A0A077Z6M3_TRITR Loading...

RNase T domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6M3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 200 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	34.1	Very low	54.8	Low	243 Å²	243	130.3 Å²	130.3	100%	1.197	63%	0.63	S	S	*	*				0	101.6	0	-162	170.8	179.8	0	0	106.5
2	K	42.9	Very low	56.3	Low	164 Å²	164	124.8 Å²	124.8	71%	0.713	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-71.9	126.8	-176.2	-71.5	178.7	176.6	178	0	109
3	E	40.1	Very low	57.1	Low	189 Å²	189	120.2 Å²	120.2	88%	0.883	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-60.6	135.7	176.2	-76.6	-175.5	142.5	0	0	110.7
4	R	42.9	Very low	57.8	Low	234 Å²	234	115.5 Å²	115.5	88%	0.883	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-74.6	130.3	178.7	-70.2	-179.7	173.5	177.8	-1.6	109.8
5	K	50.8	Low	58.8	Low	83 Å²	83	110.9 Å²	110.9	36%	0.361	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-71.7	152.6	179	-68.1	177.6	-175	151.9	0	112.4	I27 D33 T130	K5-I27 HydrophobicContact CB-CG2 4.35Å; K5-D33 WeakPolarHBondContact CD-OD1 3.43Å; K5-D33 WeakPolarHBondContact CE-OD1 2.96Å; K5-D33 VanDerWaalsContact CE-OD2 3.3Å; K5-D33 WeakPolarHBondContact CE-OD2 3.44Å; K5-D33 IonicContact NZ-OD1 3.8Å; K5-D33 PolarHBondContact NZ-OD1 2.97Å; K5-D33 IonicContact NZ-OD2 3.58Å; K5-D33 PolarHBondContact NZ-OD2 3.45Å; K5-T130 PolarHBondContact NZ-OG1 2.72Å
6	R	61.4	Low	59.1	Low	172 Å²	172	105.8 Å²	105.8	65%	0.649	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-74.6	145	-178.1	74.3	178.2	-176	111.8	4.8	112.7	I27 R68	R6-I27 WeakPolarHBondContact O-CD1 3.47Å; R6-R68 PolarHBondContact O-NH2 3.05Å
7	P	56.5	Low	59.2	Low	95 Å²	95	105.8 Å²	105.8	62%	0.617	53%	0.526	S	S	*	.			trans	-42.7	147	168.3	-31	37	0	0	0	114.3
8	L	63	Low	59.7	Low	28 Å²	28	111.2 Å²	111.2	15%	0.147	54%	0.539	C	S	.	.			trans	-60.9	144.2	161.5	-77.2	174.6	0	0	0	107.1	E12 E13 L16 V23	L8-E12 HydrophobicContact CB-CB 4.3Å; L8-E12 HydrophobicContact CD2-CB 3.78Å; L8-E12 HydrophobicContact CD2-CG 4.37Å; L8-E12 HydrophobicContact CG-CB 4.47Å; L8-E13 HydrophobicContact CB-CG 3.74Å; L8-E13 HydrophobicContact CD1-CG 4.2Å; L8-L16 HydrophobicContact CD1-CD2 4.35Å; L8-V23 HydrophobicContact CD1-CG1 3.85Å
9	N	68.2	Low	59.7	Low	59 Å²	59	108.8 Å²	108.8	32%	0.316	54%	0.535	S	S	.	.			trans	-83.2	162	169.5	75.8	66.1	0	0	0	110.7	S11 E12 E13	N9-S11 PolarHBondContact O-N 3.35Å; N9-S11 VanDerWaalsContact O-N 3.13Å; N9-S11 WeakPolarHBondContact OD1-CB 3.24Å; N9-S11 PolarHBondContact OD1-N 3.44Å; N9-S11 PolarHBondContact OD1-OG 3.12Å; N9-E12 VanDerWaalsContact CG-OE2 3.26Å; N9-E12 PolarHBondContact N-OE2 3.03Å; N9-E12 WeakPolarHBondContact ND2-CG 3.41Å; N9-E12 PolarHBondContact ND2-OE2 3.42Å; N9-E12 WeakPolarHBondContact O-CB 3.3Å; N9-E12 PolarHBondContact O-N 2.94Å; N9-E12 PolarHBondContact OD1-N 3.21Å; N9-E13 PolarHBondContact O-N 2.79Å
10	S	68	Low	59.2	Low	90 Å²	90	107 Å²	107	63%	0.629	55%	0.545	S	S	*	.	H	α-helix	trans	-57.8	-30.4	-174.6	55.2	0	0	0	0	114.3	S14	S10-S14 VanDerWaalsContact O-CB 3.25Å; S10-S14 WeakPolarHBondContact O-CB 3.42Å; S10-S14 PolarHBondContact O-N 3.41Å; S10-S14 PolarHBondContact O-OG 3.07Å
11	S	75.3	Confident	59	Low	76 Å²	76	105.4 Å²	105.4	53%	0.531	54%	0.535	S	S	.	.	H	α-helix	trans	-71.6	-37.6	176.9	75.7	0	0	0	0	112	N9 S14 A15	N9-S11 PolarHBondContact O-N 3.35Å; N9-S11 VanDerWaalsContact O-N 3.13Å; N9-S11 WeakPolarHBondContact OD1-CB 3.24Å; N9-S11 PolarHBondContact OD1-N 3.44Å; N9-S11 PolarHBondContact OD1-OG 3.12Å; S11-S14 PolarHBondContact O-N 3.5Å; S11-A15 PolarHBondContact O-N 3.46Å
12	E	72.4	Confident	59.9	Low	64 Å²	64	102.5 Å²	102.5	30%	0.299	52%	0.515	S	S	.	.	H	α-helix	trans	-68.6	-44.2	176.1	-62.3	168.3	130.7	0	0	110.3	L8 N9 S14 A15 L16	L8-E12 HydrophobicContact CB-CB 4.3Å; L8-E12 HydrophobicContact CD2-CB 3.78Å; L8-E12 HydrophobicContact CD2-CG 4.37Å; L8-E12 HydrophobicContact CG-CB 4.47Å; N9-E12 VanDerWaalsContact CG-OE2 3.26Å; N9-E12 PolarHBondContact N-OE2 3.03Å; N9-E12 WeakPolarHBondContact ND2-CG 3.41Å; N9-E12 PolarHBondContact ND2-OE2 3.42Å; N9-E12 WeakPolarHBondContact O-CB 3.3Å; N9-E12 PolarHBondContact O-N 2.94Å; N9-E12 PolarHBondContact OD1-N 3.21Å; E12-S14 VanDerWaalsContact C-N 3.34Å; E12-S14 PolarHBondContact O-N 2.97Å; E12-A15 PolarHBondContact O-N 3.16Å; E12-L16 PolarHBondContact O-N 2.81Å
