 L320 G323 V324 R325	L270-A295 HydrophobicContact CD1-CB 3.77Å; A280-A295 CarbonylContact O-C 3.54Å; A280-A295 WeakPolarHBondContact O-CA 3.39Å; V281-A295 HydrophobicContact CG2-CB 4.07Å; A295-V297 HydrophobicContact CB-CG2 4.21Å; A295-L320 HydrophobicContact CB-CD1 3.71Å; A295-L320 HydrophobicContact CB-CD2 4.01Å; A295-L320 HydrophobicContact CB-CG 4.4Å; A295-G323 PolarHBondContact N-O 2.89Å; A295-G323 VanDerWaalsContact N-O 3.16Å; A295-V324 HydrophobicContact CB-CG1 4.49Å; A295-V324 CarbonylContact O-C 3.52Å; A295-V324 WeakPolarHBondContact O-CA 3.33Å; A295-R325 PolarHBondContact O-N 2.74Å
296	Y	95.7	Very high	91.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.1	162.5	-71.5	-86.5	0	0	0	107.9	A279 A280 V282 R294 R325 V327 L343 A347 E350	A279-Y296 WeakPolarHBondContact CA-O 3.32Å; A280-Y296 PolarHBondContact N-O 3.21Å; A280-Y296 PolarHBondContact O-N 3.32Å; V282-Y296 HydrophobicContact CG2-CD2 4.32Å; V282-Y296 HydrophobicContact CG2-CE2 3.89Å; R294-Y296 HydrophobicContact CG-CD2 4.48Å; R294-Y296 HydrophobicContact CG-CE2 4.1Å; Y296-R325 CarbonylContact C-O 3.17Å; Y296-R325 WeakPolarHBondContact CA-O 3.42Å; Y296-R325 HydrophobicContact CD1-CB 3.6Å; Y296-R325 HydrophobicContact CD1-CG 4.4Å; Y296-R325 HydrophobicContact CE1-CB 3.65Å; Y296-R325 HydrophobicContact CE1-CG 3.98Å; Y296-R325 HydrophobicContact CG-CB 4.42Å; Y296-V327 HydrophobicContact CD1-CG1 3.73Å; Y296-V327 HydrophobicContact CD1-CG2 4.46Å; Y296-V327 HydrophobicContact CE1-CG1 4.35Å; Y296-L343 HydrophobicContact CD1-CD2 4.17Å; Y296-L343 HydrophobicContact CD2-CB 4.15Å; Y296-L343 HydrophobicContact CD2-CD1 4.16Å; Y296-L343 HydrophobicContact CD2-CD2 3.89Å; Y296-L343 HydrophobicContact CD2-CG 4.3Å; Y296-L343 HydrophobicContact CE1-CD2 4.48Å; Y296-L343 HydrophobicContact CE2-CB 4.05Å; Y296-L343 HydrophobicContact CE2-CD2 4.21Å; Y296-L343 HydrophobicContact CG-CD2 3.86Å; Y296-A347 WeakPolarHBondContact OH-CA 3.47Å; Y296-A347 VanDerWaalsContact OH-CB 3.28Å; Y296-A347 WeakPolarHBondContact OH-CB 3.48Å; Y296-A347 PolarHBondContact OH-N 2.86Å; Y296-E350 PolarHBondContact OH-OE1 2.95Å; Y296-E350 PolarHBondContact OH-OE2 3.44Å
297	V	94.8	Very high	91	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127	-170	176.3	0	0	0	0	109.8	I276 A295 L299 V324 R325 F326 V327	I276-V297 HydrophobicContact CB-CG1 4.47Å; I276-V297 HydrophobicContact CD1-CG1 3.83Å; I276-V297 HydrophobicContact CG1-CG1 3.84Å; I276-V297 HydrophobicContact CG2-CG1 3.99Å; A295-V297 HydrophobicContact CB-CG2 4.21Å; V297-L299 HydrophobicContact CG1-CD2 3.85Å; V297-V324 HydrophobicContact CB-CG1 4.26Å; V297-V324 HydrophobicContact CG2-CG1 3.69Å; V297-R325 PolarHBondContact N-O 3.16Å; V297-F326 HydrophobicContact CB-CD1 4.12Å; V297-F326 HydrophobicContact CB-CE1 4.29Å; V297-F326 HydrophobicContact CG1-CD1 4.12Å; V297-F326 HydrophobicContact CG1-CE1 4.1Å; V297-F326 WeakPolarHBondContact O-CA 3.43Å; V297-V327 PolarHBondContact O-N 3.08Å
298	C	94.3	Very high	90.8	Very high	4 Å²	4	63.6 Å²	63.6	3%	0.027	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.3	165.2	-62.6	0	0	0	0	109	K277 D278 V327 N329	K277-C298 HydrophobicContact CB-CB 4.48Å; K277-C298 WeakPolarHBondContact CB-O 3.38Å; K277-C298 PolarHBondContact N-O 3.08Å; D278-C298 HydrophobicContact CB-CB 3.9Å; D278-C298 PolarHBondContact N-O 3.47Å; D278-C298 PolarHBondContact O-N 3.34Å; C298-V327 WeakPolarHBondContact CA-O 3.37Å; C298-V327 PolarHBondContact SG-O 3.12Å; C298-N329 VanDerWaalsContact SG-CA 3.51Å
299	L	94.1	Very high	90.4	Very high	49 Å²	49	58.2 Å²	58.2	26%	0.257	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	155.5	175.8	-59.8	-179.5	0	0	0	111.4	A275 I276 V297 I305 F326	A275-L299 WeakPolarHBondContact O-CA 3.23Å; I276-L299 HydrophobicContact CG1-CD2 4.31Å; V297-L299 HydrophobicContact CG1-CD2 3.85Å; L299-I305 HydrophobicContact CD1-CG2 4.23Å; L299-I305 HydrophobicContact CD2-CG2 3.54Å; L299-F326 HydrophobicContact CD1-CD1 3.92Å; L299-F326 HydrophobicContact CD1-CE1 4.08Å; L299-F326 HydrophobicContact CD2-CD1 4.14Å; L299-F326 HydrophobicContact CD2-CE1 3.97Å; L299-F326 HydrophobicContact CG-CD1 3.91Å; L299-F326 HydrophobicContact CG-CE1 4.19Å
300	R	91.8	Very high	89.9	Confident	141 Å²	141	57.5 Å²	57.5	53%	0.532	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-69.3	154.2	163.3	-63.1	-174.7	-175	-142.4	-0.9	109.4	P274 A275 I276 K277 Q302 C303	P274-R300 WeakPolarHBondContact O-CD 3.44Å; P274-R300 PolarHBondContact O-NE 3.36Å; A275-R300 PolarHBondContact O-N 3Å; I276-R300 PolarHBondContact O-NE 3.14Å; K277-R300 HydrophobicContact CB-CG 3.83Å; R300-Q302 PolarHBondContact O-N 3.07Å; R300-C303 PolarHBondContact O-N 3.04Å
