A0A077ZFJ3_TRITR Loading...

Protein phosphatase

AlphaFold DB , UniProt , Accession A0A077ZFJ3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 326 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.9	Very low	38.2	Very low	241 Å²	241	157 Å²	157	100%	1.187	86%	0.856	S	S	*	*				0	111.8	0	-83.5	173.2	164.8	0	0	108.4	L3	M1-L3 PolarHBondContact O-N 3.49Å
2	C	39	Very low	37.8	Very low	126 Å²	126	160.1 Å²	160.1	85%	0.851	86%	0.86	S	S	*	*			trans	-83.6	110.9	-179	-165.5	0	0	0	0	109.1	K4	C2-K4 PolarHBondContact O-N 3.21Å
3	L	37.5	Very low	38	Very low	164 Å²	164	159.6 Å²	159.6	86%	0.859	85%	0.854	S	S	*	*			trans	-77.6	101.8	175.2	-83	156.1	0	0	0	109	M1 R5	M1-L3 PolarHBondContact O-N 3.49Å; L3-R5 PolarHBondContact O-N 3.26Å
4	K	37.7	Very low	37.9	Very low	194 Å²	194	156.7 Å²	156.7	84%	0.843	85%	0.846	S	S	*	*			trans	-63.7	111.9	171.3	-73.8	-177.9	176.8	-178.8	0	109.3	C2 T6	C2-K4 PolarHBondContact O-N 3.21Å; K4-T6 PolarHBondContact O-N 3.42Å
5	R	41.9	Very low	37.7	Very low	243 Å²	243	163.1 Å²	163.1	92%	0.917	85%	0.853	S	S	*	*			trans	-74.6	110.1	166.2	-71.7	-177.2	177.6	-169.1	-1	108.4	L3 T7	L3-R5 PolarHBondContact O-N 3.26Å; R5-T7 PolarHBondContact O-N 3.36Å
6	T	38	Very low	38.1	Very low	133 Å²	133	158.4 Å²	158.4	82%	0.816	84%	0.838	S	S	*	*			trans	-72.5	115.4	169.8	42	0	0	0	0	109.4	K4	K4-T6 PolarHBondContact O-N 3.42Å
7	T	41.3	Very low	38.5	Very low	131 Å²	131	157.2 Å²	157.2	80%	0.804	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-72.5	129.3	166.5	33.3	0	0	0	0	109.5	R5	R5-T7 PolarHBondContact O-N 3.36Å
8	P	37.4	Very low	38.9	Very low	120 Å²	120	153.4 Å²	153.4	78%	0.779	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-73.8	130.5	179.4	27.2	-31.9	0	0	0	111.3	I10	P8-I10 PolarHBondContact O-N 3.33Å
9	T	35.5	Very low	39.5	Very low	140 Å²	140	149.7 Å²	149.7	86%	0.859	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-65.5	122.1	173.4	19.5	0	0	0	0	111	G11	T9-G11 VanDerWaalsContact C-N 3.29Å; T9-G11 PolarHBondContact O-N 3.08Å
10	I	39.8	Very low	39.9	Very low	179 Å²	179	147.2 Å²	147.2	92%	0.918	79%	0.79	S	S	*	*			trans	-70.4	85.8	172.4	-59.6	167.4	0	0	0	107.8	P8	P8-I10 PolarHBondContact O-N 3.33Å
11	G	33.6	Very low	40.3	Very low	56 Å²	56	150.2 Å²	150.2	58%	0.577	79%	0.79	S	S	*	*			trans	-155.9	96.4	178.2	0	0	0	0	0	109	T9	T9-G11 VanDerWaalsContact C-N 3.29Å; T9-G11 PolarHBondContact O-N 3.08Å
12	Q	33.5	Very low	41.1	Very low	194 Å²	194	142 Å²	142	91%	0.907	75%	0.754	S	S	*	*			trans	124.2	58.7	171.8	-68.2	170.4	1.1	0	0	112.8
13	I	39.4	Very low	41.7	Very low	154 Å²	154	140.6 Å²	140.6	79%	0.79	74%	0.737	S	S	*	*			trans	-107.5	101.9	151.3	-61.2	177.6	0	0	0	105.7	R15	I13-R15 PolarHBondContact O-N 3.38Å
14	T	37.7	Very low	43	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	72%	0.724	S	S	*	*			trans	-51.2	134.1	172.5	42.5	0	0	0	0	109.9	S16	T14-S16 PolarHBondContact O-N 3.31Å
15	R	34.9	Very low	44	Very low	252 Å²	252	132.9 Å²	132.9	95%	0.951	70%	0.704	S	S	*	*			trans	-62.3	75.2	-179.8	-67.8	177.1	175.5	178.9	-1.9	111.9	I13	I13-R15 PolarHBondContact O-N 3.38Å
16	S	43.7	Very low	44.9	Very low	89 Å²	89	125.9 Å²	125.9	62%	0.622	69%	0.685	S	S	*	*			trans	-92.4	114.6	149.7	58.7	0	0	0	0	106.2	T14 L18	T14-S16 PolarHBondContact O-N 3.31Å; S16-L18 VanDerWaalsContact C-N 3.34Å; S16-L18 PolarHBondContact O-N 3.39Å
17	V	44.1	Very low	46.3	Very low	137 Å²	137	123.1 Å²	123.1	83%	0.83	67%	0.668	S	S	*	*			trans	-58.1	92.4	-174.5	-178.5	0	0	0	0	109.7	N19	V17-N19 PolarHBondContact O-N 3.25Å
18	L	45.6	Very low	47.2	Very low	89 Å²	89	122.5 Å²	122.5	47%	0.466	65%	0.651	S	S	.	*			trans	-66.3	122	161.5	-73.3	168	0	0	0	105.8	S16 L23	S16-L18 VanDerWaalsContact C-N 3.34Å; S16-L18 PolarHBondContact O-N 3.39Å; L18-L23 HydrophobicContact CB-CD1 3.7Å; L18-L23 HydrophobicContact CD1-CD1 3.81Å; L18-L23 HydrophobicContact CG-CD1 4.41Å
19	N	51.6	Low	48	Very low	84 Å²	84	119.4 Å²	119.4	45%	0.449	63%	0.628	S	S	.	*			trans	-47.4	137	174.5	170.8	-6	0	0	0	109	V17 W21 T22 L23	V17-N19 PolarHBondContact O-N 3.25Å; N19-W21 PolarHBondContact O-N 2.9Å; N19-W21 PolarHBondContact OD1-N 3.06Å; N19-W21 VanDerWaalsContact OD1-N 3.09Å; N19-T22 WeakPolarHBondContact CA-OG1 3.48Å; N19-T22 WeakPolarHBondContact CB-OG1 3.03Å; N19-T22 PolarHBondContact N-OG1 3.23Å; N19-T22 VanDerWaalsContact N-OG1 3.13Å; N19-T22 WeakPolarHBondContact O-CA 3.36Å; N19-T22 WeakPolarHBondContact O-CB 3.36Å; N19-T22 PolarHBondContact O-N 3.41Å; N19-T22 PolarHBondContact O-OG1 3.1Å; N19-L23 PolarHBondContact O-N 3.26Å
20	P	46.3	Very low	49.2	Very low	99 Å²	99	118.9 Å²	118.9	64%	0.643	62%	0.616	S	S	*	*	H	α-helix	trans	-44.8	-35.2	176.5	-30.8	32.6	0	0	0	114.6	L23 S24	P20-L23 PolarHBondContact O-N 2.82Å; P20-S24 WeakPolarHBondContact O-CB 3.43Å; P20-S24 PolarHBondContact O-N 3.14Å
21	W	49.4	Very low	50	Low	211 Å²	211	115.7 Å²	115.7	80%	0.799	60%	0.6	S	S	*	*	H	α-helix	trans	-64.2	-40.8	175.2	-68.4	91.2	0	0	0	112.9	N19 R25	N19-W21 PolarHBondContact O-N 2.9Å; N19-W21 PolarHBondContact OD1-N 3.06Å; N19-W21 VanDerWaalsContact OD1-N 3.09Å; W21-R25 WeakPolarHBondContact O-CB 3.45Å; W21-R25 PolarHBondContact O-N 2.98Å
22	T	54.8	Low	50.8	Low	68 Å²	68	114.2 Å²	114.2	42%	0.417	58%	0.579	S	S	.	*	H	α-helix	trans	-65.5	-41	175	5.8	0	0	0	0	112.3	N19 R25 L26	N19-T22 WeakPolarHBondContact CA-OG1 3.48Å; N19-T22 WeakPolarHBondContact CB-OG1 3.03Å; N19-T22 PolarHBondContact N-OG1 3.23Å; N19-T22 VanDerWaalsContact N-OG1 3.13Å; N19-T22 WeakPolarHBondContact O-CA 3.36Å; N19-T22 WeakPolarHBondContact O-CB 3.36Å; N19-T22 PolarHBondContact O-N 3.41Å; N19-T22 PolarHBondContact O-OG1 3.1Å; T22-R25 PolarHBondContact O-N 3.12Å; T22-L26 WeakPolarHBondContact O-CB 3.44Å; T22-L26 PolarHBondContact O-N 3.05Å
23	L	52.7	Low	51.9	Low	97 Å²	97	111.6 Å²	111.6	51%	0.508	57%	0.571	S	S	.	*	H	α-helix	trans	-70	-46.2	-178.2	-136.5	96.5	0	0	0	111.5	L18 N19 P20 R25 L26 V27	L18-L23 HydrophobicContact CB-CD1 3.7Å; L18-L23 HydrophobicContact CD1-CD1 3.81Å; L18-L23 HydrophobicContact CG-CD1 4.41Å; N19-L23 PolarHBondContact O-N 3.26Å; P20-L23 PolarHBondContact O-N 2.82Å; L23-R25 VanDerWaalsContact C-N 3.29Å; L23-R25 PolarHBondContact O-N 3.38Å; L23-L26 PolarHBondContact O-N 3.09Å; L23-V27 WeakPolarHBondContact O-CG2 3.24Å; L23-V27 PolarHBondContact O-N 3.33Å
24	S	65.2	Low	52.7	Low	84 Å²	84	114.3 Å²	114.3	59%	0.587	57%	0.573	S	S	*	*	H	α-helix	trans	-58	-43	174.5	-177.9	0	0	0	0	111.1	P20 L26 Y28	P20-S24 WeakPolarHBondContact O-CB 3.43Å; P20-S24 PolarHBondContact O-N 3.14Å; S24-L26 PolarHBondContact O-N 3.23Å; S24-Y28 WeakPolarHBondContact O-CB 3.43Å; S24-Y28 PolarHBondContact O-N 3.49Å
25	R	57.3	Low	53.6	Low	111 Å²	111	112.9 Å²	112.9	42%	0.419	56%	0.564	S	S	.	*	H	α-helix	trans	-66.2	-36.4	177.4	-168.5	173.4	-178.8	-166.4	-3	113	W21 T22 L23 N29 S230	W21-R25 WeakPolarHBondContact O-CB 3.45Å; W21-R25 PolarHBondContact O-N 2.98Å; T22-R25 PolarHBondContact O-N 3.12Å; L23-R25 VanDerWaalsContact C-N 3.29Å; L23-R25 PolarHBondContact O-N 3.38Å; R25-N29 WeakPolarHBondContact O-CB 3.46Å; R25-N29 PolarHBondContact O-N 3.11Å; R25-N29 PolarHBondContact O-ND2 3.19Å; R25-S230 PolarHBondContact NH2-OG 3.48Å
26	L	62	Low	54.4	Low	97 Å²	97	103.8 Å²	103.8	51%	0.508	55%	0.549	S	S	.	.	H	α-helix	trans	-70.3	-43.1	179.5	-157.9	143.1	0	0	0	111.7	T22 L23 S24 N29 Q30	T22-L26 WeakPolarHBondContact O-CB 3.44Å; T22-L26 PolarHBondContact O-N 3.05Å; L23-L26 PolarHBondContact O-N 3.09Å; S24-L26 PolarHBondContact O-N 3.23Å; L26-N29 PolarHBondContact O-N 3.45Å; L26-Q30 PolarHBondContact O-N 3.39Å
27	V	65.6	Low	55	Low	75 Å²	75	102.8 Å²	102.8	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-65	-43	173.3	175.1	0	0	0	0	111.1	L23 N29 Q30 L31	L23-V27 WeakPolarHBondContact O-CG2 3.24Å; L23-V27 PolarHBondContact O-N 3.33Å; V27-N29 PolarHBondContact O-N 3.02Å; V27-Q30 PolarHBondContact O-N 3Å; V27-L31 HydrophobicContact CG1-CD1 4.04Å; V27-L31 PolarHBondContact O-N 2.61Å
28	Y	61.2	Low	55.9	Low	117 Å²	117	105.3 Å²	105.3	46%	0.459	53%	0.533	S	S	.	.	H	α-helix	trans	-61.5	-42.7	175.9	-177.8	-112	0	0	0	112.1	S24 L31 L32 R39	S24-Y28 WeakPolarHBondContact O-CB 3.43Å; S24-Y28 PolarHBondContact O-N 3.49Å; Y28-L31 PolarHBondContact O-N 3.44Å; Y28-L32 HydrophobicContact CD1-CD1 3.76Å; Y28-L32 HydrophobicContact CD2-CD1 4.29Å; Y28-L32 HydrophobicContact CE1-CD1 3.44Å; Y28-L32 VanDerWaalsContact CE1-CD1 3.44Å; Y28-L32 HydrophobicContact CE2-CD1 3.99Å; Y28-L32 HydrophobicContact CE2-CG 4.45Å; Y28-L32 HydrophobicContact CG-CD1 4.18Å; Y28-L32 WeakPolarHBondContact O-CD1 3.4Å; Y28-L32 VanDerWaalsContact O-CG 3.24Å; Y28-L32 WeakPolarHBondContact O-CG 3.44Å; Y28-L32 PolarHBondContact O-N 2.64Å; Y28-R39 VanDerWaalsContact CE1-NH2 3.26Å
29	N	54.7	Low	57.3	Low	55 Å²	55	105.1 Å²	105.1	29%	0.294	53%	0.527	S	S	.	.	H	α-helix	trans	-64	-42.1	175.7	-71.6	-23.6	0	0	0	112.2	R25 L26 V27 L32 D33 R39	R25-N29 WeakPolarHBondContact O-CB 3.46Å; R25-N29 PolarHBondContact O-N 3.11Å; R25-N29 PolarHBondContact O-ND2 3.19Å; L26-N29 PolarHBondContact O-N 3.45Å; V27-N29 PolarHBondContact O-N 3.02Å; N29-L32 PolarHBondContact O-N 3.26Å; N29-D33 PolarHBondContact O-N 3.08Å; N29-R39 PolarHBondContact OD1-NH1 3.46Å
30	Q	60.5	Low	58.8	Low	129 Å²	129	101.6 Å²	101.6	60%	0.603	51%	0.508	S	S	*	.	H	α-helix	trans	-64.2	-40.9	176.5	-82.9	-174.1	-27.5	0	0	113.3	L26 V27 L32 Y34	L26-Q30 PolarHBondContact O-N 3.39Å; V27-Q30 PolarHBondContact O-N 3Å; Q30-L32 PolarHBondContact O-N 3.33Å; Q30-Y34 PolarHBondContact O-N 2.8Å
31	L	55.2	Low	60.9	Low	113 Å²	113	98 Å²	98	59%	0.592	48%	0.483	S	S	*	.	H	α-helix	trans	-63.6	-31.3	176.4	-78.6	165.9	0	0	0	112	V27 Y28 Y34 T35	V27-L31 HydrophobicContact CG1-CD1 4.04Å; V27-L31 PolarHBondContact O-N 2.61Å; Y28-L31 PolarHBondContact O-N 3.44Å; L31-Y34 WeakPolarHBondContact O-CB 3.19Å; L31-T35 WeakPolarHBondContact O-CG2 3.32Å; L31-T35 PolarHBondContact O-N 3.36Å
32	L	52.1	Low	63	Low	25 Å²	25	89.8 Å²	89.8	13%	0.131	45%	0.452	C	S	.	.	H	α-helix	trans	-83.3	-34.1	-179.6	-69.5	169.8	0	0	0	114	Y28 N29 Q30 Y34 T35 G36	Y28-L32 HydrophobicContact CD1-CD1 3.76Å; Y28-L32 HydrophobicContact CD2-CD1 4.29Å; Y28-L32 HydrophobicContact CE1-CD1 3.44Å; Y28-L32 VanDerWaalsContact CE1-CD1 3.44Å; Y28-L32 HydrophobicContact CE2-CD1 3.99Å; Y28-L32 HydrophobicContact CE2-CG 4.45Å; Y28-L32 HydrophobicContact CG-CD1 4.18Å; Y28-L32 WeakPolarHBondContact O-CD1 3.4Å; Y28-L32 VanDerWaalsContact O-CG 3.24Å; Y28-L32 WeakPolarHBondContact O-CG 3.44Å; Y28-L32 PolarHBondContact O-N 2.64Å; N29-L32 PolarHBondContact O-N 3.26Å; Q30-L32 PolarHBondContact O-N 3.33Å; L32-Y34 PolarHBondContact O-N 2.99Å; L32-T35 PolarHBondContact O-N 2.89Å; L32-T35 PolarHBondContact O-OG1 3.2Å; L32-G36 PolarHBondContact O-N 3.01Å
33	D	56.1	Low	65	Low	139 Å²	139	86.8 Å²	86.8	74%	0.743	43%	0.433	S	S	*	.	H	α-helix	trans	-58.2	-32.1	168	-73.8	-22.5	0	0	0	110.5	N29	N29-D33 PolarHBondContact O-N 3.08Å
34	Y	56.2	Low	67.2	Low	210 Å²	210	83.5 Å²	83.5	82%	0.824	42%	0.417	S	S	*	.	H	α-helix	trans	-71.3	-28.4	175.4	-155.6	-92.1	0	0	0	113.7	Q30 L31 L32	Q30-Y34 PolarHBondContact O-N 2.8Å; L31-Y34 WeakPolarHBondContact O-CB 3.19Å; L32-Y34 PolarHBondContact O-N 2.99Å
35	T	56	Low	68.7	Low	90 Å²	90	80.8 Å²	80.8	55%	0.552	40%	0.399	S	S	*	.	H	α-helix	trans	-84.5	-10.2	179.7	60.3	0	0	0	0	113.8	L31 L32 V37	L31-T35 WeakPolarHBondContact O-CG2 3.32Å; L31-T35 PolarHBondContact O-N 3.36Å; L32-T35 PolarHBondContact O-N 2.89Å; L32-T35 PolarHBondContact O-OG1 3.2Å; T35-V37 PolarHBondContact O-N 3.37Å
36	G	52.5	Low	70.7	Confident	61 Å²	61	75.8 Å²	75.8	63%	0.629	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	10.3	178.5	0	0	0	0	0	114.8	L32 R38	L32-G36 PolarHBondContact O-N 3.01Å; G36-R38 PolarHBondContact O-N 2.86Å; G36-R38 VanDerWaalsContact O-N 3.1Å
37	V	55.3	Low	72.4	Confident	68 Å²	68	72 Å²	72	41%	0.412	36%	0.363	S	S	.	.			trans	-68.6	105.7	174.3	178.9	0	0	0	0	108.5	T35 R39 E319	T35-V37 PolarHBondContact O-N 3.37Å; V37-R39 PolarHBondContact O-N 3.15Å; V37-E319 HydrophobicContact CG1-CB 4.48Å; V37-E319 HydrophobicContact CG1-CG 4.16Å
38	R	64.3	Low	74	Confident	189 Å²	189	69.3 Å²	69.3	71%	0.713	35%	0.348	S	S	*	.			trans	-66.5	122	175.8	-72.1	-171.3	-179.8	-169.1	2.2	109	G36 R320	G36-R38 PolarHBondContact O-N 2.86Å; G36-R38 VanDerWaalsContact O-N 3.1Å; R38-R320 WeakPolarHBondContact O-CB 3.37Å; R38-R320 PolarHBondContact O-N 3.46Å
39	R	73.3	Confident	75.8	Confident	86 Å²	86	64.1 Å²	64.1	33%	0.325	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	147.7	168.9	-73.6	-177.7	165.8	171.5	-5.7	110.5	Y28 N29 V37 A317 V318	Y28-R39 VanDerWaalsContact CE1-NH2 3.26Å; N29-R39 PolarHBondContact OD1-NH1 3.46Å; V37-R39 PolarHBondContact O-N 3.15Å; R39-A317 HydrophobicContact CB-CB 4.44Å; R39-V318 CarbonylContact C-O 3.53Å; R39-V318 WeakPolarHBondContact CA-O 3.18Å; R39-V318 VanDerWaalsContact CB-O 3.32Å; R39-V318 WeakPolarHBondContact CB-O 3.35Å; R39-V318 WeakPolarHBondContact CG-O 3.34Å
40	V	85	Confident	77.8	Confident	10 Å²	10	63.7 Å²	63.7	6%	0.061	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	149.9	169.3	-65.9	0	0	0	0	109.4	R162 V318 R320	V40-R162 HydrophobicContact CB-CB 4.32Å; V40-V318 HydrophobicContact CG2-CG2 3.8Å; V40-V318 PolarHBondContact N-O 3.43Å; V40-V318 PolarHBondContact O-N 2.93Å; V40-R320 HydrophobicContact CG1-CB 4.12Å; V40-R320 HydrophobicContact CG1-CG 3.88Å
41	Q	89	Confident	79.6	Confident	23 Å²	23	58.4 Å²	58.4	11%	0.107	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	137.8	174.7	-58	-63.1	-19.7	0	0	109.3	L160 R162 V315 T316	Q41-L160 HydrophobicContact CB-CD1 4.17Å; Q41-L160 HydrophobicContact CB-CD2 4.01Å; Q41-L160 HydrophobicContact CB-CG 4.34Å; Q41-R162 WeakPolarHBondContact O-CG 3.46Å; Q41-V315 HydrophobicContact CB-CG1 4.13Å; Q41-V315 HydrophobicContact CG-CG1 4.31Å; Q41-V315 VanDerWaalsContact OE1-CG1 3.32Å; Q41-T316 CarbonylContact C-O 3.58Å; Q41-T316 WeakPolarHBondContact CA-O 3.38Å; Q41-T316 PolarHBondContact OE1-O 3.15Å
42	R	94.4	Very high	81.5	Confident	39 Å²	39	56.9 Å²	56.9	15%	0.147	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	162.7	172.9	-67.5	-170.9	-177.3	176.1	-9.2	110.2	T316 V318 E321 D324	R42-T316 PolarHBondContact N-O 3.13Å; R42-T316 PolarHBondContact O-N 3.38Å; R42-T316 PolarHBondContact O-OG1 2.99Å; R42-V318 HydrophobicContact CB-CG2 4.43Å; R42-V318 VanDerWaalsContact CD-CG2 3.47Å; R42-V318 HydrophobicContact CG-CG2 3.71Å; R42-E321 IonicContact CZ-OE1 3.35Å; R42-E321 IonicContact CZ-OE2 3.45Å; R42-E321 IonicContact NH1-OE1 2.71Å; R42-E321 PolarHBondContact NH1-OE1 2.99Å; R42-E321 IonicContact NH1-OE2 3.36Å; R42-E321 PolarHBondContact NH1-OE2 2.84Å; R42-E321 VanDerWaalsContact NH2-CD 3.27Å; R42-E321 IonicContact NH2-OE1 3.98Å; R42-E321 IonicContact NH2-OE2 2.99Å; R42-E321 PolarHBondContact NH2-OE2 2.97Å; R42-D324 IonicContact CZ-OD2 3.37Å; R42-D324 IonicContact NH2-OD1 3.67Å; R42-D324 PolarHBondContact NH2-OD1 3.27Å; R42-D324 IonicContact NH2-OD2 2.69Å; R42-D324 PolarHBondContact NH2-OD2 3.28Å
43	F	97	Very high	83.4	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127	168.7	-74.5	-43.6	0	0	0	111.7	A45 R73 D78 L80 V158 L160 L167 I234 A313 V314 V315	F43-A45 HydrophobicContact CB-CB 4.39Å; F43-R73 PolarHBondContact O-NH2 2.93Å; F43-R73 VanDerWaalsContact O-NH2 3.12Å; F43-D78 HydrophobicContact CB-CB 4.25Å; F43-D78 HydrophobicContact CD2-CB 3.57Å; F43-D78 HydrophobicContact CE2-CB 4.35Å; F43-D78 HydrophobicContact CG-CB 4.23Å; F43-D78 PolarHBondContact N-OD2 3.26Å; F43-L80 HydrophobicContact CD2-CD1 3.83Å; F43-L80 HydrophobicContact CD2-CD2 4.26Å; F43-L80 HydrophobicContact CD2-CG 3.97Å; F43-L80 HydrophobicContact CE2-CD1 3.71Å; F43-L80 HydrophobicContact CE2-CG 3.97Å; F43-L80 HydrophobicContact CG-CD1 4.48Å; F43-L80 HydrophobicContact CZ-CD1 4.26Å; F43-V158 HydrophobicContact CZ-CG1 4.47Å; F43-L160 HydrophobicContact CD1-CD2 3.9Å; F43-L160 HydrophobicContact CD2-CB 4Å; F43-L160 HydrophobicContact CD2-CD2 4.25Å; F43-L160 HydrophobicContact CE1-CB 4.24Å; F43-L160 HydrophobicContact CE1-CD2 3.98Å; F43-L160 HydrophobicContact CE2-CB 3.44Å; F43-L160 VanDerWaalsContact CE2-CB 3.44Å; F43-L160 HydrophobicContact CE2-CD2 4.3Å; F43-L160 HydrophobicContact CE2-CG 4.49Å; F43-L160 HydrophobicContact CG-CD2 4.04Å; F43-L160 HydrophobicContact CZ-CB 3.59Å; F43-L160 HydrophobicContact CZ-CD2 4.18Å; F43-L160 HydrophobicContact CZ-CG 4.38Å; F43-L167 HydrophobicContact CZ-CD1 3.95Å; F43-I234 HydrophobicContact CE1-CG1 3.81Å; F43-I234 HydrophobicContact CZ-CG1 4.03Å; F43-A313 HydrophobicContact CB-CB 4.12Å; F43-A313 HydrophobicContact CD1-CB 3.65Å; F43-A313 HydrophobicContact CD2-CB 4.36Å; F43-A313 HydrophobicContact CE1-CB 4.05Å; F43-A313 HydrophobicContact CG-CB 3.82Å; F43-V314 WeakPolarHBondContact CA-O 2.93Å; F43-V315 HydrophobicContact CD1-CG2 4.11Å; F43-V315 HydrophobicContact CE1-CG2 3.65Å
44	V	97.5	Very high	84.8	Confident	28 Å²	28	58.2 Å²	58.2	17%	0.17	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	106.6	150.2	-177.6	0	0	0	0	106.7	P262 V265 A313 V314 T316	V44-P262 HydrophobicContact CG1-CB 4.29Å; V44-P262 HydrophobicContact CG1-CG 4.01Å; V44-V265 HydrophobicContact CG1-CB 4.47Å; V44-V265 HydrophobicContact CG1-CG2 3.97Å; V44-A313 CarbonylContact O-C 3.39Å; V44-A313 WeakPolarHBondContact O-CA 3.44Å; V44-V314 PolarHBondContact N-O 3.16Å; V44-V314 PolarHBondContact O-N 3.2Å; V44-T316 HydrophobicContact CG2-CG2 3.82Å
45	A	98.2	Very high	86.2	Confident	27 Å²	27	54.6 Å²	54.6	22%	0.223	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145	-174.4	0	0	0	0	0	112	F43 I71 L80 L312 A313	F43-A45 HydrophobicContact CB-CB 4.39Å; A45-I71 HydrophobicContact CB-CD1 4.15Å; A45-I71 HydrophobicContact CB-CG2 4.42Å; A45-L80 HydrophobicContact CB-CD2 4.17Å; A45-L312 CarbonylContact C-O 3.56Å; A45-L312 VanDerWaalsContact CA-O 3.29Å; A45-L312 WeakPolarHBondContact CA-O 3.32Å; A45-A313 HydrophobicContact CB-CB 3.87Å
46	A	98.5	Very high	87.4	Confident	6 Å²	6	55.3 Å²	55.3	5%	0.05	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	158	172.4	0	0	0	0	0	109.7	V265 Q266 C269 I311 L312	A46-V265 HydrophobicContact CB-CG1 3.89Å; A46-Q266 HydrophobicContact CB-CB 4.02Å; A46-C269 HydrophobicContact CB-CB 4.05Å; A46-I311 WeakPolarHBondContact O-CA 3.46Å; A46-I311 WeakPolarHBondContact O-CG2 3.31Å; A46-L312 PolarHBondContact N-O 3.26Å; A46-L312 PolarHBondContact O-N 3.25Å
47	C	98.6	Very high	89	Confident	18 Å²	18	53.9 Å²	53.9	12%	0.122	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	146.7	173.9	-178.5	0	0	0	0	110.8	Y69 I71 Q266 V310 I311	C47-Y69 HydrophobicContact CB-CD2 4.32Å; C47-Y69 HydrophobicContact CB-CE2 3.76Å; C47-Y69 WeakPolarHBondContact SG-CE1 3.43Å; C47-Y69 VanDerWaalsContact SG-CE2 3.59Å; C47-I71 HydrophobicContact CB-CD1 4.33Å; C47-Q266 PolarHBondContact O-NE2 3.12Å; C47-V310 CarbonylContact C-O 3.59Å; C47-V310 VanDerWaalsContact CA-O 3.24Å; C47-V310 WeakPolarHBondContact CA-O 3.37Å; C47-V310 PolarHBondContact SG-O 3.45Å; C47-I311 HydrophobicContact CB-CG1 4.35Å
48	C	98.5	Very high	90.4	Very high	19 Å²	19	55.5 Å²	55.5	13%	0.128	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	150	168	-169.2	0	0	0	0	109.4	A273 V310	C48-A273 HydrophobicContact CB-CB 3.99Å; C48-V310 PolarHBondContact N-O 3.28Å; C48-V310 PolarHBondContact O-N 2.73Å
49	G	98.2	Very high	91.5	Very high	7 Å²	7	53.7 Å²	53.7	7%	0.072	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	170.9	178.8	0	0	0	0	0	112.5	F64 I308	G49-F64 WeakPolarHBondContact O-CD1 3.29Å; G49-F64 WeakPolarHBondContact O-CE1 3.29Å; G49-I308 CarbonylContact C-O 3.54Å; G49-I308 WeakPolarHBondContact CA-O 3.31Å
50	F	97.9	Very high	92.3	Very high	46 Å²	46	51 Å²	51	20%	0.202	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	129.5	-179.1	-60.7	-84.1	0	0	0	109.1	A273 Y274 R277 I308	F50-A273 HydrophobicContact CD2-CB 4.13Å; F50-A273 HydrophobicContact CE2-CB 3.77Å; F50-Y274 HydrophobicContact CZ-CD2 4.1Å; F50-R277 HydrophobicContact CB-CG 4.25Å; F50-R277 HydrophobicContact CD2-CB 4.03Å; F50-R277 HydrophobicContact CD2-CG 4.38Å; F50-R277 HydrophobicContact CG-CB 4.33Å; F50-R277 HydrophobicContact CG-CG 4.17Å; F50-I308 PolarHBondContact N-O 3.39Å; F50-I308 PolarHBondContact O-N 2.94Å
51	P	97.4	Very high	92.6	Very high	18 Å²	18	60.6 Å²	60.6	12%	0.117	33%	0.332	C	S	.	.			trans	-65.3	149.5	166.9	29.1	-34.6	0	0	0	110.1	N53 L54 S57 D307	P51-N53 PolarHBondContact O-N 2.91Å; P51-L54 HydrophobicContact CG-CD2 3.82Å; P51-L54 HydrophobicContact CG-CG 4.37Å; P51-S57 WeakPolarHBondContact CB-OG 3.39Å; P51-D307 WeakPolarHBondContact CA-OD1 3.46Å
52	K	95.1	Very high	92.9	Very high	82 Å²	82	62.3 Å²	62.3	36%	0.357	34%	0.342	S	S	.	.	S	Bend	trans	-48.2	-48.4	170.4	-175.4	175.3	-173.1	135.1	0	110.8	P305 D306 D307	K52-P305 WeakPolarHBondContact CE-O 3.47Å; K52-P305 PolarHBondContact NZ-O 3.41Å; K52-D306 WeakPolarHBondContact CA-O 3.46Å; K52-D306 IonicContact NZ-OD1 2.62Å; K52-D306 PolarHBondContact NZ-OD1 3.49Å; K52-D307 WeakPolarHBondContact CB-OD1 3.49Å; K52-D307 PolarHBondContact N-OD1 2.98Å
53	N	91.6	Very high	93	Very high	86 Å²	86	60.9 Å²	60.9	46%	0.46	34%	0.338	S	S	.	.			trans	-114.8	95.1	-179.3	-61.2	-58.8	0	0	0	111.2	P51 T55 T56 S57	P51-N53 PolarHBondContact O-N 2.91Å; N53-T55 VanDerWaalsContact C-N 3.25Å; N53-T55 PolarHBondContact O-N 2.89Å; N53-T56 VanDerWaalsContact CB-OG1 3.22Å; N53-T56 WeakPolarHBondContact CB-OG1 3.43Å; N53-T56 PolarHBondContact O-N 2.84Å; N53-S57 VanDerWaalsContact O-CB 3.28Å; N53-S57 WeakPolarHBondContact O-CB 3.38Å; N53-S57 PolarHBondContact O-N 3.36Å; N53-S57 VanDerWaalsContact O-N 3.15Å; N53-S57 PolarHBondContact O-OG 3.17Å
54	L	85.5	Confident	93.1	Very high	105 Å²	105	62.9 Å²	62.9	55%	0.55	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.9	-179.5	-74.7	163.3	0	0	0	114.2	P51	P51-L54 HydrophobicContact CG-CD2 3.82Å; P51-L54 HydrophobicContact CG-CG 4.37Å
55	T	85.2	Confident	93	Very high	135 Å²	135	62.2 Å²	62.2	83%	0.828	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-23.5	-175.2	50.4	0	0	0	0	113.6	N53	N53-T55 VanDerWaalsContact C-N 3.25Å; N53-T55 PolarHBondContact O-N 2.89Å
56	T	83.2	Confident	93	Very high	105 Å²	105	61.3 Å²	61.3	64%	0.644	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-15.5	-172.9	56.9	0	0	0	0	113.3	N53	N53-T56 VanDerWaalsContact CB-OG1 3.22Å; N53-T56 WeakPolarHBondContact CB-OG1 3.43Å; N53-T56 PolarHBondContact O-N 2.84Å
57	S	84.3	Confident	93	Very high	30 Å²	30	61 Å²	61	21%	0.21	34%	0.335	C	S	.	.			trans	-85.6	122.9	-176.1	-55.6	0	0	0	0	110.8	P51 N53	P51-S57 WeakPolarHBondContact CB-OG 3.39Å; N53-S57 VanDerWaalsContact O-CB 3.28Å; N53-S57 WeakPolarHBondContact O-CB 3.38Å; N53-S57 PolarHBondContact O-N 3.36Å; N53-S57 VanDerWaalsContact O-N 3.15Å; N53-S57 PolarHBondContact O-OG 3.17Å
58	P	84.8	Confident	93	Very high	102 Å²	102	60.2 Å²	60.2	66%	0.662	33%	0.329	S	S	*	.			trans	-67.1	145.8	175.5	28.3	-33.6	0	0	0	110.7	V60	P58-V60 HydrophobicContact CB-CG2 4.35Å; P58-V60 HydrophobicContact CG-CG2 4.17Å; P58-V60 PolarHBondContact O-N 3.34Å; P58-V60 VanDerWaalsContact O-N 3.12Å
59	T	87.4	Confident	93	Very high	151 Å²	151	61.2 Å²	61.2	93%	0.926	33%	0.33	S	S	*	.			trans	-72.9	105.4	170.7	-53.9	0	0	0	0	109.2
60	V	90.3	Very high	93	Very high	30 Å²	30	60.9 Å²	60.9	18%	0.182	33%	0.327	C	S	.	.			trans	-112.5	136.3	175.9	-178.2	0	0	0	0	109	P58 N62 S63	P58-V60 HydrophobicContact CB-CG2 4.35Å; P58-V60 HydrophobicContact CG-CG2 4.17Å; P58-V60 PolarHBondContact O-N 3.34Å; P58-V60 VanDerWaalsContact O-N 3.12Å; V60-N62 PolarHBondContact O-N 2.99Å; V60-S63 PolarHBondContact O-N 3.24Å
61	R	91.5	Very high	93.1	Very high	212 Å²	212	61.7 Å²	61.7	80%	0.8	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	136.5	177.6	176.7	172.5	179.5	-176.7	2.8	109.7	S63	R61-S63 VanDerWaalsContact C-N 3.27Å; R61-S63 PolarHBondContact O-N 2.98Å
62	N	96.3	Very high	93.1	Very high	58 Å²	58	61.1 Å²	61.1	31%	0.31	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	26.5	177.8	-64.6	28.5	0	0	0	115.1	V60 A68 Y69	V60-N62 PolarHBondContact O-N 2.99Å; N62-A68 WeakPolarHBondContact O-CA 3.26Å; N62-Y69 VanDerWaalsContact C-CE1 3.5Å; N62-Y69 VanDerWaalsContact CA-CE1 3.42Å; N62-Y69 HydrophobicContact CB-CD1 4.49Å; N62-Y69 HydrophobicContact CB-CE1 4.25Å; N62-Y69 WeakPolarHBondContact CB-O 3.31Å; N62-Y69 WeakPolarHBondContact O-CD1 3.18Å; N62-Y69 PolarHBondContact O-N 2.93Å
63	S	96.9	Very high	93.1	Very high	10 Å²	10	64.1 Å²	64.1	7%	0.07	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	150.1	-178	174.1	0	0	0	0	111.9	V60 R61 G65 D67	V60-S63 PolarHBondContact O-N 3.24Å; R61-S63 VanDerWaalsContact C-N 3.27Å; R61-S63 PolarHBondContact O-N 2.98Å; S63-G65 PolarHBondContact OG-O 3.42Å; S63-D67 VanDerWaalsContact CA-O 3.23Å; S63-D67 WeakPolarHBondContact CA-O 3.18Å; S63-D67 VanDerWaalsContact CB-O 3.26Å; S63-D67 WeakPolarHBondContact CB-O 3.43Å; S63-D67 PolarHBondContact OG-O 3.06Å