13	E	66.7	Low	60.4	Low	65 Å²	65	95.8 Å²	95.8	30%	0.304	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-42.8	175.1	-66.8	-175.3	155.2	0	0	112.1	L8 N9 A15 L16 Q17	L8-E13 HydrophobicContact CB-CG 3.74Å; L8-E13 HydrophobicContact CD1-CG 4.2Å; N9-E13 PolarHBondContact O-N 2.79Å; E13-A15 VanDerWaalsContact C-N 3.32Å; E13-A15 PolarHBondContact O-N 2.78Å; E13-L16 PolarHBondContact O-N 3.28Å; E13-Q17 WeakPolarHBondContact O-CG 3.22Å; E13-Q17 PolarHBondContact O-N 2.58Å
14	S	66.9	Low	61.1	Low	55 Å²	55	89 Å²	89	39%	0.385	46%	0.457	S	S	.	.	H	α-helix	trans	-68.1	-30	179.2	-60.5	0	0	0	0	112.5	S10 S11 E12 R18	S10-S14 VanDerWaalsContact O-CB 3.25Å; S10-S14 WeakPolarHBondContact O-CB 3.42Å; S10-S14 PolarHBondContact O-N 3.41Å; S10-S14 PolarHBondContact O-OG 3.07Å; S11-S14 PolarHBondContact O-N 3.5Å; E12-S14 VanDerWaalsContact C-N 3.34Å; E12-S14 PolarHBondContact O-N 2.97Å; S14-R18 WeakPolarHBondContact O-CB 3.4Å; S14-R18 VanDerWaalsContact O-CG 3.24Å; S14-R18 WeakPolarHBondContact O-CG 3.36Å; S14-R18 PolarHBondContact O-N 2.65Å; S14-R18 PolarHBondContact O-NE 3Å
15	A	72.3	Confident	61.4	Low	46 Å²	46	88 Å²	88	38%	0.38	45%	0.454	S	S	.	.	H	α-helix	trans	-69	-45	174.3	0	0	0	0	0	111.7	S11 E12 E13 R18 S19	S11-A15 PolarHBondContact O-N 3.46Å; E12-A15 PolarHBondContact O-N 3.16Å; E13-A15 VanDerWaalsContact C-N 3.32Å; E13-A15 PolarHBondContact O-N 2.78Å; A15-R18 PolarHBondContact O-N 2.91Å; A15-S19 PolarHBondContact O-N 3.16Å
16	L	63.6	Low	61.6	Low	29 Å²	29	86.1 Å²	86.1	15%	0.152	45%	0.451	C	S	.	.	H	α-helix	trans	-66	-42.6	176.4	-93	59.8	0	0	0	112.4	L8 E12 E13 R18 S19 K21 V23 T69	L8-L16 HydrophobicContact CD1-CD2 4.35Å; E12-L16 PolarHBondContact O-N 2.81Å; E13-L16 PolarHBondContact O-N 3.28Å; L16-R18 VanDerWaalsContact C-N 3.32Å; L16-R18 PolarHBondContact O-N 3.04Å; L16-S19 WeakPolarHBondContact O-CB 3.42Å; L16-S19 PolarHBondContact O-N 3.13Å; L16-K21 PolarHBondContact O-N 3.13Å; L16-V23 HydrophobicContact CB-CG2 3.35Å; L16-V23 HydrophobicContact CD2-CB 4.23Å; L16-V23 HydrophobicContact CD2-CG1 3.91Å; L16-V23 HydrophobicContact CD2-CG2 3.5Å; L16-V23 HydrophobicContact CG-CG2 4.08Å; L16-T69 HydrophobicContact CD1-CG2 4.04Å; L16-T69 HydrophobicContact CD2-CG2 3.87Å; L16-T69 HydrophobicContact CG-CG2 4.17Å
17	Q	61.1	Low	61.3	Low	106 Å²	106	80.3 Å²	80.3	50%	0.495	43%	0.432	S	S	.	.	H	α-helix	trans	-61.9	-39.7	178.8	-80.6	177.9	7	0	0	112.1	E13 S19 G20 V23	E13-Q17 WeakPolarHBondContact O-CG 3.22Å; E13-Q17 PolarHBondContact O-N 2.58Å; Q17-S19 PolarHBondContact O-N 2.69Å; Q17-G20 PolarHBondContact O-N 2.98Å; Q17-V23 HydrophobicContact CG-CG2 4.38Å
18	R	67.7	Low	61.1	Low	204 Å²	204	84.1 Å²	84.1	77%	0.77	44%	0.439	S	S	*	.	H	α-helix	trans	-62.1	-24.7	174.9	-77.7	-179.5	-68	177.9	1.9	113.1	S14 A15 L16 G20	S14-R18 WeakPolarHBondContact O-CB 3.4Å; S14-R18 VanDerWaalsContact O-CG 3.24Å; S14-R18 WeakPolarHBondContact O-CG 3.36Å; S14-R18 PolarHBondContact O-N 2.65Å; S14-R18 PolarHBondContact O-NE 3Å; A15-R18 PolarHBondContact O-N 2.91Å; L16-R18 VanDerWaalsContact C-N 3.32Å; L16-R18 PolarHBondContact O-N 3.04Å; R18-G20 VanDerWaalsContact C-N 3.27Å; R18-G20 PolarHBondContact O-N 2.83Å
19	S	60.3	Low	60.9	Low	65 Å²	65	87.8 Å²	87.8	46%	0.455	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	4.1	175.6	-172	0	0	0	0	113.5	A15 L16 Q17 K21	A15-S19 PolarHBondContact O-N 3.16Å; L16-S19 WeakPolarHBondContact O-CB 3.42Å; L16-S19 PolarHBondContact O-N 3.13Å; Q17-S19 PolarHBondContact O-N 2.69Å; S19-K21 PolarHBondContact O-N 3.08Å; S19-K21 WeakPolarHBondContact OG-CD 3.4Å; S19-K21 WeakPolarHBondContact OG-CE 3.35Å; S19-K21 PolarHBondContact OG-NZ 3.36Å
20	G	50.8	Low	60.7	Low	72 Å²	72	86.6 Å²	86.6	74%	0.742	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	11.8	-177.9	0	0	0	0	0	114.2	Q17 R18	Q17-G20 PolarHBondContact O-N 2.98Å; R18-G20 VanDerWaalsContact C-N 3.27Å; R18-G20 PolarHBondContact O-N 2.83Å
21	K	54.1	Low	61	Low	75 Å²	75	87.3 Å²	87.3	33%	0.326	45%	0.45	S	S	.	.			trans	-92.6	131.8	-172.8	-67	168.7	178.8	173.6	0	110.3	L16 S19 V23 L71	L16-K21 PolarHBondContact O-N 3.13Å; S19-K21 PolarHBondContact O-N 3.08Å; S19-K21 WeakPolarHBondContact OG-CD 3.4Å; S19-K21 WeakPolarHBondContact OG-CE 3.35Å; S19-K21 PolarHBondContact OG-NZ 3.36Å; K21-V23 PolarHBondContact O-N 2.9Å; K21-L71 HydrophobicContact CD-CD1 3.57Å; K21-L71 HydrophobicContact CD-CD2 3.52Å; K21-L71 HydrophobicContact CD-CG 3.89Å; K21-L71 HydrophobicContact CG-CD2 4.35Å; K21-L71 VanDerWaalsContact NZ-CD2 3.31Å