301	S	89.2	Confident	89.2	Confident	114 Å²	114	57.6 Å²	57.6	80%	0.797	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	136.8	178.2	-56.5	0	0	0	0	111	C303	S301-C303 PolarHBondContact O-N 3.46Å
302	Q	86.5	Confident	88.2	Confident	205 Å²	205	60.4 Å²	60.4	96%	0.958	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	13.6	177.9	-54.2	176.1	-21.6	0	0	115.4	R300	R300-Q302 PolarHBondContact O-N 3.07Å
303	C	89.2	Confident	87.4	Confident	48 Å²	48	66 Å²	66	32%	0.324	35%	0.347	S	S	.	.			trans	-97.7	146.2	170.8	-61.3	0	0	0	0	111.3	A275 R300 S301	A275-C303 HydrophobicContact CB-CB 3.8Å; R300-C303 PolarHBondContact O-N 3.04Å; S301-C303 PolarHBondContact O-N 3.46Å
304	T	87.2	Confident	86.7	Confident	134 Å²	134	66.5 Å²	66.5	82%	0.822	35%	0.35	S	S	*	.			trans	-126.4	148.8	168.3	52.5	0	0	0	0	109
305	I	87.9	Confident	86.1	Confident	21 Å²	21	67.5 Å²	67.5	11%	0.108	36%	0.363	C	S	.	.			trans	-153.2	143.1	177.5	-167.9	176.8	0	0	0	108.9	H273 L299 D309 I310 F326	H273-I305 WeakPolarHBondContact CE1-CD1 3.26Å; H273-I305 WeakPolarHBondContact NE2-CD1 3.42Å; L299-I305 HydrophobicContact CD1-CG2 4.23Å; L299-I305 HydrophobicContact CD2-CG2 3.54Å; I305-D309 HydrophobicContact CD1-CB 4.24Å; I305-D309 HydrophobicContact CG1-CB 3.83Å; I305-I310 HydrophobicContact CD1-CD1 4.26Å; I305-I310 HydrophobicContact CD1-CG1 3.62Å; I305-I310 HydrophobicContact CG1-CG1 4.23Å; I305-I310 HydrophobicContact CG2-CD1 4.25Å; I305-F326 HydrophobicContact CG2-CE1 3.59Å; I305-F326 HydrophobicContact CG2-CZ 3.84Å; I305-F326 WeakPolarHBondContact O-CZ 3.47Å
306	S	85.8	Confident	85.6	Confident	48 Å²	48	71.4 Å²	71.4	34%	0.336	39%	0.388	S	S	.	.			trans	-84.8	162.1	174.5	74.8	0	0	0	0	111.7	E308 D309	S306-E308 PolarHBondContact O-N 3.47Å; S306-E308 PolarHBondContact OG-N 3.47Å; S306-D309 PolarHBondContact N-OD2 3.24Å; S306-D309 PolarHBondContact OG-N 3.21Å; S306-D309 PolarHBondContact OG-OD2 2.93Å
307	E	84	Confident	85	Confident	77 Å²	77	73.9 Å²	73.9	36%	0.36	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-30.8	172.3	-57.8	-161.9	179.6	0	0	112.1	I310 H311 V324 R325	E307-I310 WeakPolarHBondContact O-CB 3.32Å; E307-I310 PolarHBondContact O-N 3Å; E307-H311 PolarHBondContact O-CD2 3.44Å; E307-H311 PolarHBondContact O-N 3.25Å; E307-V324 HydrophobicContact CB-CB 4.5Å; E307-V324 HydrophobicContact CB-CG2 4.33Å; E307-V324 HydrophobicContact CG-CB 3.93Å; E307-V324 HydrophobicContact CG-CG2 4.31Å; E307-V324 VanDerWaalsContact OE1-O 3.07Å; E307-R325 IonicContact OE1-NH1 3.66Å
308	E	80.9	Confident	84.7	Confident	164 Å²	164	75.3 Å²	75.3	77%	0.766	41%	0.406	S	S	*	.	H	α-helix	trans	-67.5	-42.6	-179.8	-77.3	-178.1	152.7	0	0	112.4	S306 I310 H311 S312	S306-E308 PolarHBondContact O-N 3.47Å; S306-E308 PolarHBondContact OG-N 3.47Å; E308-I310 PolarHBondContact O-N 2.89Å; E308-H311 PolarHBondContact O-N 3.4Å; E308-S312 PolarHBondContact O-N 3.13Å
309	D	80.1	Confident	84.6	Confident	86 Å²	86	80.2 Å²	80.2	46%	0.46	42%	0.424	S	S	.	.	H	α-helix	trans	-58.3	-36.4	178.1	-65.3	-44.7	0	0	0	111.5	I305 S306 S312	I305-D309 HydrophobicContact CD1-CB 4.24Å; I305-D309 HydrophobicContact CG1-CB 3.83Å; S306-D309 PolarHBondContact N-OD2 3.24Å; S306-D309 PolarHBondContact OG-N 3.21Å; S306-D309 PolarHBondContact OG-OD2 2.93Å; D309-S312 PolarHBondContact O-OG 3.31Å
310	I	80	Confident	84.5	Confident	10 Å²	10	78 Å²	78	5%	0.051	41%	0.412	C	S	.	.	H	α-helix	trans	-67.3	-41.2	177.5	-66.9	174.1	0	0	0	111.4	L270 I276 I305 E307 E308 S312 L320 V324 F326	L270-I310 HydrophobicContact CD2-CG2 3.21Å; I276-I310 HydrophobicContact CD1-CD1 4.38Å; I276-I310 HydrophobicContact CD1-CG1 4.46Å; I305-I310 HydrophobicContact CD1-CD1 4.26Å; I305-I310 HydrophobicContact CD1-CG1 3.62Å; I305-I310 HydrophobicContact CG1-CG1 4.23Å; I305-I310 HydrophobicContact CG2-CD1 4.25Å; E307-I310 WeakPolarHBondContact O-CB 3.32Å; E307-I310 PolarHBondContact O-N 3Å; E308-I310 PolarHBondContact O-N 2.89Å; I310-S312 PolarHBondContact O-N 2.79Å; I310-L320 HydrophobicContact CG2-CD1 3.65Å; I310-V324 HydrophobicContact CD1-CG1 3.92Å; I310-V324 HydrophobicContact CD1-CG2 4.32Å; I310-V324 HydrophobicContact CG2-CG2 4.45Å; I310-F326 HydrophobicContact CD1-CE1 4.4Å; I310-F326 HydrophobicContact CD1-CZ 4.34Å