64	F	97.6	Very high	93.3	Very high	46 Å²	46	61.6 Å²	61.6	20%	0.202	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	93.3	176.6	-59.4	-77	0	0	0	108.9	G49 D66 D67 Y69 D307 T309	G49-F64 WeakPolarHBondContact O-CD1 3.29Å; G49-F64 WeakPolarHBondContact O-CE1 3.29Å; F64-D66 PolarHBondContact O-N 2.92Å; F64-D67 PolarHBondContact N-O 3.43Å; F64-D67 VanDerWaalsContact N-O 3.09Å; F64-D67 WeakPolarHBondContact O-CB 3.26Å; F64-D67 PolarHBondContact O-N 3.09Å; F64-Y69 HydrophobicContact CD2-CD1 4.35Å; F64-Y69 HydrophobicContact CD2-CE1 4.26Å; F64-Y69 AromaticContact CE2-CD1 3.99Å; F64-Y69 HydrophobicContact CE2-CD1 3.99Å; F64-Y69 AromaticContact CE2-CE1 3.55Å; F64-Y69 HydrophobicContact CE2-CE1 3.55Å; F64-Y69 HydrophobicContact CZ-CE1 4.24Å; F64-D307 WeakPolarHBondContact O-CB 3.31Å; F64-T309 HydrophobicContact CD2-CG2 4.04Å; F64-T309 WeakPolarHBondContact CD2-OG1 3.37Å; F64-T309 HydrophobicContact CE2-CG2 4.3Å
65	G	96.8	Very high	93.5	Very high	14 Å²	14	59.6 Å²	59.6	14%	0.144	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	-124.4	-173.7	0	0	0	0	0	110.8	S63 S97 D307	S63-G65 PolarHBondContact OG-O 3.42Å; G65-S97 VanDerWaalsContact O-CB 3.27Å; G65-S97 WeakPolarHBondContact O-CB 3.39Å; G65-D307 WeakPolarHBondContact CA-OD1 3.11Å
66	D	97.3	Very high	93.8	Very high	8 Å²	8	55.4 Å²	55.4	4%	0.043	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-17.3	175.5	-64.7	-35.5	0	0	0	113.7	F64 G85 R90 P96 S97 D307	F64-D66 PolarHBondContact O-N 2.92Å; D66-G85 WeakPolarHBondContact CB-O 3.39Å; D66-G85 PolarHBondContact O-N 2.97Å; D66-R90 IonicContact OD1-CZ 2.6Å; D66-R90 IonicContact OD1-NH1 3.98Å; D66-R90 IonicContact OD1-NH2 3.29Å; D66-R90 PolarHBondContact OD1-NH2 2.91Å; D66-R90 IonicContact OD2-CZ 2.66Å; D66-R90 IonicContact OD2-NH1 3.71Å; D66-R90 PolarHBondContact OD2-NH1 3.04Å; D66-R90 IonicContact OD2-NH2 2.96Å; D66-R90 PolarHBondContact OD2-NH2 2.98Å; D66-P96 HydrophobicContact CB-CB 4.19Å; D66-P96 WeakPolarHBondContact OD1-CB 3.24Å; D66-S97 PolarHBondContact OD1-N 3.46Å; D66-D307 WeakPolarHBondContact CB-OD2 3.22Å; D66-D307 PolarHBondContact N-OD2 3.28Å
67	D	98.7	Very high	94.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	149.1	176.3	-71.4	-10	0	0	0	112.4	S63 F64 A83 D84 T238 D307 I308 T309	S63-D67 VanDerWaalsContact CA-O 3.23Å; S63-D67 WeakPolarHBondContact CA-O 3.18Å; S63-D67 VanDerWaalsContact CB-O 3.26Å; S63-D67 WeakPolarHBondContact CB-O 3.43Å; S63-D67 PolarHBondContact OG-O 3.06Å; F64-D67 PolarHBondContact N-O 3.43Å; F64-D67 VanDerWaalsContact N-O 3.09Å; F64-D67 WeakPolarHBondContact O-CB 3.26Å; F64-D67 PolarHBondContact O-N 3.09Å; D67-A83 CarbonylContact C-O 3.53Å; D67-A83 VanDerWaalsContact CA-O 3.31Å; D67-A83 WeakPolarHBondContact CA-O 3.49Å; D67-D84 WeakPolarHBondContact OD1-CA 3.46Å; D67-D84 WeakPolarHBondContact OD1-CB 3.47Å; D67-T238 HydrophobicContact CB-CG2 4.25Å; D67-T238 WeakPolarHBondContact OD2-CB 3.28Å; D67-T238 WeakPolarHBondContact OD2-CG2 3.4Å; D67-T238 PolarHBondContact OD2-OG1 3.09Å; D67-D307 HydrophobicContact CB-CB 4.39Å; D67-I308 VanDerWaalsContact OD2-C 3.3Å; D67-I308 PolarHBondContact OD2-N 3.05Å; D67-T309 WeakPolarHBondContact CB-OG1 3.33Å; D67-T309 VanDerWaalsContact OD2-CB 3.31Å; D67-T309 WeakPolarHBondContact OD2-CB 3.49Å; D67-T309 PolarHBondContact OD2-N 3.17Å; D67-T309 VanDerWaalsContact OD2-N 3.07Å; D67-T309 PolarHBondContact OD2-OG1 3.2Å
68	A	98.5	Very high	95.1	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	158.3	166.9	0	0	0	0	0	111.6	N62 V82 A83 A100 R101 M104	N62-A68 WeakPolarHBondContact O-CA 3.26Å; A68-V82 WeakPolarHBondContact O-CA 3.49Å; A68-A83 PolarHBondContact N-O 2.82Å; A68-A83 PolarHBondContact O-N 3.07Å; A68-A100 VanDerWaalsContact CB-C 3.43Å; A68-A100 HydrophobicContact CB-CB 3.86Å; A68-R101 HydrophobicContact CB-CB 4.3Å; A68-R101 HydrophobicContact CB-CG 3.77Å; A68-M104 HydrophobicContact CB-CB 4.2Å; A68-M104 HydrophobicContact CB-CG 3.85Å
69	Y	98.8	Very high	95.8	Very high	39 Å²	39	44.2 Å²	44.2	15%	0.153	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	166.8	174.4	75.3	-86.7	0	0	0	113.1	C47 N62 F64 I71 G81 T309 I311	C47-Y69 HydrophobicContact CB-CD2 4.32Å; C47-Y69 HydrophobicContact CB-CE2 3.76Å; C47-Y69 WeakPolarHBondContact SG-CE1 3.43Å; C47-Y69 VanDerWaalsContact SG-CE2 3.59Å; N62-Y69 VanDerWaalsContact C-CE1 3.5Å; N62-Y69 VanDerWaalsContact CA-CE1 3.42Å; N62-Y69 HydrophobicContact CB-CD1 4.49Å; N62-Y69 HydrophobicContact CB-CE1 4.25Å; N62-Y69 WeakPolarHBondContact CB-O 3.31Å; N62-Y69 WeakPolarHBondContact O-CD1 3.18Å; N62-Y69 PolarHBondContact O-N 2.93Å; F64-Y69 HydrophobicContact CD2-CD1 4.35Å; F64-Y69 HydrophobicContact CD2-CE1 4.26Å; F64-Y69 AromaticContact CE2-CD1 3.99Å; F64-Y69 HydrophobicContact CE2-CD1 3.99Å; F64-Y69 AromaticContact CE2-CE1 3.55Å; F64-Y69 HydrophobicContact CE2-CE1 3.55Å; F64-Y69 HydrophobicContact CZ-CE1 4.24Å; Y69-I71 HydrophobicContact CD2-CG1 4.35Å; Y69-I71 HydrophobicContact CE2-CD1 4.48Å; Y69-I71 HydrophobicContact CE2-CG1 4.42Å; Y69-G81 CarbonylContact C-O 3.58Å; Y69-G81 WeakPolarHBondContact CA-O 3.37Å; Y69-G81 VanDerWaalsContact CB-O 3.32Å; Y69-G81 WeakPolarHBondContact CB-O 3.32Å; Y69-T309 HydrophobicContact CD1-CG2 3.89Å; Y69-T309 HydrophobicContact CG-CG2 4.17Å; Y69-I311 HydrophobicContact CD2-CD1 3.98Å; Y69-I311 HydrophobicContact CD2-CG1 4.33Å; Y69-I311 HydrophobicContact CG-CD1 4.39Å
70	F	98.6	Very high	96.3	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	153.2	163.5	76.6	-82.9	0	0	0	112.5	A72 V79 L80 G81 M104 C107 A108 V111 I157	F70-A72 HydrophobicContact CD2-CB 3.79Å; F70-A72 HydrophobicContact CE2-CB 4.05Å; F70-V79 HydrophobicContact CE2-CB 4.04Å; F70-V79 HydrophobicContact CE2-CG1 3.67Å; F70-V79 HydrophobicContact CZ-CG1 3.69Å; F70-L80 WeakPolarHBondContact O-CA 3.27Å; F70-G81 VanDerWaalsContact CE1-CA 3.46Å; F70-G81 PolarHBondContact N-O 3.48Å; F70-G81 PolarHBondContact O-N 2.99Å; F70-M104 HydrophobicContact CB-CB 4.4Å; F70-M104 HydrophobicContact CD1-CB 4Å; F70-M104 HydrophobicContact CD1-CG 4.38Å; F70-M104 WeakPolarHBondContact CD1-O 3.27Å; F70-M104 HydrophobicContact CD1-SD 3.59Å; F70-M104 VanDerWaalsContact CD1-SD 3.59Å; F70-M104 HydrophobicContact CE1-CE 4.41Å; F70-M104 HydrophobicContact CE1-SD 3.9Å; F70-C107 HydrophobicContact CD1-CB 3.88Å; F70-C107 HydrophobicContact CE1-CB 3.32Å; F70-C107 HydrophobicContact CE2-CB 4.13Å; F70-C107 HydrophobicContact CG-CB 4.48Å; F70-C107 HydrophobicContact CZ-CB 3.47Å; F70-C107 VanDerWaalsContact CZ-CB 3.47Å; F70-A108 HydrophobicContact CB-CB 3.82Å; F70-A108 HydrophobicContact CD2-CB 3.84Å; F70-A108 HydrophobicContact CG-CB 4Å; F70-V111 HydrophobicContact CE2-CG2 4.44Å; F70-I157 HydrophobicContact CE1-CG1 4.47Å; F70-I157 HydrophobicContact CZ-CG2 4.43Å
71	I	98.5	Very high	96.7	Very high	63 Å²	63	35.7 Å²	35.7	32%	0.323	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	113.7	167.4	-60.1	178.2	0	0	0	105	A45 C47 Y69 L80 I311	A45-I71 HydrophobicContact CB-CD1 4.15Å; A45-I71 HydrophobicContact CB-CG2 4.42Å; C47-I71 HydrophobicContact CB-CD1 4.33Å; Y69-I71 HydrophobicContact CD2-CG1 4.35Å; Y69-I71 HydrophobicContact CE2-CD1 4.48Å; Y69-I71 HydrophobicContact CE2-CG1 4.42Å; I71-L80 HydrophobicContact CB-CD2 4.22Å; I71-L80 HydrophobicContact CG1-CD2 3.95Å; I71-L80 HydrophobicContact CG2-CD2 3.8Å; I71-I311 HydrophobicContact CD1-CG2 4.05Å; I71-I311 HydrophobicContact CG1-CD1 4.04Å; I71-I311 HydrophobicContact CG1-CG2 4.33Å
72	A	98.2	Very high	97.1	Very high	5 Å²	5	25.6 Å²	25.6	4%	0.041	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.3	-179.3	0	0	0	0	0	110.5	F70 V79 A108 V111	F70-A72 HydrophobicContact CD2-CB 3.79Å; F70-A72 HydrophobicContact CE2-CB 4.05Å; A72-V79 PolarHBondContact N-O 3.32Å; A72-V79 PolarHBondContact O-N 3.32Å; A72-A108 HydrophobicContact CB-CB 4.27Å; A72-V111 HydrophobicContact CB-CB 3.84Å; A72-V111 HydrophobicContact CB-CG1 3.61Å
73	R	96	Very high	97.2	Very high	145 Å²	145	22.9 Å²	22.9	55%	0.547	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.4	-179	-66.9	179.7	173.1	153.9	-2.9	109.4	F43	F43-R73 PolarHBondContact O-NH2 2.93Å; F43-R73 VanDerWaalsContact O-NH2 3.12Å
74	H	94.7	Very high	97.3	Very high	34 Å²	34	23.2 Å²	23.2	16%	0.157	11%	0.111	C	C	.	.			trans	-135.5	159.7	171.4	-173.2	-107.5	0	0	0	108.3	T76 A77 V111 G114 F116 R162	H74-T76 PolarHBondContact ND1-N 3.5Å; H74-T76 PolarHBondContact ND1-OG1 2.89Å; H74-T76 PolarHBondContact O-N 2.89Å; H74-T76 VanDerWaalsContact O-N 3.13Å; H74-A77 PolarHBondContact N-O 2.97Å; H74-A77 PolarHBondContact O-N 3.48Å; H74-A77 VanDerWaalsContact O-N 3.15Å; H74-V111 HydrophobicContact CB-CG1 4.22Å; H74-V111 PolarHBondContact CD2-O 3.38Å; H74-G114 VanDerWaalsContact NE2-CA 3.29Å; H74-G114 WeakPolarHBondContact NE2-CA 3.45Å; H74-F116 HydrophobicContact CB-CE1 3.83Å; H74-F116 HydrophobicContact CB-CZ 3.91Å; H74-F116 AromaticContact CG-CE1 3.84Å; H74-F116 AromaticContact ND1-CE1 3.9Å; H74-R162 PolarHBondContact O-NE 3.18Å
75	H	90.2	Very high	97.3	Very high	62 Å²	62	21 Å²	21	29%	0.287	10%	0.101	S	C	.	.	S	Bend	trans	-61.5	-25.1	-177.7	60.6	-95.9	0	0	0	112.6	R162 T323 I326	H75-R162 WeakPolarHBondContact O-CD 3.37Å; H75-T323 WeakPolarHBondContact CB-O 3.42Å; H75-I326 PolarHBondContact CD2-OXT 2.91Å; H75-I326 PolarHBondContact NE2-OXT 3.03Å; H75-I326 VanDerWaalsContact NE2-OXT 3.09Å
76	T	92.3	Very high	97.3	Very high	47 Å²	47	22.1 Å²	22.1	29%	0.288	11%	0.105	S	C	.	.	S	Bend	trans	-88.6	-24.3	175.7	58.5	0	0	0	0	115	H74 R162	H74-T76 PolarHBondContact ND1-N 3.5Å; H74-T76 PolarHBondContact ND1-OG1 2.89Å; H74-T76 PolarHBondContact O-N 2.89Å; H74-T76 VanDerWaalsContact O-N 3.13Å; T76-R162 WeakPolarHBondContact O-CB 3.46Å; T76-R162 PolarHBondContact O-N 3.41Å
77	A	96	Very high	97.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	150.1	-171	0	0	0	0	0	114.5	H74 V79 F116 P118 V159 L160	H74-A77 PolarHBondContact N-O 2.97Å; H74-A77 PolarHBondContact O-N 3.48Å; H74-A77 VanDerWaalsContact O-N 3.15Å; A77-V79 HydrophobicContact CB-CG2 4.35Å; A77-F116 HydrophobicContact CB-CE2 3.88Å; A77-F116 HydrophobicContact CB-CZ 3.88Å; A77-P118 HydrophobicContact CB-CB 4Å; A77-P118 HydrophobicContact CB-CG 3.97Å; A77-V159 HydrophobicContact CB-CG1 3.79Å; A77-L160 WeakPolarHBondContact CA-O 3.29Å; A77-L160 VanDerWaalsContact CB-O 3.31Å; A77-L160 WeakPolarHBondContact CB-O 3.31Å
78	D	97.8	Very high	96.8	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.8	164.8	-70.6	2.1	0	0	0	109	F43 L160 R162	F43-D78 HydrophobicContact CB-CB 4.25Å; F43-D78 HydrophobicContact CD2-CB 3.57Å; F43-D78 HydrophobicContact CE2-CB 4.35Å; F43-D78 HydrophobicContact CG-CB 4.23Å; F43-D78 PolarHBondContact N-OD2 3.26Å; D78-L160 HydrophobicContact CB-CB 4.43Å; D78-L160 PolarHBondContact N-O 2.67Å; D78-L160 PolarHBondContact O-N 2.93Å; D78-R162 IonicContact OD1-CZ 3.78Å; D78-R162 IonicContact OD1-NE 2.79Å; D78-R162 PolarHBondContact OD1-NE 3.47Å; D78-R162 IonicContact OD1-NH2 3.86Å; D78-R162 PolarHBondContact OD1-NH2 3.16Å; D78-R162 IonicContact OD2-NH2 2.97Å
79	V	98.7	Very high	96.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.3	-172.7	-168.6	0	0	0	0	110.7	F70 A72 A77 V111 F116 L124 I157 V158 V159	F70-V79 HydrophobicContact CE2-CB 4.04Å; F70-V79 HydrophobicContact CE2-CG1 3.67Å; F70-V79 HydrophobicContact CZ-CG1 3.69Å; A72-V79 PolarHBondContact N-O 3.32Å; A72-V79 PolarHBondContact O-N 3.32Å; A77-V79 HydrophobicContact CB-CG2 4.35Å; V79-V111 HydrophobicContact CB-CG1 4.04Å; V79-V111 HydrophobicContact CB-CG2 3.9Å; V79-V111 HydrophobicContact CG1-CG2 4.04Å; V79-V111 HydrophobicContact CG2-CB 4.4Å; V79-V111 HydrophobicContact CG2-CG1 3.66Å; V79-V111 HydrophobicContact CG2-CG2 3.77Å; V79-F116 HydrophobicContact CG2-CE2 3.79Å; V79-F116 HydrophobicContact CG2-CZ 4.16Å; V79-L124 HydrophobicContact CG1-CD2 4.03Å; V79-I157 HydrophobicContact CG1-CG2 3.79Å; V79-V158 WeakPolarHBondContact CA-O 3.49Å; V79-V159 HydrophobicContact CB-CG2 4.46Å; V79-V159 HydrophobicContact CG1-CG2 3.79Å; V79-V159 HydrophobicContact CG2-CB 4.46Å; V79-V159 HydrophobicContact CG2-CG1 4.09Å; V79-V159 HydrophobicContact CG2-CG2 4.03Å
80	L	98.9	Very high	96.3	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	145	179.1	-47.1	175.4	0	0	0	108.3	F43 A45 F70 I71 I157 V158 L236 I311 A313	F43-L80 HydrophobicContact CD2-CD1 3.83Å; F43-L80 HydrophobicContact CD2-CD2 4.26Å; F43-L80 HydrophobicContact CD2-CG 3.97Å; F43-L80 HydrophobicContact CE2-CD1 3.71Å; F43-L80 HydrophobicContact CE2-CG 3.97Å; F43-L80 HydrophobicContact CG-CD1 4.48Å; F43-L80 HydrophobicContact CZ-CD1 4.26Å; A45-L80 HydrophobicContact CB-CD2 4.17Å; F70-L80 WeakPolarHBondContact O-CA 3.27Å; I71-L80 HydrophobicContact CB-CD2 4.22Å; I71-L80 HydrophobicContact CG1-CD2 3.95Å; I71-L80 HydrophobicContact CG2-CD2 3.8Å; L80-I157 WeakPolarHBondContact O-CA 3.18Å; L80-V158 PolarHBondContact N-O 2.97Å; L80-V158 PolarHBondContact O-N 3.46Å; L80-L236 HydrophobicContact CB-CD2 3.66Å; L80-I311 HydrophobicContact CB-CD1 4.35Å; L80-I311 HydrophobicContact CD1-CG2 4.09Å; L80-I311 HydrophobicContact CD2-CG2 4.27Å; L80-A313 HydrophobicContact CD1-CB 3.52Å
81	G	98.9	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	149.5	172.5	0	0	0	0	0	113.1	Y69 F70 C156	Y69-G81 CarbonylContact C-O 3.58Å; Y69-G81 WeakPolarHBondContact CA-O 3.37Å; Y69-G81 VanDerWaalsContact CB-O 3.32Å; Y69-G81 WeakPolarHBondContact CB-O 3.32Å; F70-G81 VanDerWaalsContact CE1-CA 3.46Å; F70-G81 PolarHBondContact N-O 3.48Å; F70-G81 PolarHBondContact O-N 2.99Å; G81-C156 CarbonylContact C-O 3.5Å; G81-C156 WeakPolarHBondContact CA-O 3.2Å
82	V	98.9	Very high	95.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.6	171.7	-63.8	0	0	0	0	109.8	A68 C156 L236 T238 T309 I311	A68-V82 WeakPolarHBondContact O-CA 3.49Å; V82-C156 HydrophobicContact CG2-CB 3.97Å; V82-C156 PolarHBondContact N-O 2.66Å; V82-C156 PolarHBondContact O-N 2.94Å; V82-L236 HydrophobicContact CB-CG 4.46Å; V82-L236 HydrophobicContact CG1-CD2 4.21Å; V82-L236 HydrophobicContact CG1-CG 3.93Å; V82-L236 HydrophobicContact CG2-CD1 3.71Å; V82-L236 HydrophobicContact CG2-CD2 4.43Å; V82-L236 HydrophobicContact CG2-CG 3.8Å; V82-T238 HydrophobicContact CB-CG2 4.1Å; V82-T238 HydrophobicContact CG2-CG2 4.39Å; V82-T309 HydrophobicContact CG1-CG2 4.14Å; V82-I311 HydrophobicContact CG1-CD1 3.96Å; V82-I311 HydrophobicContact CG1-CG1 4.08Å
83	A	98.9	Very high	95.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	138.3	173.7	0	0	0	0	0	108.9	D67 A68 A100 M104 T154	D67-A83 CarbonylContact C-O 3.53Å; D67-A83 VanDerWaalsContact CA-O 3.31Å; D67-A83 WeakPolarHBondContact CA-O 3.49Å; A68-A83 PolarHBondContact N-O 2.82Å; A68-A83 PolarHBondContact O-N 3.07Å; A83-A100 HydrophobicContact CB-CB 3.96Å; A83-M104 HydrophobicContact CB-CE 3.9Å; A83-M104 HydrophobicContact CB-CG 3.9Å; A83-M104 HydrophobicContact CB-SD 4.01Å; A83-T154 WeakPolarHBondContact CB-O 3.33Å
84	D	98.7	Very high	95	Very high	18 Å²	18	36.8 Å²	36.8	10%	0.096	22%	0.22	C	C	.	.			trans	-106.7	121.6	171.7	167.7	25.8	0	0	0	109	D67 S153 T154 T238	D67-D84 WeakPolarHBondContact OD1-CA 3.46Å; D67-D84 WeakPolarHBondContact OD1-CB 3.47Å; D84-S153 CarbonylContact O-C 3.21Å; D84-S153 WeakPolarHBondContact O-CA 3.42Å; D84-S153 WeakPolarHBondContact O-CB 3.32Å; D84-T154 PolarHBondContact N-OG1 3.04Å; D84-T154 PolarHBondContact O-N 3.09Å; D84-T238 HydrophobicContact CB-CG2 4.05Å
85	G	98.1	Very high	94.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-81.2	132	-179.1	0	0	0	0	0	112.3	D66 G87 S152	D66-G85 WeakPolarHBondContact CB-O 3.39Å; D66-G85 PolarHBondContact O-N 2.97Å; G85-G87 PolarHBondContact O-N 2.82Å; G85-S152 WeakPolarHBondContact CA-O 3.32Å
86	V	96.3	Very high	95.1	Very high	37 Å²	37	35.6 Å²	35.6	22%	0.224	22%	0.217	C	C	.	.			trans	-73.7	107.3	-173.7	175.1	0	0	0	0	112.8	G88 W89 P96 S152	V86-G88 PolarHBondContact O-N 2.84Å; V86-W89 VanDerWaalsContact O-CD1 3.24Å; V86-W89 PolarHBondContact O-N 3.37Å; V86-P96 WeakPolarHBondContact O-CB 3.13Å; V86-S152 PolarHBondContact N-O 3.01Å
87	G	93.8	Very high	95.2	Very high	33 Å²	33	33.8 Å²	33.8	34%	0.34	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-52.6	-25.3	-175.4	0	0	0	0	0	116.3	G85 W89 R90	G85-G87 PolarHBondContact O-N 2.82Å; G87-W89 PolarHBondContact O-N 2.79Å; G87-R90 PolarHBondContact O-N 2.96Å
88	G	92.7	Very high	95.1	Very high	48 Å²	48	35.5 Å²	35.5	50%	0.495	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-59.3	-25.1	180	0	0	0	0	0	114.6	V86 R90 S91	V86-G88 PolarHBondContact O-N 2.84Å; G88-R90 PolarHBondContact O-N 3.44Å; G88-R90 VanDerWaalsContact O-N 3.15Å; G88-S91 PolarHBondContact O-N 3.46Å; G88-S91 VanDerWaalsContact O-N 3.16Å; G88-S91 PolarHBondContact O-OG 3.23Å
89	W	92.9	Very high	95	Very high	10 Å²	10	35.4 Å²	35.4	4%	0.038	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-59.6	-23.9	177.1	-76.9	106.2	0	0	0	113.9	V86 G87 S91 Y92 I94 P96 G151 S152 T203 M205 F213	V86-W89 VanDerWaalsContact O-CD1 3.24Å; V86-W89 PolarHBondContact O-N 3.37Å; G87-W89 PolarHBondContact O-N 2.79Å; W89-S91 PolarHBondContact O-N 3.09Å; W89-Y92 HydrophobicContact CE3-CD2 4.36Å; W89-Y92 PolarHBondContact O-N 3.34Å; W89-I94 CarbonylContact C-O 3.46Å; W89-I94 HydrophobicContact CB-CB 4.06Å; W89-I94 HydrophobicContact CB-CG2 4Å; W89-I94 HydrophobicContact CD2-CG2 4.45Å; W89-I94 HydrophobicContact CE3-CB 4.18Å; W89-I94 HydrophobicContact CE3-CD1 3.46Å; W89-I94 VanDerWaalsContact CE3-CD1 3.46Å; W89-I94 HydrophobicContact CE3-CG1 4.41Å; W89-I94 HydrophobicContact CE3-CG2 4.24Å; W89-I94 HydrophobicContact CG-CG2 4.38Å; W89-I94 HydrophobicContact CZ3-CD1 3.65Å; W89-I94 PolarHBondContact O-N 2.66Å; W89-P96 HydrophobicContact CB-CG 4.24Å; W89-G151 VanDerWaalsContact CE2-CA 3.44Å; W89-G151 VanDerWaalsContact NE1-C 3.28Å; W89-S152 WeakPolarHBondContact CZ2-OG 3.43Å; W89-S152 VanDerWaalsContact NE1-N 3.1Å; W89-S152 PolarHBondContact NE1-OG 2.83Å; W89-T203 HydrophobicContact CZ2-CG2 3.93Å; W89-M205 HydrophobicContact CH2-CB 4.37Å; W89-F213 HydrophobicContact CH2-CD1 4.42Å; W89-F213 HydrophobicContact CH2-CE1 4.36Å; W89-F213 HydrophobicContact CZ2-CD1 4.37Å
90	R	92.8	Very high	95	Very high	132 Å²	132	35.4 Å²	35.4	50%	0.498	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-58.6	-31.2	175.7	-70.6	-169.5	179.3	86.2	-0.6	113.4	D66 G87 G88 Y92 G93 I94 P96	D66-R90 IonicContact OD1-CZ 2.6Å; D66-R90 IonicContact OD1-NH1 3.98Å; D66-R90 IonicContact OD1-NH2 3.29Å; D66-R90 PolarHBondContact OD1-NH2 2.91Å; D66-R90 IonicContact OD2-CZ 2.66Å; D66-R90 IonicContact OD2-NH1 3.71Å; D66-R90 PolarHBondContact OD2-NH1 3.04Å; D66-R90 IonicContact OD2-NH2 2.96Å; D66-R90 PolarHBondContact OD2-NH2 2.98Å; G87-R90 PolarHBondContact O-N 2.96Å; G88-R90 PolarHBondContact O-N 3.44Å; G88-R90 VanDerWaalsContact O-N 3.15Å; R90-Y92 PolarHBondContact O-N 3.32Å; R90-G93 PolarHBondContact O-N 3.01Å; R90-I94 WeakPolarHBondContact CA-O 3.42Å; R90-I94 PolarHBondContact N-O 2.87Å; R90-P96 HydrophobicContact CG-CG 3.73Å
91	S	92.4	Very high	94.9	Very high	97 Å²	97	36.3 Å²	36.3	68%	0.678	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-64.7	-20.3	176.9	64.8	0	0	0	0	113.3	G88 W89	G88-S91 PolarHBondContact O-N 3.46Å; G88-S91 VanDerWaalsContact O-N 3.16Å; G88-S91 PolarHBondContact O-OG 3.23Å; W89-S91 PolarHBondContact O-N 3.09Å
92	Y	89.9	Confident	94.7	Very high	145 Å²	145	36.3 Å²	36.3	57%	0.569	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-100.9	10.1	175.3	-58.1	-81.8	0	0	0	112.8	W89 R90 I94 F213	W89-Y92 HydrophobicContact CE3-CD2 4.36Å; W89-Y92 PolarHBondContact O-N 3.34Å; R90-Y92 PolarHBondContact O-N 3.32Å; Y92-I94 VanDerWaalsContact C-N 3.25Å; Y92-I94 PolarHBondContact O-N 3.45Å; Y92-F213 HydrophobicContact CE1-CZ 4.32Å; Y92-F213 AromaticContact CE2-CE1 3.86Å; Y92-F213 HydrophobicContact CE2-CE1 3.86Å; Y92-F213 AromaticContact CE2-CZ 3.94Å; Y92-F213 HydrophobicContact CE2-CZ 3.94Å; Y92-F213 AromaticContact CZ-CZ 3.72Å
93	G	91	Very high	94.7	Very high	74 Å²	74	36.3 Å²	36.3	76%	0.763	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	17	-176.8	0	0	0	0	0	114.3	R90	R90-G93 PolarHBondContact O-N 3.01Å
94	I	91.2	Very high	94.7	Very high	31 Å²	31	36.4 Å²	36.4	16%	0.159	22%	0.216	C	C	.	.			trans	-100.7	129.5	178.8	-68.6	162.8	0	0	0	109	W89 R90 Y92 P96 F150	W89-I94 CarbonylContact C-O 3.46Å; W89-I94 HydrophobicContact CB-CB 4.06Å; W89-I94 HydrophobicContact CB-CG2 4Å; W89-I94 HydrophobicContact CD2-CG2 4.45Å; W89-I94 HydrophobicContact CE3-CB 4.18Å; W89-I94 HydrophobicContact CE3-CD1 3.46Å; W89-I94 VanDerWaalsContact CE3-CD1 3.46Å; W89-I94 HydrophobicContact CE3-CG1 4.41Å; W89-I94 HydrophobicContact CE3-CG2 4.24Å; W89-I94 HydrophobicContact CG-CG2 4.38Å; W89-I94 HydrophobicContact CZ3-CD1 3.65Å; W89-I94 PolarHBondContact O-N 2.66Å; R90-I94 WeakPolarHBondContact CA-O 3.42Å; R90-I94 PolarHBondContact N-O 2.87Å; Y92-I94 VanDerWaalsContact C-N 3.25Å; Y92-I94 PolarHBondContact O-N 3.45Å; I94-P96 VanDerWaalsContact O-CD 3.29Å; I94-P96 WeakPolarHBondContact O-CD 3.33Å; I94-F150 HydrophobicContact CD1-CB 3.75Å; I94-F150 HydrophobicContact CD1-CG 4.48Å; I94-F150 HydrophobicContact CG1-CB 4.4Å; I94-F150 HydrophobicContact CG2-CB 4.32Å; I94-F150 WeakPolarHBondContact CG2-O 3.33Å
95	D	92.7	Very high	94.6	Very high	71 Å²	71	37.1 Å²	37.1	38%	0.38	22%	0.222	S	C	.	.			trans	-72.7	112.2	174.3	174	12.2	0	0	0	110.4	S97 R98 R101	D95-S97 VanDerWaalsContact C-N 3.3Å; D95-S97 PolarHBondContact O-N 2.97Å; D95-S97 WeakPolarHBondContact OD1-CB 3.2Å; D95-S97 PolarHBondContact OD1-N 3.28Å; D95-S97 VanDerWaalsContact OD1-N 3.11Å; D95-S97 PolarHBondContact OD1-OG 2.97Å; D95-S97 PolarHBondContact OD2-OG 3.31Å; D95-R98 HydrophobicContact CB-CB 4.32Å; D95-R98 WeakPolarHBondContact O-CB 3.38Å; D95-R98 PolarHBondContact O-N 3.37Å; D95-R101 IonicContact OD2-NH2 3.64Å
96	P	94.7	Very high	94.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-32.9	-177.4	-17.6	30.2	0	0	0	113.5	D66 V86 W89 R90 I94 R98 F99	D66-P96 HydrophobicContact CB-CB 4.19Å; D66-P96 WeakPolarHBondContact OD1-CB 3.24Å; V86-P96 WeakPolarHBondContact O-CB 3.13Å; W89-P96 HydrophobicContact CB-CG 4.24Å; R90-P96 HydrophobicContact CG-CG 3.73Å; I94-P96 VanDerWaalsContact O-CD 3.29Å; I94-P96 WeakPolarHBondContact O-CD 3.33Å; P96-R98 PolarHBondContact O-N 3.17Å; P96-R98 VanDerWaalsContact O-N 3.15Å; P96-F99 PolarHBondContact O-N 3.32Å
97	S	94.9	Very high	94.7	Very high	8 Å²	8	35.5 Å²	35.5	6%	0.056	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-27.8	178.2	79.9	0	0	0	0	112.2	G65 D66 D95 F99 A100 R101	G65-S97 VanDerWaalsContact O-CB 3.27Å; G65-S97 WeakPolarHBondContact O-CB 3.39Å; D66-S97 PolarHBondContact OD1-N 3.46Å; D95-S97 VanDerWaalsContact C-N 3.3Å; D95-S97 PolarHBondContact O-N 2.97Å; D95-S97 WeakPolarHBondContact OD1-CB 3.2Å; D95-S97 PolarHBondContact OD1-N 3.28Å; D95-S97 VanDerWaalsContact OD1-N 3.11Å; D95-S97 PolarHBondContact OD1-OG 2.97Å; D95-S97 PolarHBondContact OD2-OG 3.31Å; S97-F99 PolarHBondContact O-N 2.74Å; S97-A100 PolarHBondContact O-N 3.08Å; S97-R101 VanDerWaalsContact O-CB 3.25Å; S97-R101 WeakPolarHBondContact O-CB 3.4Å; S97-R101 VanDerWaalsContact O-CG 3.22Å; S97-R101 WeakPolarHBondContact O-CG 3.31Å; S97-R101 PolarHBondContact O-N 3.4Å; S97-R101 PolarHBondContact OG-NE 2.85Å; S97-R101 PolarHBondContact OG-NH2 2.98Å
98	R	93.6	Very high	94.9	Very high	37 Å²	37	34.9 Å²	34.9	14%	0.14	20%	0.204	C	C	.	.	H	α-helix	trans	-66.1	-40.6	-172.2	-170.8	173.4	-179.6	-123.1	-0.4	112.2	D95 P96 S102 T147 A148	D95-R98 HydrophobicContact CB-CB 4.32Å; D95-R98 WeakPolarHBondContact O-CB 3.38Å; D95-R98 PolarHBondContact O-N 3.37Å; P96-R98 PolarHBondContact O-N 3.17Å; P96-R98 VanDerWaalsContact O-N 3.15Å; R98-S102 VanDerWaalsContact O-CB 3.26Å; R98-S102 WeakPolarHBondContact O-CB 3.3Å; R98-S102 PolarHBondContact O-N 2.81Å; R98-S102 PolarHBondContact O-OG 3.37Å; R98-T147 PolarHBondContact NH1-O 2.89Å; R98-T147 PolarHBondContact NH1-OG1 2.98Å; R98-T147 PolarHBondContact NH2-O 2.97Å; R98-A148 PolarHBondContact NH1-O 2.91Å
99	F	95.3	Very high	95.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-52.6	177.3	-175.5	-80.2	0	0	0	110.6	P96 S97 R101 S102 L103 Y129 L132 I149 G151 S153 L202 L204	P96-F99 PolarHBondContact O-N 3.32Å; S97-F99 PolarHBondContact O-N 2.74Å; F99-R101 PolarHBondContact O-N 2.82Å; F99-S102 PolarHBondContact O-N 2.81Å; F99-L103 HydrophobicContact CE1-CD2 4.31Å; F99-L103 WeakPolarHBondContact O-CB 3.32Å; F99-L103 PolarHBondContact O-N 3.48Å; F99-Y129 HydrophobicContact CE2-CE2 4.39Å; F99-Y129 HydrophobicContact CZ-CD2 4.01Å; F99-Y129 HydrophobicContact CZ-CE2 4.04Å; F99-L132 HydrophobicContact CD2-CD2 4.4Å; F99-L132 HydrophobicContact CE2-CD2 4.27Å; F99-L132 HydrophobicContact CZ-CD2 4.43Å; F99-I149 HydrophobicContact CB-CG2 4.43Å; F99-I149 HydrophobicContact CD2-CG2 3.99Å; F99-G151 WeakPolarHBondContact CD2-O 3.22Å; F99-S153 VanDerWaalsContact CD1-OG 3.3Å; F99-S153 WeakPolarHBondContact CD1-OG 3.42Å; F99-S153 WeakPolarHBondContact CE1-OG 3.48Å; F99-L202 HydrophobicContact CE1-CB 3.97Å; F99-L202 HydrophobicContact CZ-CB 3.77Å; F99-L204 HydrophobicContact CD2-CB 4.36Å; F99-L204 HydrophobicContact CE2-CB 3.9Å; F99-L204 HydrophobicContact CE2-CD1 3.89Å; F99-L204 HydrophobicContact CE2-CG 3.76Å