22	K	53.1	Low	61.4	Low	181 Å²	181	85.1 Å²	85.1	79%	0.787	43%	0.43	S	S	*	.			trans	-67.1	114.7	174.7	-75.9	-177.1	178.8	177.4	0	109.1
23	V	53.9	Low	62	Low	24 Å²	24	83 Å²	83	15%	0.145	42%	0.421	C	S	.	.			trans	-90.5	123.9	175.8	-171.8	0	0	0	0	109.4	L8 L16 Q17 K21 R25	L8-V23 HydrophobicContact CD1-CG1 3.85Å; L16-V23 HydrophobicContact CB-CG2 3.35Å; L16-V23 HydrophobicContact CD2-CB 4.23Å; L16-V23 HydrophobicContact CD2-CG1 3.91Å; L16-V23 HydrophobicContact CD2-CG2 3.5Å; L16-V23 HydrophobicContact CG-CG2 4.08Å; Q17-V23 HydrophobicContact CG-CG2 4.38Å; K21-V23 PolarHBondContact O-N 2.9Å; V23-R25 PolarHBondContact O-N 3.16Å; V23-R25 VanDerWaalsContact O-N 3.16Å
24	I	53.4	Low	63.1	Low	45 Å²	45	80.5 Å²	80.5	23%	0.231	41%	0.409	C	S	.	.			trans	-68.3	112.7	169.2	-56.2	178.5	0	0	0	107.8	S26	I24-S26 VanDerWaalsContact C-N 3.26Å; I24-S26 WeakPolarHBondContact CG2-O 3.18Å; I24-S26 PolarHBondContact O-N 2.64Å
25	R	51.1	Low	64.2	Low	215 Å²	215	80.7 Å²	80.7	81%	0.811	40%	0.401	S	S	*	.			trans	-75.1	-13.1	-177.9	-66.2	179	-179.9	162.2	-0.7	113.4	V23	V23-R25 PolarHBondContact O-N 3.16Å; V23-R25 VanDerWaalsContact O-N 3.16Å
26	S	53.2	Low	65.1	Low	43 Å²	43	78.5 Å²	78.5	30%	0.301	38%	0.383	S	S	.	.			trans	-112.8	109	-177.6	176.1	0	0	0	0	110.7	I24 K28 D29	I24-S26 VanDerWaalsContact C-N 3.26Å; I24-S26 WeakPolarHBondContact CG2-O 3.18Å; I24-S26 PolarHBondContact O-N 2.64Å; S26-K28 PolarHBondContact O-N 2.85Å; S26-K28 WeakPolarHBondContact OG-CB 3.25Å; S26-K28 PolarHBondContact OG-N 3.09Å; S26-D29 WeakPolarHBondContact CB-OD2 3.46Å; S26-D29 PolarHBondContact OG-OD2 3.18Å
27	I	55.5	Low	66.4	Low	49 Å²	49	79.6 Å²	79.6	25%	0.251	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-68.3	-9.2	170.7	-66.8	-170.1	0	0	0	112.1	K5 R6 D29 V30	K5-I27 HydrophobicContact CB-CG2 4.35Å; R6-I27 WeakPolarHBondContact O-CD1 3.47Å; I27-D29 PolarHBondContact O-N 3.22Å; I27-D29 VanDerWaalsContact O-N 3.12Å; I27-V30 PolarHBondContact O-N 3.35Å
28	K	53	Low	67.8	Low	175 Å²	175	74.7 Å²	74.7	76%	0.761	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-66.2	-16	-177.5	-64.6	-177.8	176.9	176.9	0	113.1	S26	S26-K28 PolarHBondContact O-N 2.85Å; S26-K28 WeakPolarHBondContact OG-CB 3.25Å; S26-K28 PolarHBondContact OG-N 3.09Å
29	D	58.5	Low	68.8	Low	106 Å²	106	68.7 Å²	68.7	57%	0.567	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-110.6	-3.2	-172.2	-49.6	-57	0	0	0	113	S26 I27	S26-D29 WeakPolarHBondContact CB-OD2 3.46Å; S26-D29 PolarHBondContact OG-OD2 3.18Å; I27-D29 PolarHBondContact O-N 3.22Å; I27-D29 VanDerWaalsContact O-N 3.12Å
30	V	63.2	Low	70.2	Confident	33 Å²	33	66 Å²	66	20%	0.2	33%	0.332	C	S	.	.			trans	-95.5	103.6	-179.7	179.3	0	0	0	0	110.3	I27 Y32 S67	I27-V30 PolarHBondContact O-N 3.35Å; V30-Y32 WeakPolarHBondContact CG1-O 3.42Å; V30-S67 WeakPolarHBondContact CG1-OG 3.39Å
31	L	75.1	Confident	72.2	Confident	106 Å²	106	65.3 Å²	65.3	56%	0.555	31%	0.309	S	S	*	.			trans	-79.7	-28.3	-177.3	-63.9	177.2	0	0	0	113.7
32	Y	83	Confident	73.9	Confident	29 Å²	29	62.8 Å²	62.8	11%	0.114	30%	0.301	C	S	.	.			trans	-130.9	152.6	-175.3	-55.1	-82.2	0	0	0	111	V30 Y34 Y35 S67 T130 A132 V188	V30-Y32 WeakPolarHBondContact CG1-O 3.42Å; Y32-Y34 WeakPolarHBondContact CB-O 3.48Å; Y32-Y35 HydrophobicContact CD2-CE1 4.12Å; Y32-S67 WeakPolarHBondContact O-CB 3.47Å; Y32-S67 PolarHBondContact O-OG 3.38Å; Y32-T130 WeakPolarHBondContact CA-OG1 3.24Å; Y32-A132 HydrophobicContact CD1-CB 3.83Å; Y32-A132 HydrophobicContact CD2-CB 3.42Å; Y32-A132 VanDerWaalsContact CD2-CB 3.42Å; Y32-A132 HydrophobicContact CE1-CB 4.04Å; Y32-A132 HydrophobicContact CE2-CB 3.65Å; Y32-A132 HydrophobicContact CG-CB 3.53Å; Y32-V188 HydrophobicContact CE1-CB 4.47Å; Y32-V188 HydrophobicContact CE1-CG2 4.16Å; Y32-V188 WeakPolarHBondContact OH-CB 3.44Å; Y32-V188 VanDerWaalsContact OH-CG1 3.23Å; Y32-V188 WeakPolarHBondContact OH-CG1 3.27Å; Y32-V188 WeakPolarHBondContact OH-CG2 3.27Å