311	H	76.7	Confident	84.6	Confident	46 Å²	46	74.9 Å²	74.9	21%	0.213	40%	0.4	C	S	.	.	H	α-helix	trans	-69	-31.3	-174.8	-93	-125.4	0	0	0	113.8	E307 E308 K313 L314 L320	E307-H311 PolarHBondContact O-CD2 3.44Å; E307-H311 PolarHBondContact O-N 3.25Å; E308-H311 PolarHBondContact O-N 3.4Å; H311-K313 PolarHBondContact O-N 3.42Å; H311-L314 PolarHBondContact O-N 2.79Å; H311-L320 PolarHBondContact CE1-N 3.45Å; H311-L320 WeakPolarHBondContact NE2-CB 3.32Å; H311-L320 PolarHBondContact NE2-O 3.28Å
312	S	74.9	Confident	84.7	Confident	95 Å²	95	70 Å²	70	66%	0.664	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.4	-171.3	66.3	0	0	0	0	114.9	E308 D309 I310	E308-S312 PolarHBondContact O-N 3.13Å; D309-S312 PolarHBondContact O-OG 3.31Å; I310-S312 PolarHBondContact O-N 2.79Å
313	K	76.6	Confident	85	Confident	123 Å²	123	61 Å²	61	54%	0.535	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-1.4	-177.6	-63.2	-170.6	178.7	-175.3	0	114.6	I269 H311	I269-K313 HydrophobicContact CG2-CB 4.21Å; H311-K313 PolarHBondContact O-N 3.42Å
314	L	81.7	Confident	85.2	Confident	10 Å²	10	58.7 Å²	58.7	5%	0.052	31%	0.314	C	S	.	.	S	Bend	trans	-103.9	136.5	-171.2	-61.5	179.2	0	0	0	112.1	L266 I269 H311 K318 W319 L320	L266-L314 HydrophobicContact CD2-CD1 3.94Å; L266-L314 HydrophobicContact CD2-CD2 3.5Å; L266-L314 HydrophobicContact CD2-CG 4.31Å; I269-L314 HydrophobicContact CB-CD2 4.18Å; I269-L314 HydrophobicContact CD1-CD2 3.75Å; I269-L314 HydrophobicContact CG2-CD2 3.76Å; H311-L314 PolarHBondContact O-N 2.79Å; L314-K318 HydrophobicContact CB-CB 4.5Å; L314-W319 PolarHBondContact O-NE1 3.12Å; L314-L320 HydrophobicContact CD1-CD1 4.15Å; L314-L320 HydrophobicContact CD1-CD2 4.26Å; L314-L320 HydrophobicContact CD1-CG 3.81Å
315	A	82.1	Confident	85.5	Confident	43 Å²	43	55.4 Å²	55.4	36%	0.355	29%	0.287	S	S	.	.			trans	-59.1	150.1	170.2	0	0	0	0	0	110.9	H317 K318 W319	A315-H317 VanDerWaalsContact C-N 3.31Å; A315-H317 PolarHBondContact O-N 3.16Å; A315-H317 VanDerWaalsContact O-N 3.09Å; A315-K318 HydrophobicContact CB-CD 4.47Å; A315-K318 WeakPolarHBondContact O-CA 3.47Å; A315-K318 WeakPolarHBondContact O-CB 3.41Å; A315-K318 PolarHBondContact O-N 2.92Å; A315-W319 PolarHBondContact O-N 3.42Å
316	P	84.6	Confident	85.8	Confident	81 Å²	81	58.8 Å²	58.8	53%	0.526	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-53.5	-40.4	-171.4	-30.6	35.6	0	0	0	115.4	K318 W319 R321	P316-K318 PolarHBondContact O-N 3.1Å; P316-W319 HydrophobicContact CB-CZ2 4.23Å; P316-W319 HydrophobicContact CG-CZ2 4.29Å; P316-W319 PolarHBondContact O-N 2.77Å; P316-R321 PolarHBondContact O-NH1 2.8Å; P316-R321 PolarHBondContact O-NH2 2.78Å
317	H	82	Confident	86.1	Confident	53 Å²	53	58 Å²	58	25%	0.245	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-73.5	-9.2	179.4	65.1	-79.3	0	0	0	114	Y256 K259 A315	Y256-H317 HydrophobicContact CD1-CB 4.5Å; K259-H317 HydrophobicContact CD-CB 3.69Å; A315-H317 VanDerWaalsContact C-N 3.31Å; A315-H317 PolarHBondContact O-N 3.16Å; A315-H317 VanDerWaalsContact O-N 3.09Å
318	K	88.6	Confident	86.5	Confident	30 Å²	30	62.7 Å²	62.7	13%	0.13	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-105.2	-3.8	-179.8	-70.9	-179.3	172.8	166.3	0	113.1	V261 E265 L266 L314 A315 P316 L320	V261-K318 HydrophobicContact CG1-CG 4.07Å; V261-K318 HydrophobicContact CG2-CG 4.37Å; E265-K318 IonicContact OE1-NZ 3.27Å; E265-K318 PolarHBondContact OE1-NZ 3.07Å; E265-K318 VanDerWaalsContact OE2-CE 3.25Å; E265-K318 WeakPolarHBondContact OE2-CE 3.45Å; E265-K318 IonicContact OE2-NZ 2.75Å; E265-K318 PolarHBondContact OE2-NZ 2.86Å; L266-K318 HydrophobicContact CD2-CB 3.87Å; L314-K318 HydrophobicContact CB-CB 4.5Å; A315-K318 HydrophobicContact CB-CD 4.47Å; A315-K318 WeakPolarHBondContact O-CA 3.47Å; A315-K318 WeakPolarHBondContact O-CB 3.41Å; A315-K318 PolarHBondContact O-N 2.92Å; P316-K318 PolarHBondContact O-N 3.1Å; K318-L320 PolarHBondContact O-N 3.2Å
319	W	92.4	Very high	87	Confident	107 Å²	107	60.5 Å²	60.5	41%	0.405	31%	0.309	S	S	.	.	S	Bend	trans	-53.5	140.2	177.1	-66.5	-13.2	0	0	0	112.2	L314 A315 P316 R321	L314-W319 PolarHBondContact O-NE1 3.12Å; A315-W319 PolarHBondContact O-N 3.42Å; P316-W319 HydrophobicContact CB-CZ2 4.23Å; P316-W319 HydrophobicContact CG-CZ2 4.29Å; P316-W319 PolarHBondContact O-N 2.77Å; W319-R321 HydrophobicContact CB-CG 4.31Å; W319-R321 PolarHBondContact O-N 3.35Å