100	A	97.7	Very high	95.4	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.5	-47.6	179.7	0	0	0	0	0	111.8	A68 A83 S97 S102 L103 M104	A68-A100 VanDerWaalsContact CB-C 3.43Å; A68-A100 HydrophobicContact CB-CB 3.86Å; A83-A100 HydrophobicContact CB-CB 3.96Å; S97-A100 PolarHBondContact O-N 3.08Å; A100-S102 PolarHBondContact O-N 3.21Å; A100-L103 PolarHBondContact O-N 3.41Å; A100-M104 WeakPolarHBondContact O-CG 3.27Å; A100-M104 PolarHBondContact O-N 3.21Å
101	R	96.6	Very high	95.7	Very high	22 Å²	22	29.8 Å²	29.8	8%	0.083	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-43.1	177.5	-73.5	-171.3	-66.4	125.9	-0.7	112.6	A68 D95 S97 F99 S105 D139	A68-R101 HydrophobicContact CB-CB 4.3Å; A68-R101 HydrophobicContact CB-CG 3.77Å; D95-R101 IonicContact OD2-NH2 3.64Å; S97-R101 VanDerWaalsContact O-CB 3.25Å; S97-R101 WeakPolarHBondContact O-CB 3.4Å; S97-R101 VanDerWaalsContact O-CG 3.22Å; S97-R101 WeakPolarHBondContact O-CG 3.31Å; S97-R101 PolarHBondContact O-N 3.4Å; S97-R101 PolarHBondContact OG-NE 2.85Å; S97-R101 PolarHBondContact OG-NH2 2.98Å; F99-R101 PolarHBondContact O-N 2.82Å; R101-S105 WeakPolarHBondContact O-CB 3.45Å; R101-S105 PolarHBondContact O-N 2.89Å; R101-D139 IonicContact CZ-OD2 3.1Å; R101-D139 IonicContact NH1-OD1 2.63Å; R101-D139 PolarHBondContact NH1-OD1 2.83Å; R101-D139 IonicContact NH1-OD2 3.54Å; R101-D139 PolarHBondContact NH1-OD2 2.75Å; R101-D139 IonicContact NH2-OD2 3.37Å
102	S	95.9	Very high	95.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-42.1	178.6	-58.7	0	0	0	0	111.3	R98 F99 A100 T106 C137	R98-S102 VanDerWaalsContact O-CB 3.26Å; R98-S102 WeakPolarHBondContact O-CB 3.3Å; R98-S102 PolarHBondContact O-N 2.81Å; R98-S102 PolarHBondContact O-OG 3.37Å; F99-S102 PolarHBondContact O-N 2.81Å; A100-S102 PolarHBondContact O-N 3.21Å; S102-T106 WeakPolarHBondContact O-CB 3.38Å; S102-T106 PolarHBondContact O-N 2.69Å; S102-T106 PolarHBondContact O-OG1 3.27Å; S102-C137 PolarHBondContact OG-SG 2.97Å
103	L	98.1	Very high	96.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-53.7	178.2	-175.5	68.3	0	0	0	111	F99 A100 S105 T106 C107 L132 A155 L202	F99-L103 HydrophobicContact CE1-CD2 4.31Å; F99-L103 WeakPolarHBondContact O-CB 3.32Å; F99-L103 PolarHBondContact O-N 3.48Å; A100-L103 PolarHBondContact O-N 3.41Å; L103-S105 PolarHBondContact O-N 3.06Å; L103-T106 PolarHBondContact O-N 3.02Å; L103-C107 PolarHBondContact O-N 3.29Å; L103-C107 PolarHBondContact O-SG 2.83Å; L103-C107 VanDerWaalsContact O-SG 3.34Å; L103-L132 HydrophobicContact CB-CD2 4.06Å; L103-L132 HydrophobicContact CD1-CD2 4.45Å; L103-A155 HydrophobicContact CD2-CB 3.95Å; L103-L202 HydrophobicContact CD1-CD1 4.23Å; L103-L202 HydrophobicContact CD2-CD1 3.84Å
104	M	98.5	Very high	96.5	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-38.8	-179.1	-65.4	-61	94.8	0	0	112.7	A68 F70 A83 A100 T106 C107 A108	A68-M104 HydrophobicContact CB-CB 4.2Å; A68-M104 HydrophobicContact CB-CG 3.85Å; F70-M104 HydrophobicContact CB-CB 4.4Å; F70-M104 HydrophobicContact CD1-CB 4Å; F70-M104 HydrophobicContact CD1-CG 4.38Å; F70-M104 WeakPolarHBondContact CD1-O 3.27Å; F70-M104 HydrophobicContact CD1-SD 3.59Å; F70-M104 VanDerWaalsContact CD1-SD 3.59Å; F70-M104 HydrophobicContact CE1-CE 4.41Å; F70-M104 HydrophobicContact CE1-SD 3.9Å; A83-M104 HydrophobicContact CB-CE 3.9Å; A83-M104 HydrophobicContact CB-CG 3.9Å; A83-M104 HydrophobicContact CB-SD 4.01Å; A100-M104 WeakPolarHBondContact O-CG 3.27Å; A100-M104 PolarHBondContact O-N 3.21Å; M104-T106 VanDerWaalsContact C-N 3.34Å; M104-C107 PolarHBondContact O-N 3.45Å; M104-A108 PolarHBondContact O-N 3.12Å
105	S	97.5	Very high	96.8	Very high	33 Å²	33	30.6 Å²	30.6	23%	0.231	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-39.4	175.1	-176	0	0	0	0	111.8	R101 L103 A108 Q109 S138	R101-S105 WeakPolarHBondContact O-CB 3.45Å; R101-S105 PolarHBondContact O-N 2.89Å; L103-S105 PolarHBondContact O-N 3.06Å; S105-A108 PolarHBondContact O-N 3.16Å; S105-Q109 WeakPolarHBondContact O-CG 3.41Å; S105-Q109 PolarHBondContact O-N 3.25Å; S105-Q109 VanDerWaalsContact O-N 3.08Å; S105-S138 WeakPolarHBondContact CB-OG 3.37Å; S105-S138 WeakPolarHBondContact OG-CB 3.21Å; S105-S138 PolarHBondContact OG-O 2.77Å; S105-S138 PolarHBondContact OG-OG 3.09Å
106	T	97.7	Very high	97	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.012	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-44.9	177.6	-58.8	0	0	0	0	110.9	S102 L103 M104 A108 Q109 L110 A131 L132 Y136 S138	S102-T106 WeakPolarHBondContact O-CB 3.38Å; S102-T106 PolarHBondContact O-N 2.69Å; S102-T106 PolarHBondContact O-OG1 3.27Å; L103-T106 PolarHBondContact O-N 3.02Å; M104-T106 VanDerWaalsContact C-N 3.34Å; T106-A108 VanDerWaalsContact C-N 3.31Å; T106-A108 PolarHBondContact O-N 2.83Å; T106-Q109 PolarHBondContact O-N 3.01Å; T106-Q109 VanDerWaalsContact O-N 3.17Å; T106-L110 HydrophobicContact CG2-CD1 4.31Å; T106-L110 HydrophobicContact CG2-CG 4.45Å; T106-L110 WeakPolarHBondContact O-CG 3.42Å; T106-L110 PolarHBondContact O-N 3.43Å; T106-A131 HydrophobicContact CG2-CB 3.93Å; T106-L132 HydrophobicContact CG2-CD1 4.45Å; T106-L132 WeakPolarHBondContact OG1-CD1 3.36Å; T106-Y136 HydrophobicContact CG2-CD1 4.24Å; T106-Y136 HydrophobicContact CG2-CE1 4.36Å; T106-S138 PolarHBondContact N-OG 3.03Å; T106-S138 VanDerWaalsContact N-OG 3.15Å; T106-S138 PolarHBondContact OG1-OG 2.79Å
107	C	98.6	Very high	97.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-53.7	-49.4	173	-67.9	0	0	0	0	111.2	F70 L103 M104 Q109 L110 V111 S128	F70-C107 HydrophobicContact CD1-CB 3.88Å; F70-C107 HydrophobicContact CE1-CB 3.32Å; F70-C107 HydrophobicContact CE2-CB 4.13Å; F70-C107 HydrophobicContact CG-CB 4.48Å; F70-C107 HydrophobicContact CZ-CB 3.47Å; F70-C107 VanDerWaalsContact CZ-CB 3.47Å; L103-C107 PolarHBondContact O-N 3.29Å; L103-C107 PolarHBondContact O-SG 2.83Å; L103-C107 VanDerWaalsContact O-SG 3.34Å; M104-C107 PolarHBondContact O-N 3.45Å; C107-Q109 VanDerWaalsContact C-N 3.28Å; C107-Q109 PolarHBondContact O-N 3.17Å; C107-L110 PolarHBondContact O-N 2.95Å; C107-V111 VanDerWaalsContact O-CG2 3.32Å; C107-V111 WeakPolarHBondContact O-CG2 3.49Å; C107-V111 PolarHBondContact O-N 2.83Å; C107-S128 WeakPolarHBondContact CA-OG 3.4Å; C107-S128 PolarHBondContact N-OG 3.38Å; C107-S128 PolarHBondContact SG-OG 2.97Å
108	A	98.4	Very high	97.2	Very high	21 Å²	21	32.6 Å²	32.6	17%	0.174	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-39.9	-179.6	0	0	0	0	0	112.7	F70 A72 M104 S105 T106 T112	F70-A108 HydrophobicContact CB-CB 3.82Å; F70-A108 HydrophobicContact CD2-CB 3.84Å; F70-A108 HydrophobicContact CG-CB 4Å; A72-A108 HydrophobicContact CB-CB 4.27Å; M104-A108 PolarHBondContact O-N 3.12Å; S105-A108 PolarHBondContact O-N 3.16Å; T106-A108 VanDerWaalsContact C-N 3.31Å; T106-A108 PolarHBondContact O-N 2.83Å; A108-T112 WeakPolarHBondContact O-CB 3.37Å; A108-T112 PolarHBondContact O-N 2.79Å; A108-T112 PolarHBondContact O-OG1 2.82Å
109	Q	97.7	Very high	97.4	Very high	57 Å²	57	34.2 Å²	34.2	27%	0.266	18%	0.182	S	C	.	.	H	α-helix	trans	-69.1	-44.7	177.7	-73.7	-168.8	-6.6	0	0	112.8	S105 T106 C107 V111 T112 K113 Y136 S138	S105-Q109 WeakPolarHBondContact O-CG 3.41Å; S105-Q109 PolarHBondContact O-N 3.25Å; S105-Q109 VanDerWaalsContact O-N 3.08Å; T106-Q109 PolarHBondContact O-N 3.01Å; T106-Q109 VanDerWaalsContact O-N 3.17Å; C107-Q109 VanDerWaalsContact C-N 3.28Å; C107-Q109 PolarHBondContact O-N 3.17Å; Q109-V111 VanDerWaalsContact C-N 3.3Å; Q109-V111 PolarHBondContact O-N 2.99Å; Q109-T112 PolarHBondContact O-N 3.5Å; Q109-K113 WeakPolarHBondContact O-CB 3.46Å; Q109-K113 VanDerWaalsContact O-CG 3.29Å; Q109-K113 WeakPolarHBondContact O-CG 3.25Å; Q109-K113 PolarHBondContact O-N 2.85Å; Q109-Y136 PolarHBondContact OE1-OH 3.06Å; Q109-S138 VanDerWaalsContact OE1-CB 3.25Å
110	L	98.2	Very high	97.5	Very high	25 Å²	25	37 Å²	37	13%	0.131	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-43.2	176.8	-68.6	178.6	0	0	0	110.8	T106 C107 K113 G114 Q115 L124 A127 S128	T106-L110 HydrophobicContact CG2-CD1 4.31Å; T106-L110 HydrophobicContact CG2-CG 4.45Å; T106-L110 WeakPolarHBondContact O-CG 3.42Å; T106-L110 PolarHBondContact O-N 3.43Å; C107-L110 PolarHBondContact O-N 2.95Å; L110-K113 PolarHBondContact O-N 2.85Å; L110-G114 PolarHBondContact O-N 2.84Å; L110-G114 VanDerWaalsContact O-N 3.17Å; L110-Q115 HydrophobicContact CB-CB 4.39Å; L110-Q115 HydrophobicContact CD2-CB 3.91Å; L110-Q115 PolarHBondContact O-N 2.87Å; L110-L124 HydrophobicContact CB-CD1 3.73Å; L110-L124 HydrophobicContact CD1-CD1 3.96Å; L110-L124 HydrophobicContact CG-CD1 4.5Å; L110-A127 HydrophobicContact CD1-CB 3.89Å; L110-S128 WeakPolarHBondContact CD1-OG 3.42Å
111	V	98.4	Very high	97.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-50.3	175.3	172.3	0	0	0	0	111.5	F70 A72 H74 V79 C107 Q109 K113 G114 F116 L124	F70-V111 HydrophobicContact CE2-CG2 4.44Å; A72-V111 HydrophobicContact CB-CB 3.84Å; A72-V111 HydrophobicContact CB-CG1 3.61Å; H74-V111 HydrophobicContact CB-CG1 4.22Å; H74-V111 PolarHBondContact CD2-O 3.38Å; V79-V111 HydrophobicContact CB-CG1 4.04Å; V79-V111 HydrophobicContact CB-CG2 3.9Å; V79-V111 HydrophobicContact CG1-CG2 4.04Å; V79-V111 HydrophobicContact CG2-CB 4.4Å; V79-V111 HydrophobicContact CG2-CG1 3.66Å; V79-V111 HydrophobicContact CG2-CG2 3.77Å; C107-V111 VanDerWaalsContact O-CG2 3.32Å; C107-V111 WeakPolarHBondContact O-CG2 3.49Å; C107-V111 PolarHBondContact O-N 2.83Å; Q109-V111 VanDerWaalsContact C-N 3.3Å; Q109-V111 PolarHBondContact O-N 2.99Å; V111-K113 PolarHBondContact O-N 3.35Å; V111-G114 PolarHBondContact O-N 2.91Å; V111-F116 HydrophobicContact CB-CD1 4.34Å; V111-F116 HydrophobicContact CB-CE1 4.2Å; V111-F116 HydrophobicContact CG1-CE1 3.93Å; V111-F116 HydrophobicContact CG1-CZ 3.94Å; V111-F116 HydrophobicContact CG2-CD1 4.28Å; V111-F116 HydrophobicContact CG2-CD2 4.35Å; V111-F116 HydrophobicContact CG2-CE1 4.4Å; V111-F116 HydrophobicContact CG2-CE2 4.46Å; V111-F116 HydrophobicContact CG2-CG 4.25Å; V111-F116 HydrophobicContact CG2-CZ 4.48Å; V111-F116 WeakPolarHBondContact O-CE1 3.47Å; V111-L124 HydrophobicContact CG2-CD1 4.22Å; V111-L124 HydrophobicContact CG2-CD2 3.54Å
112	T	97.6	Very high	97.6	Very high	93 Å²	93	38.1 Å²	38.1	57%	0.571	20%	0.204	S	C	*	.	H	α-helix	trans	-61.3	-33.1	-178.5	-56.2	0	0	0	0	111.9	A108 Q109 G114	A108-T112 WeakPolarHBondContact O-CB 3.37Å; A108-T112 PolarHBondContact O-N 2.79Å; A108-T112 PolarHBondContact O-OG1 2.82Å; Q109-T112 PolarHBondContact O-N 3.5Å; T112-G114 VanDerWaalsContact C-N 3.33Å
113	K	97.2	Very high	97.8	Very high	122 Å²	122	43 Å²	43	53%	0.53	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-3	177.2	-69.9	173.3	-179.8	171	0	114	Q109 L110 V111 Q115	Q109-K113 WeakPolarHBondContact O-CB 3.46Å; Q109-K113 VanDerWaalsContact O-CG 3.29Å; Q109-K113 WeakPolarHBondContact O-CG 3.25Å; Q109-K113 PolarHBondContact O-N 2.85Å; L110-K113 PolarHBondContact O-N 2.85Å; V111-K113 PolarHBondContact O-N 3.35Å; K113-Q115 HydrophobicContact CB-CG 3.94Å; K113-Q115 PolarHBondContact O-N 2.87Å
114	G	96.3	Very high	97.8	Very high	30 Å²	30	43.2 Å²	43.2	31%	0.309	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	18.1	-174.6	0	0	0	0	0	114	H74 L110 V111 T112 F116	H74-G114 VanDerWaalsContact NE2-CA 3.29Å; H74-G114 WeakPolarHBondContact NE2-CA 3.45Å; L110-G114 PolarHBondContact O-N 2.84Å; L110-G114 VanDerWaalsContact O-N 3.17Å; V111-G114 PolarHBondContact O-N 2.91Å; T112-G114 VanDerWaalsContact C-N 3.33Å; G114-F116 PolarHBondContact O-N 3.12Å; G114-F116 VanDerWaalsContact O-N 3.15Å
115	Q	97.4	Very high	97.8	Very high	119 Å²	119	43.1 Å²	43.1	56%	0.556	23%	0.228	S	C	*	.			trans	-89.4	52.2	-179.4	-66.2	179.9	-24.1	0	0	110.9	L110 K113	L110-Q115 HydrophobicContact CB-CB 4.39Å; L110-Q115 HydrophobicContact CD2-CB 3.91Å; L110-Q115 PolarHBondContact O-N 2.87Å; K113-Q115 HydrophobicContact CB-CG 3.94Å; K113-Q115 PolarHBondContact O-N 2.87Å
116	F	97.9	Very high	97.8	Very high	28 Å²	28	43.2 Å²	43.2	12%	0.123	23%	0.231	C	C	.	.	S	Bend	trans	-159.4	160	-179.8	76.2	-68.1	0	0	0	110.4	H74 A77 V79 V111 G114 P118 L124	H74-F116 HydrophobicContact CB-CE1 3.83Å; H74-F116 HydrophobicContact CB-CZ 3.91Å; H74-F116 AromaticContact CG-CE1 3.84Å; H74-F116 AromaticContact ND1-CE1 3.9Å; A77-F116 HydrophobicContact CB-CE2 3.88Å; A77-F116 HydrophobicContact CB-CZ 3.88Å; V79-F116 HydrophobicContact CG2-CE2 3.79Å; V79-F116 HydrophobicContact CG2-CZ 4.16Å; V111-F116 HydrophobicContact CB-CD1 4.34Å; V111-F116 HydrophobicContact CB-CE1 4.2Å; V111-F116 HydrophobicContact CG1-CE1 3.93Å; V111-F116 HydrophobicContact CG1-CZ 3.94Å; V111-F116 HydrophobicContact CG2-CD1 4.28Å; V111-F116 HydrophobicContact CG2-CD2 4.35Å; V111-F116 HydrophobicContact CG2-CE1 4.4Å; V111-F116 HydrophobicContact CG2-CE2 4.46Å; V111-F116 HydrophobicContact CG2-CG 4.25Å; V111-F116 HydrophobicContact CG2-CZ 4.48Å; V111-F116 WeakPolarHBondContact O-CE1 3.47Å; G114-F116 PolarHBondContact O-N 3.12Å; G114-F116 VanDerWaalsContact O-N 3.15Å; F116-P118 HydrophobicContact CE2-CB 4.42Å; F116-P118 HydrophobicContact CE2-CG 4.01Å; F116-P118 HydrophobicContact CZ-CG 4.47Å; F116-L124 HydrophobicContact CB-CB 4.49Å; F116-L124 HydrophobicContact CB-CD1 4.1Å
117	I	97.2	Very high	97.9	Very high	80 Å²	80	45.3 Å²	45.3	41%	0.41	25%	0.248	S	C	.	.			trans	-109.2	120.2	173.3	-63.9	171.2	0	0	0	107.5	Q119 L120	I117-Q119 HydrophobicContact CG2-CB 4.44Å; I117-Q119 VanDerWaalsContact CG2-OE1 3.28Å; I117-Q119 PolarHBondContact O-N 3.43Å; I117-Q119 VanDerWaalsContact O-N 3.08Å; I117-L120 HydrophobicContact CB-CB 4.25Å; I117-L120 HydrophobicContact CB-CD1 4.17Å; I117-L120 HydrophobicContact CB-CG 4.34Å; I117-L120 HydrophobicContact CD1-CD1 3.99Å; I117-L120 HydrophobicContact CG2-CB 4.35Å; I117-L120 HydrophobicContact CG2-CD1 3.95Å; I117-L120 HydrophobicContact CG2-CG 3.99Å; I117-L120 PolarHBondContact O-N 2.94Å
118	P	96.4	Very high	97.9	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.084	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.9	-175.1	-29.5	35.7	0	0	0	115	A77 F116 L120 V159 D161 Y168	A77-P118 HydrophobicContact CB-CB 4Å; A77-P118 HydrophobicContact CB-CG 3.97Å; F116-P118 HydrophobicContact CE2-CB 4.42Å; F116-P118 HydrophobicContact CE2-CG 4.01Å; F116-P118 HydrophobicContact CZ-CG 4.47Å; P118-L120 VanDerWaalsContact C-N 3.29Å; P118-L120 PolarHBondContact O-N 3.3Å; P118-V159 HydrophobicContact CB-CG1 3.94Å; P118-V159 VanDerWaalsContact O-CG1 3.26Å; P118-V159 WeakPolarHBondContact O-CG1 3.47Å; P118-D161 HydrophobicContact CB-CB 4.25Å; P118-Y168 WeakPolarHBondContact O-CD2 3.43Å
119	Q	97.4	Very high	97.8	Very high	72 Å²	72	45.9 Å²	45.9	34%	0.336	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-7.8	-177.9	-58.5	77.1	18.8	0	0	113.5	I117 P121 D161 Y168	I117-Q119 HydrophobicContact CG2-CB 4.44Å; I117-Q119 VanDerWaalsContact CG2-OE1 3.28Å; I117-Q119 PolarHBondContact O-N 3.43Å; I117-Q119 VanDerWaalsContact O-N 3.08Å; Q119-P121 VanDerWaalsContact C-CD 3.46Å; Q119-P121 WeakPolarHBondContact O-CD 3.4Å; Q119-D161 PolarHBondContact NE2-OD2 3.49Å; Q119-Y168 HydrophobicContact CB-CD1 4.27Å; Q119-Y168 HydrophobicContact CB-CE1 3.93Å; Q119-Y168 HydrophobicContact CB-CE2 4.26Å; Q119-Y168 HydrophobicContact CG-CD2 4.48Å; Q119-Y168 HydrophobicContact CG-CE1 4.05Å; Q119-Y168 HydrophobicContact CG-CE2 3.76Å
120	L	97.9	Very high	97.8	Very high	59 Å²	59	46.3 Å²	46.3	31%	0.309	25%	0.248	S	C	.	.			trans	-127.1	66.7	-172.9	-56.3	175.3	0	0	0	111.3	I117 P118 D122 E123 L124	I117-L120 HydrophobicContact CB-CB 4.25Å; I117-L120 HydrophobicContact CB-CD1 4.17Å; I117-L120 HydrophobicContact CB-CG 4.34Å; I117-L120 HydrophobicContact CD1-CD1 3.99Å; I117-L120 HydrophobicContact CG2-CB 4.35Å; I117-L120 HydrophobicContact CG2-CD1 3.95Å; I117-L120 HydrophobicContact CG2-CG 3.99Å; I117-L120 PolarHBondContact O-N 2.94Å; P118-L120 VanDerWaalsContact C-N 3.29Å; P118-L120 PolarHBondContact O-N 3.3Å; L120-D122 PolarHBondContact O-N 3.11Å; L120-E123 HydrophobicContact CB-CB 4.01Å; L120-E123 HydrophobicContact CB-CG 3.94Å; L120-E123 VanDerWaalsContact CD1-CD 3.45Å; L120-E123 HydrophobicContact CD1-CG 4.31Å; L120-E123 WeakPolarHBondContact CD1-OE2 3.33Å; L120-E123 PolarHBondContact O-N 2.96Å; L120-E123 VanDerWaalsContact O-N 3.16Å; L120-L124 PolarHBondContact O-N 3.17Å
121	P	98.4	Very high	97.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-25.7	179.6	24.8	-33.5	0	0	0	113.9	Q119 L124 M125 I157 V159 A170	Q119-P121 VanDerWaalsContact C-CD 3.46Å; Q119-P121 WeakPolarHBondContact O-CD 3.4Å; P121-L124 PolarHBondContact O-N 3.4Å; P121-M125 PolarHBondContact O-N 3.44Å; P121-I157 HydrophobicContact CB-CB 4.46Å; P121-I157 HydrophobicContact CB-CG2 4.13Å; P121-V159 HydrophobicContact CB-CG2 3.94Å; P121-A170 HydrophobicContact CB-CB 3.93Å; P121-A170 HydrophobicContact CG-CB 3.92Å
122	D	98.2	Very high	97.5	Very high	45 Å²	45	46.3 Å²	46.3	24%	0.241	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-37.1	172.3	57.6	-45.2	0	0	0	112.3	L120 L124 M125 A126 A170 V223	L120-D122 PolarHBondContact O-N 3.11Å; D122-L124 VanDerWaalsContact C-N 3.35Å; D122-M125 WeakPolarHBondContact O-CB 3.49Å; D122-M125 PolarHBondContact O-N 3.19Å; D122-A126 WeakPolarHBondContact O-CB 3.34Å; D122-A126 PolarHBondContact O-N 3.34Å; D122-A170 HydrophobicContact CB-CB 4.04Å; D122-V223 HydrophobicContact CB-CG2 3.7Å
123	E	98.4	Very high	97.2	Very high	102 Å²	102	48.9 Å²	48.9	48%	0.477	25%	0.251	S	S	.	.	H	α-helix	trans	-66.7	-36.2	172.1	-70.6	-169.7	173.1	0	0	112.1	L120 M125 A126 A127	L120-E123 HydrophobicContact CB-CB 4.01Å; L120-E123 HydrophobicContact CB-CG 3.94Å; L120-E123 VanDerWaalsContact CD1-CD 3.45Å; L120-E123 HydrophobicContact CD1-CG 4.31Å; L120-E123 WeakPolarHBondContact CD1-OE2 3.33Å; L120-E123 PolarHBondContact O-N 2.96Å; L120-E123 VanDerWaalsContact O-N 3.16Å; E123-M125 VanDerWaalsContact C-N 3.34Å; E123-A126 PolarHBondContact O-N 3.03Å; E123-A127 VanDerWaalsContact O-CB 3.27Å; E123-A127 WeakPolarHBondContact O-CB 3.35Å; E123-A127 PolarHBondContact O-N 3.4Å
124	L	98.7	Very high	97	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-42	172	173.8	61	0	0	0	111.3	V79 L110 V111 F116 L120 P121 D122 S128 I157	V79-L124 HydrophobicContact CG1-CD2 4.03Å; L110-L124 HydrophobicContact CB-CD1 3.73Å; L110-L124 HydrophobicContact CD1-CD1 3.96Å; L110-L124 HydrophobicContact CG-CD1 4.5Å; V111-L124 HydrophobicContact CG2-CD1 4.22Å; V111-L124 HydrophobicContact CG2-CD2 3.54Å; F116-L124 HydrophobicContact CB-CB 4.49Å; F116-L124 HydrophobicContact CB-CD1 4.1Å; L120-L124 PolarHBondContact O-N 3.17Å; P121-L124 PolarHBondContact O-N 3.4Å; D122-L124 VanDerWaalsContact C-N 3.35Å; L124-S128 WeakPolarHBondContact O-CB 3.15Å; L124-S128 PolarHBondContact O-N 3.38Å; L124-S128 VanDerWaalsContact O-N 3.09Å; L124-S128 PolarHBondContact O-OG 3.47Å; L124-I157 HydrophobicContact CD2-CD1 4.41Å; L124-I157 HydrophobicContact CD2-CG2 4.22Å; L124-I157 HydrophobicContact CG-CD1 4.31Å
125	M	98.6	Very high	96.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-47.7	173.9	-172.5	-174.6	-62.8	0	0	110.9	P121 D122 E123 S128 Y129 A155 I157 A170 L172 L202 A221	P121-M125 PolarHBondContact O-N 3.44Å; D122-M125 WeakPolarHBondContact O-CB 3.49Å; D122-M125 PolarHBondContact O-N 3.19Å; E123-M125 VanDerWaalsContact C-N 3.34Å; M125-S128 PolarHBondContact O-N 3.36Å; M125-Y129 WeakPolarHBondContact O-CB 3.43Å; M125-Y129 PolarHBondContact O-N 2.92Å; M125-A155 HydrophobicContact CE-CB 3.61Å; M125-A155 VanDerWaalsContact CE-O 3.32Å; M125-A155 WeakPolarHBondContact CE-O 3.5Å; M125-A155 HydrophobicContact CG-CB 4.17Å; M125-A155 HydrophobicContact SD-CB 3.81Å; M125-I157 HydrophobicContact CB-CD1 3.93Å; M125-I157 HydrophobicContact CE-CD1 4.48Å; M125-I157 HydrophobicContact CE-CG1 4.47Å; M125-A170 HydrophobicContact CE-CB 4.04Å; M125-L172 HydrophobicContact CE-CB 4.32Å; M125-L172 HydrophobicContact SD-CB 4.07Å; M125-L202 HydrophobicContact CG-CD1 4.08Å; M125-L202 HydrophobicContact SD-CD1 4.4Å; M125-A221 HydrophobicContact CE-CB 4.38Å; M125-A221 HydrophobicContact SD-CB 4.34Å
126	A	98.5	Very high	96.2	Very high	36 Å²	36	48.4 Å²	48.4	30%	0.298	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-44.9	-179.2	0	0	0	0	0	112.9	D122 E123 S128 Y129 Q130 P218	D122-A126 WeakPolarHBondContact O-CB 3.34Å; D122-A126 PolarHBondContact O-N 3.34Å; E123-A126 PolarHBondContact O-N 3.03Å; A126-S128 VanDerWaalsContact C-N 3.31Å; A126-S128 PolarHBondContact O-N 3.35Å; A126-Y129 PolarHBondContact O-N 3.31Å; A126-Q130 VanDerWaalsContact O-CB 3.31Å; A126-Q130 WeakPolarHBondContact O-CB 3.12Å; A126-Q130 PolarHBondContact O-N 3.1Å; A126-P218 HydrophobicContact CB-CB 3.67Å; A126-P218 HydrophobicContact CB-CG 3.84Å
127	A	98.4	Very high	95.4	Very high	46 Å²	46	48.9 Å²	48.9	38%	0.38	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-40.5	176.8	0	0	0	0	0	111.5	L110 E123 Q130 A131	L110-A127 HydrophobicContact CD1-CB 3.89Å; E123-A127 VanDerWaalsContact O-CB 3.27Å; E123-A127 WeakPolarHBondContact O-CB 3.35Å; E123-A127 PolarHBondContact O-N 3.4Å; A127-Q130 PolarHBondContact O-N 2.92Å; A127-A131 WeakPolarHBondContact O-CB 3.48Å; A127-A131 PolarHBondContact O-N 2.79Å
128	S	98.2	Very high	94.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.6	-46.4	176.9	-57.9	0	0	0	0	111.6	C107 L110 L124 M125 A126 Q130 A131 L132	C107-S128 WeakPolarHBondContact CA-OG 3.4Å; C107-S128 PolarHBondContact N-OG 3.38Å; C107-S128 PolarHBondContact SG-OG 2.97Å; L110-S128 WeakPolarHBondContact CD1-OG 3.42Å; L124-S128 WeakPolarHBondContact O-CB 3.15Å; L124-S128 PolarHBondContact O-N 3.38Å; L124-S128 VanDerWaalsContact O-N 3.09Å; L124-S128 PolarHBondContact O-OG 3.47Å; M125-S128 PolarHBondContact O-N 3.36Å; A126-S128 VanDerWaalsContact C-N 3.31Å; A126-S128 PolarHBondContact O-N 3.35Å; S128-Q130 VanDerWaalsContact C-N 3.33Å; S128-Q130 PolarHBondContact O-N 3.48Å; S128-A131 WeakPolarHBondContact O-CB 3.46Å; S128-A131 PolarHBondContact O-N 3.13Å; S128-L132 VanDerWaalsContact O-CD1 3.25Å; S128-L132 WeakPolarHBondContact O-CD1 3.36Å; S128-L132 PolarHBondContact O-N 2.75Å; S128-L132 VanDerWaalsContact O-N 3.11Å
129	Y	97.5	Very high	93.6	Very high	33 Å²	33	46 Å²	46	13%	0.129	25%	0.246	C	C	.	.	H	α-helix	trans	-59.9	-42.1	174.8	178	-117.9	0	0	0	112.3	F99 M125 A126 A131 L132 R133 L202 T203 L204 P218	F99-Y129 HydrophobicContact CE2-CE2 4.39Å; F99-Y129 HydrophobicContact CZ-CD2 4.01Å; F99-Y129 HydrophobicContact CZ-CE2 4.04Å; M125-Y129 WeakPolarHBondContact O-CB 3.43Å; M125-Y129 PolarHBondContact O-N 2.92Å; A126-Y129 PolarHBondContact O-N 3.31Å; Y129-A131 VanDerWaalsContact C-N 3.34Å; Y129-A131 PolarHBondContact O-N 2.65Å; Y129-L132 WeakPolarHBondContact O-CB 3.39Å; Y129-L132 PolarHBondContact O-N 3.15Å; Y129-R133 PolarHBondContact O-N 2.76Å; Y129-L202 HydrophobicContact CD1-CD2 4.45Å; Y129-L202 HydrophobicContact CD2-CB 3.96Å; Y129-L202 HydrophobicContact CD2-CD1 4.06Å; Y129-L202 HydrophobicContact CD2-CD2 4.39Å; Y129-L202 HydrophobicContact CD2-CG 4.37Å; Y129-L202 HydrophobicContact CE2-CB 4Å; Y129-L202 HydrophobicContact CG-CD1 4.16Å; Y129-L202 HydrophobicContact CG-CD2 4.29Å; Y129-T203 PolarHBondContact OH-O 3.01Å; Y129-L204 HydrophobicContact CE2-CD2 3.92Å; Y129-L204 HydrophobicContact CE2-CG 3.84Å; Y129-P218 HydrophobicContact CD1-CG 3.88Å; Y129-P218 HydrophobicContact CG-CG 4.39Å
130	Q	96.4	Very high	92.3	Very high	65 Å²	65	51.6 Å²	51.6	30%	0.304	27%	0.272	S	S	.	.	H	α-helix	trans	-63.7	-38.8	176.6	-176.1	59	32.2	0	0	112.3	A126 A127 S128 R133 N134	A126-Q130 VanDerWaalsContact O-CB 3.31Å; A126-Q130 WeakPolarHBondContact O-CB 3.12Å; A126-Q130 PolarHBondContact O-N 3.1Å; A127-Q130 PolarHBondContact O-N 2.92Å; S128-Q130 VanDerWaalsContact C-N 3.33Å; S128-Q130 PolarHBondContact O-N 3.48Å; Q130-R133 WeakPolarHBondContact O-CB 3.45Å; Q130-R133 PolarHBondContact O-N 3.19Å; Q130-N134 PolarHBondContact NE2-OD1 3.49Å; Q130-N134 VanDerWaalsContact O-CG 3.29Å; Q130-N134 PolarHBondContact O-N 2.75Å