33	D	86.1	Confident	75.8	Confident	20 Å²	20	54.3 Å²	54.3	11%	0.107	26%	0.264	C	S	.	.	S	Bend	trans	-71.1	-40.5	171.5	-66.6	-60.9	0	0	0	111.4	K5 S67 K129 T130	K5-D33 WeakPolarHBondContact CD-OD1 3.43Å; K5-D33 WeakPolarHBondContact CE-OD1 2.96Å; K5-D33 VanDerWaalsContact CE-OD2 3.3Å; K5-D33 WeakPolarHBondContact CE-OD2 3.44Å; K5-D33 IonicContact NZ-OD1 3.8Å; K5-D33 PolarHBondContact NZ-OD1 2.97Å; K5-D33 IonicContact NZ-OD2 3.58Å; K5-D33 PolarHBondContact NZ-OD2 3.45Å; D33-S67 VanDerWaalsContact C-OG 3.31Å; D33-S67 VanDerWaalsContact O-CB 3.25Å; D33-S67 WeakPolarHBondContact O-CB 3.3Å; D33-S67 PolarHBondContact O-N 3.34Å; D33-S67 PolarHBondContact O-OG 3.01Å; D33-K129 HydrophobicContact CB-CB 3.84Å; D33-K129 HydrophobicContact CB-CD 4.15Å; D33-K129 HydrophobicContact CB-CG 3.99Å; D33-K129 WeakPolarHBondContact OD2-CA 3.37Å; D33-K129 VanDerWaalsContact OD2-CB 3.29Å; D33-K129 WeakPolarHBondContact OD2-CB 3.5Å; D33-K129 WeakPolarHBondContact OD2-CG 3.29Å; D33-T130 WeakPolarHBondContact CA-O 3.36Å; D33-T130 WeakPolarHBondContact CB-O 3.44Å; D33-T130 PolarHBondContact N-O 2.81Å; D33-T130 PolarHBondContact N-OG1 3.45Å; D33-T130 PolarHBondContact OD2-N 3.28Å; D33-T130 PolarHBondContact OD2-OG1 2.92Å
34	Y	89.1	Confident	77.5	Confident	12 Å²	12	54 Å²	54	5%	0.047	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	150.4	179.7	-59.1	-69.7	0	0	0	112.2	Y32 L64 I65 D66 V73 H123 V124 K129 T130 V131 A132	Y32-Y34 WeakPolarHBondContact CB-O 3.48Å; Y34-L64 HydrophobicContact CD1-CD1 4.41Å; Y34-L64 HydrophobicContact CD1-CD2 4.18Å; Y34-L64 HydrophobicContact CD1-CG 3.96Å; Y34-L64 HydrophobicContact CD2-CD1 4.48Å; Y34-L64 HydrophobicContact CD2-CD2 4.34Å; Y34-L64 HydrophobicContact CE1-CD2 4.41Å; Y34-L64 HydrophobicContact CE2-CD2 4.48Å; Y34-L64 HydrophobicContact CG-CD1 3.95Å; Y34-L64 HydrophobicContact CG-CD2 4.17Å; Y34-L64 HydrophobicContact CG-CG 3.98Å; Y34-I65 CarbonylContact C-O 3.53Å; Y34-I65 WeakPolarHBondContact CA-O 3.38Å; Y34-D66 HydrophobicContact CD1-CB 4.2Å; Y34-D66 HydrophobicContact CE1-CB 3.98Å; Y34-V73 HydrophobicContact CD1-CG2 4.1Å; Y34-V73 HydrophobicContact CE1-CB 4.36Å; Y34-V73 HydrophobicContact CE1-CG1 4.19Å; Y34-V73 HydrophobicContact CE1-CG2 3.65Å; Y34-H123 HydrophobicContact CE2-CB 4.18Å; Y34-V124 HydrophobicContact CD2-CG1 4.37Å; Y34-K129 HydrophobicContact CD2-CB 4.39Å; Y34-K129 HydrophobicContact CD2-CD 4.21Å; Y34-K129 HydrophobicContact CE2-CB 4.19Å; Y34-K129 HydrophobicContact CE2-CD 3.31Å; Y34-K129 HydrophobicContact CE2-CG 4.38Å; Y34-K129 PolarHBondContact OH-NZ 3.44Å; Y34-T130 PolarHBondContact N-O 2.73Å; Y34-V131 HydrophobicContact CD2-CG2 4.22Å; Y34-V131 WeakPolarHBondContact O-CA 3.34Å; Y34-A132 PolarHBondContact O-N 2.61Å
35	Y	89.6	Confident	79.3	Confident	59 Å²	59	55.8 Å²	55.8	23%	0.231	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.7	157	-61.8	-72.9	0	0	0	107.9	Y32 I65 A132 V134	Y32-Y35 HydrophobicContact CD2-CE1 4.12Å; Y35-I65 PolarHBondContact N-O 3.19Å; Y35-I65 PolarHBondContact O-N 3.43Å; Y35-A132 CarbonylContact C-O 3.55Å; Y35-A132 WeakPolarHBondContact CA-O 3.45Å; Y35-A132 HydrophobicContact CD1-CB 4.02Å; Y35-A132 HydrophobicContact CE1-CB 4.28Å; Y35-V134 HydrophobicContact CD1-CG2 3.93Å; Y35-V134 HydrophobicContact CG-CG2 4.37Å
36	C	90.9	Very high	81.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	100.6	172.7	-177.6	0	0	0	0	107.5	I63 L64 V131 A132 F133 V134	C36-I63 CarbonylContact C-O 3.59Å; C36-I63 WeakPolarHBondContact CA-O 3.07Å; C36-L64 HydrophobicContact CB-CD1 3.97Å; C36-V131 HydrophobicContact CB-CG1 3.61Å; C36-A132 PolarHBondContact N-O 3.49Å; C36-F133 HydrophobicContact CB-CD1 3.59Å; C36-F133 HydrophobicContact CB-CE1 3.74Å; C36-F133 CarbonylContact O-C 3.56Å; C36-F133 VanDerWaalsContact O-CA 3.3Å; C36-F133 WeakPolarHBondContact O-CA 3.48Å; C36-V134 PolarHBondContact O-N 3.4Å
37	V	91	Very high	82.8	Confident	53 Å²	53	58 Å²	58	32%	0.321	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	127.4	178.8	-172.9	0	0	0	0	107.8	A62 I63 I65 V134	V37-A62 CarbonylContact O-C 3.58Å; V37-A62 WeakPolarHBondContact O-CA 3.15Å; V37-I63 PolarHBondContact N-O 3.23Å; V37-I63 PolarHBondContact O-N 3.22Å; V37-I65 HydrophobicContact CG2-CD1 3.74Å; V37-V134 CarbonylContact C-O 3.57Å; V37-V134 VanDerWaalsContact CA-O 3.27Å; V37-V134 WeakPolarHBondContact CA-O 3.16Å; V37-V134 HydrophobicContact CG2-CB 4.15Å