320	L	93.3	Very high	87.6	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	29%	0.29	C	S	.	.			trans	-77	63.5	-177.9	-48.4	165.2	0	0	0	110	L266 L270 P293 A295 I310 H311 L314 K318 G322 G323 V324	L266-L320 HydrophobicContact CD1-CD2 4.14Å; L270-L320 HydrophobicContact CD2-CD1 4.29Å; P293-L320 HydrophobicContact CB-CD2 4.08Å; P293-L320 CarbonylContact O-C 3.58Å; P293-L320 VanDerWaalsContact O-CA 3.23Å; P293-L320 WeakPolarHBondContact O-CA 3.36Å; A295-L320 HydrophobicContact CB-CD1 3.71Å; A295-L320 HydrophobicContact CB-CD2 4.01Å; A295-L320 HydrophobicContact CB-CG 4.4Å; I310-L320 HydrophobicContact CG2-CD1 3.65Å; H311-L320 PolarHBondContact CE1-N 3.45Å; H311-L320 WeakPolarHBondContact NE2-CB 3.32Å; H311-L320 PolarHBondContact NE2-O 3.28Å; L314-L320 HydrophobicContact CD1-CD1 4.15Å; L314-L320 HydrophobicContact CD1-CD2 4.26Å; L314-L320 HydrophobicContact CD1-CG 3.81Å; K318-L320 PolarHBondContact O-N 3.2Å; L320-G322 PolarHBondContact O-N 3.26Å; L320-G322 VanDerWaalsContact O-N 3.12Å; L320-G323 WeakPolarHBondContact O-CA 3.28Å; L320-G323 PolarHBondContact O-N 3.38Å; L320-V324 HydrophobicContact CB-CG2 4.48Å; L320-V324 HydrophobicContact CD1-CG2 3.73Å
321	R	92.7	Very high	88.1	Confident	76 Å²	76	58.1 Å²	58.1	29%	0.287	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.6	-178.6	-69.8	177.4	-179.3	77.2	6.3	113.7	Y256 V292 P293 P316 W319	Y256-R321 PolarHBondContact OH-NE 3.36Å; V292-R321 HydrophobicContact CB-CB 3.83Å; V292-R321 HydrophobicContact CG1-CB 3.77Å; V292-R321 HydrophobicContact CG2-CB 4.5Å; P293-R321 PolarHBondContact O-N 3.16Å; P316-R321 PolarHBondContact O-NH1 2.8Å; P316-R321 PolarHBondContact O-NH2 2.78Å; W319-R321 HydrophobicContact CB-CG 4.31Å; W319-R321 PolarHBondContact O-N 3.35Å
322	G	92	Very high	88.2	Confident	10 Å²	10	58.6 Å²	58.6	10%	0.103	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-7.6	167.7	0	0	0	0	0	113.1	P293 R294 L320	P293-G322 VanDerWaalsContact O-CA 3.32Å; P293-G322 WeakPolarHBondContact O-CA 3.34Å; P293-G322 PolarHBondContact O-N 3.19Å; R294-G322 VanDerWaalsContact CZ-O 3.24Å; R294-G322 PolarHBondContact NE-O 3.03Å; R294-G322 PolarHBondContact NH2-O 3.4Å; L320-G322 PolarHBondContact O-N 3.26Å; L320-G322 VanDerWaalsContact O-N 3.12Å
323	G	92.4	Very high	87.9	Confident	16 Å²	16	55.7 Å²	55.7	17%	0.165	28%	0.281	C	S	.	.			trans	88.4	177.4	-175.4	0	0	0	0	0	113.1	R294 A295 L320	R294-G323 WeakPolarHBondContact CA-O 3.32Å; R294-G323 WeakPolarHBondContact CG-O 3.16Å; A295-G323 PolarHBondContact N-O 2.89Å; A295-G323 VanDerWaalsContact N-O 3.16Å; L320-G323 WeakPolarHBondContact O-CA 3.28Å; L320-G323 PolarHBondContact O-N 3.38Å
324	V	92.9	Very high	86.9	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	145.2	171.6	-174.9	0	0	0	0	109.5	A295 V297 E307 I310 L320 F326	A295-V324 HydrophobicContact CB-CG1 4.49Å; A295-V324 CarbonylContact O-C 3.52Å; A295-V324 WeakPolarHBondContact O-CA 3.33Å; V297-V324 HydrophobicContact CB-CG1 4.26Å; V297-V324 HydrophobicContact CG2-CG1 3.69Å; E307-V324 HydrophobicContact CB-CB 4.5Å; E307-V324 HydrophobicContact CB-CG2 4.33Å; E307-V324 HydrophobicContact CG-CB 3.93Å; E307-V324 HydrophobicContact CG-CG2 4.31Å; E307-V324 VanDerWaalsContact OE1-O 3.07Å; I310-V324 HydrophobicContact CD1-CG1 3.92Å; I310-V324 HydrophobicContact CD1-CG2 4.32Å; I310-V324 HydrophobicContact CG2-CG2 4.45Å; L320-V324 HydrophobicContact CB-CG2 4.48Å; L320-V324 HydrophobicContact CD1-CG2 3.73Å; V324-F326 HydrophobicContact CG1-CE1 4.43Å; V324-F326 HydrophobicContact CG1-CZ 4.3Å
325	R	93.8	Very high	85.7	Confident	64 Å²	64	58.7 Å²	58.7	24%	0.242	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.1	174.6	-69.9	-68	174.6	-103.2	9.3	109.8	A295 Y296 V297 E307 E350	A295-R325 PolarHBondContact O-N 2.74Å; Y296-R325 CarbonylContact C-O 3.17Å; Y296-R325 WeakPolarHBondContact CA-O 3.42Å; Y296-R325 HydrophobicContact CD1-CB 3.6Å; Y296-R325 HydrophobicContact CD1-CG 4.4Å; Y296-R325 HydrophobicContact CE1-CB 3.65Å; Y296-R325 HydrophobicContact CE1-CG 3.98Å; Y296-R325 HydrophobicContact CG-CB 4.42Å; V297-R325 PolarHBondContact N-O 3.16Å; E307-R325 IonicContact OE1-NH1 3.66Å; R325-E350 IonicContact NE-OE2 3.82Å; R325-E350 PolarHBondContact NE-OE2 3.35Å