131	A	95.8	Very high	91	Very high	23 Å²	23	52.2 Å²	52.2	19%	0.19	28%	0.281	C	S	.	.	H	α-helix	trans	-61.6	-47.3	175.4	0	0	0	0	0	110.8	T106 A127 S128 Y129 R133 N134 G135 Y136	T106-A131 HydrophobicContact CG2-CB 3.93Å; A127-A131 WeakPolarHBondContact O-CB 3.48Å; A127-A131 PolarHBondContact O-N 2.79Å; S128-A131 WeakPolarHBondContact O-CB 3.46Å; S128-A131 PolarHBondContact O-N 3.13Å; Y129-A131 VanDerWaalsContact C-N 3.34Å; Y129-A131 PolarHBondContact O-N 2.65Å; A131-R133 VanDerWaalsContact C-N 3.31Å; A131-R133 PolarHBondContact O-N 3.35Å; A131-N134 CarbonylContact O-C 3.5Å; A131-N134 PolarHBondContact O-N 2.71Å; A131-N134 VanDerWaalsContact O-N 3.1Å; A131-G135 PolarHBondContact O-N 2.79Å; A131-Y136 HydrophobicContact CB-CD1 4Å; A131-Y136 HydrophobicContact CB-CG 4.28Å; A131-Y136 WeakPolarHBondContact O-CB 3.43Å; A131-Y136 PolarHBondContact O-N 3.33Å
132	L	94.9	Very high	89.4	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-57.6	-44.1	174.7	-89.7	63.1	0	0	0	111.6	F99 L103 T106 S128 Y129 N134 G135 I149 L204	F99-L132 HydrophobicContact CD2-CD2 4.4Å; F99-L132 HydrophobicContact CE2-CD2 4.27Å; F99-L132 HydrophobicContact CZ-CD2 4.43Å; L103-L132 HydrophobicContact CB-CD2 4.06Å; L103-L132 HydrophobicContact CD1-CD2 4.45Å; T106-L132 HydrophobicContact CG2-CD1 4.45Å; T106-L132 WeakPolarHBondContact OG1-CD1 3.36Å; S128-L132 VanDerWaalsContact O-CD1 3.25Å; S128-L132 WeakPolarHBondContact O-CD1 3.36Å; S128-L132 PolarHBondContact O-N 2.75Å; S128-L132 VanDerWaalsContact O-N 3.11Å; Y129-L132 WeakPolarHBondContact O-CB 3.39Å; Y129-L132 PolarHBondContact O-N 3.15Å; L132-N134 PolarHBondContact O-N 3.42Å; L132-G135 WeakPolarHBondContact O-CA 3.26Å; L132-G135 PolarHBondContact O-N 2.88Å; L132-I149 HydrophobicContact CB-CD1 4.39Å; L132-I149 HydrophobicContact CD2-CD1 4.48Å; L132-I149 HydrophobicContact CD2-CG2 4.24Å; L132-I149 HydrophobicContact CG-CD1 3.79Å; L132-L204 HydrophobicContact CB-CD1 3.69Å
133	R	92.5	Very high	87.5	Confident	148 Å²	148	55.8 Å²	55.8	56%	0.558	31%	0.31	S	S	*	.	H	α-helix	trans	-59.7	-34.5	177.1	-171.5	160.3	70.3	155.8	0.8	112.5	Y129 Q130 A131 G135 L204	Y129-R133 PolarHBondContact O-N 2.76Å; Q130-R133 WeakPolarHBondContact O-CB 3.45Å; Q130-R133 PolarHBondContact O-N 3.19Å; A131-R133 VanDerWaalsContact C-N 3.31Å; A131-R133 PolarHBondContact O-N 3.35Å; R133-G135 PolarHBondContact O-N 2.81Å; R133-L204 HydrophobicContact CB-CD1 4.49Å; R133-L204 HydrophobicContact CB-CD2 3.8Å; R133-L204 HydrophobicContact CG-CD2 3.83Å
134	N	92.2	Very high	85.3	Confident	119 Å²	119	62.3 Å²	62.3	64%	0.636	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	7.5	175.3	-67.7	-11.8	0	0	0	113.3	Q130 A131 L132	Q130-N134 PolarHBondContact NE2-OD1 3.49Å; Q130-N134 VanDerWaalsContact O-CG 3.29Å; Q130-N134 PolarHBondContact O-N 2.75Å; A131-N134 CarbonylContact O-C 3.5Å; A131-N134 PolarHBondContact O-N 2.71Å; A131-N134 VanDerWaalsContact O-N 3.1Å; L132-N134 PolarHBondContact O-N 3.42Å
135	G	88.7	Confident	83.2	Confident	42 Å²	42	66.6 Å²	66.6	43%	0.433	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	8	179.4	0	0	0	0	0	114.6	A131 L132 R133	A131-G135 PolarHBondContact O-N 2.79Å; L132-G135 WeakPolarHBondContact O-CA 3.26Å; L132-G135 PolarHBondContact O-N 2.88Å; R133-G135 PolarHBondContact O-N 2.81Å
136	Y	87.4	Confident	81.1	Confident	99 Å²	99	74.6 Å²	74.6	39%	0.388	40%	0.397	S	S	.	.			trans	-72.1	130.2	175.5	-171.8	-104.9	0	0	0	110.8	T106 Q109 A131 I149	T106-Y136 HydrophobicContact CG2-CD1 4.24Å; T106-Y136 HydrophobicContact CG2-CE1 4.36Å; Q109-Y136 PolarHBondContact OE1-OH 3.06Å; A131-Y136 HydrophobicContact CB-CD1 4Å; A131-Y136 HydrophobicContact CB-CG 4.28Å; A131-Y136 WeakPolarHBondContact O-CB 3.43Å; A131-Y136 PolarHBondContact O-N 3.33Å; Y136-I149 WeakPolarHBondContact O-CD1 3.44Å
137	C	82.5	Confident	79.7	Confident	38 Å²	38	77.4 Å²	77.4	26%	0.257	41%	0.411	S	S	.	.			trans	-135.5	117.6	173.5	-169.6	0	0	0	0	109.7	S102 I149	S102-C137 PolarHBondContact OG-SG 2.97Å; C137-I149 HydrophobicContact CB-CD1 3.79Å
138	S	79.7	Confident	79	Confident	12 Å²	12	77.8 Å²	77.8	8%	0.084	41%	0.414	C	S	.	.			trans	-91.9	-9.7	174.2	54.7	0	0	0	0	113.9	S105 T106 Q109 Q140	S105-S138 WeakPolarHBondContact CB-OG 3.37Å; S105-S138 WeakPolarHBondContact OG-CB 3.21Å; S105-S138 PolarHBondContact OG-O 2.77Å; S105-S138 PolarHBondContact OG-OG 3.09Å; T106-S138 PolarHBondContact N-OG 3.03Å; T106-S138 VanDerWaalsContact N-OG 3.15Å; T106-S138 PolarHBondContact OG1-OG 2.79Å; Q109-S138 VanDerWaalsContact OE1-CB 3.25Å; S138-Q140 PolarHBondContact O-N 3Å
139	D	76.3	Confident	78.6	Confident	21 Å²	21	78.1 Å²	78.1	11%	0.112	42%	0.416	C	S	.	.			trans	-69.7	109.8	-179.2	172	36.9	0	0	0	111.1	R101 S141 S142	R101-D139 IonicContact CZ-OD2 3.1Å; R101-D139 IonicContact NH1-OD1 2.63Å; R101-D139 PolarHBondContact NH1-OD1 2.83Å; R101-D139 IonicContact NH1-OD2 3.54Å; R101-D139 PolarHBondContact NH1-OD2 2.75Å; R101-D139 IonicContact NH2-OD2 3.37Å; D139-S141 PolarHBondContact O-N 2.79Å; D139-S141 WeakPolarHBondContact OD1-CB 3.33Å; D139-S141 PolarHBondContact OD1-N 2.88Å; D139-S142 WeakPolarHBondContact O-CB 3.29Å; D139-S142 PolarHBondContact O-N 3.05Å; D139-S142 PolarHBondContact OD2-N 2.85Å; D139-S142 PolarHBondContact OD2-OG 2.92Å
140	Q	69.8	Low	78.4	Confident	190 Å²	190	79.2 Å²	79.2	89%	0.888	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-14.2	-179.6	-60.9	-148	45.4	0	0	113.7	S138 S142	S138-Q140 PolarHBondContact O-N 3Å; Q140-S142 VanDerWaalsContact C-N 3.28Å
141	S	69.8	Low	78.3	Confident	72 Å²	72	76.1 Å²	76.1	50%	0.503	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.4	175.3	-64.4	0	0	0	0	112.7	D139 S143	D139-S141 PolarHBondContact O-N 2.79Å; D139-S141 WeakPolarHBondContact OD1-CB 3.33Å; D139-S141 PolarHBondContact OD1-N 2.88Å; S141-S143 PolarHBondContact O-N 2.77Å
142	S	64.2	Low	78.4	Confident	27 Å²	27	75.1 Å²	75.1	19%	0.189	40%	0.398	C	S	.	.	S	Bend	trans	-73.1	123.8	172.2	-72.5	0	0	0	0	110.4	D139 Q140 R144	D139-S142 WeakPolarHBondContact O-CB 3.29Å; D139-S142 PolarHBondContact O-N 3.05Å; D139-S142 PolarHBondContact OD2-N 2.85Å; D139-S142 PolarHBondContact OD2-OG 2.92Å; Q140-S142 VanDerWaalsContact C-N 3.28Å; S142-R144 PolarHBondContact O-N 3.49Å
143	S	59.2	Low	78.5	Confident	92 Å²	92	75 Å²	75	64%	0.643	40%	0.398	S	S	*	.			trans	-52.5	139.3	174.8	-177.5	0	0	0	0	111	S141 S145	S141-S143 PolarHBondContact O-N 2.77Å; S143-S145 PolarHBondContact O-N 2.89Å
144	R	52	Low	78.8	Confident	240 Å²	240	68 Å²	68	91%	0.906	37%	0.371	S	S	*	.	S	Bend	trans	-60.2	-8.1	-174	-166.5	134.6	81.5	164.1	4.3	114.6	S142 Q146	S142-R144 PolarHBondContact O-N 3.49Å; R144-Q146 VanDerWaalsContact C-N 3.32Å; R144-Q146 PolarHBondContact O-N 3.29Å
145	S	54.1	Low	79.1	Confident	93 Å²	93	62.3 Å²	62.3	65%	0.65	34%	0.341	S	S	*	.	S	Bend	trans	-76.4	82	170.7	-48.1	0	0	0	0	109	S143 T147	S143-S145 PolarHBondContact O-N 2.89Å; S145-T147 PolarHBondContact O-N 2.85Å
146	Q	54.8	Low	79.6	Confident	168 Å²	168	60.3 Å²	60.3	79%	0.785	32%	0.32	S	S	*	.			trans	-60.7	90.6	-176.4	-77.7	179.1	1.1	0	0	112.2	R144	R144-Q146 VanDerWaalsContact C-N 3.32Å; R144-Q146 PolarHBondContact O-N 3.29Å
147	T	68.4	Low	80.2	Confident	96 Å²	96	55.6 Å²	55.6	59%	0.589	30%	0.302	S	S	*	.			trans	-76.8	143.2	153.7	53.2	0	0	0	0	108.2	R98 S145	R98-T147 PolarHBondContact NH1-O 2.89Å; R98-T147 PolarHBondContact NH1-OG1 2.98Å; R98-T147 PolarHBondContact NH2-O 2.97Å; S145-T147 PolarHBondContact O-N 2.85Å
148	A	84.7	Confident	81	Confident	53 Å²	53	53.8 Å²	53.8	44%	0.438	29%	0.29	S	S	.	.			trans	-50.8	147.9	173.2	0	0	0	0	0	111.1	R98 F150	R98-A148 PolarHBondContact NH1-O 2.91Å; A148-F150 HydrophobicContact CB-CD2 4.47Å; A148-F150 HydrophobicContact CB-CE1 3.95Å; A148-F150 HydrophobicContact CB-CE2 3.79Å; A148-F150 HydrophobicContact CB-CZ 3.5Å; A148-F150 VanDerWaalsContact CB-CZ 3.5Å; A148-F150 PolarHBondContact O-N 2.9Å
149	I	90.6	Very high	81.9	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.041	29%	0.286	C	S	.	.			trans	-76.7	113.3	176	-61.2	169.6	0	0	0	107.4	F99 L132 Y136 C137 L204	F99-I149 HydrophobicContact CB-CG2 4.43Å; F99-I149 HydrophobicContact CD2-CG2 3.99Å; L132-I149 HydrophobicContact CB-CD1 4.39Å; L132-I149 HydrophobicContact CD2-CD1 4.48Å; L132-I149 HydrophobicContact CD2-CG2 4.24Å; L132-I149 HydrophobicContact CG-CD1 3.79Å; Y136-I149 WeakPolarHBondContact O-CD1 3.44Å; C137-I149 HydrophobicContact CB-CD1 3.79Å; I149-L204 WeakPolarHBondContact O-CB 3.49Å
150	F	92.3	Very high	82.9	Confident	56 Å²	56	52.2 Å²	52.2	25%	0.246	28%	0.281	C	S	.	.			trans	-117.8	154	170.3	-57.8	-54.1	0	0	0	108.9	I94 A148 L204 M205 P206	I94-F150 HydrophobicContact CD1-CB 3.75Å; I94-F150 HydrophobicContact CD1-CG 4.48Å; I94-F150 HydrophobicContact CG1-CB 4.4Å; I94-F150 HydrophobicContact CG2-CB 4.32Å; I94-F150 WeakPolarHBondContact CG2-O 3.33Å; A148-F150 HydrophobicContact CB-CD2 4.47Å; A148-F150 HydrophobicContact CB-CE1 3.95Å; A148-F150 HydrophobicContact CB-CE2 3.79Å; A148-F150 HydrophobicContact CB-CZ 3.5Å; A148-F150 VanDerWaalsContact CB-CZ 3.5Å; A148-F150 PolarHBondContact O-N 2.9Å; F150-L204 VanDerWaalsContact CA-O 3.31Å; F150-L204 WeakPolarHBondContact CA-O 3.3Å; F150-M205 VanDerWaalsContact CD1-C 3.47Å; F150-M205 VanDerWaalsContact CE1-C 3.5Å; F150-P206 HydrophobicContact CD1-CB 4.27Å; F150-P206 VanDerWaalsContact CD1-CD 3.45Å; F150-P206 HydrophobicContact CD1-CG 3.83Å; F150-P206 HydrophobicContact CD2-CB 4.41Å; F150-P206 HydrophobicContact CD2-CG 3.74Å; F150-P206 VanDerWaalsContact CE1-CA 3.48Å; F150-P206 HydrophobicContact CE1-CB 3.74Å; F150-P206 HydrophobicContact CE1-CG 3.81Å; F150-P206 VanDerWaalsContact CE1-N 3.28Å; F150-P206 HydrophobicContact CE2-CB 3.88Å; F150-P206 HydrophobicContact CE2-CG 3.71Å; F150-P206 HydrophobicContact CG-CG 3.79Å; F150-P206 HydrophobicContact CZ-CB 3.5Å; F150-P206 HydrophobicContact CZ-CG 3.74Å
151	G	95	Very high	84.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.5	-171.8	-176.6	0	0	0	0	0	111.6	W89 F99 L204	W89-G151 VanDerWaalsContact CE2-CA 3.44Å; W89-G151 VanDerWaalsContact NE1-C 3.28Å; F99-G151 WeakPolarHBondContact CD2-O 3.22Å; G151-L204 PolarHBondContact N-O 2.82Å; G151-L204 PolarHBondContact O-N 3.28Å
152	S	96.7	Very high	85.1	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.2	175.9	-50	0	0	0	0	110.2	G85 V86 W89 L202 T203	G85-S152 WeakPolarHBondContact CA-O 3.32Å; V86-S152 PolarHBondContact N-O 3.01Å; W89-S152 WeakPolarHBondContact CZ2-OG 3.43Å; W89-S152 VanDerWaalsContact NE1-N 3.1Å; W89-S152 PolarHBondContact NE1-OG 2.83Å; S152-L202 CarbonylContact C-O 3.51Å; S152-L202 WeakPolarHBondContact CA-O 3.26Å; S152-L202 WeakPolarHBondContact CB-O 3.33Å; S152-T203 WeakPolarHBondContact CB-OG1 3.02Å; S152-T203 WeakPolarHBondContact OG-CB 3.44Å; S152-T203 VanDerWaalsContact OG-CG2 3.26Å; S152-T203 WeakPolarHBondContact OG-CG2 3.14Å; S152-T203 PolarHBondContact OG-OG1 3.28Å
153	S	98.4	Very high	86	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	158.4	170.7	73.5	0	0	0	0	112	D84 F99 Q201 L202	D84-S153 CarbonylContact O-C 3.21Å; D84-S153 WeakPolarHBondContact O-CA 3.42Å; D84-S153 WeakPolarHBondContact O-CB 3.32Å; F99-S153 VanDerWaalsContact CD1-OG 3.3Å; F99-S153 WeakPolarHBondContact CD1-OG 3.42Å; F99-S153 WeakPolarHBondContact CE1-OG 3.48Å; S153-Q201 WeakPolarHBondContact O-CA 3.34Å; S153-L202 PolarHBondContact N-O 3.1Å; S153-L202 VanDerWaalsContact N-O 3.09Å; S153-L202 PolarHBondContact O-N 2.89Å
154	T	98.7	Very high	87.3	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.			trans	-64.9	170.4	156.8	66.7	0	0	0	0	109.9	A83 D84 L172 S175 P199	A83-T154 WeakPolarHBondContact CB-O 3.33Å; D84-T154 PolarHBondContact N-OG1 3.04Å; D84-T154 PolarHBondContact O-N 3.09Å; T154-L172 WeakPolarHBondContact CA-O 3.16Å; T154-L172 WeakPolarHBondContact CB-O 3.16Å; T154-S175 PolarHBondContact OG1-OG 2.95Å; T154-P199 HydrophobicContact CG2-CB 4.02Å; T154-P199 HydrophobicContact CG2-CG 4.1Å
155	A	98.9	Very high	89	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	122	170.7	0	0	0	0	0	110.9	L103 M125 L172 L202	L103-A155 HydrophobicContact CD2-CB 3.95Å; M125-A155 HydrophobicContact CE-CB 3.61Å; M125-A155 VanDerWaalsContact CE-O 3.32Å; M125-A155 WeakPolarHBondContact CE-O 3.5Å; M125-A155 HydrophobicContact CG-CB 4.17Å; M125-A155 HydrophobicContact SD-CB 3.81Å; A155-L172 PolarHBondContact N-O 2.85Å; A155-L172 PolarHBondContact O-N 3.48Å; A155-L202 HydrophobicContact CB-CD1 4.45Å
156	C	98.9	Very high	91	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	117.4	171.6	-172.6	0	0	0	0	109.6	G81 V82 A170 N171 L236	G81-C156 CarbonylContact C-O 3.5Å; G81-C156 WeakPolarHBondContact CA-O 3.2Å; V82-C156 HydrophobicContact CG2-CB 3.97Å; V82-C156 PolarHBondContact N-O 2.66Å; V82-C156 PolarHBondContact O-N 2.94Å; C156-A170 WeakPolarHBondContact CA-O 3.18Å; C156-N171 WeakPolarHBondContact CB-OD1 3.32Å; C156-N171 PolarHBondContact SG-OD1 3.31Å; C156-L236 HydrophobicContact CB-CD1 3.82Å; C156-L236 WeakPolarHBondContact SG-CD1 3.32Å
157	I	98.9	Very high	93	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.9	-179.8	-59.7	179	0	0	0	109.1	F70 V79 L80 P121 L124 M125 V159 A169 A170	F70-I157 HydrophobicContact CE1-CG1 4.47Å; F70-I157 HydrophobicContact CZ-CG2 4.43Å; V79-I157 HydrophobicContact CG1-CG2 3.79Å; L80-I157 WeakPolarHBondContact O-CA 3.18Å; P121-I157 HydrophobicContact CB-CB 4.46Å; P121-I157 HydrophobicContact CB-CG2 4.13Å; L124-I157 HydrophobicContact CD2-CD1 4.41Å; L124-I157 HydrophobicContact CD2-CG2 4.22Å; L124-I157 HydrophobicContact CG-CD1 4.31Å; M125-I157 HydrophobicContact CB-CD1 3.93Å; M125-I157 HydrophobicContact CE-CD1 4.48Å; M125-I157 HydrophobicContact CE-CG1 4.47Å; I157-V159 HydrophobicContact CG2-CG2 4.23Å; I157-A169 CarbonylContact O-C 3.58Å; I157-A169 VanDerWaalsContact O-CA 3.22Å; I157-A169 WeakPolarHBondContact O-CA 3.49Å; I157-A170 PolarHBondContact N-O 2.83Å; I157-A170 PolarHBondContact O-N 3.36Å
158	V	98.8	Very high	94.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129	174.5	175.9	0	0	0	0	109.6	F43 V79 L80 L167 Y168 A169 F177 I234 L236	F43-V158 HydrophobicContact CZ-CG1 4.47Å; V79-V158 WeakPolarHBondContact CA-O 3.49Å; L80-V158 PolarHBondContact N-O 2.97Å; L80-V158 PolarHBondContact O-N 3.46Å; V158-L167 HydrophobicContact CG1-CD1 3.67Å; V158-L167 HydrophobicContact CG1-CD2 3.65Å; V158-L167 HydrophobicContact CG1-CG 3.63Å; V158-Y168 CarbonylContact C-O 3.53Å; V158-Y168 WeakPolarHBondContact CA-O 3.47Å; V158-A169 HydrophobicContact CG2-CB 4.05Å; V158-F177 HydrophobicContact CG2-CB 4.12Å; V158-F177 HydrophobicContact CG2-CD1 4.12Å; V158-F177 HydrophobicContact CG2-CG 4.09Å; V158-I234 HydrophobicContact CG1-CG2 4.42Å; V158-L236 HydrophobicContact CG2-CD1 4.18Å; V158-L236 HydrophobicContact CG2-CD2 4.43Å
159	V	98.6	Very high	95.1	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.006	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.6	-179.4	-179.4	0	0	0	0	109.2	A77 V79 P118 P121 I157 L167 Y168	A77-V159 HydrophobicContact CB-CG1 3.79Å; V79-V159 HydrophobicContact CB-CG2 4.46Å; V79-V159 HydrophobicContact CG1-CG2 3.79Å; V79-V159 HydrophobicContact CG2-CB 4.46Å; V79-V159 HydrophobicContact CG2-CG1 4.09Å; V79-V159 HydrophobicContact CG2-CG2 4.03Å; P118-V159 HydrophobicContact CB-CG1 3.94Å; P118-V159 VanDerWaalsContact O-CG1 3.26Å; P118-V159 WeakPolarHBondContact O-CG1 3.47Å; P121-V159 HydrophobicContact CB-CG2 3.94Å; I157-V159 HydrophobicContact CG2-CG2 4.23Å; V159-L167 CarbonylContact O-C 3.55Å; V159-L167 VanDerWaalsContact O-CA 3.27Å; V159-L167 WeakPolarHBondContact O-CA 3.28Å; V159-Y168 PolarHBondContact N-O 3.31Å; V159-Y168 PolarHBondContact O-N 3.07Å
160	L	98.1	Very high	95.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	111.3	164.8	176.4	66.2	0	0	0	108.9	Q41 F43 A77 D78 R162 V228	Q41-L160 HydrophobicContact CB-CD1 4.17Å; Q41-L160 HydrophobicContact CB-CD2 4.01Å; Q41-L160 HydrophobicContact CB-CG 4.34Å; F43-L160 HydrophobicContact CD1-CD2 3.9Å; F43-L160 HydrophobicContact CD2-CB 4Å; F43-L160 HydrophobicContact CD2-CD2 4.25Å; F43-L160 HydrophobicContact CE1-CB 4.24Å; F43-L160 HydrophobicContact CE1-CD2 3.98Å; F43-L160 HydrophobicContact CE2-CB 3.44Å; F43-L160 VanDerWaalsContact CE2-CB 3.44Å; F43-L160 HydrophobicContact CE2-CD2 4.3Å; F43-L160 HydrophobicContact CE2-CG 4.49Å; F43-L160 HydrophobicContact CG-CD2 4.04Å; F43-L160 HydrophobicContact CZ-CB 3.59Å; F43-L160 HydrophobicContact CZ-CD2 4.18Å; F43-L160 HydrophobicContact CZ-CG 4.38Å; A77-L160 WeakPolarHBondContact CA-O 3.29Å; A77-L160 VanDerWaalsContact CB-O 3.31Å; A77-L160 WeakPolarHBondContact CB-O 3.31Å; D78-L160 HydrophobicContact CB-CB 4.43Å; D78-L160 PolarHBondContact N-O 2.67Å; D78-L160 PolarHBondContact O-N 2.93Å; L160-R162 PolarHBondContact O-N 2.93Å; L160-V228 HydrophobicContact CD1-CG2 3.57Å
161	D	95.2	Very high	95.8	Very high	3 Å²	3	13.8 Å²	13.8	2%	0.016	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	114.4	171.2	177.3	-5.5	0	0	0	109.3	P118 Q119 S163 S164 Q166 Y168	P118-D161 HydrophobicContact CB-CB 4.25Å; Q119-D161 PolarHBondContact NE2-OD2 3.49Å; D161-S163 PolarHBondContact O-N 2.87Å; D161-S163 WeakPolarHBondContact OD1-CB 3.49Å; D161-S163 PolarHBondContact OD1-N 2.75Å; D161-S163 PolarHBondContact OD1-OG 3.18Å; D161-S163 PolarHBondContact OD2-OG 3.23Å; D161-S164 WeakPolarHBondContact CB-OG 3.36Å; D161-S164 WeakPolarHBondContact OD2-CB 3.33Å; D161-S164 PolarHBondContact OD2-OG 3.04Å; D161-Q166 PolarHBondContact N-O 3.28Å; D161-Y168 HydrophobicContact CB-CD2 4.31Å; D161-Y168 HydrophobicContact CB-CE2 3.89Å
162	R	90.4	Very high	96	Very high	19 Å²	19	13.8 Å²	13.8	7%	0.072	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-22.7	-176	-67.7	177.9	163.9	-139.4	-0.2	112.4	V40 Q41 H74 H75 T76 D78 L160 D324	V40-R162 HydrophobicContact CB-CB 4.32Å; Q41-R162 WeakPolarHBondContact O-CG 3.46Å; H74-R162 PolarHBondContact O-NE 3.18Å; H75-R162 WeakPolarHBondContact O-CD 3.37Å; T76-R162 WeakPolarHBondContact O-CB 3.46Å; T76-R162 PolarHBondContact O-N 3.41Å; D78-R162 IonicContact OD1-CZ 3.78Å; D78-R162 IonicContact OD1-NE 2.79Å; D78-R162 PolarHBondContact OD1-NE 3.47Å; D78-R162 IonicContact OD1-NH2 3.86Å; D78-R162 PolarHBondContact OD1-NH2 3.16Å; D78-R162 IonicContact OD2-NH2 2.97Å; L160-R162 PolarHBondContact O-N 2.93Å; R162-D324 IonicContact NH1-OD1 3.68Å; R162-D324 PolarHBondContact NH1-OD1 3.23Å
163	S	83.1	Confident	96.1	Very high	102 Å²	102	13.8 Å²	13.8	71%	0.713	8%	0.083	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-31.7	-173.5	73.6	0	0	0	0	114	D161	D161-S163 PolarHBondContact O-N 2.87Å; D161-S163 WeakPolarHBondContact OD1-CB 3.49Å; D161-S163 PolarHBondContact OD1-N 2.75Å; D161-S163 PolarHBondContact OD1-OG 3.18Å; D161-S163 PolarHBondContact OD2-OG 3.23Å
164	S	86.1	Confident	96.1	Very high	43 Å²	43	14.1 Å²	14.1	30%	0.301	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-0.3	-168.5	65.4	0	0	0	0	115	D161 Q166	D161-S164 WeakPolarHBondContact CB-OG 3.36Å; D161-S164 WeakPolarHBondContact OD2-CB 3.33Å; D161-S164 PolarHBondContact OD2-OG 3.04Å; S164-Q166 PolarHBondContact O-N 3.17Å; S164-Q166 VanDerWaalsContact O-N 3.11Å; S164-Q166 PolarHBondContact O-NE2 2.83Å; S164-Q166 WeakPolarHBondContact OG-CB 3.44Å; S164-Q166 WeakPolarHBondContact OG-CG 3.47Å
165	S	87.4	Confident	96.1	Very high	39 Å²	39	14.1 Å²	14.1	27%	0.273	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	30.5	-169.2	-59.5	0	0	0	0	112.3	V228	S165-V228 VanDerWaalsContact O-CG2 3.26Å; S165-V228 WeakPolarHBondContact O-CG2 3.26Å; S165-V228 PolarHBondContact O-N 2.7Å
166	Q	96	Very high	96.1	Very high	42 Å²	42	14.2 Å²	14.2	20%	0.196	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	145.7	174.4	-60.8	-56.6	-49.6	0	0	109.8	D161 S164 Y168 F226 T227	D161-Q166 PolarHBondContact N-O 3.28Å; S164-Q166 PolarHBondContact O-N 3.17Å; S164-Q166 VanDerWaalsContact O-N 3.11Å; S164-Q166 PolarHBondContact O-NE2 2.83Å; S164-Q166 WeakPolarHBondContact OG-CB 3.44Å; S164-Q166 WeakPolarHBondContact OG-CG 3.47Å; Q166-Y168 HydrophobicContact CB-CD2 4.31Å; Q166-Y168 HydrophobicContact CB-CE2 3.49Å; Q166-Y168 VanDerWaalsContact CB-CE2 3.49Å; Q166-Y168 HydrophobicContact CG-CE2 4.48Å; Q166-F226 CarbonylContact C-O 3.6Å; Q166-F226 WeakPolarHBondContact CA-O 3.4Å; Q166-F226 PolarHBondContact OE1-O 3.46Å; Q166-T227 PolarHBondContact NE2-OG1 3.28Å; Q166-T227 PolarHBondContact OE1-OG1 2.86Å; Q166-T227 VanDerWaalsContact OE1-OG1 3.09Å
167	L	98.2	Very high	96.1	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.8	169.4	-177.4	150	0	0	0	108.2	F43 V158 V159 A169 S225 F226 V228 I234	F43-L167 HydrophobicContact CZ-CD1 3.95Å; V158-L167 HydrophobicContact CG1-CD1 3.67Å; V158-L167 HydrophobicContact CG1-CD2 3.65Å; V158-L167 HydrophobicContact CG1-CG 3.63Å; V159-L167 CarbonylContact O-C 3.55Å; V159-L167 VanDerWaalsContact O-CA 3.27Å; V159-L167 WeakPolarHBondContact O-CA 3.28Å; L167-A169 HydrophobicContact CD2-CB 4.45Å; L167-S225 CarbonylContact O-C 3.55Å; L167-S225 VanDerWaalsContact O-CA 3.24Å; L167-S225 WeakPolarHBondContact O-CA 3.23Å; L167-F226 HydrophobicContact CD2-CD2 3.75Å; L167-F226 HydrophobicContact CD2-CE2 4.29Å; L167-F226 PolarHBondContact N-O 3.07Å; L167-F226 PolarHBondContact O-N 2.96Å; L167-V228 HydrophobicContact CB-CG1 3.57Å; L167-V228 HydrophobicContact CD1-CG1 3.98Å; L167-V228 HydrophobicContact CG-CG1 4.44Å; L167-I234 HydrophobicContact CD1-CD1 3.5Å; L167-I234 HydrophobicContact CD1-CG1 3.73Å
168	Y	98.5	Very high	96.1	Very high	40 Å²	40	14.5 Å²	14.5	16%	0.157	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.3	176.2	-58	-92.3	0	0	0	108.7	P118 Q119 V158 V159 D161 Q166 R224	P118-Y168 WeakPolarHBondContact O-CD2 3.43Å; Q119-Y168 HydrophobicContact CB-CD1 4.27Å; Q119-Y168 HydrophobicContact CB-CE1 3.93Å; Q119-Y168 HydrophobicContact CB-CE2 4.26Å; Q119-Y168 HydrophobicContact CG-CD2 4.48Å; Q119-Y168 HydrophobicContact CG-CE1 4.05Å; Q119-Y168 HydrophobicContact CG-CE2 3.76Å; V158-Y168 CarbonylContact C-O 3.53Å; V158-Y168 WeakPolarHBondContact CA-O 3.47Å; V159-Y168 PolarHBondContact N-O 3.31Å; V159-Y168 PolarHBondContact O-N 3.07Å; D161-Y168 HydrophobicContact CB-CD2 4.31Å; D161-Y168 HydrophobicContact CB-CE2 3.89Å; Q166-Y168 HydrophobicContact CB-CD2 4.31Å; Q166-Y168 HydrophobicContact CB-CE2 3.49Å; Q166-Y168 VanDerWaalsContact CB-CE2 3.49Å; Q166-Y168 HydrophobicContact CG-CE2 4.48Å; Y168-R224 CarbonylContact C-O 3.56Å; Y168-R224 WeakPolarHBondContact CA-O 3.26Å
169	A	98.7	Very high	96	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144	178.9	0	0	0	0	0	111.1	I157 V158 L167 F177 V223 R224	I157-A169 CarbonylContact O-C 3.58Å; I157-A169 VanDerWaalsContact O-CA 3.22Å; I157-A169 WeakPolarHBondContact O-CA 3.49Å; V158-A169 HydrophobicContact CG2-CB 4.05Å; L167-A169 HydrophobicContact CD2-CB 4.45Å; A169-F177 HydrophobicContact CB-CD1 4Å; A169-F177 HydrophobicContact CB-CE1 3.36Å; A169-F177 HydrophobicContact CB-CE2 4.44Å; A169-F177 HydrophobicContact CB-CZ 3.63Å; A169-V223 CarbonylContact O-C 3.42Å; A169-V223 VanDerWaalsContact O-CA 3.31Å; A169-V223 WeakPolarHBondContact O-CA 3.25Å; A169-R224 PolarHBondContact N-O 2.84Å; A169-R224 PolarHBondContact O-N 2.94Å
170	A	98.7	Very high	96	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	121.4	167.8	0	0	0	0	0	108.2	P121 D122 M125 C156 I157 A221 V223	P121-A170 HydrophobicContact CB-CB 3.93Å; P121-A170 HydrophobicContact CG-CB 3.92Å; D122-A170 HydrophobicContact CB-CB 4.04Å; M125-A170 HydrophobicContact CE-CB 4.04Å; C156-A170 WeakPolarHBondContact CA-O 3.18Å; I157-A170 PolarHBondContact N-O 2.83Å; I157-A170 PolarHBondContact O-N 3.36Å; A170-A221 HydrophobicContact CB-CB 4.31Å; A170-V223 HydrophobicContact CB-CG2 4.28Å
171	N	98.8	Very high	96	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.2	178.3	-172.8	56.7	0	0	0	110.5	C156 G173 S175 K190 Q192 A221 D222	C156-N171 WeakPolarHBondContact CB-OD1 3.32Å; C156-N171 PolarHBondContact SG-OD1 3.31Å; N171-G173 PolarHBondContact ND2-O 2.89Å; N171-S175 PolarHBondContact ND2-O 3.48Å; N171-S175 PolarHBondContact OD1-O 2.86Å; N171-K190 PolarHBondContact ND2-O 2.91Å; N171-Q192 PolarHBondContact O-OE1 3.03Å; N171-A221 CarbonylContact O-C 3.55Å; N171-A221 WeakPolarHBondContact O-CA 3.22Å; N171-D222 PolarHBondContact N-O 3.46Å; N171-D222 PolarHBondContact O-N 3.3Å
172	L	98.7	Very high	96	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	107.3	170.3	-170.8	83.4	0	0	0	109	M125 T154 A155 Q192 F200 L202 D216 A221	M125-L172 HydrophobicContact CE-CB 4.32Å; M125-L172 HydrophobicContact SD-CB 4.07Å; T154-L172 WeakPolarHBondContact CA-O 3.16Å; T154-L172 WeakPolarHBondContact CB-O 3.16Å; A155-L172 PolarHBondContact N-O 2.85Å; A155-L172 PolarHBondContact O-N 3.48Å; L172-Q192 VanDerWaalsContact CA-OE1 3.24Å; L172-F200 HydrophobicContact CD1-CB 4.07Å; L172-F200 HydrophobicContact CD1-CD1 4.42Å; L172-F200 HydrophobicContact CG-CB 4.15Å; L172-L202 HydrophobicContact CD2-CB 4.48Å; L172-L202 HydrophobicContact CD2-CD2 3.58Å; L172-L202 HydrophobicContact CD2-CG 3.53Å; L172-D216 HydrophobicContact CD1-CB 4.33Å; L172-A221 HydrophobicContact CB-CB 4.24Å; L172-A221 HydrophobicContact CD1-CB 4.42Å