38	I	90.6	Very high	84.1	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	140.7	-179.7	-60.5	171.4	0	0	0	107.7	F40 F60 P61 A62 F116 F133 V134 V135 Q140 L144	I38-F40 HydrophobicContact CG2-CD1 4.06Å; I38-F40 HydrophobicContact CG2-CD2 3.81Å; I38-F40 HydrophobicContact CG2-CE1 3.82Å; I38-F40 HydrophobicContact CG2-CE2 3.55Å; I38-F40 HydrophobicContact CG2-CG 4.07Å; I38-F40 HydrophobicContact CG2-CZ 3.56Å; I38-F60 HydrophobicContact CD1-CE2 4.1Å; I38-F60 HydrophobicContact CG1-CE2 4.36Å; I38-F60 HydrophobicContact CG2-CD2 4.08Å; I38-F60 HydrophobicContact CG2-CE2 3.76Å; I38-P61 WeakPolarHBondContact CA-O 3.4Å; I38-A62 HydrophobicContact CG1-CB 3.85Å; I38-F116 HydrophobicContact CD1-CZ 3.97Å; I38-F133 HydrophobicContact CD1-CD1 3.43Å; I38-F133 VanDerWaalsContact CD1-CD1 3.43Å; I38-F133 HydrophobicContact CD1-CE1 3.88Å; I38-F133 HydrophobicContact CD1-CG 4.33Å; I38-F133 HydrophobicContact CG1-CD1 4.31Å; I38-V134 PolarHBondContact N-O 2.76Å; I38-V135 HydrophobicContact CB-CG1 4.09Å; I38-Q140 PolarHBondContact O-OE1 3.03Å; I38-L144 HydrophobicContact CD1-CD2 4.48Å
39	D	88.6	Confident	85.4	Confident	78 Å²	78	52.6 Å²	52.6	42%	0.417	26%	0.263	S	S	.	.			trans	-138	88.3	179.7	-172.4	13.2	0	0	0	109.6	P61 Q140	D39-P61 HydrophobicContact CB-CG 4.14Å; D39-P61 PolarHBondContact N-O 3.04Å; D39-P61 WeakPolarHBondContact O-CD 3.24Å; D39-P61 WeakPolarHBondContact O-CG 3.23Å; D39-Q140 PolarHBondContact OD1-NE2 2.82Å
40	F	90.1	Very high	86.1	Confident	9 Å²	9	51.4 Å²	51.4	4%	0.039	26%	0.256	C	S	.	.			trans	-76.7	136.1	-174.3	-66.8	-68.4	0	0	0	112	I38 I57 F60 L143 L144 I182	I38-F40 HydrophobicContact CG2-CD1 4.06Å; I38-F40 HydrophobicContact CG2-CD2 3.81Å; I38-F40 HydrophobicContact CG2-CE1 3.82Å; I38-F40 HydrophobicContact CG2-CE2 3.55Å; I38-F40 HydrophobicContact CG2-CG 4.07Å; I38-F40 HydrophobicContact CG2-CZ 3.56Å; F40-I57 HydrophobicContact CD1-CD1 3.82Å; F40-I57 HydrophobicContact CD1-CG1 4.11Å; F40-I57 HydrophobicContact CD1-CG2 3.78Å; F40-I57 HydrophobicContact CE1-CD1 3.78Å; F40-I57 HydrophobicContact CE1-CG2 4.33Å; F40-I57 HydrophobicContact CG-CD1 4.22Å; F40-I57 HydrophobicContact CG-CG1 4.36Å; F40-I57 HydrophobicContact CZ-CD1 4.19Å; F40-F60 HydrophobicContact CD1-CB 4.32Å; F40-F60 AromaticContact CD1-CD2 3.89Å; F40-F60 HydrophobicContact CD1-CD2 3.89Å; F40-F60 HydrophobicContact CD1-CE2 4.31Å; F40-F60 HydrophobicContact CD1-CG 4.02Å; F40-F60 HydrophobicContact CE1-CB 4.22Å; F40-F60 AromaticContact CE1-CD1 3.67Å; F40-F60 HydrophobicContact CE1-CD1 3.67Å; F40-F60 AromaticContact CE1-CD2 3.24Å; F40-F60 HydrophobicContact CE1-CD2 3.24Å; F40-F60 AromaticContact CE1-CE1 3.71Å; F40-F60 HydrophobicContact CE1-CE1 3.71Å; F40-F60 AromaticContact CE1-CE2 3.29Å; F40-F60 HydrophobicContact CE1-CE2 3.29Å; F40-F60 AromaticContact CE1-CG 3.45Å; F40-F60 HydrophobicContact CE1-CG 3.45Å; F40-F60 VanDerWaalsContact CE1-CG 3.45Å; F40-F60 AromaticContact CE1-CZ 3.53Å; F40-F60 HydrophobicContact CE1-CZ 3.53Å; F40-F60 HydrophobicContact CZ-CD2 4.03Å; F40-F60 HydrophobicContact CZ-CE1 4.14Å; F40-F60 AromaticContact CZ-CE2 3.59Å; F40-F60 HydrophobicContact CZ-CE2 3.59Å; F40-F60 HydrophobicContact CZ-CG 4.49Å; F40-F60 AromaticContact CZ-CZ 3.65Å; F40-F60 HydrophobicContact CZ-CZ 3.65Å; F40-L143 HydrophobicContact CB-CD1 3.71Å; F40-L143 HydrophobicContact CD2-CB 4.03Å; F40-L143 HydrophobicContact CD2-CD1 3.55Å; F40-L143 HydrophobicContact CD2-CG 4.44Å; F40-L143 HydrophobicContact CE2-CB 4.1Å; F40-L143 HydrophobicContact CE2-CD1 4.42Å; F40-L143 HydrophobicContact CG-CD1 3.92Å; F40-L144 HydrophobicContact CE2-CD2 3.76Å; F40-L144 HydrophobicContact CE2-CG 4.17Å; F40-L144 HydrophobicContact CZ-CD2 4.08Å; F40-I182 HydrophobicContact CZ-CD1 4.03Å
41	E	92.4	Very high	86.4	Confident	58 Å²	58	54.8 Å²	54.8	27%	0.271	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	141.2	160.4	-60.6	-62.9	166.9	0	0	110	I57 I58 E59 T96 I98	E41-I57 CarbonylContact O-C 3.47Å; E41-I57 WeakPolarHBondContact O-CA 3.39Å; E41-I58 HydrophobicContact CB-CG1 4.09Å; E41-I58 WeakPolarHBondContact O-CG1 3.35Å; E41-I58 PolarHBondContact O-N 2.87Å; E41-E59 HydrophobicContact CB-CB 3.65Å; E41-E59 HydrophobicContact CG-CB 3.94Å; E41-E59 PolarHBondContact N-O 2.76Å; E41-E59 PolarHBondContact O-N 3.23Å; E41-T96 HydrophobicContact CB-CG2 4.25Å; E41-T96 HydrophobicContact CG-CG2 4.43Å; E41-T96 VanDerWaalsContact OE2-CG2 3.31Å; E41-T96 WeakPolarHBondContact OE2-CG2 3.33Å; E41-I98 HydrophobicContact CB-CD1 3.97Å; E41-I98 HydrophobicContact CG-CD1 4.32Å