326	F	93.5	Very high	84.9	Confident	92 Å²	92	58.6 Å²	58.6	40%	0.404	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123.1	172.6	-60.5	-73.9	0	0	0	109.4	V297 L299 I305 I310 V324	V297-F326 HydrophobicContact CB-CD1 4.12Å; V297-F326 HydrophobicContact CB-CE1 4.29Å; V297-F326 HydrophobicContact CG1-CD1 4.12Å; V297-F326 HydrophobicContact CG1-CE1 4.1Å; V297-F326 WeakPolarHBondContact O-CA 3.43Å; L299-F326 HydrophobicContact CD1-CD1 3.92Å; L299-F326 HydrophobicContact CD1-CE1 4.08Å; L299-F326 HydrophobicContact CD2-CD1 4.14Å; L299-F326 HydrophobicContact CD2-CE1 3.97Å; L299-F326 HydrophobicContact CG-CD1 3.91Å; L299-F326 HydrophobicContact CG-CE1 4.19Å; I305-F326 HydrophobicContact CG2-CE1 3.59Å; I305-F326 HydrophobicContact CG2-CZ 3.84Å; I305-F326 WeakPolarHBondContact O-CZ 3.47Å; I310-F326 HydrophobicContact CD1-CE1 4.4Å; I310-F326 HydrophobicContact CD1-CZ 4.34Å; V324-F326 HydrophobicContact CG1-CE1 4.43Å; V324-F326 HydrophobicContact CG1-CZ 4.3Å
327	V	93.7	Very high	84.2	Confident	32 Å²	32	59.7 Å²	59.7	19%	0.194	31%	0.311	C	S	.	.			trans	-128.8	153.1	-178.7	-67.8	0	0	0	0	110.1	Y296 V297 C298 I330	Y296-V327 HydrophobicContact CD1-CG1 3.73Å; Y296-V327 HydrophobicContact CD1-CG2 4.46Å; Y296-V327 HydrophobicContact CE1-CG1 4.35Å; V297-V327 PolarHBondContact O-N 3.08Å; C298-V327 WeakPolarHBondContact CA-O 3.37Å; C298-V327 PolarHBondContact SG-O 3.12Å; V327-I330 HydrophobicContact CG2-CG1 4.15Å
328	Q	91.5	Very high	84.2	Confident	175 Å²	175	58.2 Å²	58.2	82%	0.818	31%	0.305	S	S	*	.	S	Bend	trans	-69.9	-38.7	178.3	-69	-162.2	-8.7	0	0	112.4
329	N	91.8	Very high	84	Confident	118 Å²	118	60.5 Å²	60.5	63%	0.631	32%	0.316	S	S	*	.			trans	-145.3	144.2	179.6	-62.9	-67.5	0	0	0	110.6	C298	C298-N329 VanDerWaalsContact SG-CA 3.51Å
330	I	92.6	Very high	83.9	Confident	11 Å²	11	56.9 Å²	56.9	6%	0.056	30%	0.303	C	S	.	.			trans	-89.8	138.5	168.4	-72.7	162.9	0	0	0	108.6	D278 A279 A280 V327 H332 V338 L343	D278-I330 HydrophobicContact CB-CD1 3.93Å; A279-I330 VanDerWaalsContact CA-CD1 3.41Å; A279-I330 VanDerWaalsContact N-CD1 3.33Å; A280-I330 HydrophobicContact CB-CD1 3.88Å; A280-I330 HydrophobicContact CB-CG1 4.2Å; A280-I330 HydrophobicContact CB-CG2 3.73Å; V327-I330 HydrophobicContact CG2-CG1 4.15Å; I330-H332 VanDerWaalsContact CG2-NE2 3.33Å; I330-H332 WeakPolarHBondContact CG2-NE2 3.49Å; I330-H332 PolarHBondContact O-CD2 3.23Å; I330-H332 PolarHBondContact O-N 3.36Å; I330-V338 HydrophobicContact CG2-CG1 4.18Å; I330-V338 HydrophobicContact CG2-CG2 4.34Å; I330-L343 HydrophobicContact CG2-CD1 4.46Å
331	P	89.5	Confident	83.6	Confident	35 Å²	35	64.1 Å²	64.1	23%	0.227	33%	0.334	C	S	.	.			trans	-75	119.7	178.1	29.7	-33.3	0	0	0	110.4	Q339 L342 L343	P331-Q339 HydrophobicContact CB-CB 4.15Å; P331-Q339 HydrophobicContact CG-CB 4.32Å; P331-Q339 PolarHBondContact O-N 3.05Å; P331-L342 HydrophobicContact CB-CD1 3.98Å; P331-L342 HydrophobicContact CG-CB 4.23Å; P331-L342 HydrophobicContact CG-CD1 4.44Å; P331-L343 HydrophobicContact CG-CD2 3.92Å; P331-L343 HydrophobicContact CG-CG 3.9Å
332	H	78.9	Confident	83.4	Confident	56 Å²	56	64.1 Å²	64.1	26%	0.259	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-114.7	152	173.1	-65.8	-96.6	0	0	0	111.7	D278 I330 G336 K337 Q339	D278-H332 IonicContact OD1-NE2 3.39Å; D278-H332 IonicContact OD2-CD2 3.96Å; D278-H332 IonicContact OD2-CE1 3.44Å; D278-H332 IonicContact OD2-NE2 3.98Å; D278-H332 PolarHBondContact OD2-NE2 3.47Å; D278-H332 VanDerWaalsContact OD2-NE2 3.1Å; I330-H332 VanDerWaalsContact CG2-NE2 3.33Å; I330-H332 WeakPolarHBondContact CG2-NE2 3.49Å; I330-H332 PolarHBondContact O-CD2 3.23Å; I330-H332 PolarHBondContact O-N 3.36Å; H332-G336 PolarHBondContact ND1-O 3.31Å; H332-K337 CarbonylContact C-O 3.58Å; H332-K337 VanDerWaalsContact CA-O 3.23Å; H332-K337 WeakPolarHBondContact CA-O 3.48Å; H332-Q339 PolarHBondContact O-NE2 3.41Å; H332-Q339 VanDerWaalsContact O-NE2 3.12Å
333	S	68.9	Low	83.5	Confident	35 Å²	35	63.7 Å²	63.7	25%	0.245	34%	0.335	C	S	.	.			trans	-74.9	171.5	165.6	55.6	0	0	0	0	111.3	N335 G336 K337	S333-N335 WeakPolarHBondContact CB-OD1 3.34Å; S333-N335 PolarHBondContact O-N 2.86Å; S333-N335 VanDerWaalsContact O-N 3.12Å; S333-N335 PolarHBondContact OG-OD1 2.92Å; S333-G336 PolarHBondContact O-N 3.37Å; S333-K337 PolarHBondContact N-O 3.34Å; S333-K337 WeakPolarHBondContact OG-CB 3.49Å; S333-K337 PolarHBondContact OG-N 3.47Å; S333-K337 VanDerWaalsContact OG-N 3.09Å; S333-K337 PolarHBondContact OG-O 3.1Å
334	C	57.1	Low	83.4	Confident	124 Å²	124	66.2 Å²	66.2	84%	0.838	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.2	178.7	60.3	0	0	0	0	114.5
335	N	56.4	Low	83.3	Confident	71 Å²	71	70.2 Å²	70.2	38%	0.38	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	14.1	173.3	63.8	0.2	0	0	0	113.2	S333 K337	S333-N335 WeakPolarHBondContact CB-OD1 3.34Å; S333-N335 PolarHBondContact O-N 2.86Å; S333-N335 VanDerWaalsContact O-N 3.12Å; S333-N335 PolarHBondContact OG-OD1 2.92Å; N335-K337 PolarHBondContact O-N 2.89Å