173	G	98.5	Very high	96.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	111.1	-154.7	177.7	0	0	0	0	0	114.9	N171 Q192 F200	N171-G173 PolarHBondContact ND2-O 2.89Å; G173-Q192 CarbonylContact C-O 3.56Å; G173-Q192 WeakPolarHBondContact CA-O 3.42Å; G173-Q192 PolarHBondContact O-N 2.92Å; G173-F200 WeakPolarHBondContact CA-O 3.32Å
174	D	98.2	Very high	96.8	Very high	8 Å²	8	28.6 Å²	28.6	4%	0.043	15%	0.147	C	C	.	.	S	Bend	trans	-109.8	-1.2	-175.5	57.5	0.7	0	0	0	115.2	V191 Q193 P199	D174-V191 HydrophobicContact CB-CG1 3.72Å; D174-Q193 HydrophobicContact CB-CG 4.17Å; D174-Q193 PolarHBondContact OD2-NE2 3.31Å; D174-P199 HydrophobicContact CB-CB 4.32Å; D174-P199 WeakPolarHBondContact OD1-CB 3.5Å
175	S	98.7	Very high	97.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.141	C	C	.	.			trans	-58.5	170.2	148	-63.2	0	0	0	0	110.4	T154 N171 T238	T154-S175 PolarHBondContact OG1-OG 2.95Å; N171-S175 PolarHBondContact ND2-O 3.48Å; N171-S175 PolarHBondContact OD1-O 2.86Å; S175-T238 WeakPolarHBondContact OG-CA 3.35Å
176	G	98.7	Very high	97.9	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.9	-173.4	-177.7	0	0	0	0	0	116.5	S189 L236 A237	G176-S189 WeakPolarHBondContact CA-OG 3.35Å; G176-L236 WeakPolarHBondContact O-CD1 3.49Å; G176-A237 PolarHBondContact N-O 3.36Å; G176-A237 PolarHBondContact O-N 3.39Å
177	F	98.8	Very high	98	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.009	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	156.3	179.2	70.4	-88.8	0	0	0	112.6	V158 A169 R188 S189 F226 V235 L236	V158-F177 HydrophobicContact CG2-CB 4.12Å; V158-F177 HydrophobicContact CG2-CD1 4.12Å; V158-F177 HydrophobicContact CG2-CG 4.09Å; A169-F177 HydrophobicContact CB-CD1 4Å; A169-F177 HydrophobicContact CB-CE1 3.36Å; A169-F177 HydrophobicContact CB-CE2 4.44Å; A169-F177 HydrophobicContact CB-CZ 3.63Å; F177-R188 CarbonylContact O-C 3.6Å; F177-R188 VanDerWaalsContact O-CA 3.28Å; F177-R188 WeakPolarHBondContact O-CA 3.13Å; F177-S189 PolarHBondContact N-OG 2.95Å; F177-S189 PolarHBondContact O-N 2.94Å; F177-F226 AromaticContact CE2-CE2 3.64Å; F177-F226 HydrophobicContact CE2-CE2 3.64Å; F177-F226 AromaticContact CE2-CZ 3.98Å; F177-F226 HydrophobicContact CE2-CZ 3.98Å; F177-F226 AromaticContact CZ-CE2 3.57Å; F177-F226 HydrophobicContact CZ-CE2 3.57Å; F177-F226 AromaticContact CZ-CZ 3.84Å; F177-F226 HydrophobicContact CZ-CZ 3.84Å; F177-V235 CarbonylContact C-O 3.32Å; F177-V235 WeakPolarHBondContact CA-O 3.14Å; F177-L236 HydrophobicContact CB-CB 4.49Å; F177-L236 HydrophobicContact CB-CD1 4.01Å
178	L	98.8	Very high	98	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.3	167.8	-51.9	175.8	0	0	0	108.8	L180 I185 H187 R188 I234 V235 F242 L247 I250	L178-L180 HydrophobicContact CB-CD1 3.9Å; L178-I185 HydrophobicContact CD1-CD1 3.97Å; L178-I185 HydrophobicContact CD1-CG1 4.41Å; L178-I185 HydrophobicContact CD2-CG2 4.39Å; L178-H187 WeakPolarHBondContact CA-O 3.2Å; L178-R188 HydrophobicContact CD2-CB 3.53Å; L178-I234 WeakPolarHBondContact O-CA 3.38Å; L178-V235 HydrophobicContact CB-CB 4.27Å; L178-V235 HydrophobicContact CD1-CB 4.49Å; L178-V235 PolarHBondContact N-O 3.29Å; L178-V235 PolarHBondContact O-N 2.86Å; L178-F242 HydrophobicContact CD1-CE1 3.96Å; L178-F242 HydrophobicContact CD2-CE1 4.09Å; L178-F242 HydrophobicContact CG-CE1 3.86Å; L178-F242 HydrophobicContact CG-CZ 4.28Å; L178-L247 HydrophobicContact CD1-CD2 3.97Å; L178-L247 HydrophobicContact CD2-CD2 3.98Å; L178-I250 HydrophobicContact CD1-CD1 3.9Å; L178-I250 HydrophobicContact CD1-CG2 4Å
179	L	98.5	Very high	98	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.3	166.1	-166.9	153.7	0	0	0	108.2	I185 V186 H187 F226 V228 D232 I234	L179-I185 WeakPolarHBondContact O-CA 3.36Å; L179-V186 HydrophobicContact CB-CG2 4.44Å; L179-V186 HydrophobicContact CD2-CG2 3.18Å; L179-V186 HydrophobicContact CG-CG2 4.35Å; L179-V186 WeakPolarHBondContact O-CG2 3.43Å; L179-V186 PolarHBondContact O-N 3.21Å; L179-H187 HydrophobicContact CB-CB 3.98Å; L179-H187 PolarHBondContact N-O 2.79Å; L179-H187 PolarHBondContact O-N 2.95Å; L179-F226 HydrophobicContact CD1-CB 4.21Å; L179-F226 HydrophobicContact CD1-CG 4.49Å; L179-V228 HydrophobicContact CD1-CG1 3.94Å; L179-D232 HydrophobicContact CD2-CB 4.47Å; L179-I234 HydrophobicContact CB-CD1 4.07Å; L179-I234 HydrophobicContact CD1-CD1 3.84Å; L179-I234 HydrophobicContact CG-CD1 3.62Å
180	L	98.5	Very high	97.9	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132	177.2	-61.9	92.1	0	0	0	110.6	L178 R184 I185 D232 C233 V235 E251 M254	L178-L180 HydrophobicContact CB-CD1 3.9Å; L180-R184 CarbonylContact C-O 3.58Å; L180-R184 WeakPolarHBondContact CA-O 3.18Å; L180-I185 HydrophobicContact CD1-CG1 4.42Å; L180-I185 HydrophobicContact CD2-CG1 3.88Å; L180-I185 HydrophobicContact CG-CG1 3.79Å; L180-D232 WeakPolarHBondContact O-CA 3.4Å; L180-C233 HydrophobicContact CB-CB 4.36Å; L180-C233 PolarHBondContact N-O 2.79Å; L180-C233 PolarHBondContact O-N 2.85Å; L180-V235 HydrophobicContact CD1-CB 4.49Å; L180-V235 HydrophobicContact CD1-CG2 3.84Å; L180-E251 HydrophobicContact CD2-CG 4.23Å; L180-M254 HydrophobicContact CD2-CB 4.11Å; L180-M254 HydrophobicContact CD2-CG 3.91Å
181	R	97.3	Very high	97.9	Very high	61 Å²	61	46.3 Å²	46.3	23%	0.23	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.2	173.3	-178.3	170.4	-66.5	162.2	3.3	108.9	G183 R184 V186 T227 D232	R181-G183 PolarHBondContact O-N 3.05Å; R181-R184 PolarHBondContact N-O 2.92Å; R181-R184 PolarHBondContact O-N 3.33Å; R181-V186 HydrophobicContact CB-CG1 4.1Å; R181-V186 HydrophobicContact CB-CG2 4.13Å; R181-T227 PolarHBondContact NH2-O 3Å; R181-D232 WeakPolarHBondContact CB-OD1 3.44Å; R181-D232 VanDerWaalsContact CG-OD1 3.26Å; R181-D232 WeakPolarHBondContact CG-OD1 3.47Å; R181-D232 IonicContact CZ-OD1 2.91Å; R181-D232 IonicContact CZ-OD2 3.6Å; R181-D232 IonicContact NE-OD1 2.92Å; R181-D232 PolarHBondContact NE-OD1 3.19Å; R181-D232 IonicContact NE-OD2 2.7Å; R181-D232 PolarHBondContact NE-OD2 2.68Å; R181-D232 IonicContact NH2-OD1 3.26Å; R181-D232 IonicContact NH2-OD2 3.49Å; R181-D232 PolarHBondContact NH2-OD2 3.09Å
182	N	95	Very high	97.8	Very high	156 Å²	156	47.4 Å²	47.4	83%	0.834	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	42.1	-176.9	-58	-39.4	0	0	0	112.8	R184	N182-R184 VanDerWaalsContact C-N 3.28Å; N182-R184 PolarHBondContact O-N 3.22Å
183	G	93.3	Very high	97.7	Very high	35 Å²	35	50.1 Å²	50.1	36%	0.361	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	5.7	178.9	0	0	0	0	0	115.7	R181	R181-G183 PolarHBondContact O-N 3.05Å
184	R	97.8	Very high	97.6	Very high	167 Å²	167	54.1 Å²	54.1	63%	0.63	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.3	178	-64.7	-61.2	-171.2	-178.5	-0	111.7	L180 R181 N182 V186 E251	L180-R184 CarbonylContact C-O 3.58Å; L180-R184 WeakPolarHBondContact CA-O 3.18Å; R181-R184 PolarHBondContact N-O 2.92Å; R181-R184 PolarHBondContact O-N 3.33Å; N182-R184 VanDerWaalsContact C-N 3.28Å; N182-R184 PolarHBondContact O-N 3.22Å; R184-V186 PolarHBondContact O-N 3.19Å; R184-E251 WeakPolarHBondContact CA-OE1 3.39Å; R184-E251 IonicContact NH1-OE2 3.41Å; R184-E251 PolarHBondContact NH1-OE2 3.06Å
185	I	98.3	Very high	97.4	Very high	37 Å²	37	61.1 Å²	61.1	19%	0.19	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	118.1	172.3	-63	162.2	0	0	0	108.6	L178 L179 L180 H187 L247 E251	L178-I185 HydrophobicContact CD1-CD1 3.97Å; L178-I185 HydrophobicContact CD1-CG1 4.41Å; L178-I185 HydrophobicContact CD2-CG2 4.39Å; L179-I185 WeakPolarHBondContact O-CA 3.36Å; L180-I185 HydrophobicContact CD1-CG1 4.42Å; L180-I185 HydrophobicContact CD2-CG1 3.88Å; L180-I185 HydrophobicContact CG-CG1 3.79Å; I185-H187 WeakPolarHBondContact CG2-O 3.47Å; I185-L247 HydrophobicContact CD1-CB 3.75Å; I185-L247 HydrophobicContact CD1-CD1 4.37Å; I185-L247 HydrophobicContact CD1-CD2 4.25Å; I185-L247 HydrophobicContact CD1-CG 4.34Å; I185-E251 HydrophobicContact CD1-CG 3.74Å; I185-E251 HydrophobicContact CG1-CG 3.83Å; I185-E251 PolarHBondContact N-OE1 3.24Å
186	V	98	Very high	97.2	Very high	67 Å²	67	63 Å²	63	41%	0.406	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-25.8	176.9	-64.1	0	0	0	0	112.3	L179 R181 R184	L179-V186 HydrophobicContact CB-CG2 4.44Å; L179-V186 HydrophobicContact CD2-CG2 3.18Å; L179-V186 HydrophobicContact CG-CG2 4.35Å; L179-V186 WeakPolarHBondContact O-CG2 3.43Å; L179-V186 PolarHBondContact O-N 3.21Å; R181-V186 HydrophobicContact CB-CG1 4.1Å; R181-V186 HydrophobicContact CB-CG2 4.13Å; R184-V186 PolarHBondContact O-N 3.19Å
187	H	98	Very high	96.9	Very high	78 Å²	78	66.4 Å²	66.4	36%	0.361	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	152.9	170.5	-60.1	-72.9	0	0	0	111.3	L178 L179 I185 F226	L178-H187 WeakPolarHBondContact CA-O 3.2Å; L179-H187 HydrophobicContact CB-CB 3.98Å; L179-H187 PolarHBondContact N-O 2.79Å; L179-H187 PolarHBondContact O-N 2.95Å; I185-H187 WeakPolarHBondContact CG2-O 3.47Å; H187-F226 HydrophobicContact CB-CD1 4.05Å; H187-F226 HydrophobicContact CB-CE1 3.71Å; H187-F226 HydrophobicContact CB-CZ 4.09Å; H187-F226 AromaticContact CD2-CD1 3.39Å; H187-F226 WeakPolarHBondContact CD2-CD1 3.5Å; H187-F226 AromaticContact CD2-CE1 3.93Å; H187-F226 AromaticContact CD2-CG 4Å; H187-F226 AromaticContact CE1-CD1 3.57Å; H187-F226 AromaticContact CE1-CE1 3.87Å; H187-F226 AromaticContact CG-CD1 3.37Å; H187-F226 AromaticContact CG-CE1 3.38Å; H187-F226 AromaticContact ND1-CD1 3.48Å; H187-F226 WeakPolarHBondContact ND1-CD1 3.43Å; H187-F226 AromaticContact ND1-CE1 3.35Å; H187-F226 WeakPolarHBondContact ND1-CE1 3.22Å; H187-F226 AromaticContact NE2-CD1 3.53Å
188	R	98	Very high	96.8	Very high	151 Å²	151	66.7 Å²	66.7	57%	0.57	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.6	150.5	171.3	62.3	-180	-179.2	176.6	1.4	109.8	F177 L178 R224	F177-R188 CarbonylContact O-C 3.6Å; F177-R188 VanDerWaalsContact O-CA 3.28Å; F177-R188 WeakPolarHBondContact O-CA 3.13Å; L178-R188 HydrophobicContact CD2-CB 3.53Å; R188-R224 PolarHBondContact O-NH1 3.01Å
189	S	98.3	Very high	96.7	Very high	14 Å²	14	67.3 Å²	67.3	10%	0.098	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-61	154.8	171.4	58.5	0	0	0	0	111.3	G176 F177	G176-S189 WeakPolarHBondContact CA-OG 3.35Å; F177-S189 PolarHBondContact N-OG 2.95Å; F177-S189 PolarHBondContact O-N 2.94Å
190	K	97.3	Very high	96.7	Very high	121 Å²	121	69.4 Å²	69.4	53%	0.526	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-82.7	125	166.5	-175.3	-177.2	175.6	-171.2	0	108.3	N171	N171-K190 PolarHBondContact ND2-O 2.91Å
191	V	97.6	Very high	96.7	Very high	68 Å²	68	70 Å²	70	41%	0.412	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-67.1	132.9	170.7	174.2	0	0	0	0	109	D174 Q193	D174-V191 HydrophobicContact CB-CG1 3.72Å; V191-Q193 HydrophobicContact CG1-CG 4.09Å
192	Q	97.8	Very high	96.7	Very high	23 Å²	23	67.1 Å²	67.1	11%	0.107	32%	0.322	C	S	.	.			trans	-119.7	116.8	178.3	-63.5	179.3	-51.3	0	0	110.8	N171 L172 G173 P199 F200 S220	N171-Q192 PolarHBondContact O-OE1 3.03Å; L172-Q192 VanDerWaalsContact CA-OE1 3.24Å; G173-Q192 CarbonylContact C-O 3.56Å; G173-Q192 WeakPolarHBondContact CA-O 3.42Å; G173-Q192 PolarHBondContact O-N 2.92Å; Q192-P199 WeakPolarHBondContact O-CA 3.4Å; Q192-F200 HydrophobicContact CB-CB 3.96Å; Q192-F200 HydrophobicContact CB-CD2 3.65Å; Q192-F200 HydrophobicContact CB-CE2 4.3Å; Q192-F200 HydrophobicContact CB-CG 3.84Å; Q192-F200 PolarHBondContact O-N 3.1Å; Q192-F200 VanDerWaalsContact O-N 3.09Å; Q192-S220 PolarHBondContact NE2-O 3.13Å
193	Q	96.7	Very high	96.7	Very high	56 Å²	56	60.3 Å²	60.3	26%	0.262	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	143.3	177.5	-66.2	-178.5	-39.2	0	0	109.6	D174 V191 Y195 A198	D174-Q193 HydrophobicContact CB-CG 4.17Å; D174-Q193 PolarHBondContact OD2-NE2 3.31Å; V191-Q193 HydrophobicContact CG1-CG 4.09Å; Q193-Y195 WeakPolarHBondContact CB-O 3.41Å; Q193-A198 CarbonylContact C-O 3.44Å; Q193-A198 VanDerWaalsContact CA-O 3.28Å; Q193-A198 WeakPolarHBondContact CA-O 3.21Å
194	H	95.3	Very high	96.7	Very high	85 Å²	85	59.4 Å²	59.4	39%	0.394	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	-41.6	173.2	-71.7	-79.2	0	0	0	111.2	A198 F200 I214 D216	H194-A198 PolarHBondContact N-O 2.93Å; H194-F200 AromaticContact CD2-CD2 3.9Å; H194-F200 AromaticContact CE1-CE2 3.93Å; H194-F200 AromaticContact CE1-CZ 3.8Å; H194-F200 AromaticContact NE2-CD2 3.82Å; H194-F200 AromaticContact NE2-CE2 3.96Å; H194-F200 AromaticContact NE2-CG 3.9Å; H194-I214 WeakPolarHBondContact CD2-CG2 3.06Å; H194-I214 WeakPolarHBondContact NE2-CG2 3.13Å; H194-D216 IonicContact CD2-OD2 3.88Å; H194-D216 IonicContact CE1-OD1 3.08Å; H194-D216 PolarHBondContact CE1-OD1 2.95Å; H194-D216 IonicContact CE1-OD2 3.32Å; H194-D216 VanDerWaalsContact NE2-CG 3.32Å; H194-D216 IonicContact NE2-OD1 2.78Å; H194-D216 PolarHBondContact NE2-OD1 3.23Å; H194-D216 IonicContact NE2-OD2 3.58Å; H194-D216 PolarHBondContact NE2-OD2 3.47Å
195	Y	94	Very high	96.1	Very high	155 Å²	155	53.3 Å²	53.3	61%	0.608	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.7	175.5	171.6	50.5	-92.2	0	0	0	108.3	Q193 N197 A198 I214	Q193-Y195 WeakPolarHBondContact CB-O 3.41Å; Y195-N197 PolarHBondContact O-N 2.94Å; Y195-N197 VanDerWaalsContact O-N 3.14Å; Y195-A198 HydrophobicContact CD1-CB 4.06Å; Y195-A198 HydrophobicContact CD2-CB 3.55Å; Y195-A198 HydrophobicContact CE1-CB 3.77Å; Y195-A198 HydrophobicContact CE2-CB 3.24Å; Y195-A198 HydrophobicContact CG-CB 3.95Å; Y195-A198 PolarHBondContact O-N 3.03Å; Y195-I214 HydrophobicContact CE1-CD1 3.98Å
196	F	94.5	Very high	95	Very high	40 Å²	40	54.7 Å²	54.7	18%	0.175	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	123.9	-176.5	179.8	-108	0	0	0	112.1	A198 F289 K292 A293 Q296 F298	F196-A198 VanDerWaalsContact C-N 3.26Å; F196-A198 PolarHBondContact O-N 2.88Å; F196-F289 HydrophobicContact CE1-CE2 4.04Å; F196-F289 AromaticContact CE1-CZ 3.86Å; F196-F289 HydrophobicContact CE1-CZ 3.86Å; F196-F289 HydrophobicContact CE2-CD2 4.46Å; F196-F289 HydrophobicContact CE2-CE2 4.17Å; F196-F289 AromaticContact CZ-CD2 3.99Å; F196-F289 HydrophobicContact CZ-CD2 3.99Å; F196-F289 HydrophobicContact CZ-CE1 4.22Å; F196-F289 AromaticContact CZ-CE2 3.4Å; F196-F289 HydrophobicContact CZ-CE2 3.4Å; F196-F289 VanDerWaalsContact CZ-CE2 3.4Å; F196-F289 AromaticContact CZ-CZ 3.54Å; F196-F289 HydrophobicContact CZ-CZ 3.54Å; F196-K292 HydrophobicContact CD2-CB 4.47Å; F196-K292 HydrophobicContact CE2-CB 3.79Å; F196-A293 HydrophobicContact CE1-CB 3.87Å; F196-A293 HydrophobicContact CE2-CB 4.26Å; F196-A293 HydrophobicContact CZ-CB 3.49Å; F196-A293 VanDerWaalsContact CZ-CB 3.49Å; F196-Q296 HydrophobicContact CB-CG 3.97Å; F196-Q296 HydrophobicContact CD2-CG 3.95Å; F196-Q296 HydrophobicContact CG-CB 4.4Å; F196-Q296 HydrophobicContact CG-CG 3.96Å; F196-F298 AromaticContact CD1-CD2 3.88Å; F196-F298 HydrophobicContact CD1-CD2 3.88Å; F196-F298 AromaticContact CD1-CE2 3.61Å; F196-F298 HydrophobicContact CD1-CE2 3.61Å; F196-F298 HydrophobicContact CD1-CZ 4.5Å; F196-F298 HydrophobicContact CE1-CD2 4.07Å; F196-F298 HydrophobicContact CE1-CE2 4.24Å; F196-F298 HydrophobicContact CG-CE2 4.34Å
197	N	94	Very high	93.7	Very high	72 Å²	72	54.5 Å²	54.5	39%	0.385	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	26.3	178.8	-161.7	64.4	0	0	0	114.7	Y195 F289 K304	Y195-N197 PolarHBondContact O-N 2.94Å; Y195-N197 VanDerWaalsContact O-N 3.14Å; N197-F289 HydrophobicContact CB-CE2 4.19Å; N197-F289 WeakPolarHBondContact OD1-CE2 3.33Å; N197-K304 WeakPolarHBondContact OD1-CE 3.24Å
198	A	95.4	Very high	91.8	Very high	8 Å²	8	62.6 Å²	62.6	7%	0.066	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	88.6	170.1	0	0	0	0	0	110.1	Q193 H194 Y195 F196 I214	Q193-A198 CarbonylContact C-O 3.44Å; Q193-A198 VanDerWaalsContact CA-O 3.28Å; Q193-A198 WeakPolarHBondContact CA-O 3.21Å; H194-A198 PolarHBondContact N-O 2.93Å; Y195-A198 HydrophobicContact CD1-CB 4.06Å; Y195-A198 HydrophobicContact CD2-CB 3.55Å; Y195-A198 HydrophobicContact CE1-CB 3.77Å; Y195-A198 HydrophobicContact CE2-CB 3.24Å; Y195-A198 HydrophobicContact CG-CB 3.95Å; Y195-A198 PolarHBondContact O-N 3.03Å; F196-A198 VanDerWaalsContact C-N 3.26Å; F196-A198 PolarHBondContact O-N 2.88Å; A198-I214 HydrophobicContact CB-CD1 4Å
199	P	97.5	Very high	90	Very high	16 Å²	16	60.1 Å²	60.1	10%	0.104	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	157.7	-177	26.5	-33	0	0	0	113.2	T154 D174 Q192	T154-P199 HydrophobicContact CG2-CB 4.02Å; T154-P199 HydrophobicContact CG2-CG 4.1Å; D174-P199 HydrophobicContact CB-CB 4.32Å; D174-P199 WeakPolarHBondContact OD1-CB 3.5Å; Q192-P199 WeakPolarHBondContact O-CA 3.4Å
200	F	98.2	Very high	88.3	Confident	44 Å²	44	62.5 Å²	62.5	19%	0.193	32%	0.321	C	S	.	.			trans	-62	137.3	159.7	-79.7	-119.8	0	0	0	108.9	L172 G173 Q192 H194 D216	L172-F200 HydrophobicContact CD1-CB 4.07Å; L172-F200 HydrophobicContact CD1-CD1 4.42Å; L172-F200 HydrophobicContact CG-CB 4.15Å; G173-F200 WeakPolarHBondContact CA-O 3.32Å; Q192-F200 HydrophobicContact CB-CB 3.96Å; Q192-F200 HydrophobicContact CB-CD2 3.65Å; Q192-F200 HydrophobicContact CB-CE2 4.3Å; Q192-F200 HydrophobicContact CB-CG 3.84Å; Q192-F200 PolarHBondContact O-N 3.1Å; Q192-F200 VanDerWaalsContact O-N 3.09Å; H194-F200 AromaticContact CD2-CD2 3.9Å; H194-F200 AromaticContact CE1-CE2 3.93Å; H194-F200 AromaticContact CE1-CZ 3.8Å; H194-F200 AromaticContact NE2-CD2 3.82Å; H194-F200 AromaticContact NE2-CE2 3.96Å; H194-F200 AromaticContact NE2-CG 3.9Å; F200-D216 WeakPolarHBondContact CA-OD2 3.47Å; F200-D216 HydrophobicContact CD1-CB 4.04Å; F200-D216 VanDerWaalsContact CD1-CG 3.46Å; F200-D216 WeakPolarHBondContact CD1-OD1 3.45Å
201	Q	98	Very high	86.6	Confident	16 Å²	16	65.7 Å²	65.7	8%	0.075	34%	0.338	C	S	.	.			trans	-154.7	145.4	-171.8	61.7	-171.1	-63.4	0	0	112.1	S153 I214 D216	S153-Q201 WeakPolarHBondContact O-CA 3.34Å; Q201-I214 HydrophobicContact CG-CG2 4.07Å; Q201-D216 PolarHBondContact N-OD2 2.88Å; Q201-D216 PolarHBondContact O-N 2.93Å
202	L	97.5	Very high	85.2	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	140	168.5	-61.1	175.3	0	0	0	109	F99 L103 M125 Y129 S152 S153 A155 L172 D216 P218	F99-L202 HydrophobicContact CE1-CB 3.97Å; F99-L202 HydrophobicContact CZ-CB 3.77Å; L103-L202 HydrophobicContact CD1-CD1 4.23Å; L103-L202 HydrophobicContact CD2-CD1 3.84Å; M125-L202 HydrophobicContact CG-CD1 4.08Å; M125-L202 HydrophobicContact SD-CD1 4.4Å; Y129-L202 HydrophobicContact CD1-CD2 4.45Å; Y129-L202 HydrophobicContact CD2-CB 3.96Å; Y129-L202 HydrophobicContact CD2-CD1 4.06Å; Y129-L202 HydrophobicContact CD2-CD2 4.39Å; Y129-L202 HydrophobicContact CD2-CG 4.37Å; Y129-L202 HydrophobicContact CE2-CB 4Å; Y129-L202 HydrophobicContact CG-CD1 4.16Å; Y129-L202 HydrophobicContact CG-CD2 4.29Å; S152-L202 CarbonylContact C-O 3.51Å; S152-L202 WeakPolarHBondContact CA-O 3.26Å; S152-L202 WeakPolarHBondContact CB-O 3.33Å; S153-L202 PolarHBondContact N-O 3.1Å; S153-L202 VanDerWaalsContact N-O 3.09Å; S153-L202 PolarHBondContact O-N 2.89Å; A155-L202 HydrophobicContact CB-CD1 4.45Å; L172-L202 HydrophobicContact CD2-CB 4.48Å; L172-L202 HydrophobicContact CD2-CD2 3.58Å; L172-L202 HydrophobicContact CD2-CG 3.53Å; L202-D216 WeakPolarHBondContact CD2-O 3.31Å; L202-P218 HydrophobicContact CD2-CG 3.83Å
203	T	95.4	Very high	84.1	Confident	13 Å²	13	72.5 Å²	72.5	8%	0.08	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	133.5	-176.9	-61.7	0	0	0	0	112.2	W89 Y129 S152 I214	W89-T203 HydrophobicContact CZ2-CG2 3.93Å; Y129-T203 PolarHBondContact OH-O 3.01Å; S152-T203 WeakPolarHBondContact CB-OG1 3.02Å; S152-T203 WeakPolarHBondContact OG-CB 3.44Å; S152-T203 VanDerWaalsContact OG-CG2 3.26Å; S152-T203 WeakPolarHBondContact OG-CG2 3.14Å; S152-T203 PolarHBondContact OG-OG1 3.28Å; T203-I214 PolarHBondContact OG1-O 2.76Å
204	L	93.1	Very high	83.4	Confident	17 Å²	17	72.1 Å²	72.1	9%	0.089	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.2	163.1	-71.8	174.2	0	0	0	109.6	F99 Y129 L132 R133 I149 F150 G151	F99-L204 HydrophobicContact CD2-CB 4.36Å; F99-L204 HydrophobicContact CE2-CB 3.9Å; F99-L204 HydrophobicContact CE2-CD1 3.89Å; F99-L204 HydrophobicContact CE2-CG 3.76Å; Y129-L204 HydrophobicContact CE2-CD2 3.92Å; Y129-L204 HydrophobicContact CE2-CG 3.84Å; L132-L204 HydrophobicContact CB-CD1 3.69Å; R133-L204 HydrophobicContact CB-CD1 4.49Å; R133-L204 HydrophobicContact CB-CD2 3.8Å; R133-L204 HydrophobicContact CG-CD2 3.83Å; I149-L204 WeakPolarHBondContact O-CB 3.49Å; F150-L204 VanDerWaalsContact CA-O 3.31Å; F150-L204 WeakPolarHBondContact CA-O 3.3Å; G151-L204 PolarHBondContact N-O 2.82Å; G151-L204 PolarHBondContact O-N 3.28Å
205	M	85.7	Confident	82.9	Confident	39 Å²	39	70.4 Å²	70.4	19%	0.192	37%	0.366	C	S	.	.			trans	-123	147.2	-174.5	152.7	166.3	11.2	0	0	111.7	W89 F150 N209 A210 F213	W89-M205 HydrophobicContact CH2-CB 4.37Å; F150-M205 VanDerWaalsContact CD1-C 3.47Å; F150-M205 VanDerWaalsContact CE1-C 3.5Å; M205-N209 HydrophobicContact SD-CB 4.15Å; M205-A210 HydrophobicContact CE-CB 4.4Å; M205-A210 WeakPolarHBondContact CE-O 3.12Å; M205-A210 PolarHBondContact SD-N 2.8Å; M205-F213 HydrophobicContact CE-CB 3.74Å; M205-F213 HydrophobicContact CE-CD2 3.31Å; M205-F213 HydrophobicContact CE-CE2 4.18Å; M205-F213 HydrophobicContact CE-CG 3.81Å; M205-F213 HydrophobicContact SD-CD2 3.76Å; M205-F213 HydrophobicContact SD-CE2 4.05Å
206	P	74.2	Confident	83	Confident	65 Å²	65	64 Å²	64	42%	0.422	34%	0.342	S	S	.	.	S	Bend	trans	-72.5	122.8	165	4.8	5.4	0	0	0	112.1	F150	F150-P206 HydrophobicContact CD1-CB 4.27Å; F150-P206 VanDerWaalsContact CD1-CD 3.45Å; F150-P206 HydrophobicContact CD1-CG 3.83Å; F150-P206 HydrophobicContact CD2-CB 4.41Å; F150-P206 HydrophobicContact CD2-CG 3.74Å; F150-P206 VanDerWaalsContact CE1-CA 3.48Å; F150-P206 HydrophobicContact CE1-CB 3.74Å; F150-P206 HydrophobicContact CE1-CG 3.81Å; F150-P206 VanDerWaalsContact CE1-N 3.28Å; F150-P206 HydrophobicContact CE2-CB 3.88Å; F150-P206 HydrophobicContact CE2-CG 3.71Å; F150-P206 HydrophobicContact CG-CG 3.79Å; F150-P206 HydrophobicContact CZ-CB 3.5Å; F150-P206 HydrophobicContact CZ-CG 3.74Å
207	G	70.9	Confident	82.9	Confident	64 Å²	64	62.8 Å²	62.8	66%	0.66	34%	0.341	S	S	*	.	S	Bend	trans	80.1	-168	160.2	0	0	0	0	0	117.3	N209	G207-N209 VanDerWaalsContact C-N 3.27Å; G207-N209 PolarHBondContact O-N 2.94Å
208	R	57.8	Low	83	Confident	247 Å²	247	60 Å²	60	93%	0.932	33%	0.327	S	S	*	.	S	Bend	trans	-74.9	2.3	-167.7	-68.4	-173.8	179	-174.8	-0.2	115.9	A210	R208-A210 PolarHBondContact O-N 2.92Å
209	N	60.3	Low	83	Confident	100 Å²	100	66.9 Å²	66.9	54%	0.535	36%	0.358	S	S	.	.			trans	-90.2	24.1	-178.4	-73.1	-14.5	0	0	0	113.4	M205 G207 E211 K212	M205-N209 HydrophobicContact SD-CB 4.15Å; G207-N209 VanDerWaalsContact C-N 3.27Å; G207-N209 PolarHBondContact O-N 2.94Å; N209-E211 PolarHBondContact O-N 3.02Å; N209-K212 PolarHBondContact O-N 3.02Å; N209-K212 VanDerWaalsContact O-N 3.13Å
210	A	63.2	Low	83	Confident	63 Å²	63	68 Å²	68	52%	0.521	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-45.2	-38.8	-177.2	0	0	0	0	0	113.6	M205 R208 K212	M205-A210 HydrophobicContact CE-CB 4.4Å; M205-A210 WeakPolarHBondContact CE-O 3.12Å; M205-A210 PolarHBondContact SD-N 2.8Å; R208-A210 PolarHBondContact O-N 2.92Å; A210-K212 VanDerWaalsContact C-N 3.29Å; A210-K212 PolarHBondContact O-N 2.95Å
211	E	62	Low	83.1	Confident	189 Å²	189	66.6 Å²	66.6	88%	0.883	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-71.5	-15.5	-171.6	-56.3	-178.3	-173.4	0	0	114.8	N209	N209-E211 PolarHBondContact O-N 3.02Å
212	K	68.6	Low	83.1	Confident	170 Å²	170	67.4 Å²	67.4	74%	0.739	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-86.2	-10.5	-175.9	-70.4	-171.9	178.7	-178.1	0	114.6	N209 A210	N209-K212 PolarHBondContact O-N 3.02Å; N209-K212 VanDerWaalsContact O-N 3.13Å; A210-K212 VanDerWaalsContact C-N 3.29Å; A210-K212 PolarHBondContact O-N 2.95Å
213	F	74.8	Confident	83.1	Confident	64 Å²	64	70.6 Å²	70.6	28%	0.281	39%	0.387	S	S	.	.	S	Bend	trans	-115.9	144.6	-175	-68.7	-96.7	0	0	0	109.9	W89 Y92 M205 G215	W89-F213 HydrophobicContact CH2-CD1 4.42Å; W89-F213 HydrophobicContact CH2-CE1 4.36Å; W89-F213 HydrophobicContact CZ2-CD1 4.37Å; Y92-F213 HydrophobicContact CE1-CZ 4.32Å; Y92-F213 AromaticContact CE2-CE1 3.86Å; Y92-F213 HydrophobicContact CE2-CE1 3.86Å; Y92-F213 AromaticContact CE2-CZ 3.94Å; Y92-F213 HydrophobicContact CE2-CZ 3.94Å; Y92-F213 AromaticContact CZ-CZ 3.72Å; M205-F213 HydrophobicContact CE-CB 3.74Å; M205-F213 HydrophobicContact CE-CD2 3.31Å; M205-F213 HydrophobicContact CE-CE2 4.18Å; M205-F213 HydrophobicContact CE-CG 3.81Å; M205-F213 HydrophobicContact SD-CD2 3.76Å; M205-F213 HydrophobicContact SD-CE2 4.05Å; F213-G215 PolarHBondContact O-N 2.9Å