42	C	91	Very high	86.5	Confident	22 Å²	22	54.2 Å²	54.2	15%	0.149	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	155.1	-178.5	-63.8	0	0	0	0	111.7	C44 H55 E56	C42-C44 PolarHBondContact O-N 3.47Å; C42-H55 HydrophobicContact CB-CB 3.99Å; C42-E56 CarbonylContact C-O 3.45Å; C42-E56 WeakPolarHBondContact CA-O 3.41Å; C42-E56 WeakPolarHBondContact CB-O 3.25Å
43	T	92.5	Very high	86.4	Confident	2 Å²	2	54 Å²	54	1%	0.012	27%	0.266	C	S	.	.			trans	-54.9	139.2	168.6	59.5	0	0	0	0	110.2	H55 E56 I58 P82 L88	T43-H55 VanDerWaalsContact O-CB 3.24Å; T43-H55 WeakPolarHBondContact O-CB 3.43Å; T43-H55 PolarHBondContact O-ND1 3.2Å; T43-H55 WeakPolarHBondContact OG1-CA 2.88Å; T43-E56 HydrophobicContact CG2-CB 4.24Å; T43-E56 PolarHBondContact N-O 3.17Å; T43-E56 PolarHBondContact OG1-N 2.84Å; T43-I58 HydrophobicContact CG2-CG2 3.57Å; T43-P82 HydrophobicContact CG2-CB 3.86Å; T43-P82 HydrophobicContact CG2-CG 4.04Å; T43-L88 HydrophobicContact CG2-CD2 3.98Å
44	C	90.4	Very high	86.3	Confident	17 Å²	17	55.6 Å²	55.6	12%	0.115	28%	0.277	C	S	.	.			trans	-148.3	166	175.8	53.7	0	0	0	0	112.1	C42 S89 F91 C92	C42-C44 PolarHBondContact O-N 3.47Å; C44-S89 WeakPolarHBondContact O-CB 3.27Å; C44-S89 PolarHBondContact O-OG 2.84Å; C44-F91 HydrophobicContact CB-CD1 4.44Å; C44-F91 HydrophobicContact CB-CE1 4.34Å; C44-C92 WeakPolarHBondContact O-CB 3.36Å; C44-C92 VanDerWaalsContact SG-CA 3.54Å; C44-C92 VanDerWaalsContact SG-CB 3.58Å
45	E	89.7	Confident	86.1	Confident	84 Å²	84	56 Å²	56	39%	0.393	28%	0.279	S	S	.	.			trans	-135.6	140.2	177.8	-78.9	-71.2	-172.3	0	0	109.2	Y47 A48 Y53 S89	E45-Y47 VanDerWaalsContact C-N 3.27Å; E45-Y47 PolarHBondContact O-N 2.77Å; E45-A48 HydrophobicContact CB-CB 3.66Å; E45-A48 PolarHBondContact O-N 2.58Å; E45-Y53 HydrophobicContact CB-CD2 4.29Å; E45-Y53 HydrophobicContact CB-CE2 3.95Å; E45-Y53 HydrophobicContact CG-CD2 4.19Å; E45-Y53 HydrophobicContact CG-CE2 3.38Å; E45-S89 VanDerWaalsContact OE1-CB 3.27Å; E45-S89 WeakPolarHBondContact OE1-CB 3.41Å; E45-S89 WeakPolarHBondContact OE2-CB 3.5Å
46	E	90.1	Very high	86.1	Confident	108 Å²	108	53.5 Å²	53.5	51%	0.505	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.5	-168.8	-169.3	173.1	-155	0	0	114.1	F91	E46-F91 HydrophobicContact CB-CB 3.82Å; E46-F91 HydrophobicContact CB-CD1 4.27Å; E46-F91 HydrophobicContact CB-CD2 3.65Å; E46-F91 HydrophobicContact CB-CE2 4.28Å; E46-F91 HydrophobicContact CB-CG 3.64Å; E46-F91 HydrophobicContact CG-CD2 3.62Å; E46-F91 HydrophobicContact CG-CE2 3.99Å; E46-F91 HydrophobicContact CG-CG 4.17Å
47	Y	89.3	Confident	86.1	Confident	196 Å²	196	53.9 Å²	53.9	77%	0.769	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.9	13.5	-174.3	-50.7	-70.5	0	0	0	113	E45	E45-Y47 VanDerWaalsContact C-N 3.27Å; E45-Y47 PolarHBondContact O-N 2.77Å
48	A	82.2	Confident	86.3	Confident	40 Å²	40	51.4 Å²	51.4	33%	0.331	26%	0.256	S	S	.	.	S	Bend	trans	-80.4	142.5	176.7	0	0	0	0	0	110.1	E45 I50 Y53	E45-A48 HydrophobicContact CB-CB 3.66Å; E45-A48 PolarHBondContact O-N 2.58Å; A48-I50 PolarHBondContact O-N 3.14Å; A48-Y53 HydrophobicContact CB-CD2 3.58Å; A48-Y53 HydrophobicContact CB-CE2 4.45Å; A48-Y53 HydrophobicContact CB-CG 3.91Å
49	D	79.4	Confident	86.6	Confident	70 Å²	70	52.8 Å²	52.8	37%	0.374	26%	0.263	S	S	.	.			trans	-66.5	117.8	170.9	-176.3	-18.8	0	0	0	108.5	R51 T52 Y53	D49-R51 PolarHBondContact O-N 2.75Å; D49-R51 VanDerWaalsContact OD1-CB 3.27Å; D49-R51 WeakPolarHBondContact OD1-CB 3.19Å; D49-R51 IonicContact OD1-CZ 3.87Å; D49-R51 PolarHBondContact OD1-N 3.29Å; D49-R51 IonicContact OD1-NE 3.4Å; D49-R51 IonicContact OD1-NH2 2.69Å; D49-R51 IonicContact OD2-NH2 3.26Å; D49-T52 PolarHBondContact O-N 2.84Å; D49-T52 PolarHBondContact O-OG1 3.03Å; D49-Y53 PolarHBondContact O-N 2.79Å
50	I	73	Confident	86.8	Confident	81 Å²	81	49.1 Å²	49.1	42%	0.415	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-27.7	177.9	-166.4	169.1	0	0	0	112.2	A48 H55 Y173	A48-I50 PolarHBondContact O-N 3.14Å; I50-H55 PolarHBondContact O-NE2 3.14Å; I50-Y173 VanDerWaalsContact C-OH 3.31Å; I50-Y173 VanDerWaalsContact O-CE1 3.27Å; I50-Y173 WeakPolarHBondContact O-CE1 3.01Å; I50-Y173 VanDerWaalsContact O-CZ 3.29Å; I50-Y173 PolarHBondContact O-OH 3.17Å