336	G	63.9	Low	83.2	Confident	41 Å²	41	70.7 Å²	70.7	42%	0.423	37%	0.365	S	S	.	.	S	Bend	trans	80.8	4.7	174.2	0	0	0	0	0	115.6	H332 S333	H332-G336 PolarHBondContact ND1-O 3.31Å; S333-G336 PolarHBondContact O-N 3.37Å
337	K	70	Confident	83.1	Confident	105 Å²	105	66.3 Å²	66.3	46%	0.457	35%	0.346	S	S	.	.			trans	-75.1	136.4	177.8	-62.4	-177.9	177.9	-175.8	0	110.8	H332 S333 N335 Q339	H332-K337 CarbonylContact C-O 3.58Å; H332-K337 VanDerWaalsContact CA-O 3.23Å; H332-K337 WeakPolarHBondContact CA-O 3.48Å; S333-K337 PolarHBondContact N-O 3.34Å; S333-K337 WeakPolarHBondContact OG-CB 3.49Å; S333-K337 PolarHBondContact OG-N 3.47Å; S333-K337 VanDerWaalsContact OG-N 3.09Å; S333-K337 PolarHBondContact OG-O 3.1Å; N335-K337 PolarHBondContact O-N 2.89Å; K337-Q339 PolarHBondContact O-N 3.29Å
338	V	82.9	Confident	82.7	Confident	22 Å²	22	70.4 Å²	70.4	13%	0.133	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-59	128.5	172.8	176.8	0	0	0	0	109.8	A280 I330 R340 L343	A280-V338 HydrophobicContact CB-CG1 3.64Å; A280-V338 HydrophobicContact CB-CG2 4.26Å; I330-V338 HydrophobicContact CG2-CG1 4.18Å; I330-V338 HydrophobicContact CG2-CG2 4.34Å; V338-R340 VanDerWaalsContact C-N 3.29Å; V338-R340 HydrophobicContact CB-CG 4.35Å; V338-R340 HydrophobicContact CG1-CG 3.73Å; V338-R340 PolarHBondContact O-N 3.21Å; V338-R340 VanDerWaalsContact O-N 3.07Å; V338-L343 HydrophobicContact CG1-CD1 3.83Å
339	Q	84.6	Confident	82.5	Confident	77 Å²	77	67.7 Å²	67.7	36%	0.36	35%	0.354	S	S	.	.			trans	-84.4	71.7	174.6	-59.3	-164.6	19.2	0	0	110.4	P331 H332 K337 K341 L342 L343	P331-Q339 HydrophobicContact CB-CB 4.15Å; P331-Q339 HydrophobicContact CG-CB 4.32Å; P331-Q339 PolarHBondContact O-N 3.05Å; H332-Q339 PolarHBondContact O-NE2 3.41Å; H332-Q339 VanDerWaalsContact O-NE2 3.12Å; K337-Q339 PolarHBondContact O-N 3.29Å; Q339-K341 PolarHBondContact O-N 3.22Å; Q339-K341 VanDerWaalsContact O-N 3.08Å; Q339-L342 HydrophobicContact CB-CD1 4.1Å; Q339-L342 HydrophobicContact CB-CG 4.3Å; Q339-L342 PolarHBondContact O-N 2.76Å; Q339-L342 VanDerWaalsContact O-N 3.08Å; Q339-L343 PolarHBondContact O-N 3.22Å
340	R	89.4	Confident	82.2	Confident	32 Å²	32	64.1 Å²	64.1	12%	0.121	33%	0.334	C	S	.	.	H	α-helix	trans	-57.2	-26.8	-175.7	-69.4	-172.9	177.2	85.7	3	114.3	E252 E267 V281 V282 V338 L343 K344	E252-R340 IonicContact OE1-CZ 3.23Å; E252-R340 IonicContact OE1-NH1 3.5Å; E252-R340 PolarHBondContact OE1-NH1 2.97Å; E252-R340 IonicContact OE2-CZ 2.8Å; E252-R340 IonicContact OE2-NH1 3.12Å; E252-R340 PolarHBondContact OE2-NH1 3.19Å; E267-R340 IonicContact OE1-CZ 2.7Å; E267-R340 IonicContact OE1-NE 3.83Å; E267-R340 IonicContact OE1-NH2 3.94Å; E267-R340 PolarHBondContact OE1-NH2 3.12Å; E267-R340 IonicContact OE2-NH2 2.88Å; E267-R340 PolarHBondContact OE2-NH2 3.4Å; V281-R340 PolarHBondContact O-NE 3.15Å; V282-R340 HydrophobicContact CG1-CB 4.05Å; V282-R340 HydrophobicContact CG1-CG 4.13Å; V338-R340 VanDerWaalsContact C-N 3.29Å; V338-R340 HydrophobicContact CB-CG 4.35Å; V338-R340 HydrophobicContact CG1-CG 3.73Å; V338-R340 PolarHBondContact O-N 3.21Å; V338-R340 VanDerWaalsContact O-N 3.07Å; R340-L343 PolarHBondContact O-N 3.49Å; R340-K344 WeakPolarHBondContact O-CB 3.43Å; R340-K344 WeakPolarHBondContact O-CG 3.43Å; R340-K344 PolarHBondContact O-N 2.83Å
341	K	86.9	Confident	81.5	Confident	154 Å²	154	65.6 Å²	65.6	67%	0.67	35%	0.345	S	S	*	.	H	α-helix	trans	-58.3	-49	175.3	-171.5	-174.6	179.1	-161.6	0	111.4	Q339 L343 K344 E345	Q339-K341 PolarHBondContact O-N 3.22Å; Q339-K341 VanDerWaalsContact O-N 3.08Å; K341-L343 VanDerWaalsContact C-N 3.33Å; K341-L343 PolarHBondContact O-N 2.81Å; K341-K344 PolarHBondContact O-N 2.82Å; K341-E345 WeakPolarHBondContact CE-OE1 3.22Å; K341-E345 IonicContact NZ-OE1 2.87Å; K341-E345 WeakPolarHBondContact O-CG 3.47Å; K341-E345 PolarHBondContact O-N 2.85Å
342	L	89.4	Confident	80.8	Confident	75 Å²	75	66.3 Å²	66.3	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-40.5	178.6	-63.7	-179.2	0	0	0	111.5	P331 Q339 E345 Q346	P331-L342 HydrophobicContact CB-CD1 3.98Å; P331-L342 HydrophobicContact CG-CB 4.23Å; P331-L342 HydrophobicContact CG-CD1 4.44Å; Q339-L342 HydrophobicContact CB-CD1 4.1Å; Q339-L342 HydrophobicContact CB-CG 4.3Å; Q339-L342 PolarHBondContact O-N 2.76Å; Q339-L342 VanDerWaalsContact O-N 3.08Å; L342-E345 PolarHBondContact O-N 2.93Å; L342-Q346 WeakPolarHBondContact O-CB 3.32Å; L342-Q346 PolarHBondContact O-N 3.39Å