214	I	81.9	Confident	83.2	Confident	48 Å²	48	74.2 Å²	74.2	25%	0.246	40%	0.399	C	S	.	.			trans	-62.1	124.9	165.6	-62.4	174.2	0	0	0	106.7	H194 Y195 A198 Q201 T203	H194-I214 WeakPolarHBondContact CD2-CG2 3.06Å; H194-I214 WeakPolarHBondContact NE2-CG2 3.13Å; Y195-I214 HydrophobicContact CE1-CD1 3.98Å; A198-I214 HydrophobicContact CB-CD1 4Å; Q201-I214 HydrophobicContact CG-CG2 4.07Å; T203-I214 PolarHBondContact OG1-O 2.76Å
215	G	85.2	Confident	83.5	Confident	49 Å²	49	76.8 Å²	76.8	51%	0.505	42%	0.418	S	S	.	.			trans	-152.7	109.8	176.2	0	0	0	0	0	108.7	F213	F213-G215 PolarHBondContact O-N 2.9Å
216	D	94.4	Very high	83.9	Confident	20 Å²	20	75.8 Å²	75.8	11%	0.107	41%	0.413	C	S	.	.			trans	-99.1	152	178.4	-55.2	-77.8	0	0	0	109.6	L172 H194 F200 Q201 L202	L172-D216 HydrophobicContact CD1-CB 4.33Å; H194-D216 IonicContact CD2-OD2 3.88Å; H194-D216 IonicContact CE1-OD1 3.08Å; H194-D216 PolarHBondContact CE1-OD1 2.95Å; H194-D216 IonicContact CE1-OD2 3.32Å; H194-D216 VanDerWaalsContact NE2-CG 3.32Å; H194-D216 IonicContact NE2-OD1 2.78Å; H194-D216 PolarHBondContact NE2-OD1 3.23Å; H194-D216 IonicContact NE2-OD2 3.58Å; H194-D216 PolarHBondContact NE2-OD2 3.47Å; F200-D216 WeakPolarHBondContact CA-OD2 3.47Å; F200-D216 HydrophobicContact CD1-CB 4.04Å; F200-D216 VanDerWaalsContact CD1-CG 3.46Å; F200-D216 WeakPolarHBondContact CD1-OD1 3.45Å; Q201-D216 PolarHBondContact N-OD2 2.88Å; Q201-D216 PolarHBondContact O-N 2.93Å; L202-D216 WeakPolarHBondContact CD2-O 3.31Å
217	G	92.7	Very high	85	Confident	15 Å²	15	76.7 Å²	76.7	16%	0.155	42%	0.417	C	S	.	.			trans	-88.5	158.6	172.8	0	0	0	0	0	112.2	E219 S220	G217-E219 VanDerWaalsContact C-OE2 3.23Å; G217-E219 WeakPolarHBondContact CA-OE1 3.4Å; G217-E219 VanDerWaalsContact CA-OE2 3.27Å; G217-E219 WeakPolarHBondContact CA-OE2 3.31Å; G217-E219 PolarHBondContact O-N 3.43Å; G217-E219 VanDerWaalsContact O-N 3.12Å; G217-S220 VanDerWaalsContact O-CB 3.29Å; G217-S220 WeakPolarHBondContact O-CB 3.36Å; G217-S220 PolarHBondContact O-N 2.96Å; G217-S220 PolarHBondContact O-OG 3.24Å
218	P	96.1	Very high	86.2	Confident	12 Å²	12	73.9 Å²	73.9	8%	0.078	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-52.7	-29.9	173.9	-23.4	32	0	0	0	113.7	A126 Y129 L202 S220 A221	A126-P218 HydrophobicContact CB-CB 3.67Å; A126-P218 HydrophobicContact CB-CG 3.84Å; Y129-P218 HydrophobicContact CD1-CG 3.88Å; Y129-P218 HydrophobicContact CG-CG 4.39Å; L202-P218 HydrophobicContact CD2-CG 3.83Å; P218-S220 PolarHBondContact O-N 3.41Å; P218-S220 VanDerWaalsContact O-N 3.16Å; P218-A221 WeakPolarHBondContact O-CB 3.46Å; P218-A221 PolarHBondContact O-N 2.98Å
219	E	96.4	Very high	87.9	Confident	154 Å²	154	67.1 Å²	67.1	72%	0.72	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-63	-15.5	175.6	69.8	-78.9	-178.6	0	0	114.1	G217 A221	G217-E219 VanDerWaalsContact C-OE2 3.23Å; G217-E219 WeakPolarHBondContact CA-OE1 3.4Å; G217-E219 VanDerWaalsContact CA-OE2 3.27Å; G217-E219 WeakPolarHBondContact CA-OE2 3.31Å; G217-E219 PolarHBondContact O-N 3.43Å; G217-E219 VanDerWaalsContact O-N 3.12Å; E219-A221 VanDerWaalsContact C-N 3.3Å
220	S	97.8	Very high	89.5	Confident	40 Å²	40	64.3 Å²	64.3	28%	0.28	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-82.4	-6.8	174.5	-59.7	0	0	0	0	112.9	Q192 G217 P218	Q192-S220 PolarHBondContact NE2-O 3.13Å; G217-S220 VanDerWaalsContact O-CB 3.29Å; G217-S220 WeakPolarHBondContact O-CB 3.36Å; G217-S220 PolarHBondContact O-N 2.96Å; G217-S220 PolarHBondContact O-OG 3.24Å; P218-S220 PolarHBondContact O-N 3.41Å; P218-S220 VanDerWaalsContact O-N 3.16Å
221	A	98.4	Very high	91	Very high	13 Å²	13	62.2 Å²	62.2	11%	0.107	34%	0.339	C	S	.	.	S	Bend	trans	-64.6	139	179.6	0	0	0	0	0	111.9	M125 A170 N171 L172 P218 E219 V223	M125-A221 HydrophobicContact CE-CB 4.38Å; M125-A221 HydrophobicContact SD-CB 4.34Å; A170-A221 HydrophobicContact CB-CB 4.31Å; N171-A221 CarbonylContact O-C 3.55Å; N171-A221 WeakPolarHBondContact O-CA 3.22Å; L172-A221 HydrophobicContact CB-CB 4.24Å; L172-A221 HydrophobicContact CD1-CB 4.42Å; P218-A221 WeakPolarHBondContact O-CB 3.46Å; P218-A221 PolarHBondContact O-N 2.98Å; E219-A221 VanDerWaalsContact C-N 3.3Å; A221-V223 PolarHBondContact O-N 3.09Å
222	D	98.4	Very high	92.7	Very high	34 Å²	34	53.4 Å²	53.4	18%	0.182	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	108.2	169.7	-175.7	73.4	0	0	0	108.8	N171 R224	N171-D222 PolarHBondContact N-O 3.46Å; N171-D222 PolarHBondContact O-N 3.3Å; D222-R224 IonicContact OD1-NE 3.88Å; D222-R224 IonicContact OD1-NH2 3.92Å; D222-R224 IonicContact OD2-CZ 3.95Å; D222-R224 IonicContact OD2-NE 2.95Å; D222-R224 PolarHBondContact OD2-NE 3.21Å; D222-R224 IonicContact OD2-NH2 3.46Å; D222-R224 PolarHBondContact OD2-NH2 2.93Å
223	V	98.4	Very high	94.1	Very high	67 Å²	67	45.7 Å²	45.7	41%	0.406	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.6	-179.6	-174.3	0	0	0	0	110.5	D122 A169 A170 A221	D122-V223 HydrophobicContact CB-CG2 3.7Å; A169-V223 CarbonylContact O-C 3.42Å; A169-V223 VanDerWaalsContact O-CA 3.31Å; A169-V223 WeakPolarHBondContact O-CA 3.25Å; A170-V223 HydrophobicContact CB-CG2 4.28Å; A221-V223 PolarHBondContact O-N 3.09Å
224	R	97.9	Very high	95.3	Very high	89 Å²	89	42.7 Å²	42.7	34%	0.336	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	155.4	179.9	-61.2	-171.5	-178.9	-158.6	-10.2	112.2	Y168 A169 R188 D222 F226	Y168-R224 CarbonylContact C-O 3.56Å; Y168-R224 WeakPolarHBondContact CA-O 3.26Å; A169-R224 PolarHBondContact N-O 2.84Å; A169-R224 PolarHBondContact O-N 2.94Å; R188-R224 PolarHBondContact O-NH1 3.01Å; D222-R224 IonicContact OD1-NE 3.88Å; D222-R224 IonicContact OD1-NH2 3.92Å; D222-R224 IonicContact OD2-CZ 3.95Å; D222-R224 IonicContact OD2-NE 2.95Å; D222-R224 PolarHBondContact OD2-NE 3.21Å; D222-R224 IonicContact OD2-NH2 3.46Å; D222-R224 PolarHBondContact OD2-NH2 2.93Å; R224-F226 HydrophobicContact CB-CE1 4.24Å; R224-F226 HydrophobicContact CB-CE2 3.7Å; R224-F226 HydrophobicContact CB-CZ 3.44Å; R224-F226 VanDerWaalsContact CB-CZ 3.44Å; R224-F226 HydrophobicContact CG-CZ 4.21Å
225	S	97.7	Very high	96.1	Very high	71 Å²	71	40.4 Å²	40.4	50%	0.497	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149.4	171.3	61.2	0	0	0	0	111.7	L167	L167-S225 CarbonylContact O-C 3.55Å; L167-S225 VanDerWaalsContact O-CA 3.24Å; L167-S225 WeakPolarHBondContact O-CA 3.23Å
226	F	95	Very high	96.7	Very high	17 Å²	17	38 Å²	38	8%	0.075	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	142.6	-177.1	-44.1	-83	0	0	0	110.8	Q166 L167 F177 L179 H187 R224	Q166-F226 CarbonylContact C-O 3.6Å; Q166-F226 WeakPolarHBondContact CA-O 3.4Å; Q166-F226 PolarHBondContact OE1-O 3.46Å; L167-F226 HydrophobicContact CD2-CD2 3.75Å; L167-F226 HydrophobicContact CD2-CE2 4.29Å; L167-F226 PolarHBondContact N-O 3.07Å; L167-F226 PolarHBondContact O-N 2.96Å; F177-F226 AromaticContact CE2-CE2 3.64Å; F177-F226 HydrophobicContact CE2-CE2 3.64Å; F177-F226 AromaticContact CE2-CZ 3.98Å; F177-F226 HydrophobicContact CE2-CZ 3.98Å; F177-F226 AromaticContact CZ-CE2 3.57Å; F177-F226 HydrophobicContact CZ-CE2 3.57Å; F177-F226 AromaticContact CZ-CZ 3.84Å; F177-F226 HydrophobicContact CZ-CZ 3.84Å; L179-F226 HydrophobicContact CD1-CB 4.21Å; L179-F226 HydrophobicContact CD1-CG 4.49Å; H187-F226 HydrophobicContact CB-CD1 4.05Å; H187-F226 HydrophobicContact CB-CE1 3.71Å; H187-F226 HydrophobicContact CB-CZ 4.09Å; H187-F226 AromaticContact CD2-CD1 3.39Å; H187-F226 WeakPolarHBondContact CD2-CD1 3.5Å; H187-F226 AromaticContact CD2-CE1 3.93Å; H187-F226 AromaticContact CD2-CG 4Å; H187-F226 AromaticContact CE1-CD1 3.57Å; H187-F226 AromaticContact CE1-CE1 3.87Å; H187-F226 AromaticContact CG-CD1 3.37Å; H187-F226 AromaticContact CG-CE1 3.38Å; H187-F226 AromaticContact ND1-CD1 3.48Å; H187-F226 WeakPolarHBondContact ND1-CD1 3.43Å; H187-F226 AromaticContact ND1-CE1 3.35Å; H187-F226 WeakPolarHBondContact ND1-CE1 3.22Å; H187-F226 AromaticContact NE2-CD1 3.53Å; R224-F226 HydrophobicContact CB-CE1 4.24Å; R224-F226 HydrophobicContact CB-CE2 3.7Å; R224-F226 HydrophobicContact CB-CZ 3.44Å; R224-F226 VanDerWaalsContact CB-CZ 3.44Å; R224-F226 HydrophobicContact CG-CZ 4.21Å
227	T	96.3	Very high	97	Very high	84 Å²	84	37.1 Å²	37.1	52%	0.515	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.4	168.8	-57.2	0	0	0	0	110.1	Q166 R181	Q166-T227 PolarHBondContact NE2-OG1 3.28Å; Q166-T227 PolarHBondContact OE1-OG1 2.86Å; Q166-T227 VanDerWaalsContact OE1-OG1 3.09Å; R181-T227 PolarHBondContact NH2-O 3Å
228	V	96.2	Very high	97.3	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.03	20%	0.204	C	C	.	.			trans	-102.4	157.1	178.6	-68.1	0	0	0	0	112.1	L160 S165 L167 L179 D232 V315	L160-V228 HydrophobicContact CD1-CG2 3.57Å; S165-V228 VanDerWaalsContact O-CG2 3.26Å; S165-V228 WeakPolarHBondContact O-CG2 3.26Å; S165-V228 PolarHBondContact O-N 2.7Å; L167-V228 HydrophobicContact CB-CG1 3.57Å; L167-V228 HydrophobicContact CD1-CG1 3.98Å; L167-V228 HydrophobicContact CG-CG1 4.44Å; L179-V228 HydrophobicContact CD1-CG1 3.94Å; V228-D232 WeakPolarHBondContact CA-OD2 3.28Å; V228-V315 HydrophobicContact CB-CG1 4.47Å; V228-V315 HydrophobicContact CB-CG2 4.24Å; V228-V315 HydrophobicContact CG1-CG2 4.45Å; V228-V315 HydrophobicContact CG2-CG1 4.23Å; V228-V315 HydrophobicContact CG2-CG2 4.45Å
229	Q	93.9	Very high	97.4	Very high	106 Å²	106	36 Å²	36	50%	0.495	20%	0.201	S	C	.	.			trans	-127.6	154.8	175.9	-63.7	176.2	-7.8	0	0	109.4	G231 D232	Q229-G231 PolarHBondContact O-N 3.45Å; Q229-D232 PolarHBondContact N-OD2 3.41Å; Q229-D232 VanDerWaalsContact O-CB 3.3Å; Q229-D232 WeakPolarHBondContact O-CB 3.46Å; Q229-D232 PolarHBondContact O-N 3.45Å
230	S	93.8	Very high	97.5	Very high	41 Å²	41	28.7 Å²	28.7	29%	0.287	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	129	173.7	-179.5	0	0	0	0	110.5	R25 V315	R25-S230 PolarHBondContact NH2-OG 3.48Å; S230-V315 CarbonylContact C-O 3.57Å; S230-V315 WeakPolarHBondContact CA-O 3.09Å; S230-V315 PolarHBondContact OG-O 3.42Å
231	G	95.8	Very high	97.5	Very high	19 Å²	19	26.8 Å²	26.8	20%	0.196	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	98	-9.4	-173.7	0	0	0	0	0	114.1	Q229 V315	Q229-G231 PolarHBondContact O-N 3.45Å; G231-V315 PolarHBondContact N-O 3.41Å
232	D	97.8	Very high	97.5	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.016	15%	0.154	C	C	.	.			trans	-62.2	140.8	166.7	-72.4	-14.2	0	0	0	109.9	L179 L180 R181 V228 Q229 V315	L179-D232 HydrophobicContact CD2-CB 4.47Å; L180-D232 WeakPolarHBondContact O-CA 3.4Å; R181-D232 WeakPolarHBondContact CB-OD1 3.44Å; R181-D232 VanDerWaalsContact CG-OD1 3.26Å; R181-D232 WeakPolarHBondContact CG-OD1 3.47Å; R181-D232 IonicContact CZ-OD1 2.91Å; R181-D232 IonicContact CZ-OD2 3.6Å; R181-D232 IonicContact NE-OD1 2.92Å; R181-D232 PolarHBondContact NE-OD1 3.19Å; R181-D232 IonicContact NE-OD2 2.7Å; R181-D232 PolarHBondContact NE-OD2 2.68Å; R181-D232 IonicContact NH2-OD1 3.26Å; R181-D232 IonicContact NH2-OD2 3.49Å; R181-D232 PolarHBondContact NH2-OD2 3.09Å; V228-D232 WeakPolarHBondContact CA-OD2 3.28Å; Q229-D232 PolarHBondContact N-OD2 3.41Å; Q229-D232 VanDerWaalsContact O-CB 3.3Å; Q229-D232 WeakPolarHBondContact O-CB 3.46Å; Q229-D232 PolarHBondContact O-N 3.45Å; D232-V315 HydrophobicContact CB-CB 4.37Å; D232-V315 HydrophobicContact CB-CG2 4.16Å; D232-V315 PolarHBondContact O-N 3.15Å
233	C	98.4	Very high	97.5	Very high	9 Å²	9	26.1 Å²	26.1	6%	0.061	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.9	-179.6	-61.5	0	0	0	0	110.2	L180 M254 L312 A313	L180-C233 HydrophobicContact CB-CB 4.36Å; L180-C233 PolarHBondContact N-O 2.79Å; L180-C233 PolarHBondContact O-N 2.85Å; C233-M254 HydrophobicContact CB-CE 3.47Å; C233-M254 VanDerWaalsContact CB-CE 3.47Å; C233-L312 HydrophobicContact CB-CD1 4.45Å; C233-A313 CarbonylContact C-O 3.51Å; C233-A313 WeakPolarHBondContact CA-O 3.24Å
234	I	98.7	Very high	97.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.8	177.4	-47.3	-54.1	0	0	0	108.4	F43 V158 L167 L178 L179 L312 A313	F43-I234 HydrophobicContact CE1-CG1 3.81Å; F43-I234 HydrophobicContact CZ-CG1 4.03Å; V158-I234 HydrophobicContact CG1-CG2 4.42Å; L167-I234 HydrophobicContact CD1-CD1 3.5Å; L167-I234 HydrophobicContact CD1-CG1 3.73Å; L178-I234 WeakPolarHBondContact O-CA 3.38Å; L179-I234 HydrophobicContact CB-CD1 4.07Å; L179-I234 HydrophobicContact CD1-CD1 3.84Å; L179-I234 HydrophobicContact CG-CD1 3.62Å; I234-L312 WeakPolarHBondContact O-CA 3.32Å; I234-A313 HydrophobicContact CB-CB 4.44Å; I234-A313 PolarHBondContact N-O 3.36Å; I234-A313 PolarHBondContact O-N 3Å
235	V	98.8	Very high	97.6	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	107.8	167.3	178.3	0	0	0	0	106.7	F177 L178 L180 L241 I250 M254 V310 L312	F177-V235 CarbonylContact C-O 3.32Å; F177-V235 WeakPolarHBondContact CA-O 3.14Å; L178-V235 HydrophobicContact CB-CB 4.27Å; L178-V235 HydrophobicContact CD1-CB 4.49Å; L178-V235 PolarHBondContact N-O 3.29Å; L178-V235 PolarHBondContact O-N 2.86Å; L180-V235 HydrophobicContact CD1-CB 4.49Å; L180-V235 HydrophobicContact CD1-CG2 3.84Å; V235-L241 HydrophobicContact CG1-CD2 3.86Å; V235-I250 HydrophobicContact CG2-CG2 4.33Å; V235-M254 HydrophobicContact CG2-CG 4.47Å; V235-M254 HydrophobicContact CG2-SD 4.04Å; V235-V310 HydrophobicContact CG1-CG1 4.22Å; V235-L312 HydrophobicContact CG2-CD1 3.94Å
236	L	98.9	Very high	97.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.1	175	172.7	67.3	0	0	0	107.9	L80 V82 C156 V158 G176 F177 I311	L80-L236 HydrophobicContact CB-CD2 3.66Å; V82-L236 HydrophobicContact CB-CG 4.46Å; V82-L236 HydrophobicContact CG1-CD2 4.21Å; V82-L236 HydrophobicContact CG1-CG 3.93Å; V82-L236 HydrophobicContact CG2-CD1 3.71Å; V82-L236 HydrophobicContact CG2-CD2 4.43Å; V82-L236 HydrophobicContact CG2-CG 3.8Å; C156-L236 HydrophobicContact CB-CD1 3.82Å; C156-L236 WeakPolarHBondContact SG-CD1 3.32Å; V158-L236 HydrophobicContact CG2-CD1 4.18Å; V158-L236 HydrophobicContact CG2-CD2 4.43Å; G176-L236 WeakPolarHBondContact O-CD1 3.49Å; F177-L236 HydrophobicContact CB-CB 4.49Å; F177-L236 HydrophobicContact CB-CD1 4.01Å; L236-I311 HydrophobicContact CB-CB 4.33Å; L236-I311 HydrophobicContact CD2-CD1 4.2Å; L236-I311 PolarHBondContact N-O 3.01Å; L236-I311 PolarHBondContact O-N 3.34Å
237	A	98.9	Very high	97.7	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	160.6	-172.7	0	0	0	0	0	113.4	G176 L241 F242 T309 V310	G176-A237 PolarHBondContact N-O 3.36Å; G176-A237 PolarHBondContact O-N 3.39Å; A237-L241 HydrophobicContact CB-CB 3.82Å; A237-L241 HydrophobicContact CB-CD2 3.41Å; A237-L241 VanDerWaalsContact CB-CD2 3.41Å; A237-L241 HydrophobicContact CB-CG 4.23Å; A237-F242 HydrophobicContact CB-CE2 3.91Å; A237-F242 HydrophobicContact CB-CZ 4.17Å; A237-T309 CarbonylContact C-O 3.5Å; A237-T309 WeakPolarHBondContact CA-O 3.29Å; A237-T309 VanDerWaalsContact CB-O 3.28Å; A237-T309 WeakPolarHBondContact CB-O 3.4Å; A237-V310 HydrophobicContact CB-CG2 4.15Å
238	T	98.9	Very high	97.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.			trans	-76.2	167.5	167	53.6	0	0	0	0	111.2	D67 V82 D84 S175 G240 L241 T309	D67-T238 HydrophobicContact CB-CG2 4.25Å; D67-T238 WeakPolarHBondContact OD2-CB 3.28Å; D67-T238 WeakPolarHBondContact OD2-CG2 3.4Å; D67-T238 PolarHBondContact OD2-OG1 3.09Å; V82-T238 HydrophobicContact CB-CG2 4.1Å; V82-T238 HydrophobicContact CG2-CG2 4.39Å; D84-T238 HydrophobicContact CB-CG2 4.05Å; S175-T238 WeakPolarHBondContact OG-CA 3.35Å; T238-G240 PolarHBondContact O-N 3.26Å; T238-L241 PolarHBondContact O-N 2.85Å; T238-T309 PolarHBondContact N-O 2.78Å; T238-T309 PolarHBondContact OG1-N 3.35Å
239	D	98.5	Very high	97.9	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-61	-28.4	-175.5	71.7	-30.9	0	0	0	112.4	L241 F242 D243 K304	D239-L241 CarbonylContact O-C 3.58Å; D239-L241 PolarHBondContact O-N 2.92Å; D239-F242 PolarHBondContact O-N 3.01Å; D239-D243 WeakPolarHBondContact O-CB 3.46Å; D239-D243 PolarHBondContact O-N 3.09Å; D239-K304 IonicContact OD2-NZ 2.89Å; D239-K304 PolarHBondContact OD2-NZ 3.46Å
240	G	98.7	Very high	98.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-51.5	-29	174.2	0	0	0	0	0	114.2	T238 N244 D307	T238-G240 PolarHBondContact O-N 3.26Å; G240-N244 PolarHBondContact O-ND2 2.94Å; G240-D307 WeakPolarHBondContact CA-O 3.34Å
241	L	98.9	Very high	98.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-72.3	-57.9	167.3	176.6	63.8	0	0	0	111.6	V235 A237 T238 D239 D243 N244 M245 I250 I272 A276 V310	V235-L241 HydrophobicContact CG1-CD2 3.86Å; A237-L241 HydrophobicContact CB-CB 3.82Å; A237-L241 HydrophobicContact CB-CD2 3.41Å; A237-L241 VanDerWaalsContact CB-CD2 3.41Å; A237-L241 HydrophobicContact CB-CG 4.23Å; T238-L241 PolarHBondContact O-N 2.85Å; D239-L241 CarbonylContact O-C 3.58Å; D239-L241 PolarHBondContact O-N 2.92Å; L241-D243 VanDerWaalsContact C-N 3.31Å; L241-D243 PolarHBondContact O-N 3.27Å; L241-N244 PolarHBondContact O-N 3.2Å; L241-M245 HydrophobicContact CD1-CB 3.93Å; L241-M245 HydrophobicContact CD1-CG 3.9Å; L241-M245 HydrophobicContact CD1-SD 3.4Å; L241-M245 WeakPolarHBondContact CD1-SD 3.4Å; L241-M245 PolarHBondContact O-N 3.35Å; L241-I250 HydrophobicContact CD1-CD1 4.36Å; L241-I250 HydrophobicContact CD2-CD1 4.1Å; L241-I250 HydrophobicContact CG-CD1 4.19Å; L241-I272 HydrophobicContact CD1-CG2 3.6Å; L241-I272 HydrophobicContact CD2-CG2 4.15Å; L241-A276 HydrophobicContact CD1-CB 3.77Å; L241-V310 HydrophobicContact CB-CG2 4.42Å; L241-V310 HydrophobicContact CD2-CG2 4.16Å
242	F	98.6	Very high	98.5	Very high	28 Å²	28	22.7 Å²	22.7	12%	0.123	11%	0.11	C	C	.	.	H	α-helix	trans	-71.4	-23.4	-168.7	-62.3	-63	0	0	0	114.3	L178 A237 D239 N244 I250 P288	L178-F242 HydrophobicContact CD1-CE1 3.96Å; L178-F242 HydrophobicContact CD2-CE1 4.09Å; L178-F242 HydrophobicContact CG-CE1 3.86Å; L178-F242 HydrophobicContact CG-CZ 4.28Å; A237-F242 HydrophobicContact CB-CE2 3.91Å; A237-F242 HydrophobicContact CB-CZ 4.17Å; D239-F242 PolarHBondContact O-N 3.01Å; F242-N244 VanDerWaalsContact C-N 3.31Å; F242-I250 HydrophobicContact CD1-CD1 4.42Å; F242-I250 HydrophobicContact CE1-CD1 4.35Å; F242-P288 WeakPolarHBondContact O-CB 3.49Å
243	D	98.4	Very high	98.5	Very high	5 Å²	5	23.3 Å²	23.3	3%	0.027	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-22.9	175	-85.9	-10.1	0	0	0	112.5	D239 L241 S287 P288 F289 K292 K304	D239-D243 WeakPolarHBondContact O-CB 3.46Å; D239-D243 PolarHBondContact O-N 3.09Å; L241-D243 VanDerWaalsContact C-N 3.31Å; L241-D243 PolarHBondContact O-N 3.27Å; D243-S287 WeakPolarHBondContact O-CB 3.43Å; D243-P288 VanDerWaalsContact O-CD 3.29Å; D243-P288 WeakPolarHBondContact O-CD 3.45Å; D243-F289 HydrophobicContact CB-CB 3.8Å; D243-F289 WeakPolarHBondContact O-CB 3.37Å; D243-F289 PolarHBondContact O-N 3.15Å; D243-K292 IonicContact OD1-NZ 3.69Å; D243-K304 HydrophobicContact CB-CB 4.45Å; D243-K304 HydrophobicContact CB-CD 3.97Å; D243-K304 WeakPolarHBondContact OD2-CD 3.44Å; D243-K304 WeakPolarHBondContact OD2-CE 3.4Å; D243-K304 IonicContact OD2-NZ 3.37Å; D243-K304 PolarHBondContact OD2-NZ 3.35Å
244	N	98.7	Very high	98.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-31.3	-173.3	-67.2	-60.7	0	0	0	114	G240 L241 F242 L279 S280 Y285 G303 K304	G240-N244 PolarHBondContact O-ND2 2.94Å; L241-N244 PolarHBondContact O-N 3.2Å; F242-N244 VanDerWaalsContact C-N 3.31Å; N244-L279 HydrophobicContact CB-CB 4.29Å; N244-S280 VanDerWaalsContact CG-CB 3.49Å; N244-S280 VanDerWaalsContact ND2-CB 3.34Å; N244-S280 WeakPolarHBondContact ND2-CB 3.22Å; N244-S280 VanDerWaalsContact OD1-CA 3.26Å; N244-S280 WeakPolarHBondContact OD1-CA 3.43Å; N244-Y285 VanDerWaalsContact O-CE1 3.3Å; N244-Y285 WeakPolarHBondContact O-CE1 3.45Å; N244-Y285 PolarHBondContact O-OH 3.23Å; N244-G303 VanDerWaalsContact OD1-CA 3.31Å; N244-G303 WeakPolarHBondContact OD1-CA 3.47Å; N244-K304 PolarHBondContact ND2-O 2.96Å; N244-K304 PolarHBondContact OD1-N 3.02Å; N244-K304 PolarHBondContact OD1-O 2.83Å
245	M	98.4	Very high	98.4	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.143	C	C	.	.	S	Bend	trans	-104.9	121	180	-73.9	-169.6	73.8	0	0	112.3	L241 L249 I250 E253 I272 Q275 A276 L279	L241-M245 HydrophobicContact CD1-CB 3.93Å; L241-M245 HydrophobicContact CD1-CG 3.9Å; L241-M245 HydrophobicContact CD1-SD 3.4Å; L241-M245 WeakPolarHBondContact CD1-SD 3.4Å; L241-M245 PolarHBondContact O-N 3.35Å; M245-L249 HydrophobicContact CE-CB 4.11Å; M245-L249 HydrophobicContact CE-CD2 3.65Å; M245-L249 HydrophobicContact CE-CG 3.59Å; M245-L249 HydrophobicContact CG-CD2 4.42Å; M245-I250 HydrophobicContact CB-CD1 4.29Å; M245-I250 HydrophobicContact CB-CG1 4.03Å; M245-I250 HydrophobicContact CE-CG1 4.11Å; M245-E253 HydrophobicContact CE-CG 3.99Å; M245-I272 HydrophobicContact SD-CG2 4.13Å; M245-Q275 HydrophobicContact CE-CB 3.84Å; M245-Q275 HydrophobicContact SD-CB 3.86Å; M245-A276 HydrophobicContact CG-CB 3.91Å; M245-A276 HydrophobicContact SD-CB 3.84Å; M245-A276 PolarHBondContact SD-N 3.25Å; M245-L279 HydrophobicContact CG-CD1 3.93Å
246	P	98	Very high	98.3	Very high	30 Å²	30	32.5 Å²	32.5	20%	0.195	16%	0.163	C	C	.	.			trans	-62.7	146.1	167.5	-20.1	33.1	0	0	0	110.6	Q248 L249 I250 Y285 P288	P246-Q248 PolarHBondContact O-N 3.18Å; P246-Q248 VanDerWaalsContact O-N 3.15Å; P246-L249 WeakPolarHBondContact O-CA 3.31Å; P246-L249 WeakPolarHBondContact O-CB 3.36Å; P246-L249 PolarHBondContact O-N 3.2Å; P246-I250 PolarHBondContact O-N 2.62Å; P246-Y285 WeakPolarHBondContact CD-OH 3.22Å; P246-Y285 WeakPolarHBondContact CG-OH 3.43Å; P246-P288 HydrophobicContact CG-CG 4.22Å
247	L	98.3	Very high	98.2	Very high	42 Å²	42	33.8 Å²	33.8	22%	0.22	17%	0.17	C	C	.	.	H	α-helix	trans	-55.2	-37.1	-179.1	-63.3	-174.5	0	0	0	112.9	L178 I185 L249 I250 E251	L178-L247 HydrophobicContact CD1-CD2 3.97Å; L178-L247 HydrophobicContact CD2-CD2 3.98Å; I185-L247 HydrophobicContact CD1-CB 3.75Å; I185-L247 HydrophobicContact CD1-CD1 4.37Å; I185-L247 HydrophobicContact CD1-CD2 4.25Å; I185-L247 HydrophobicContact CD1-CG 4.34Å; L247-L249 VanDerWaalsContact C-N 3.26Å; L247-L249 PolarHBondContact O-N 3.13Å; L247-I250 HydrophobicContact CD2-CD1 4.25Å; L247-I250 WeakPolarHBondContact O-CB 2.99Å; L247-I250 PolarHBondContact O-N 2.97Å; L247-I250 VanDerWaalsContact O-N 3.14Å; L247-E251 PolarHBondContact O-N 3.07Å
248	Q	97.9	Very high	98	Very high	135 Å²	135	39.9 Å²	39.9	63%	0.631	20%	0.203	S	C	*	.	H	α-helix	trans	-63.4	-31.6	177.4	-63.6	78.8	9	0	0	112.6	P246 K252	P246-Q248 PolarHBondContact O-N 3.18Å; P246-Q248 VanDerWaalsContact O-N 3.15Å; Q248-K252 WeakPolarHBondContact O-CB 3.49Å; Q248-K252 PolarHBondContact O-N 3.34Å
249	L	98	Very high	97.8	Very high	44 Å²	44	42 Å²	42	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-74.3	-36.6	175.9	-171.3	63.8	0	0	0	110.7	M245 P246 L247 K252 E253 L279	M245-L249 HydrophobicContact CE-CB 4.11Å; M245-L249 HydrophobicContact CE-CD2 3.65Å; M245-L249 HydrophobicContact CE-CG 3.59Å; M245-L249 HydrophobicContact CG-CD2 4.42Å; P246-L249 WeakPolarHBondContact O-CA 3.31Å; P246-L249 WeakPolarHBondContact O-CB 3.36Å; P246-L249 PolarHBondContact O-N 3.2Å; L247-L249 VanDerWaalsContact C-N 3.26Å; L247-L249 PolarHBondContact O-N 3.13Å; L249-K252 HydrophobicContact CD1-CD 4.28Å; L249-K252 WeakPolarHBondContact O-CB 2.86Å; L249-K252 PolarHBondContact O-N 2.88Å; L249-E253 WeakPolarHBondContact O-CG 3.49Å; L249-E253 PolarHBondContact O-N 3.34Å; L249-L279 HydrophobicContact CD2-CD1 3.57Å
250	I	98.6	Very high	97.6	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-47	172.6	-58.5	172.9	0	0	0	110.1	L178 V235 L241 F242 M245 P246 L247 K252 E253 M254	L178-I250 HydrophobicContact CD1-CD1 3.9Å; L178-I250 HydrophobicContact CD1-CG2 4Å; V235-I250 HydrophobicContact CG2-CG2 4.33Å; L241-I250 HydrophobicContact CD1-CD1 4.36Å; L241-I250 HydrophobicContact CD2-CD1 4.1Å; L241-I250 HydrophobicContact CG-CD1 4.19Å; F242-I250 HydrophobicContact CD1-CD1 4.42Å; F242-I250 HydrophobicContact CE1-CD1 4.35Å; M245-I250 HydrophobicContact CB-CD1 4.29Å; M245-I250 HydrophobicContact CB-CG1 4.03Å; M245-I250 HydrophobicContact CE-CG1 4.11Å; P246-I250 PolarHBondContact O-N 2.62Å; L247-I250 HydrophobicContact CD2-CD1 4.25Å; L247-I250 WeakPolarHBondContact O-CB 2.99Å; L247-I250 PolarHBondContact O-N 2.97Å; L247-I250 VanDerWaalsContact O-N 3.14Å; I250-K252 VanDerWaalsContact C-N 3.29Å; I250-K252 PolarHBondContact O-N 2.86Å; I250-E253 PolarHBondContact O-N 3.04Å; I250-M254 HydrophobicContact CG2-CG 4.35Å; I250-M254 WeakPolarHBondContact O-CB 3.37Å; I250-M254 VanDerWaalsContact O-CG 3.24Å; I250-M254 WeakPolarHBondContact O-CG 3.34Å; I250-M254 PolarHBondContact O-N 3.06Å
251	E	98.5	Very high	97.4	Very high	32 Å²	32	51.2 Å²	51.2	15%	0.15	26%	0.259	C	S	.	.	H	α-helix	trans	-56.4	-42.5	173.9	-69.9	-171.9	146.5	0	0	112.1	L180 R184 I185 L247 M254 A255	L180-E251 HydrophobicContact CD2-CG 4.23Å; R184-E251 WeakPolarHBondContact CA-OE1 3.39Å; R184-E251 IonicContact NH1-OE2 3.41Å; R184-E251 PolarHBondContact NH1-OE2 3.06Å; I185-E251 HydrophobicContact CD1-CG 3.74Å; I185-E251 HydrophobicContact CG1-CG 3.83Å; I185-E251 PolarHBondContact N-OE1 3.24Å; L247-E251 PolarHBondContact O-N 3.07Å; E251-M254 PolarHBondContact O-N 3.47Å; E251-A255 PolarHBondContact O-N 3.44Å