51	R	70.7	Confident	87.1	Confident	105 Å²	105	49.9 Å²	49.9	40%	0.396	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-23.5	177.3	-69.5	178.4	-69.7	-101.4	-6.3	115.5	D49 Y173	D49-R51 PolarHBondContact O-N 2.75Å; D49-R51 VanDerWaalsContact OD1-CB 3.27Å; D49-R51 WeakPolarHBondContact OD1-CB 3.19Å; D49-R51 IonicContact OD1-CZ 3.87Å; D49-R51 PolarHBondContact OD1-N 3.29Å; D49-R51 IonicContact OD1-NE 3.4Å; D49-R51 IonicContact OD1-NH2 2.69Å; D49-R51 IonicContact OD2-NH2 3.26Å; R51-Y173 VanDerWaalsContact CA-CZ 3.44Å; R51-Y173 WeakPolarHBondContact CA-OH 3.45Å; R51-Y173 PolarHBondContact N-OH 3.4Å; R51-Y173 WeakPolarHBondContact O-CE1 3.07Å; R51-Y173 WeakPolarHBondContact O-CE2 3.48Å; R51-Y173 VanDerWaalsContact O-CZ 3.22Å
52	T	76.6	Confident	87.2	Confident	94 Å²	94	47.2 Å²	47.2	58%	0.577	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.4	-20.3	-170.2	66.6	0	0	0	0	113.3	D49	D49-T52 PolarHBondContact O-N 2.84Å; D49-T52 PolarHBondContact O-OG1 3.03Å
53	Y	81	Confident	87.4	Confident	25 Å²	25	48.3 Å²	48.3	10%	0.098	24%	0.24	C	C	.	.	S	Bend	trans	-65.2	126.9	175.8	-170.6	-97.3	0	0	0	109.8	E45 A48 D49 H55	E45-Y53 HydrophobicContact CB-CD2 4.29Å; E45-Y53 HydrophobicContact CB-CE2 3.95Å; E45-Y53 HydrophobicContact CG-CD2 4.19Å; E45-Y53 HydrophobicContact CG-CE2 3.38Å; A48-Y53 HydrophobicContact CB-CD2 3.58Å; A48-Y53 HydrophobicContact CB-CE2 4.45Å; A48-Y53 HydrophobicContact CB-CG 3.91Å; D49-Y53 PolarHBondContact O-N 2.79Å; Y53-H55 VanDerWaalsContact C-N 3.27Å; Y53-H55 HydrophobicContact CD1-CB 4.21Å; Y53-H55 AromaticContact CD1-CD2 3.84Å; Y53-H55 AromaticContact CD1-CE1 3.7Å; Y53-H55 AromaticContact CD1-CG 3.6Å; Y53-H55 AromaticContact CD1-ND1 3.53Å; Y53-H55 AromaticContact CD1-NE2 3.89Å; Y53-H55 HydrophobicContact CE1-CB 4.5Å; Y53-H55 PolarHBondContact O-CD2 3.09Å; Y53-H55 PolarHBondContact O-N 2.69Å
54	P	83.7	Confident	87.5	Confident	52 Å²	52	48.2 Å²	48.2	34%	0.338	24%	0.24	S	C	.	.			trans	-80.1	78.7	-178.3	28	-26.5	0	0	0	109.3	N85	P54-N85 PolarHBondContact O-ND2 3.3Å
55	H	85.9	Confident	87.6	Confident	22 Å²	22	49.6 Å²	49.6	10%	0.102	25%	0.246	C	C	.	.			trans	-70.6	147.2	179.9	-33.6	-118.2	0	0	0	111.8	C42 T43 I50 Y53 F175	C42-H55 HydrophobicContact CB-CB 3.99Å; T43-H55 VanDerWaalsContact O-CB 3.24Å; T43-H55 WeakPolarHBondContact O-CB 3.43Å; T43-H55 PolarHBondContact O-ND1 3.2Å; T43-H55 WeakPolarHBondContact OG1-CA 2.88Å; I50-H55 PolarHBondContact O-NE2 3.14Å; Y53-H55 VanDerWaalsContact C-N 3.27Å; Y53-H55 HydrophobicContact CD1-CB 4.21Å; Y53-H55 AromaticContact CD1-CD2 3.84Å; Y53-H55 AromaticContact CD1-CE1 3.7Å; Y53-H55 AromaticContact CD1-CG 3.6Å; Y53-H55 AromaticContact CD1-ND1 3.53Å; Y53-H55 AromaticContact CD1-NE2 3.89Å; Y53-H55 HydrophobicContact CE1-CB 4.5Å; Y53-H55 PolarHBondContact O-CD2 3.09Å; Y53-H55 PolarHBondContact O-N 2.69Å; H55-F175 HydrophobicContact CB-CE1 3.52Å; H55-F175 HydrophobicContact CB-CE2 4.13Å; H55-F175 HydrophobicContact CB-CZ 3.19Å; H55-F175 AromaticContact CD2-CE2 3.58Å; H55-F175 AromaticContact CD2-CZ 3.36Å; H55-F175 WeakPolarHBondContact CD2-CZ 3.43Å; H55-F175 AromaticContact CG-CZ 3.44Å; H55-F175 VanDerWaalsContact CG-CZ 3.44Å; H55-F175 WeakPolarHBondContact O-CD1 3.47Å; H55-F175 VanDerWaalsContact O-CE1 3.26Å; H55-F175 WeakPolarHBondContact O-CE1 3.25Å
56	E	89.5	Confident	87.6	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.028	24%	0.235	C	C	.	.			trans	-124.7	139.3	177	-62.9	175.8	98.9	0	0	108.9	C42 T43 I58 P82 V83 E84 N85 F174	C42-E56 CarbonylContact C-O 3.45Å; C42-E56 WeakPolarHBondContact CA-O 3.41Å; C42-E56 WeakPolarHBondContact CB-O 3.25Å; T43-E56 HydrophobicContact CG2-CB 4.24Å; T43-E56 PolarHBondContact N-O 3.17Å; T43-E56 PolarHBondContact OG1-N 2.84Å; E56-I58 PolarHBondContact O-N 3.44Å; E56-P82 HydrophobicContact CB-CB 3.98Å; E56-P82 HydrophobicContact CG-CB 4.47Å; E56-P82 WeakPolarHBondContact OE2-CB 3.31Å; E56-V83 PolarHBondContact OE1-N 2.7Å; E56-V83 PolarHBondContact OE2-N 3.21Å; E56-E84 VanDerWaalsContact CD-N 3.33Å; E56-E84 PolarHBondContact OE1-N 2.93Å; E56-E84 PolarHBondContact OE2-N 3.07Å; E56-N85 PolarHBondContact OE2-N 3.27Å; E56-F174 HydrophobicContact CG-CD1 4.49Å; E56-F174 HydrophobicContact CG-CE1 4.41Å