343	L	93	Very high	80.2	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-66.5	-36.9	176.5	-67.6	178.1	0	0	0	112.4	A280 V282 Y296 I330 P331 V338 Q339 R340 K341 A347	A280-L343 HydrophobicContact CB-CD1 3.41Å; A280-L343 VanDerWaalsContact CB-CD1 3.41Å; V282-L343 HydrophobicContact CG1-CB 3.78Å; V282-L343 HydrophobicContact CG1-CD1 4.36Å; Y296-L343 HydrophobicContact CD1-CD2 4.17Å; Y296-L343 HydrophobicContact CD2-CB 4.15Å; Y296-L343 HydrophobicContact CD2-CD1 4.16Å; Y296-L343 HydrophobicContact CD2-CD2 3.89Å; Y296-L343 HydrophobicContact CD2-CG 4.3Å; Y296-L343 HydrophobicContact CE1-CD2 4.48Å; Y296-L343 HydrophobicContact CE2-CB 4.05Å; Y296-L343 HydrophobicContact CE2-CD2 4.21Å; Y296-L343 HydrophobicContact CG-CD2 3.86Å; I330-L343 HydrophobicContact CG2-CD1 4.46Å; P331-L343 HydrophobicContact CG-CD2 3.92Å; P331-L343 HydrophobicContact CG-CG 3.9Å; V338-L343 HydrophobicContact CG1-CD1 3.83Å; Q339-L343 PolarHBondContact O-N 3.22Å; R340-L343 PolarHBondContact O-N 3.49Å; K341-L343 VanDerWaalsContact C-N 3.33Å; K341-L343 PolarHBondContact O-N 2.81Å; L343-A347 VanDerWaalsContact O-CB 3.32Å; L343-A347 WeakPolarHBondContact O-CB 3.4Å; L343-A347 PolarHBondContact O-N 2.81Å
344	K	90.6	Very high	79.9	Confident	70 Å²	70	73.1 Å²	73.1	30%	0.304	38%	0.383	S	S	.	.	H	α-helix	trans	-65.6	-44.3	173.5	-78.4	-170.7	173.2	-160.6	0	111.4	V282 G283 E291 R340 K341 A347 M348	V282-K344 HydrophobicContact CB-CG 3.95Å; V282-K344 HydrophobicContact CG1-CG 4.12Å; V282-K344 HydrophobicContact CG2-CG 4.48Å; G283-K344 WeakPolarHBondContact O-CE 3.33Å; E291-K344 IonicContact OE1-NZ 3.84Å; E291-K344 PolarHBondContact OE1-NZ 2.86Å; R340-K344 WeakPolarHBondContact O-CB 3.43Å; R340-K344 WeakPolarHBondContact O-CG 3.43Å; R340-K344 PolarHBondContact O-N 2.83Å; K341-K344 PolarHBondContact O-N 2.82Å; K344-A347 PolarHBondContact O-N 2.91Å; K344-M348 WeakPolarHBondContact O-CG 3.33Å; K344-M348 PolarHBondContact O-N 3.15Å
345	E	90.9	Very high	79.7	Confident	85 Å²	85	72.4 Å²	72.4	40%	0.397	37%	0.371	S	S	.	.	H	α-helix	trans	-59.9	-47.4	175.1	-72.4	167.3	-176.3	0	0	111	K341 L342 A347 M348 L349	K341-E345 WeakPolarHBondContact CE-OE1 3.22Å; K341-E345 IonicContact NZ-OE1 2.87Å; K341-E345 WeakPolarHBondContact O-CG 3.47Å; K341-E345 PolarHBondContact O-N 2.85Å; L342-E345 PolarHBondContact O-N 2.93Å; E345-A347 VanDerWaalsContact C-N 3.29Å; E345-A347 PolarHBondContact O-N 2.99Å; E345-M348 PolarHBondContact O-N 3.27Å; E345-L349 WeakPolarHBondContact O-CG 3.4Å; E345-L349 PolarHBondContact O-N 3.2Å; E345-L349 VanDerWaalsContact O-N 3.1Å
346	Q	91.7	Very high	79.2	Confident	73 Å²	73	75.6 Å²	75.6	34%	0.341	38%	0.384	S	S	.	.	H	α-helix	trans	-56.9	-43.8	174.3	-175.2	-178.7	-25.6	0	0	111.5	L342 M348 L349 E350	L342-Q346 WeakPolarHBondContact O-CB 3.32Å; L342-Q346 PolarHBondContact O-N 3.39Å; Q346-M348 VanDerWaalsContact C-N 3.32Å; Q346-M348 PolarHBondContact O-N 3.5Å; Q346-L349 PolarHBondContact O-N 3.12Å; Q346-E350 HydrophobicContact CG-CG 4.48Å; Q346-E350 WeakPolarHBondContact CG-OE1 3.46Å; Q346-E350 PolarHBondContact NE2-OE1 3.44Å; Q346-E350 VanDerWaalsContact O-CG 3.32Å; Q346-E350 WeakPolarHBondContact O-CG 3.41Å; Q346-E350 PolarHBondContact O-N 3.48Å
347	A	90.4	Very high	78.2	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.008	40%	0.397	C	S	.	.	H	α-helix	trans	-66.4	-32.6	-179.8	0	0	0	0	0	113.7	I284 Y296 L343 K344 E345 S351	I284-A347 HydrophobicContact CD1-CB 3.46Å; I284-A347 VanDerWaalsContact CD1-CB 3.46Å; I284-A347 HydrophobicContact CG1-CB 4.06Å; Y296-A347 WeakPolarHBondContact OH-CA 3.47Å; Y296-A347 VanDerWaalsContact OH-CB 3.28Å; Y296-A347 WeakPolarHBondContact OH-CB 3.48Å; Y296-A347 PolarHBondContact OH-N 2.86Å; L343-A347 VanDerWaalsContact O-CB 3.32Å; L343-A347 WeakPolarHBondContact O-CB 3.4Å; L343-A347 PolarHBondContact O-N 2.81Å; K344-A347 PolarHBondContact O-N 2.91Å; E345-A347 VanDerWaalsContact C-N 3.29Å; E345-A347 PolarHBondContact O-N 2.99Å; A347-S351 WeakPolarHBondContact O-CB 3.32Å; A347-S351 PolarHBondContact O-N 3.25Å; A347-S351 VanDerWaalsContact O-N 3.16Å; A347-S351 PolarHBondContact O-OG 3.47Å
348	M	86.3	Confident	77	Confident	117 Å²	117	79.7 Å²	79.7	58%	0.576	41%	0.405	S	S	*	.	H	α-helix	trans	-67	-45.4	173.3	-68.4	-169	-162	0	0	111	K344 E345 Q346 E350 S351 A352	K344-M348 WeakPolarHBondContact O-CG 3.33Å; K344-M348 PolarHBondContact O-N 3.15Å; E345-M348 PolarHBondContact O-N 3.27Å; Q346-M348 VanDerWaalsContact C-N 3.32Å; Q346-M348 PolarHBondContact O-N 3.5Å; M348-E350 PolarHBondContact O-N 2.94Å; M348-S351 PolarHBondContact O-N 3.18Å; M348-S351 VanDerWaalsContact O-N 3.15Å; M348-A352 PolarHBondContact O-N 2.88Å