252	K	98.3	Very high	97.4	Very high	143 Å²	143	55 Å²	55	62%	0.622	28%	0.284	S	S	*	.	H	α-helix	trans	-64.4	-42.7	177	-175.4	-176.5	177.7	-175.1	0	112.4	Q248 L249 I250 M254 A255	Q248-K252 WeakPolarHBondContact O-CB 3.49Å; Q248-K252 PolarHBondContact O-N 3.34Å; L249-K252 HydrophobicContact CD1-CD 4.28Å; L249-K252 WeakPolarHBondContact O-CB 2.86Å; L249-K252 PolarHBondContact O-N 2.88Å; I250-K252 VanDerWaalsContact C-N 3.29Å; I250-K252 PolarHBondContact O-N 2.86Å; K252-M254 VanDerWaalsContact C-N 3.3Å; K252-A255 WeakPolarHBondContact O-CB 3.4Å; K252-A255 PolarHBondContact O-N 2.95Å
253	E	98.1	Very high	97.3	Very high	15 Å²	15	59.9 Å²	59.9	7%	0.07	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-38.7	177.2	-70.8	-68.5	100.5	0	0	111.1	M245 L249 I250 A255 R256 S271 I272 Q275	M245-E253 HydrophobicContact CE-CG 3.99Å; L249-E253 WeakPolarHBondContact O-CG 3.49Å; L249-E253 PolarHBondContact O-N 3.34Å; I250-E253 PolarHBondContact O-N 3.04Å; E253-A255 VanDerWaalsContact C-N 3.34Å; E253-R256 WeakPolarHBondContact O-CB 3.27Å; E253-R256 PolarHBondContact O-N 3.2Å; E253-R256 PolarHBondContact O-NE 3.46Å; E253-R256 PolarHBondContact O-NH2 3.09Å; E253-R256 IonicContact OE1-CZ 2.74Å; E253-R256 IonicContact OE1-NE 2.92Å; E253-R256 IonicContact OE1-NH1 3.18Å; E253-R256 IonicContact OE1-NH2 3.5Å; E253-R256 IonicContact OE2-CZ 3.56Å; E253-R256 IonicContact OE2-NE 2.69Å; E253-R256 IonicContact OE2-NH1 3.66Å; E253-R256 PolarHBondContact OE2-NH1 3.35Å; E253-R256 IonicContact OE2-NH2 3.62Å; E253-R256 PolarHBondContact OE2-NH2 2.95Å; E253-S271 WeakPolarHBondContact OE2-CB 3.35Å; E253-S271 PolarHBondContact OE2-OG 3.21Å; E253-I272 HydrophobicContact CB-CD1 4.31Å; E253-I272 HydrophobicContact CB-CG1 3.62Å; E253-I272 HydrophobicContact CG-CG1 4.24Å; E253-Q275 HydrophobicContact CG-CG 4.46Å
254	M	97.9	Very high	97.3	Very high	11 Å²	11	60.1 Å²	60.1	5%	0.054	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-30.2	176.5	-75	-61	-56.4	0	0	113.4	L180 C233 V235 I250 E251 K252 R256 L257 V268 I272 L312	L180-M254 HydrophobicContact CD2-CB 4.11Å; L180-M254 HydrophobicContact CD2-CG 3.91Å; C233-M254 HydrophobicContact CB-CE 3.47Å; C233-M254 VanDerWaalsContact CB-CE 3.47Å; V235-M254 HydrophobicContact CG2-CG 4.47Å; V235-M254 HydrophobicContact CG2-SD 4.04Å; I250-M254 HydrophobicContact CG2-CG 4.35Å; I250-M254 WeakPolarHBondContact O-CB 3.37Å; I250-M254 VanDerWaalsContact O-CG 3.24Å; I250-M254 WeakPolarHBondContact O-CG 3.34Å; I250-M254 PolarHBondContact O-N 3.06Å; E251-M254 PolarHBondContact O-N 3.47Å; K252-M254 VanDerWaalsContact C-N 3.3Å; M254-R256 PolarHBondContact O-N 3.03Å; M254-R256 VanDerWaalsContact O-N 3.09Å; M254-L257 HydrophobicContact CE-CD2 4.21Å; M254-L257 VanDerWaalsContact O-CB 3.29Å; M254-L257 WeakPolarHBondContact O-CB 3.29Å; M254-L257 PolarHBondContact O-N 3.02Å; M254-V268 HydrophobicContact SD-CG1 3.86Å; M254-I272 HydrophobicContact CG-CD1 4.16Å; M254-I272 HydrophobicContact SD-CD1 3.76Å; M254-L312 HydrophobicContact CE-CD1 3.73Å; M254-L312 HydrophobicContact CE-CD2 4.46Å; M254-L312 HydrophobicContact SD-CD1 3.67Å; M254-L312 HydrophobicContact SD-CD2 4.01Å
255	A	96.9	Very high	97.3	Very high	78 Å²	78	60.1 Å²	60.1	65%	0.645	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-12.7	174.6	0	0	0	0	0	114	E251 K252 E253 L257	E251-A255 PolarHBondContact O-N 3.44Å; K252-A255 WeakPolarHBondContact O-CB 3.4Å; K252-A255 PolarHBondContact O-N 2.95Å; E253-A255 VanDerWaalsContact C-N 3.34Å; A255-L257 VanDerWaalsContact C-N 3.34Å
256	R	97.1	Very high	97.3	Very high	114 Å²	114	63.3 Å²	63.3	43%	0.43	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-1	173.9	-60.1	174.4	-59.9	154.7	18.4	113.5	E253 M254 D258 S271	E253-R256 WeakPolarHBondContact O-CB 3.27Å; E253-R256 PolarHBondContact O-N 3.2Å; E253-R256 PolarHBondContact O-NE 3.46Å; E253-R256 PolarHBondContact O-NH2 3.09Å; E253-R256 IonicContact OE1-CZ 2.74Å; E253-R256 IonicContact OE1-NE 2.92Å; E253-R256 IonicContact OE1-NH1 3.18Å; E253-R256 IonicContact OE1-NH2 3.5Å; E253-R256 IonicContact OE2-CZ 3.56Å; E253-R256 IonicContact OE2-NE 2.69Å; E253-R256 IonicContact OE2-NH1 3.66Å; E253-R256 PolarHBondContact OE2-NH1 3.35Å; E253-R256 IonicContact OE2-NH2 3.62Å; E253-R256 PolarHBondContact OE2-NH2 2.95Å; M254-R256 PolarHBondContact O-N 3.03Å; M254-R256 VanDerWaalsContact O-N 3.09Å; R256-D258 PolarHBondContact O-N 2.76Å; R256-D258 VanDerWaalsContact O-N 3.1Å; R256-S271 VanDerWaalsContact CZ-OG 3.31Å; R256-S271 PolarHBondContact NH1-OG 3.23Å; R256-S271 PolarHBondContact NH2-OG 3.39Å
257	L	97.1	Very high	97.3	Very high	27 Å²	27	69.8 Å²	69.8	14%	0.141	35%	0.349	C	S	.	.			trans	-73.3	98.9	173.6	-172.6	66.2	0	0	0	109.3	M254 A255 S259 F260 A264 V265 V268 V314	M254-L257 HydrophobicContact CE-CD2 4.21Å; M254-L257 VanDerWaalsContact O-CB 3.29Å; M254-L257 WeakPolarHBondContact O-CB 3.29Å; M254-L257 PolarHBondContact O-N 3.02Å; A255-L257 VanDerWaalsContact C-N 3.34Å; L257-S259 VanDerWaalsContact CD1-O 3.22Å; L257-S259 WeakPolarHBondContact CD1-O 3.48Å; L257-F260 HydrophobicContact CD2-CD1 4.27Å; L257-F260 HydrophobicContact CD2-CE1 4.35Å; L257-A264 HydrophobicContact CD1-CB 4.3Å; L257-V265 HydrophobicContact CD1-CG2 4.17Å; L257-V268 HydrophobicContact CB-CG2 4.03Å; L257-V268 HydrophobicContact CD1-CB 4.46Å; L257-V268 HydrophobicContact CD1-CG2 3.98Å; L257-V314 HydrophobicContact CD2-CG2 3.89Å
258	D	93.5	Very high	97.4	Very high	128 Å²	128	68 Å²	68	68%	0.684	34%	0.339	S	S	*	.			trans	-87.3	-19	-175.1	58.3	14.5	0	0	0	114	R256	R256-D258 PolarHBondContact O-N 2.76Å; R256-D258 VanDerWaalsContact O-N 3.1Å
259	S	95.2	Very high	97.4	Very high	44 Å²	44	61.5 Å²	61.5	31%	0.308	31%	0.309	S	S	.	.			trans	-155.3	163.7	-177.3	60.1	0	0	0	0	110.2	L257 E261 A264	L257-S259 VanDerWaalsContact CD1-O 3.22Å; L257-S259 WeakPolarHBondContact CD1-O 3.48Å; S259-E261 VanDerWaalsContact C-N 3.31Å; S259-A264 WeakPolarHBondContact OG-CB 3.45Å
260	F	94.3	Very high	97.4	Very high	67 Å²	67	61.3 Å²	61.3	29%	0.294	31%	0.312	S	S	.	.			trans	-96.9	14.5	177.6	-53.1	-27.7	0	0	0	112.4	L257 V314 T316	L257-F260 HydrophobicContact CD2-CD1 4.27Å; L257-F260 HydrophobicContact CD2-CE1 4.35Å; F260-V314 HydrophobicContact CB-CG1 4.21Å; F260-V314 HydrophobicContact CD1-CG1 3.64Å; F260-V314 HydrophobicContact CD1-CG2 4.46Å; F260-V314 HydrophobicContact CD2-CG1 4.12Å; F260-V314 HydrophobicContact CE1-CG1 3.96Å; F260-V314 HydrophobicContact CE2-CG1 4.4Å; F260-V314 HydrophobicContact CG-CG1 3.73Å; F260-V314 HydrophobicContact CZ-CG1 4.33Å; F260-T316 HydrophobicContact CB-CG2 4.1Å; F260-T316 HydrophobicContact CD2-CG2 4.33Å
261	E	95.6	Very high	97.4	Very high	130 Å²	130	62.4 Å²	62.4	61%	0.607	32%	0.319	S	S	*	.	S	Bend	trans	-67.5	142.5	175.1	-69.9	-57.5	138.1	0	0	110.4	S259 L263 A264 V265	S259-E261 VanDerWaalsContact C-N 3.31Å; E261-L263 PolarHBondContact O-N 3.34Å; E261-A264 PolarHBondContact O-N 2.82Å; E261-V265 PolarHBondContact O-N 2.97Å; E261-V265 VanDerWaalsContact O-N 3.09Å
262	P	97.1	Very high	97.5	Very high	80 Å²	80	60.9 Å²	60.9	52%	0.519	31%	0.312	S	S	.	.	H	α-helix	trans	-50.8	-37.6	-176.1	-29.1	34.3	0	0	0	114.4	V44 Q266	V44-P262 HydrophobicContact CG1-CB 4.29Å; V44-P262 HydrophobicContact CG1-CG 4.01Å; P262-Q266 WeakPolarHBondContact O-CB 3.36Å; P262-Q266 PolarHBondContact O-N 3.44Å
263	L	97.9	Very high	97.5	Very high	130 Å²	130	54.1 Å²	54.1	68%	0.681	28%	0.283	S	S	*	.	H	α-helix	trans	-69.4	-36.5	179.6	-176.5	60.9	0	0	0	113	E261 R267	E261-L263 PolarHBondContact O-N 3.34Å; L263-R267 WeakPolarHBondContact O-CB 3.5Å; L263-R267 PolarHBondContact O-N 3.2Å
264	A	98.2	Very high	97.5	Very high	11 Å²	11	59.1 Å²	59.1	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-69.4	-43.6	176.4	0	0	0	0	0	110.7	L257 S259 E261 Q266 R267 V268	L257-A264 HydrophobicContact CD1-CB 4.3Å; S259-A264 WeakPolarHBondContact OG-CB 3.45Å; E261-A264 PolarHBondContact O-N 2.82Å; A264-Q266 VanDerWaalsContact C-N 3.35Å; A264-Q266 PolarHBondContact O-N 3.4Å; A264-R267 PolarHBondContact O-N 3.19Å; A264-V268 PolarHBondContact O-N 3.36Å; A264-V268 VanDerWaalsContact O-N 3.13Å
265	V	98.5	Very high	97.5	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-46.6	173.6	-177.3	0	0	0	0	110.4	V44 A46 L257 E261 R267 V268 C269 L312 V314	V44-V265 HydrophobicContact CG1-CB 4.47Å; V44-V265 HydrophobicContact CG1-CG2 3.97Å; A46-V265 HydrophobicContact CB-CG1 3.89Å; L257-V265 HydrophobicContact CD1-CG2 4.17Å; E261-V265 PolarHBondContact O-N 2.97Å; E261-V265 VanDerWaalsContact O-N 3.09Å; V265-R267 PolarHBondContact O-N 3.46Å; V265-V268 PolarHBondContact O-N 3.11Å; V265-C269 VanDerWaalsContact O-CB 3.32Å; V265-C269 WeakPolarHBondContact O-CB 3.35Å; V265-C269 PolarHBondContact O-N 2.63Å; V265-L312 HydrophobicContact CG1-CB 4.38Å; V265-L312 HydrophobicContact CG1-CD2 4.05Å; V265-L312 HydrophobicContact CG1-CG 3.9Å; V265-V314 HydrophobicContact CG1-CG2 4.33Å; V265-V314 HydrophobicContact CG2-CG2 3.74Å
266	Q	98.7	Very high	97.6	Very high	68 Å²	68	57.6 Å²	57.6	32%	0.318	28%	0.281	S	S	.	.	H	α-helix	trans	-60.6	-42.9	176.7	-175.9	65.2	64.5	0	0	112.4	A46 C47 P262 A264 V268 C269 S270	A46-Q266 HydrophobicContact CB-CB 4.02Å; C47-Q266 PolarHBondContact O-NE2 3.12Å; P262-Q266 WeakPolarHBondContact O-CB 3.36Å; P262-Q266 PolarHBondContact O-N 3.44Å; A264-Q266 VanDerWaalsContact C-N 3.35Å; A264-Q266 PolarHBondContact O-N 3.4Å; Q266-V268 PolarHBondContact O-N 2.95Å; Q266-C269 WeakPolarHBondContact O-CB 3.4Å; Q266-C269 PolarHBondContact O-N 3.14Å; Q266-S270 PolarHBondContact NE2-OG 3.32Å; Q266-S270 VanDerWaalsContact NE2-OG 3.07Å; Q266-S270 WeakPolarHBondContact O-CB 3.38Å; Q266-S270 PolarHBondContact O-N 2.89Å; Q266-S270 PolarHBondContact O-OG 2.79Å; Q266-S270 VanDerWaalsContact O-OG 3.06Å
267	R	98.6	Very high	97.7	Very high	166 Å²	166	54.8 Å²	54.8	63%	0.626	27%	0.27	S	S	*	.	H	α-helix	trans	-60.1	-46.8	179.8	-175.2	-175.4	-61.7	-175.8	0.9	111.9	L263 A264 V265 S271	L263-R267 WeakPolarHBondContact O-CB 3.5Å; L263-R267 PolarHBondContact O-N 3.2Å; A264-R267 PolarHBondContact O-N 3.19Å; V265-R267 PolarHBondContact O-N 3.46Å; R267-S271 WeakPolarHBondContact O-CB 3.49Å; R267-S271 PolarHBondContact O-N 3.15Å
268	V	98.6	Very high	97.7	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-43.1	178.8	176.6	0	0	0	0	110.6	M254 L257 A264 V265 Q266 S270 S271 I272 L312	M254-V268 HydrophobicContact SD-CG1 3.86Å; L257-V268 HydrophobicContact CB-CG2 4.03Å; L257-V268 HydrophobicContact CD1-CB 4.46Å; L257-V268 HydrophobicContact CD1-CG2 3.98Å; A264-V268 PolarHBondContact O-N 3.36Å; A264-V268 VanDerWaalsContact O-N 3.13Å; V265-V268 PolarHBondContact O-N 3.11Å; Q266-V268 PolarHBondContact O-N 2.95Å; V268-S270 PolarHBondContact O-N 2.88Å; V268-S271 PolarHBondContact O-N 3.04Å; V268-I272 HydrophobicContact CG1-CD1 3.97Å; V268-I272 HydrophobicContact CG1-CG1 4.47Å; V268-I272 WeakPolarHBondContact O-CG1 3.5Å; V268-I272 PolarHBondContact O-N 3Å; V268-L312 HydrophobicContact CB-CD2 3.92Å; V268-L312 HydrophobicContact CG1-CD2 3.82Å
269	C	98.8	Very high	97.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-55.5	-49.8	175.4	-168.6	0	0	0	0	111.9	A46 V265 Q266 S271 I272 A273 L312	A46-C269 HydrophobicContact CB-CB 4.05Å; V265-C269 VanDerWaalsContact O-CB 3.32Å; V265-C269 WeakPolarHBondContact O-CB 3.35Å; V265-C269 PolarHBondContact O-N 2.63Å; Q266-C269 WeakPolarHBondContact O-CB 3.4Å; Q266-C269 PolarHBondContact O-N 3.14Å; C269-S271 VanDerWaalsContact C-N 3.33Å; C269-S271 PolarHBondContact O-N 3.14Å; C269-I272 PolarHBondContact O-N 3.24Å; C269-A273 PolarHBondContact O-N 3.34Å; C269-A273 VanDerWaalsContact O-N 3.09Å; C269-L312 HydrophobicContact CB-CB 3.77Å; C269-L312 HydrophobicContact CB-CD2 4.25Å
270	S	98.7	Very high	98.1	Very high	40 Å²	40	50.4 Å²	50.4	28%	0.28	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-38	179	-61.9	0	0	0	0	112.2	Q266 V268 Y274	Q266-S270 PolarHBondContact NE2-OG 3.32Å; Q266-S270 VanDerWaalsContact NE2-OG 3.07Å; Q266-S270 WeakPolarHBondContact O-CB 3.38Å; Q266-S270 PolarHBondContact O-N 2.89Å; Q266-S270 PolarHBondContact O-OG 2.79Å; Q266-S270 VanDerWaalsContact O-OG 3.06Å; V268-S270 PolarHBondContact O-N 2.88Å; S270-Y274 VanDerWaalsContact O-CB 3.22Å; S270-Y274 WeakPolarHBondContact O-CB 3.36Å; S270-Y274 PolarHBondContact O-N 2.79Å
271	S	98.7	Very high	98.2	Very high	23 Å²	23	50 Å²	50	16%	0.161	25%	0.249	C	C	.	.	H	α-helix	trans	-66.7	-41.4	176.9	-168.9	0	0	0	0	112.2	E253 R256 R267 V268 C269 Y274 Q275	E253-S271 WeakPolarHBondContact OE2-CB 3.35Å; E253-S271 PolarHBondContact OE2-OG 3.21Å; R256-S271 VanDerWaalsContact CZ-OG 3.31Å; R256-S271 PolarHBondContact NH1-OG 3.23Å; R256-S271 PolarHBondContact NH2-OG 3.39Å; R267-S271 WeakPolarHBondContact O-CB 3.49Å; R267-S271 PolarHBondContact O-N 3.15Å; V268-S271 PolarHBondContact O-N 3.04Å; C269-S271 VanDerWaalsContact C-N 3.33Å; C269-S271 PolarHBondContact O-N 3.14Å; S271-Y274 PolarHBondContact O-N 3.38Å; S271-Q275 WeakPolarHBondContact O-CB 3.36Å; S271-Q275 VanDerWaalsContact O-CG 3.29Å; S271-Q275 WeakPolarHBondContact O-CG 3.4Å; S271-Q275 PolarHBondContact O-N 3.26Å
272	I	98.9	Very high	98.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-51.9	175.6	-69.8	169.3	0	0	0	110.3	L241 M245 E253 M254 V268 C269 Y274 Q275 A276 V310	L241-I272 HydrophobicContact CD1-CG2 3.6Å; L241-I272 HydrophobicContact CD2-CG2 4.15Å; M245-I272 HydrophobicContact SD-CG2 4.13Å; E253-I272 HydrophobicContact CB-CD1 4.31Å; E253-I272 HydrophobicContact CB-CG1 3.62Å; E253-I272 HydrophobicContact CG-CG1 4.24Å; M254-I272 HydrophobicContact CG-CD1 4.16Å; M254-I272 HydrophobicContact SD-CD1 3.76Å; V268-I272 HydrophobicContact CG1-CD1 3.97Å; V268-I272 HydrophobicContact CG1-CG1 4.47Å; V268-I272 WeakPolarHBondContact O-CG1 3.5Å; V268-I272 PolarHBondContact O-N 3Å; C269-I272 PolarHBondContact O-N 3.24Å; I272-Y274 VanDerWaalsContact C-N 3.28Å; I272-Y274 PolarHBondContact O-N 3Å; I272-Q275 PolarHBondContact O-N 3.34Å; I272-A276 PolarHBondContact O-N 2.86Å; I272-V310 HydrophobicContact CG2-CG1 4.27Å; I272-V310 HydrophobicContact CG2-CG2 4.41Å
273	A	98.8	Very high	98.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.3	-40.4	178.5	0	0	0	0	0	111.9	C48 F50 C269 A276 R277 I308 V310	C48-A273 HydrophobicContact CB-CB 3.99Å; F50-A273 HydrophobicContact CD2-CB 4.13Å; F50-A273 HydrophobicContact CE2-CB 3.77Å; C269-A273 PolarHBondContact O-N 3.34Å; C269-A273 VanDerWaalsContact O-N 3.09Å; A273-A276 PolarHBondContact O-N 2.8Å; A273-R277 PolarHBondContact O-N 2.78Å; A273-I308 HydrophobicContact CB-CG2 4.33Å; A273-V310 HydrophobicContact CB-CB 4.37Å; A273-V310 HydrophobicContact CB-CG2 3.98Å
274	Y	98.5	Very high	98.1	Very high	121 Å²	121	47.7 Å²	47.7	48%	0.475	25%	0.245	S	C	.	.	H	α-helix	trans	-68.7	-41.1	179.2	-174.6	-112.6	0	0	0	112.6	F50 S270 S271 I272 A276 R277 L278	F50-Y274 HydrophobicContact CZ-CD2 4.1Å; S270-Y274 VanDerWaalsContact O-CB 3.22Å; S270-Y274 WeakPolarHBondContact O-CB 3.36Å; S270-Y274 PolarHBondContact O-N 2.79Å; S271-Y274 PolarHBondContact O-N 3.38Å; I272-Y274 VanDerWaalsContact C-N 3.28Å; I272-Y274 PolarHBondContact O-N 3Å; Y274-A276 PolarHBondContact O-N 3.19Å; Y274-R277 WeakPolarHBondContact O-CB 3.01Å; Y274-R277 PolarHBondContact O-N 2.6Å; Y274-L278 HydrophobicContact CD1-CD1 4Å; Y274-L278 HydrophobicContact CD1-CG 4.38Å; Y274-L278 HydrophobicContact CE1-CD1 3.57Å; Y274-L278 HydrophobicContact CE1-CD2 4.4Å; Y274-L278 HydrophobicContact CE1-CG 4.04Å; Y274-L278 HydrophobicContact CE2-CD2 4.45Å; Y274-L278 HydrophobicContact CE2-CG 4.5Å; Y274-L278 WeakPolarHBondContact O-CG 3.41Å; Y274-L278 PolarHBondContact O-N 2.82Å
275	Q	98.5	Very high	97.9	Very high	56 Å²	56	49.3 Å²	49.3	26%	0.262	25%	0.25	S	C	.	.	H	α-helix	trans	-62.3	-42.5	174.7	-72.4	-60.1	-32.7	0	0	111.6	M245 E253 S271 I272 R277 L278 L279	M245-Q275 HydrophobicContact CE-CB 3.84Å; M245-Q275 HydrophobicContact SD-CB 3.86Å; E253-Q275 HydrophobicContact CG-CG 4.46Å; S271-Q275 WeakPolarHBondContact O-CB 3.36Å; S271-Q275 VanDerWaalsContact O-CG 3.29Å; S271-Q275 WeakPolarHBondContact O-CG 3.4Å; S271-Q275 PolarHBondContact O-N 3.26Å; I272-Q275 PolarHBondContact O-N 3.34Å; Q275-R277 VanDerWaalsContact C-N 3.28Å; Q275-R277 PolarHBondContact O-N 3.29Å; Q275-L278 PolarHBondContact O-N 2.69Å; Q275-L279 WeakPolarHBondContact O-CB 3.43Å; Q275-L279 WeakPolarHBondContact O-CG 3.13Å; Q275-L279 PolarHBondContact O-N 2.74Å
276	A	98.7	Very high	97.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.5	-43.4	173	0	0	0	0	0	111.5	L241 M245 I272 A273 Y274 L278 L279 S280 I308	L241-A276 HydrophobicContact CD1-CB 3.77Å; M245-A276 HydrophobicContact CG-CB 3.91Å; M245-A276 HydrophobicContact SD-CB 3.84Å; M245-A276 PolarHBondContact SD-N 3.25Å; I272-A276 PolarHBondContact O-N 2.86Å; A273-A276 PolarHBondContact O-N 2.8Å; Y274-A276 PolarHBondContact O-N 3.19Å; A276-L278 PolarHBondContact O-N 3.46Å; A276-L279 PolarHBondContact O-N 2.61Å; A276-S280 VanDerWaalsContact O-CB 3.31Å; A276-S280 WeakPolarHBondContact O-CB 3.38Å; A276-S280 PolarHBondContact O-N 2.91Å; A276-I308 HydrophobicContact CB-CD1 3.97Å; A276-I308 HydrophobicContact CB-CG2 4.24Å
277	R	98	Very high	97.8	Very high	55 Å²	55	49.3 Å²	49.3	21%	0.208	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-34.6	179.2	-177.1	59	-174.9	77.4	-9.7	113.8	F50 A273 Y274 Q275 S280 S281 I308	F50-R277 HydrophobicContact CB-CG 4.25Å; F50-R277 HydrophobicContact CD2-CB 4.03Å; F50-R277 HydrophobicContact CD2-CG 4.38Å; F50-R277 HydrophobicContact CG-CB 4.33Å; F50-R277 HydrophobicContact CG-CG 4.17Å; A273-R277 PolarHBondContact O-N 2.78Å; Y274-R277 WeakPolarHBondContact O-CB 3.01Å; Y274-R277 PolarHBondContact O-N 2.6Å; Q275-R277 VanDerWaalsContact C-N 3.28Å; Q275-R277 PolarHBondContact O-N 3.29Å; R277-S280 PolarHBondContact O-OG 3.02Å; R277-S281 PolarHBondContact NH1-OG 2.96Å; R277-I308 VanDerWaalsContact CA-CD1 3.49Å; R277-I308 HydrophobicContact CB-CD1 3.79Å
278	L	98.1	Very high	97.8	Very high	80 Å²	80	42.5 Å²	42.5	42%	0.419	23%	0.228	S	C	.	.	H	α-helix	trans	-69.4	-47	174.1	-71.2	178.9	0	0	0	111	Y274 Q275 A276 S280 S281 N282	Y274-L278 HydrophobicContact CD1-CD1 4Å; Y274-L278 HydrophobicContact CD1-CG 4.38Å; Y274-L278 HydrophobicContact CE1-CD1 3.57Å; Y274-L278 HydrophobicContact CE1-CD2 4.4Å; Y274-L278 HydrophobicContact CE1-CG 4.04Å; Y274-L278 HydrophobicContact CE2-CD2 4.45Å; Y274-L278 HydrophobicContact CE2-CG 4.5Å; Y274-L278 WeakPolarHBondContact O-CG 3.41Å; Y274-L278 PolarHBondContact O-N 2.82Å; Q275-L278 PolarHBondContact O-N 2.69Å; A276-L278 PolarHBondContact O-N 3.46Å; L278-S280 VanDerWaalsContact C-N 3.32Å; L278-S280 PolarHBondContact O-N 3.46Å; L278-S281 PolarHBondContact O-N 3.5Å; L278-N282 PolarHBondContact O-N 2.93Å
279	L	98.4	Very high	97.8	Very high	26 Å²	26	43.8 Å²	43.8	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-34.6	-180	-69.4	170.9	0	0	0	112	N244 M245 L249 Q275 A276 S281 N282 Y285 G303	N244-L279 HydrophobicContact CB-CB 4.29Å; M245-L279 HydrophobicContact CG-CD1 3.93Å; L249-L279 HydrophobicContact CD2-CD1 3.57Å; Q275-L279 WeakPolarHBondContact O-CB 3.43Å; Q275-L279 WeakPolarHBondContact O-CG 3.13Å; Q275-L279 PolarHBondContact O-N 2.74Å; A276-L279 PolarHBondContact O-N 2.61Å; L279-S281 PolarHBondContact O-N 3.34Å; L279-N282 PolarHBondContact O-N 3.05Å; L279-N282 VanDerWaalsContact O-N 3.1Å; L279-Y285 HydrophobicContact CB-CD1 4.15Å; L279-Y285 HydrophobicContact CB-CE1 4.06Å; L279-Y285 HydrophobicContact CD1-CE1 4.37Å; L279-Y285 HydrophobicContact CD2-CD1 3.88Å; L279-Y285 HydrophobicContact CD2-CD2 4.34Å; L279-Y285 HydrophobicContact CD2-CE1 3.89Å; L279-Y285 HydrophobicContact CD2-CE2 4.36Å; L279-Y285 HydrophobicContact CD2-CG 4.12Å; L279-Y285 HydrophobicContact CG-CE1 4.33Å; L279-G303 WeakPolarHBondContact O-CA 3.3Å
280	S	97.8	Very high	97.7	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-25.9	177.2	77.5	0	0	0	0	113.8	N244 A276 R277 L278 G303 K304 P305	N244-S280 VanDerWaalsContact CG-CB 3.49Å; N244-S280 VanDerWaalsContact ND2-CB 3.34Å; N244-S280 WeakPolarHBondContact ND2-CB 3.22Å; N244-S280 VanDerWaalsContact OD1-CA 3.26Å; N244-S280 WeakPolarHBondContact OD1-CA 3.43Å; A276-S280 VanDerWaalsContact O-CB 3.31Å; A276-S280 WeakPolarHBondContact O-CB 3.38Å; A276-S280 PolarHBondContact O-N 2.91Å; R277-S280 PolarHBondContact O-OG 3.02Å; L278-S280 VanDerWaalsContact C-N 3.32Å; L278-S280 PolarHBondContact O-N 3.46Å; S280-G303 CarbonylContact O-C 3.38Å; S280-K304 WeakPolarHBondContact CB-O 3.37Å; S280-P305 WeakPolarHBondContact O-CD 3.49Å; S280-P305 WeakPolarHBondContact O-CG 3.38Å
281	S	96.4	Very high	97.7	Very high	59 Å²	59	46.8 Å²	46.8	41%	0.413	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-2.5	177.4	-59.1	0	0	0	0	113.9	R277 L278 L279 T283	R277-S281 PolarHBondContact NH1-OG 2.96Å; L278-S281 PolarHBondContact O-N 3.5Å; L279-S281 PolarHBondContact O-N 3.34Å; S281-T283 PolarHBondContact O-N 3.33Å
282	N	97.3	Very high	97.6	Very high	64 Å²	64	49.3 Å²	49.3	34%	0.342	25%	0.25	S	S	.	.			trans	-81.3	105.2	178.2	-175	-22	0	0	0	109.9	L278 L279 T284 Y285 G302 G303	L278-N282 PolarHBondContact O-N 2.93Å; L279-N282 PolarHBondContact O-N 3.05Å; L279-N282 VanDerWaalsContact O-N 3.1Å; N282-T284 VanDerWaalsContact C-N 3.26Å; N282-T284 PolarHBondContact O-N 3.29Å; N282-T284 PolarHBondContact OD1-N 2.86Å; N282-T284 PolarHBondContact OD1-OG1 2.68Å; N282-Y285 VanDerWaalsContact CG-CB 3.41Å; N282-Y285 PolarHBondContact O-N 2.86Å; N282-Y285 PolarHBondContact OD1-N 3.5Å; N282-G302 CarbonylContact O-C 3.41Å; N282-G302 WeakPolarHBondContact O-CA 3.28Å; N282-G303 PolarHBondContact O-N 2.9Å
283	T	95.9	Very high	97.5	Very high	107 Å²	107	49.4 Å²	49.4	66%	0.656	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-13	-175.8	55.7	0	0	0	0	114.6	S281 G302	S281-T283 PolarHBondContact O-N 3.33Å; T283-G302 WeakPolarHBondContact O-CA 3.26Å
284	T	95.3	Very high	97.4	Very high	119 Å²	119	53.1 Å²	53.1	73%	0.73	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-8	-178.9	63.2	0	0	0	0	113.1	N282	N282-T284 VanDerWaalsContact C-N 3.26Å; N282-T284 PolarHBondContact O-N 3.29Å; N282-T284 PolarHBondContact OD1-N 2.86Å; N282-T284 PolarHBondContact OD1-OG1 2.68Å
285	Y	95.2	Very high	97.3	Very high	46 Å²	46	54.5 Å²	54.5	18%	0.18	28%	0.283	C	S	.	.	S	Bend	trans	-80.9	129.2	-176.4	169	-119.6	0	0	0	111.7	N244 P246 L279 N282 S287 G302	N244-Y285 VanDerWaalsContact O-CE1 3.3Å; N244-Y285 WeakPolarHBondContact O-CE1 3.45Å; N244-Y285 PolarHBondContact O-OH 3.23Å; P246-Y285 WeakPolarHBondContact CD-OH 3.22Å; P246-Y285 WeakPolarHBondContact CG-OH 3.43Å; L279-Y285 HydrophobicContact CB-CD1 4.15Å; L279-Y285 HydrophobicContact CB-CE1 4.06Å; L279-Y285 HydrophobicContact CD1-CE1 4.37Å; L279-Y285 HydrophobicContact CD2-CD1 3.88Å; L279-Y285 HydrophobicContact CD2-CD2 4.34Å; L279-Y285 HydrophobicContact CD2-CE1 3.89Å; L279-Y285 HydrophobicContact CD2-CE2 4.36Å; L279-Y285 HydrophobicContact CD2-CG 4.12Å; L279-Y285 HydrophobicContact CG-CE1 4.33Å; N282-Y285 VanDerWaalsContact CG-CB 3.41Å; N282-Y285 PolarHBondContact O-N 2.86Å; N282-Y285 PolarHBondContact OD1-N 3.5Å; Y285-S287 PolarHBondContact O-N 2.75Å; Y285-G302 CarbonylContact O-C 3.05Å; Y285-G302 WeakPolarHBondContact O-CA 3.31Å; Y285-G302 PolarHBondContact O-N 2.9Å
286	L	96.7	Very high	97.1	Very high	68 Å²	68	57.7 Å²	57.7	36%	0.356	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-80.5	84.3	173.9	-172.7	62.1	0	0	0	110.6	A290 K291	L286-A290 HydrophobicContact CD1-CB 3.98Å; L286-K291 HydrophobicContact CD1-CG 3.97Å; L286-K291 HydrophobicContact CD2-CD 4.45Å; L286-K291 HydrophobicContact CD2-CG 3.92Å; L286-K291 HydrophobicContact CG-CD 4.31Å; L286-K291 HydrophobicContact CG-CG 3.59Å; L286-K291 WeakPolarHBondContact O-CE 3.48Å
287	S	98.2	Very high	96.9	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.332	C	S	.	.			trans	-66.6	158.8	-179.2	67.7	0	0	0	0	113.5	D243 Y285 F289 A290 K291 G302	D243-S287 WeakPolarHBondContact O-CB 3.43Å; Y285-S287 PolarHBondContact O-N 2.75Å; S287-F289 PolarHBondContact O-N 3.21Å; S287-A290 PolarHBondContact O-N 3.18Å; S287-A290 VanDerWaalsContact O-N 3.16Å; S287-A290 VanDerWaalsContact OG-CB 3.32Å; S287-A290 WeakPolarHBondContact OG-CB 3.43Å; S287-A290 PolarHBondContact OG-N 2.92Å; S287-K291 WeakPolarHBondContact O-CG 3.39Å; S287-K291 PolarHBondContact O-N 3.16Å; S287-G302 VanDerWaalsContact CB-O 3.28Å; S287-G302 WeakPolarHBondContact CB-O 3.46Å; S287-G302 PolarHBondContact OG-O 3.22Å