349	L	87.7	Confident	75.1	Confident	118 Å²	118	87.6 Å²	87.6	62%	0.618	44%	0.438	S	S	*	.	H	α-helix	trans	-60.7	-45.1	176.3	-67.3	169.4	0	0	0	111.9	E345 Q346 S351 A352 N353	E345-L349 WeakPolarHBondContact O-CG 3.4Å; E345-L349 PolarHBondContact O-N 3.2Å; E345-L349 VanDerWaalsContact O-N 3.1Å; Q346-L349 PolarHBondContact O-N 3.12Å; L349-S351 PolarHBondContact O-N 3.21Å; L349-A352 PolarHBondContact O-N 3.19Å; L349-N353 PolarHBondContact O-N 3.27Å; L349-N353 VanDerWaalsContact O-N 3.12Å
350	E	85.5	Confident	72.7	Confident	44 Å²	44	94.9 Å²	94.9	21%	0.206	47%	0.471	C	S	.	.	H	α-helix	trans	-60.2	-31.7	175.7	-73.1	170.5	-166.9	0	0	113	R294 Y296 R325 Q346 M348	R294-E350 IonicContact CZ-OE2 2.81Å; R294-E350 IonicContact NH1-OE2 3.99Å; R294-E350 PolarHBondContact NH1-OE2 2.66Å; Y296-E350 PolarHBondContact OH-OE1 2.95Å; Y296-E350 PolarHBondContact OH-OE2 3.44Å; R325-E350 IonicContact NE-OE2 3.82Å; R325-E350 PolarHBondContact NE-OE2 3.35Å; Q346-E350 HydrophobicContact CG-CG 4.48Å; Q346-E350 WeakPolarHBondContact CG-OE1 3.46Å; Q346-E350 PolarHBondContact NE2-OE1 3.44Å; Q346-E350 VanDerWaalsContact O-CG 3.32Å; Q346-E350 WeakPolarHBondContact O-CG 3.41Å; Q346-E350 PolarHBondContact O-N 3.48Å; M348-E350 PolarHBondContact O-N 2.94Å
351	S	77.6	Confident	71.8	Confident	41 Å²	41	98.1 Å²	98.1	29%	0.287	49%	0.489	S	S	.	.	H	α-helix	trans	-80.1	-34.6	179.7	-54.9	0	0	0	0	111.6	A347 M348 L349 K354	A347-S351 WeakPolarHBondContact O-CB 3.32Å; A347-S351 PolarHBondContact O-N 3.25Å; A347-S351 VanDerWaalsContact O-N 3.16Å; A347-S351 PolarHBondContact O-OG 3.47Å; M348-S351 PolarHBondContact O-N 3.18Å; M348-S351 VanDerWaalsContact O-N 3.15Å; L349-S351 PolarHBondContact O-N 3.21Å; S351-K354 PolarHBondContact O-N 3.42Å
352	A	74.6	Confident	71	Confident	51 Å²	51	95.1 Å²	95.1	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-46.9	174	0	0	0	0	0	111.7	M348 L349 K354 N355 E356	M348-A352 PolarHBondContact O-N 2.88Å; L349-A352 PolarHBondContact O-N 3.19Å; A352-K354 PolarHBondContact O-N 3.36Å; A352-N355 PolarHBondContact O-N 3.05Å; A352-E356 PolarHBondContact O-N 3.45Å
353	N	66.7	Low	70	Confident	98 Å²	98	96.2 Å²	96.2	52%	0.524	48%	0.484	S	S	.	.	H	α-helix	trans	-64.6	-25.9	-179.8	-70	1.3	0	0	0	113.5	L349 N355 N357	L349-N353 PolarHBondContact O-N 3.27Å; L349-N353 VanDerWaalsContact O-N 3.12Å; N353-N355 VanDerWaalsContact C-N 3.35Å; N353-N357 PolarHBondContact O-N 2.89Å
354	K	61.8	Low	68.7	Low	136 Å²	136	101.8 Å²	101.8	59%	0.591	51%	0.512	S	S	*	.	H	α-helix	trans	-69.2	-33.9	174.3	-96.5	-170.4	172.3	-164	0	112.6	S351 A352 T358	S351-K354 PolarHBondContact O-N 3.42Å; A352-K354 PolarHBondContact O-N 3.36Å; K354-T358 PolarHBondContact O-OG1 3.2Å
355	N	53	Low	67.3	Low	109 Å²	109	103.8 Å²	103.8	58%	0.583	53%	0.525	S	S	*	.	H	α-helix	trans	-75.4	-32	179.9	-70.4	-11.1	0	0	0	111.7	A352 N353 T358 F359	A352-N355 PolarHBondContact O-N 3.05Å; N353-N355 VanDerWaalsContact C-N 3.35Å; N355-T358 PolarHBondContact O-N 3.22Å; N355-T358 PolarHBondContact O-OG1 3.38Å; N355-F359 WeakPolarHBondContact O-CD2 3.35Å
356	E	45.8	Very low	65.7	Low	137 Å²	137	105.1 Å²	105.1	64%	0.64	53%	0.534	S	S	*	.	H	α-helix	trans	-68.5	-37.5	175.8	-72.5	-176.9	166.3	0	0	112.5	A352 T358 F359	A352-E356 PolarHBondContact O-N 3.45Å; E356-T358 PolarHBondContact O-N 3.34Å; E356-F359 PolarHBondContact O-N 3.18Å
357	N	44.3	Very low	63.9	Low	132 Å²	132	107.4 Å²	107.4	71%	0.706	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	0.5	177.1	-79.9	-14.7	0	0	0	114.6	N353	N353-N357 PolarHBondContact O-N 2.89Å
358	T	44.7	Very low	61.8	Low	100 Å²	100	115.5 Å²	115.5	61%	0.613	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-0.2	175.3	5.7	0	0	0	0	113.6	K354 N355 E356	K354-T358 PolarHBondContact O-OG1 3.2Å; N355-T358 PolarHBondContact O-N 3.22Å; N355-T358 PolarHBondContact O-OG1 3.38Å; E356-T358 PolarHBondContact O-N 3.34Å
359	F	42.1	Very low	59.8	Low	188 Å²	188	115.4 Å²	115.4	83%	0.825	59%	0.59	S	S	*	*			trans	-108	15.3	178	-78.9	-80.3	0	0	0	114.4	N355 E356	N355-F359 WeakPolarHBondContact O-CD2 3.35Å; E356-F359 PolarHBondContact O-N 3.18Å
360	H	33.7	Very low	57.2	Low	231 Å²	231	115.2 Å²	115.2	100%	1.069	59%	0.588	S	S	*	*			trans	-114.2	0	166	-72.8	-52.8	0	0	0	109.2

Retrieved 360 of 360 residues in 1276.4 ms (Link to these results)

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