288	P	98.1	Very high	96.7	Very high	22 Å²	22	64 Å²	64	14%	0.143	35%	0.346	C	S	.	.	H	α-helix	trans	-49	-42.1	168.9	-27.7	33.8	0	0	0	113.4	F242 D243 P246 K292	F242-P288 WeakPolarHBondContact O-CB 3.49Å; D243-P288 VanDerWaalsContact O-CD 3.29Å; D243-P288 WeakPolarHBondContact O-CD 3.45Å; P246-P288 HydrophobicContact CG-CG 4.22Å; P288-K292 WeakPolarHBondContact O-CG 3.45Å; P288-K292 PolarHBondContact O-N 3.28Å; P288-K292 VanDerWaalsContact O-N 3.14Å
289	F	98	Very high	96.4	Very high	31 Å²	31	67.8 Å²	67.8	14%	0.136	37%	0.368	C	S	.	.	H	α-helix	trans	-61.8	-52.5	174.5	177	-94.4	0	0	0	112	F196 N197 D243 S287 K291 K292 A293 K304	F196-F289 HydrophobicContact CE1-CE2 4.04Å; F196-F289 AromaticContact CE1-CZ 3.86Å; F196-F289 HydrophobicContact CE1-CZ 3.86Å; F196-F289 HydrophobicContact CE2-CD2 4.46Å; F196-F289 HydrophobicContact CE2-CE2 4.17Å; F196-F289 AromaticContact CZ-CD2 3.99Å; F196-F289 HydrophobicContact CZ-CD2 3.99Å; F196-F289 HydrophobicContact CZ-CE1 4.22Å; F196-F289 AromaticContact CZ-CE2 3.4Å; F196-F289 HydrophobicContact CZ-CE2 3.4Å; F196-F289 VanDerWaalsContact CZ-CE2 3.4Å; F196-F289 AromaticContact CZ-CZ 3.54Å; F196-F289 HydrophobicContact CZ-CZ 3.54Å; N197-F289 HydrophobicContact CB-CE2 4.19Å; N197-F289 WeakPolarHBondContact OD1-CE2 3.33Å; D243-F289 HydrophobicContact CB-CB 3.8Å; D243-F289 WeakPolarHBondContact O-CB 3.37Å; D243-F289 PolarHBondContact O-N 3.15Å; S287-F289 PolarHBondContact O-N 3.21Å; F289-K291 VanDerWaalsContact C-N 3.27Å; F289-K291 PolarHBondContact O-N 3.29Å; F289-K292 WeakPolarHBondContact O-CB 3.37Å; F289-K292 PolarHBondContact O-N 3.02Å; F289-A293 HydrophobicContact CE1-CB 4.49Å; F289-A293 WeakPolarHBondContact O-CB 3.28Å; F289-A293 PolarHBondContact O-N 3.15Å; F289-K304 HydrophobicContact CB-CB 4.2Å; F289-K304 HydrophobicContact CD1-CB 3.94Å; F289-K304 HydrophobicContact CD1-CD 4.4Å; F289-K304 HydrophobicContact CD1-CG 4.27Å; F289-K304 HydrophobicContact CD2-CD 3.7Å; F289-K304 HydrophobicContact CD2-CG 4.43Å; F289-K304 HydrophobicContact CE1-CB 4.49Å; F289-K304 HydrophobicContact CE1-CG 4.38Å; F289-K304 HydrophobicContact CE2-CD 3.88Å; F289-K304 HydrophobicContact CG-CB 3.98Å; F289-K304 HydrophobicContact CG-CD 3.97Å; F289-K304 HydrophobicContact CG-CG 4.29Å; F289-K304 HydrophobicContact CZ-CD 4.32Å
290	A	97.8	Very high	96.1	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-36.9	-178.9	0	0	0	0	0	112.2	L286 S287 A293 Q294 T300	L286-A290 HydrophobicContact CD1-CB 3.98Å; S287-A290 PolarHBondContact O-N 3.18Å; S287-A290 VanDerWaalsContact O-N 3.16Å; S287-A290 VanDerWaalsContact OG-CB 3.32Å; S287-A290 WeakPolarHBondContact OG-CB 3.43Å; S287-A290 PolarHBondContact OG-N 2.92Å; A290-A293 PolarHBondContact O-N 2.85Å; A290-Q294 VanDerWaalsContact O-CG 3.31Å; A290-Q294 WeakPolarHBondContact O-CG 3.49Å; A290-Q294 PolarHBondContact O-N 3.4Å; A290-T300 HydrophobicContact CB-CG2 4.07Å
291	K	97.5	Very high	96	Very high	104 Å²	104	73 Å²	73	45%	0.452	40%	0.4	S	S	.	.	H	α-helix	trans	-61.4	-47.5	172.6	-69	177.7	-176.8	178.7	0	112.1	L286 S287 F289 A293 Q294 L295	L286-K291 HydrophobicContact CD1-CG 3.97Å; L286-K291 HydrophobicContact CD2-CD 4.45Å; L286-K291 HydrophobicContact CD2-CG 3.92Å; L286-K291 HydrophobicContact CG-CD 4.31Å; L286-K291 HydrophobicContact CG-CG 3.59Å; L286-K291 WeakPolarHBondContact O-CE 3.48Å; S287-K291 WeakPolarHBondContact O-CG 3.39Å; S287-K291 PolarHBondContact O-N 3.16Å; F289-K291 VanDerWaalsContact C-N 3.27Å; F289-K291 PolarHBondContact O-N 3.29Å; K291-A293 VanDerWaalsContact C-N 3.34Å; K291-Q294 PolarHBondContact O-N 2.62Å; K291-L295 WeakPolarHBondContact O-CG 3.29Å; K291-L295 PolarHBondContact O-N 3.48Å; K291-L295 VanDerWaalsContact O-N 3.16Å
292	K	96.8	Very high	96	Very high	76 Å²	76	70.3 Å²	70.3	33%	0.33	38%	0.382	S	S	.	.	H	α-helix	trans	-62.2	-43.1	177.3	-68.5	170.7	-172	170.4	0	110.9	F196 D243 P288 F289 Q294 L295 Q296	F196-K292 HydrophobicContact CD2-CB 4.47Å; F196-K292 HydrophobicContact CE2-CB 3.79Å; D243-K292 IonicContact OD1-NZ 3.69Å; P288-K292 WeakPolarHBondContact O-CG 3.45Å; P288-K292 PolarHBondContact O-N 3.28Å; P288-K292 VanDerWaalsContact O-N 3.14Å; F289-K292 WeakPolarHBondContact O-CB 3.37Å; F289-K292 PolarHBondContact O-N 3.02Å; K292-Q294 PolarHBondContact O-N 2.71Å; K292-L295 WeakPolarHBondContact O-CB 3.44Å; K292-L295 PolarHBondContact O-N 3.05Å; K292-Q296 WeakPolarHBondContact O-CG 3.39Å; K292-Q296 PolarHBondContact O-N 3.28Å
293	A	96.9	Very high	96	Very high	1 Å²	1	68 Å²	68	1%	0.008	37%	0.374	C	S	.	.	H	α-helix	trans	-59.2	-45.3	177.2	0	0	0	0	0	112.2	F196 F289 A290 K291 L295 Q296 G297 F298 T300	F196-A293 HydrophobicContact CE1-CB 3.87Å; F196-A293 HydrophobicContact CE2-CB 4.26Å; F196-A293 HydrophobicContact CZ-CB 3.49Å; F196-A293 VanDerWaalsContact CZ-CB 3.49Å; F289-A293 HydrophobicContact CE1-CB 4.49Å; F289-A293 WeakPolarHBondContact O-CB 3.28Å; F289-A293 PolarHBondContact O-N 3.15Å; A290-A293 PolarHBondContact O-N 2.85Å; K291-A293 VanDerWaalsContact C-N 3.34Å; A293-L295 VanDerWaalsContact C-N 3.33Å; A293-L295 PolarHBondContact O-N 3.14Å; A293-Q296 CarbonylContact O-C 3.53Å; A293-Q296 WeakPolarHBondContact O-CA 3.05Å; A293-Q296 WeakPolarHBondContact O-CB 3.11Å; A293-Q296 PolarHBondContact O-N 3.16Å; A293-G297 PolarHBondContact O-N 3.28Å; A293-F298 CarbonylContact C-O 3.51Å; A293-F298 HydrophobicContact CB-CB 4.1Å; A293-F298 WeakPolarHBondContact O-CB 3.44Å; A293-F298 PolarHBondContact O-N 2.93Å; A293-T300 HydrophobicContact CB-CG2 3.25Å
294	Q	97.2	Very high	96.1	Very high	79 Å²	79	64.2 Å²	64.2	37%	0.369	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-39.1	176.2	-73.6	178	0.4	0	0	112.5	A290 K291 K292 Q296 G297 F298 T300	A290-Q294 VanDerWaalsContact O-CG 3.31Å; A290-Q294 WeakPolarHBondContact O-CG 3.49Å; A290-Q294 PolarHBondContact O-N 3.4Å; K291-Q294 PolarHBondContact O-N 2.62Å; K292-Q294 PolarHBondContact O-N 2.71Å; Q294-Q296 PolarHBondContact O-N 3Å; Q294-G297 PolarHBondContact O-N 2.94Å; Q294-F298 VanDerWaalsContact CA-O 3.31Å; Q294-F298 WeakPolarHBondContact CA-O 3.35Å; Q294-F298 PolarHBondContact N-O 3.49Å; Q294-T300 PolarHBondContact NE2-O 2.81Å
295	L	95.8	Very high	96.1	Very high	149 Å²	149	61.8 Å²	61.8	78%	0.78	33%	0.334	S	S	*	.	H	α-helix	trans	-64.7	-21.4	173.9	-67.5	172.8	0	0	0	113.1	K291 K292 A293	K291-L295 WeakPolarHBondContact O-CG 3.29Å; K291-L295 PolarHBondContact O-N 3.48Å; K291-L295 VanDerWaalsContact O-N 3.16Å; K292-L295 WeakPolarHBondContact O-CB 3.44Å; K292-L295 PolarHBondContact O-N 3.05Å; A293-L295 VanDerWaalsContact C-N 3.33Å; A293-L295 PolarHBondContact O-N 3.14Å
296	Q	94.7	Very high	96.2	Very high	124 Å²	124	60.5 Å²	60.5	58%	0.579	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	5.9	174.6	-61.4	-65.9	-52.4	0	0	112.5	F196 K292 A293 Q294 F298	F196-Q296 HydrophobicContact CB-CG 3.97Å; F196-Q296 HydrophobicContact CD2-CG 3.95Å; F196-Q296 HydrophobicContact CG-CB 4.4Å; F196-Q296 HydrophobicContact CG-CG 3.96Å; K292-Q296 WeakPolarHBondContact O-CG 3.39Å; K292-Q296 PolarHBondContact O-N 3.28Å; A293-Q296 CarbonylContact O-C 3.53Å; A293-Q296 WeakPolarHBondContact O-CA 3.05Å; A293-Q296 WeakPolarHBondContact O-CB 3.11Å; A293-Q296 PolarHBondContact O-N 3.16Å; Q294-Q296 PolarHBondContact O-N 3Å; Q296-F298 HydrophobicContact CB-CD2 3.77Å; Q296-F298 HydrophobicContact CB-CE2 3.87Å
297	G	95.5	Very high	96.3	Very high	70 Å²	70	57.6 Å²	57.6	72%	0.722	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	5.1	179.1	0	0	0	0	0	115.1	A293 Q294	A293-G297 PolarHBondContact O-N 3.28Å; Q294-G297 PolarHBondContact O-N 2.94Å
298	F	93.5	Very high	96.3	Very high	116 Å²	116	57.6 Å²	57.6	51%	0.509	32%	0.315	S	S	.	.			trans	-85.1	117.9	174	-59.5	-78.5	0	0	0	110.6	F196 A293 Q294 Q296 T300	F196-F298 AromaticContact CD1-CD2 3.88Å; F196-F298 HydrophobicContact CD1-CD2 3.88Å; F196-F298 AromaticContact CD1-CE2 3.61Å; F196-F298 HydrophobicContact CD1-CE2 3.61Å; F196-F298 HydrophobicContact CD1-CZ 4.5Å; F196-F298 HydrophobicContact CE1-CD2 4.07Å; F196-F298 HydrophobicContact CE1-CE2 4.24Å; F196-F298 HydrophobicContact CG-CE2 4.34Å; A293-F298 CarbonylContact C-O 3.51Å; A293-F298 HydrophobicContact CB-CB 4.1Å; A293-F298 WeakPolarHBondContact O-CB 3.44Å; A293-F298 PolarHBondContact O-N 2.93Å; Q294-F298 VanDerWaalsContact CA-O 3.31Å; Q294-F298 WeakPolarHBondContact CA-O 3.35Å; Q294-F298 PolarHBondContact N-O 3.49Å; Q296-F298 HydrophobicContact CB-CD2 3.77Å; Q296-F298 HydrophobicContact CB-CE2 3.87Å; F298-T300 VanDerWaalsContact C-N 3.31Å; F298-T300 PolarHBondContact O-N 3.46Å
299	N	91.9	Very high	96.4	Very high	161 Å²	161	56.6 Å²	56.6	86%	0.861	31%	0.309	S	S	*	.			trans	-77	81.5	174.6	-171.4	21.4	0	0	0	110.7
300	T	91.4	Very high	96.4	Very high	48 Å²	48	55.1 Å²	55.1	29%	0.294	30%	0.302	S	S	.	.			trans	-124.8	148.6	177.8	-165.5	0	0	0	0	111.3	A290 A293 Q294 F298	A290-T300 HydrophobicContact CB-CG2 4.07Å; A293-T300 HydrophobicContact CB-CG2 3.25Å; Q294-T300 PolarHBondContact NE2-O 2.81Å; F298-T300 VanDerWaalsContact C-N 3.31Å; F298-T300 PolarHBondContact O-N 3.46Å
301	V	95.1	Very high	96.5	Very high	88 Å²	88	55.1 Å²	55.1	53%	0.533	30%	0.302	S	S	.	.			trans	-140.4	157.4	174.1	-66.6	0	0	0	0	108.5
302	G	97.3	Very high	96.5	Very high	3 Å²	3	50.1 Å²	50.1	3%	0.031	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	104.6	174.9	-177.6	0	0	0	0	0	113.3	N282 T283 Y285 S287	N282-G302 CarbonylContact O-C 3.41Å; N282-G302 WeakPolarHBondContact O-CA 3.28Å; T283-G302 WeakPolarHBondContact O-CA 3.26Å; Y285-G302 CarbonylContact O-C 3.05Å; Y285-G302 WeakPolarHBondContact O-CA 3.31Å; Y285-G302 PolarHBondContact O-N 2.9Å; S287-G302 VanDerWaalsContact CB-O 3.28Å; S287-G302 WeakPolarHBondContact CB-O 3.46Å; S287-G302 PolarHBondContact OG-O 3.22Å
303	G	97.4	Very high	96.6	Very high	17 Å²	17	46.5 Å²	46.5	18%	0.175	27%	0.265	C	S	.	.			trans	-68.9	164.4	163.9	0	0	0	0	0	112.6	N244 L279 S280 N282 P305	N244-G303 VanDerWaalsContact OD1-CA 3.31Å; N244-G303 WeakPolarHBondContact OD1-CA 3.47Å; L279-G303 WeakPolarHBondContact O-CA 3.3Å; S280-G303 CarbonylContact O-C 3.38Å; N282-G303 PolarHBondContact O-N 2.9Å; G303-P305 WeakPolarHBondContact O-CD 3.29Å
304	K	97.1	Very high	96.7	Very high	27 Å²	27	46.5 Å²	46.5	12%	0.117	26%	0.264	C	S	.	.			trans	-101.8	104.9	170.6	-176.6	-160.4	-178.5	-151	0	108.1	N197 D239 D243 N244 S280 F289 D306	N197-K304 WeakPolarHBondContact OD1-CE 3.24Å; D239-K304 IonicContact OD2-NZ 2.89Å; D239-K304 PolarHBondContact OD2-NZ 3.46Å; D243-K304 HydrophobicContact CB-CB 4.45Å; D243-K304 HydrophobicContact CB-CD 3.97Å; D243-K304 WeakPolarHBondContact OD2-CD 3.44Å; D243-K304 WeakPolarHBondContact OD2-CE 3.4Å; D243-K304 IonicContact OD2-NZ 3.37Å; D243-K304 PolarHBondContact OD2-NZ 3.35Å; N244-K304 PolarHBondContact ND2-O 2.96Å; N244-K304 PolarHBondContact OD1-N 3.02Å; N244-K304 PolarHBondContact OD1-O 2.83Å; S280-K304 WeakPolarHBondContact CB-O 3.37Å; F289-K304 HydrophobicContact CB-CB 4.2Å; F289-K304 HydrophobicContact CD1-CB 3.94Å; F289-K304 HydrophobicContact CD1-CD 4.4Å; F289-K304 HydrophobicContact CD1-CG 4.27Å; F289-K304 HydrophobicContact CD2-CD 3.7Å; F289-K304 HydrophobicContact CD2-CG 4.43Å; F289-K304 HydrophobicContact CE1-CB 4.49Å; F289-K304 HydrophobicContact CE1-CG 4.38Å; F289-K304 HydrophobicContact CE2-CD 3.88Å; F289-K304 HydrophobicContact CG-CB 3.98Å; F289-K304 HydrophobicContact CG-CD 3.97Å; F289-K304 HydrophobicContact CG-CG 4.29Å; F289-K304 HydrophobicContact CZ-CD 4.32Å; K304-D306 WeakPolarHBondContact CE-OD2 3.39Å; K304-D306 IonicContact NZ-OD2 3.22Å; K304-D306 PolarHBondContact NZ-OD2 3.38Å; K304-D306 PolarHBondContact O-N 2.85Å
305	P	96.7	Very high	96.7	Very high	68 Å²	68	42.7 Å²	42.7	44%	0.442	25%	0.247	S	C	.	.			trans	-61	120.3	175.5	-22.9	33.1	0	0	0	110.7	K52 S280 G303	K52-P305 WeakPolarHBondContact CE-O 3.47Å; K52-P305 PolarHBondContact NZ-O 3.41Å; S280-P305 WeakPolarHBondContact O-CD 3.49Å; S280-P305 WeakPolarHBondContact O-CG 3.38Å; G303-P305 WeakPolarHBondContact O-CD 3.29Å
306	D	97.5	Very high	96.6	Very high	19 Å²	19	36.7 Å²	36.7	10%	0.102	22%	0.216	C	C	.	.			trans	-151.4	169.2	-177.7	-119.4	-7.9	0	0	0	113.2	K52 K304	K52-D306 WeakPolarHBondContact CA-O 3.46Å; K52-D306 IonicContact NZ-OD1 2.62Å; K52-D306 PolarHBondContact NZ-OD1 3.49Å; K304-D306 WeakPolarHBondContact CE-OD2 3.39Å; K304-D306 IonicContact NZ-OD2 3.22Å; K304-D306 PolarHBondContact NZ-OD2 3.38Å; K304-D306 PolarHBondContact O-N 2.85Å
307	D	98.4	Very high	96.3	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.037	20%	0.2	C	C	.	.			trans	-65.9	140.6	164.4	-65.6	-44.2	0	0	0	108.9	P51 K52 F64 G65 D66 D67 G240	P51-D307 WeakPolarHBondContact CA-OD1 3.46Å; K52-D307 WeakPolarHBondContact CB-OD1 3.49Å; K52-D307 PolarHBondContact N-OD1 2.98Å; F64-D307 WeakPolarHBondContact O-CB 3.31Å; G65-D307 WeakPolarHBondContact CA-OD1 3.11Å; D66-D307 WeakPolarHBondContact CB-OD2 3.22Å; D66-D307 PolarHBondContact N-OD2 3.28Å; D67-D307 HydrophobicContact CB-CB 4.39Å; G240-D307 WeakPolarHBondContact CA-O 3.34Å
308	I	98.7	Very high	95.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.9	-175	-64.2	165.5	0	0	0	107.8	G49 F50 D67 A273 A276 R277 V310	G49-I308 CarbonylContact C-O 3.54Å; G49-I308 WeakPolarHBondContact CA-O 3.31Å; F50-I308 PolarHBondContact N-O 3.39Å; F50-I308 PolarHBondContact O-N 2.94Å; D67-I308 VanDerWaalsContact OD2-C 3.3Å; D67-I308 PolarHBondContact OD2-N 3.05Å; A273-I308 HydrophobicContact CB-CG2 4.33Å; A276-I308 HydrophobicContact CB-CD1 3.97Å; A276-I308 HydrophobicContact CB-CG2 4.24Å; R277-I308 VanDerWaalsContact CA-CD1 3.49Å; R277-I308 HydrophobicContact CB-CD1 3.79Å; I308-V310 HydrophobicContact CG2-CG2 4.19Å
309	T	98.9	Very high	94.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.6	172.4	-60.6	0	0	0	0	109.7	F64 D67 Y69 V82 A237 T238	F64-T309 HydrophobicContact CD2-CG2 4.04Å; F64-T309 WeakPolarHBondContact CD2-OG1 3.37Å; F64-T309 HydrophobicContact CE2-CG2 4.3Å; D67-T309 WeakPolarHBondContact CB-OG1 3.33Å; D67-T309 VanDerWaalsContact OD2-CB 3.31Å; D67-T309 WeakPolarHBondContact OD2-CB 3.49Å; D67-T309 PolarHBondContact OD2-N 3.17Å; D67-T309 VanDerWaalsContact OD2-N 3.07Å; D67-T309 PolarHBondContact OD2-OG1 3.2Å; Y69-T309 HydrophobicContact CD1-CG2 3.89Å; Y69-T309 HydrophobicContact CG-CG2 4.17Å; V82-T309 HydrophobicContact CG1-CG2 4.14Å; A237-T309 CarbonylContact C-O 3.5Å; A237-T309 WeakPolarHBondContact CA-O 3.29Å; A237-T309 VanDerWaalsContact CB-O 3.28Å; A237-T309 WeakPolarHBondContact CB-O 3.4Å; T238-T309 PolarHBondContact N-O 2.78Å; T238-T309 PolarHBondContact OG1-N 3.35Å
310	V	98.9	Very high	93.5	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.4	178.7	-174.9	0	0	0	0	108.9	C47 C48 V235 A237 L241 I272 A273 I308	C47-V310 CarbonylContact C-O 3.59Å; C47-V310 VanDerWaalsContact CA-O 3.24Å; C47-V310 WeakPolarHBondContact CA-O 3.37Å; C47-V310 PolarHBondContact SG-O 3.45Å; C48-V310 PolarHBondContact N-O 3.28Å; C48-V310 PolarHBondContact O-N 2.73Å; V235-V310 HydrophobicContact CG1-CG1 4.22Å; A237-V310 HydrophobicContact CB-CG2 4.15Å; L241-V310 HydrophobicContact CB-CG2 4.42Å; L241-V310 HydrophobicContact CD2-CG2 4.16Å; I272-V310 HydrophobicContact CG2-CG1 4.27Å; I272-V310 HydrophobicContact CG2-CG2 4.41Å; A273-V310 HydrophobicContact CB-CB 4.37Å; A273-V310 HydrophobicContact CB-CG2 3.98Å; I308-V310 HydrophobicContact CG2-CG2 4.19Å
311	I	98.9	Very high	92.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.9	162.6	-53.2	-178.9	0	0	0	107.3	A46 C47 Y69 I71 L80 V82 L236	A46-I311 WeakPolarHBondContact O-CA 3.46Å; A46-I311 WeakPolarHBondContact O-CG2 3.31Å; C47-I311 HydrophobicContact CB-CG1 4.35Å; Y69-I311 HydrophobicContact CD2-CD1 3.98Å; Y69-I311 HydrophobicContact CD2-CG1 4.33Å; Y69-I311 HydrophobicContact CG-CD1 4.39Å; I71-I311 HydrophobicContact CD1-CG2 4.05Å; I71-I311 HydrophobicContact CG1-CD1 4.04Å; I71-I311 HydrophobicContact CG1-CG2 4.33Å; L80-I311 HydrophobicContact CB-CD1 4.35Å; L80-I311 HydrophobicContact CD1-CG2 4.09Å; L80-I311 HydrophobicContact CD2-CG2 4.27Å; V82-I311 HydrophobicContact CG1-CD1 3.96Å; V82-I311 HydrophobicContact CG1-CG1 4.08Å; L236-I311 HydrophobicContact CB-CB 4.33Å; L236-I311 HydrophobicContact CD2-CD1 4.2Å; L236-I311 PolarHBondContact N-O 3.01Å; L236-I311 PolarHBondContact O-N 3.34Å
312	L	98.8	Very high	90.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.6	169.3	174.8	59.7	0	0	0	108.5	A45 A46 C233 I234 V235 M254 V265 V268 C269	A45-L312 CarbonylContact C-O 3.56Å; A45-L312 VanDerWaalsContact CA-O 3.29Å; A45-L312 WeakPolarHBondContact CA-O 3.32Å; A46-L312 PolarHBondContact N-O 3.26Å; A46-L312 PolarHBondContact O-N 3.25Å; C233-L312 HydrophobicContact CB-CD1 4.45Å; I234-L312 WeakPolarHBondContact O-CA 3.32Å; V235-L312 HydrophobicContact CG2-CD1 3.94Å; M254-L312 HydrophobicContact CE-CD1 3.73Å; M254-L312 HydrophobicContact CE-CD2 4.46Å; M254-L312 HydrophobicContact SD-CD1 3.67Å; M254-L312 HydrophobicContact SD-CD2 4.01Å; V265-L312 HydrophobicContact CG1-CB 4.38Å; V265-L312 HydrophobicContact CG1-CD2 4.05Å; V265-L312 HydrophobicContact CG1-CG 3.9Å; V268-L312 HydrophobicContact CB-CD2 3.92Å; V268-L312 HydrophobicContact CG1-CD2 3.82Å; C269-L312 HydrophobicContact CB-CB 3.77Å; C269-L312 HydrophobicContact CB-CD2 4.25Å
313	A	98.6	Very high	88.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.5	176	0	0	0	0	0	111.8	F43 V44 A45 L80 C233 I234	F43-A313 HydrophobicContact CB-CB 4.12Å; F43-A313 HydrophobicContact CD1-CB 3.65Å; F43-A313 HydrophobicContact CD2-CB 4.36Å; F43-A313 HydrophobicContact CE1-CB 4.05Å; F43-A313 HydrophobicContact CG-CB 3.82Å; V44-A313 CarbonylContact O-C 3.39Å; V44-A313 WeakPolarHBondContact O-CA 3.44Å; A45-A313 HydrophobicContact CB-CB 3.87Å; L80-A313 HydrophobicContact CD1-CB 3.52Å; C233-A313 CarbonylContact C-O 3.51Å; C233-A313 WeakPolarHBondContact CA-O 3.24Å; I234-A313 HydrophobicContact CB-CB 4.44Å; I234-A313 PolarHBondContact N-O 3.36Å; I234-A313 PolarHBondContact O-N 3Å
314	V	98.3	Very high	86.8	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.9	175	-173.4	0	0	0	0	109	F43 V44 L257 F260 V265 T316	F43-V314 WeakPolarHBondContact CA-O 2.93Å; V44-V314 PolarHBondContact N-O 3.16Å; V44-V314 PolarHBondContact O-N 3.2Å; L257-V314 HydrophobicContact CD2-CG2 3.89Å; F260-V314 HydrophobicContact CB-CG1 4.21Å; F260-V314 HydrophobicContact CD1-CG1 3.64Å; F260-V314 HydrophobicContact CD1-CG2 4.46Å; F260-V314 HydrophobicContact CD2-CG1 4.12Å; F260-V314 HydrophobicContact CE1-CG1 3.96Å; F260-V314 HydrophobicContact CE2-CG1 4.4Å; F260-V314 HydrophobicContact CG-CG1 3.73Å; F260-V314 HydrophobicContact CZ-CG1 4.33Å; V265-V314 HydrophobicContact CG1-CG2 4.33Å; V265-V314 HydrophobicContact CG2-CG2 3.74Å; V314-T316 HydrophobicContact CG1-CG2 4.27Å; V314-T316 PolarHBondContact O-N 3.23Å
315	V	97	Very high	84.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	115.6	174.4	-179.2	0	0	0	0	108.8	Q41 F43 V228 S230 G231 D232	Q41-V315 HydrophobicContact CB-CG1 4.13Å; Q41-V315 HydrophobicContact CG-CG1 4.31Å; Q41-V315 VanDerWaalsContact OE1-CG1 3.32Å; F43-V315 HydrophobicContact CD1-CG2 4.11Å; F43-V315 HydrophobicContact CE1-CG2 3.65Å; V228-V315 HydrophobicContact CB-CG1 4.47Å; V228-V315 HydrophobicContact CB-CG2 4.24Å; V228-V315 HydrophobicContact CG1-CG2 4.45Å; V228-V315 HydrophobicContact CG2-CG1 4.23Å; V228-V315 HydrophobicContact CG2-CG2 4.45Å; S230-V315 CarbonylContact C-O 3.57Å; S230-V315 WeakPolarHBondContact CA-O 3.09Å; S230-V315 PolarHBondContact OG-O 3.42Å; G231-V315 PolarHBondContact N-O 3.41Å; D232-V315 HydrophobicContact CB-CB 4.37Å; D232-V315 HydrophobicContact CB-CG2 4.16Å; D232-V315 PolarHBondContact O-N 3.15Å
316	T	94.2	Very high	82.2	Confident	22 Å²	22	41.4 Å²	41.4	14%	0.135	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.7	177.2	63.5	0	0	0	0	110.3	Q41 R42 V44 F260 V314	Q41-T316 CarbonylContact C-O 3.58Å; Q41-T316 WeakPolarHBondContact CA-O 3.38Å; Q41-T316 PolarHBondContact OE1-O 3.15Å; R42-T316 PolarHBondContact N-O 3.13Å; R42-T316 PolarHBondContact O-N 3.38Å; R42-T316 PolarHBondContact O-OG1 2.99Å; V44-T316 HydrophobicContact CG2-CG2 3.82Å; F260-T316 HydrophobicContact CB-CG2 4.1Å; F260-T316 HydrophobicContact CD2-CG2 4.33Å; V314-T316 HydrophobicContact CG1-CG2 4.27Å; V314-T316 PolarHBondContact O-N 3.23Å
317	A	87.6	Confident	81.5	Confident	30 Å²	30	42.5 Å²	42.5	25%	0.248	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	123	173.8	0	0	0	0	0	108.9	R39	R39-A317 HydrophobicContact CB-CB 4.44Å
318	V	81.9	Confident	80.6	Confident	43 Å²	43	44.4 Å²	44.4	26%	0.261	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	158.7	175.9	-60.7	0	0	0	0	110.4	R39 V40 R42	R39-V318 CarbonylContact C-O 3.53Å; R39-V318 WeakPolarHBondContact CA-O 3.18Å; R39-V318 VanDerWaalsContact CB-O 3.32Å; R39-V318 WeakPolarHBondContact CB-O 3.35Å; R39-V318 WeakPolarHBondContact CG-O 3.34Å; V40-V318 HydrophobicContact CG2-CG2 3.8Å; V40-V318 PolarHBondContact N-O 3.43Å; V40-V318 PolarHBondContact O-N 2.93Å; R42-V318 HydrophobicContact CB-CG2 4.43Å; R42-V318 VanDerWaalsContact CD-CG2 3.47Å; R42-V318 HydrophobicContact CG-CG2 3.71Å
319	E	74.1	Confident	79.6	Confident	113 Å²	113	46.8 Å²	46.8	53%	0.528	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	137.1	168.5	-66.4	-177.1	179.4	0	0	109.6	V37 E321	V37-E319 HydrophobicContact CG1-CB 4.48Å; V37-E319 HydrophobicContact CG1-CG 4.16Å; E319-E321 PolarHBondContact O-N 2.95Å
320	R	66	Low	78.4	Confident	103 Å²	103	49.6 Å²	49.6	39%	0.389	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-68.6	123.8	178.7	-172.4	176.4	-170	-172.7	3.7	109.9	R38 V40 D324	R38-R320 WeakPolarHBondContact O-CB 3.37Å; R38-R320 PolarHBondContact O-N 3.46Å; V40-R320 HydrophobicContact CG1-CB 4.12Å; V40-R320 HydrophobicContact CG1-CG 3.88Å; R320-D324 HydrophobicContact CG-CB 3.67Å; R320-D324 PolarHBondContact NE-O 3.1Å; R320-D324 PolarHBondContact NH2-O 3.33Å
321	E	65.8	Low	77.1	Confident	98 Å²	98	52.7 Å²	52.7	46%	0.458	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-81.8	156.2	174.8	-71.7	161.5	-165.9	0	0	109.9	R42 E319 T323 D324	R42-E321 IonicContact CZ-OE1 3.35Å; R42-E321 IonicContact CZ-OE2 3.45Å; R42-E321 IonicContact NH1-OE1 2.71Å; R42-E321 PolarHBondContact NH1-OE1 2.99Å; R42-E321 IonicContact NH1-OE2 3.36Å; R42-E321 PolarHBondContact NH1-OE2 2.84Å; R42-E321 VanDerWaalsContact NH2-CD 3.27Å; R42-E321 IonicContact NH2-OE1 3.98Å; R42-E321 IonicContact NH2-OE2 2.99Å; R42-E321 PolarHBondContact NH2-OE2 2.97Å; E319-E321 PolarHBondContact O-N 2.95Å; E321-T323 PolarHBondContact O-N 3.45Å; E321-T323 VanDerWaalsContact O-N 3.12Å; E321-D324 PolarHBondContact N-OD2 2.95Å; E321-D324 WeakPolarHBondContact O-CB 3.47Å; E321-D324 PolarHBondContact O-N 3.31Å
322	A	58.5	Low	75.7	Confident	89 Å²	89	56.2 Å²	56.2	74%	0.736	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-56.2	-31.4	179	0	0	0	0	0	112.9	D324 S325	A322-D324 VanDerWaalsContact C-N 3.28Å; A322-D324 PolarHBondContact O-N 2.66Å; A322-S325 WeakPolarHBondContact O-CB 3.48Å; A322-S325 PolarHBondContact O-N 2.85Å; A322-S325 PolarHBondContact O-OG 3.2Å; A322-S325 VanDerWaalsContact O-OG 3.08Å
323	T	60.4	Low	74	Confident	82 Å²	82	60.2 Å²	60.2	50%	0.503	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-68	-19	177	47.6	0	0	0	0	114.3	H75 E321 S325	H75-T323 WeakPolarHBondContact CB-O 3.42Å; E321-T323 PolarHBondContact O-N 3.45Å; E321-T323 VanDerWaalsContact O-N 3.12Å; T323-S325 PolarHBondContact O-N 2.87Å
324	D	57.6	Low	72.2	Confident	12 Å²	12	64.8 Å²	64.8	6%	0.064	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-78.1	8.4	175	-63.1	-45.9	0	0	0	112.3	R42 R162 R320 E321 A322	R42-D324 IonicContact CZ-OD2 3.37Å; R42-D324 IonicContact NH2-OD1 3.67Å; R42-D324 PolarHBondContact NH2-OD1 3.27Å; R42-D324 IonicContact NH2-OD2 2.69Å; R42-D324 PolarHBondContact NH2-OD2 3.28Å; R162-D324 IonicContact NH1-OD1 3.68Å; R162-D324 PolarHBondContact NH1-OD1 3.23Å; R320-D324 HydrophobicContact CG-CB 3.67Å; R320-D324 PolarHBondContact NE-O 3.1Å; R320-D324 PolarHBondContact NH2-O 3.33Å; E321-D324 PolarHBondContact N-OD2 2.95Å; E321-D324 WeakPolarHBondContact O-CB 3.47Å; E321-D324 PolarHBondContact O-N 3.31Å; A322-D324 VanDerWaalsContact C-N 3.28Å; A322-D324 PolarHBondContact O-N 2.66Å
325	S	52.4	Low	70	Confident	77 Å²	77	70.3 Å²	70.3	54%	0.538	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-116.7	-5.1	-173	-37.5	0	0	0	0	115	A322 T323	A322-S325 WeakPolarHBondContact O-CB 3.48Å; A322-S325 PolarHBondContact O-N 2.85Å; A322-S325 PolarHBondContact O-OG 3.2Å; A322-S325 VanDerWaalsContact O-OG 3.08Å; T323-S325 PolarHBondContact O-N 2.87Å
326	I	44.4	Very low	67.5	Low	174 Å²	174	76.6 Å²	76.6	89%	0.892	43%	0.432	S	S	*	.			trans	-86.1	0	176.4	-55.7	175.7	0	0	0	108.1	H75	H75-I326 PolarHBondContact CD2-OXT 2.91Å; H75-I326 PolarHBondContact NE2-OXT 3.03Å; H75-I326 VanDerWaalsContact NE2-OXT 3.09Å

Retrieved 326 of 326 residues in 92.2 ms (Link to these results)

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