57	I	91.2	Very high	87.5	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.041	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	132	174.4	-67.3	164.4	0	0	0	108.2	F40 E41 E59 F60 C80 F109	F40-I57 HydrophobicContact CD1-CD1 3.82Å; F40-I57 HydrophobicContact CD1-CG1 4.11Å; F40-I57 HydrophobicContact CD1-CG2 3.78Å; F40-I57 HydrophobicContact CE1-CD1 3.78Å; F40-I57 HydrophobicContact CE1-CG2 4.33Å; F40-I57 HydrophobicContact CG-CD1 4.22Å; F40-I57 HydrophobicContact CG-CG1 4.36Å; F40-I57 HydrophobicContact CZ-CD1 4.19Å; E41-I57 CarbonylContact O-C 3.47Å; E41-I57 WeakPolarHBondContact O-CA 3.39Å; I57-E59 WeakPolarHBondContact CG2-O 3.23Å; I57-F60 HydrophobicContact CG2-CB 4.42Å; I57-C80 HydrophobicContact CG2-CB 4.35Å; I57-C80 WeakPolarHBondContact O-CB 3.47Å; I57-F109 HydrophobicContact CB-CD2 4.19Å; I57-F109 HydrophobicContact CB-CE2 4.28Å; I57-F109 HydrophobicContact CD1-CD2 4.26Å; I57-F109 HydrophobicContact CD1-CE2 3.51Å; I57-F109 HydrophobicContact CD1-CZ 4.19Å; I57-F109 HydrophobicContact CG1-CE2 4.45Å; I57-F109 HydrophobicContact CG2-CD2 4.49Å
58	I	95.1	Very high	87.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-16.2	177.2	57.2	175.4	0	0	0	112.7	E41 T43 E56 Y79 C80 P82 L88 I98 V103	E41-I58 HydrophobicContact CB-CG1 4.09Å; E41-I58 WeakPolarHBondContact O-CG1 3.35Å; E41-I58 PolarHBondContact O-N 2.87Å; T43-I58 HydrophobicContact CG2-CG2 3.57Å; E56-I58 PolarHBondContact O-N 3.44Å; I58-Y79 CarbonylContact O-C 3.59Å; I58-Y79 VanDerWaalsContact O-CA 3.31Å; I58-Y79 WeakPolarHBondContact O-CA 3.4Å; I58-Y79 WeakPolarHBondContact O-CD1 3.46Å; I58-C80 PolarHBondContact O-N 3.31Å; I58-P82 HydrophobicContact CG2-CB 4.34Å; I58-P82 HydrophobicContact CG2-CG 3.93Å; I58-L88 HydrophobicContact CD1-CD2 4.08Å; I58-L88 HydrophobicContact CG2-CD2 4.25Å; I58-I98 HydrophobicContact CD1-CD1 3.86Å; I58-I98 HydrophobicContact CG1-CD1 3.89Å; I58-V103 HydrophobicContact CB-CG1 3.99Å; I58-V103 HydrophobicContact CG2-CG1 4.16Å
59	E	96.1	Very high	87.5	Confident	32 Å²	32	35.2 Å²	35.2	15%	0.15	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.4	169.4	-157.4	177.5	171.9	0	0	110.4	E41 I57 H77 Y79 I98	E41-E59 HydrophobicContact CB-CB 3.65Å; E41-E59 HydrophobicContact CG-CB 3.94Å; E41-E59 PolarHBondContact N-O 2.76Å; E41-E59 PolarHBondContact O-N 3.23Å; I57-E59 WeakPolarHBondContact CG2-O 3.23Å; E59-H77 IonicContact OE1-CD2 3.56Å; E59-H77 IonicContact OE1-CE1 2.73Å; E59-H77 IonicContact OE1-NE2 3.63Å; E59-H77 PolarHBondContact OE1-NE2 3.43Å; E59-Y79 HydrophobicContact CB-CD1 4.21Å; E59-Y79 HydrophobicContact CB-CE1 4.42Å; E59-Y79 HydrophobicContact CG-CD1 3.87Å; E59-Y79 HydrophobicContact CG-CE1 3.8Å; E59-I98 HydrophobicContact CB-CD1 3.87Å; E59-I98 WeakPolarHBondContact OE2-CD1 3.26Å
60	F	93.6	Very high	87.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.182	C	C	.	.			trans	-131	74.3	-179.8	-164.8	163.1	0	0	0	110	I38 F40 I57 F76 S78 V112 V113 F116 I182	I38-F60 HydrophobicContact CD1-CE2 4.1Å; I38-F60 HydrophobicContact CG1-CE2 4.36Å; I38-F60 HydrophobicContact CG2-CD2 4.08Å; I38-F60 HydrophobicContact CG2-CE2 3.76Å; F40-F60 HydrophobicContact CD1-CB 4.32Å; F40-F60 AromaticContact CD1-CD2 3.89Å; F40-F60 HydrophobicContact CD1-CD2 3.89Å; F40-F60 HydrophobicContact CD1-CE2 4.31Å; F40-F60 HydrophobicContact CD1-CG 4.02Å; F40-F60 HydrophobicContact CE1-CB 4.22Å; F40-F60 AromaticContact CE1-CD1 3.67Å; F40-F60 HydrophobicContact CE1-CD1 3.67Å; F40-F60 AromaticContact CE1-CD2 3.24Å; F40-F60 HydrophobicContact CE1-CD2 3.24Å; F40-F60 AromaticContact CE1-CE1 3.71Å; F40-F60 HydrophobicContact CE1-CE1 3.71Å; F40-F60 AromaticContact CE1-CE2 3.29Å; F40-F60 HydrophobicContact CE1-CE2 3.29Å; F40-F60 AromaticContact CE1-CG 3.45Å; F40-F60 HydrophobicContact CE1-CG 3.45Å; F40-F60 VanDerWaalsContact CE1-CG 3.45Å; F40-F60 AromaticContact CE1-CZ 3.53Å; F40-F60 HydrophobicContact CE1-CZ 3.53Å; F40-F60 HydrophobicContact CZ-CD2 4.03Å; F40-F60 HydrophobicContact CZ-CE1 4.14Å; F40-F60 AromaticContact CZ-CE2 3.59Å; F40-F60 HydrophobicContact CZ-CE2 3.59Å; F40-F60 HydrophobicContact CZ-CG 4.49Å; F40-F60 AromaticContact CZ-CZ 3.65Å; F40-F60 HydrophobicContact CZ-CZ 3.65Å; I57-F60 HydrophobicContact CG2-CB 4.42Å; F60-F76 HydrophobicContact CB-CE1 4.36Å; F60-F76 HydrophobicContact CD1-CE1 4.49Å; F60-F76 HydrophobicContact CD2-CE1 4.41Å; F60-F76 HydrophobicContact CG-CE1 4.15Å; F60-F76 VanDerWaalsContact O-CD1 3.27Å; F60-F76 WeakPolarHBondContact O-CD1 3.34Å; F60-F76 WeakPolarHBondContact O-CE1 3.46Å; F60-S78 PolarHBondContact N-O 3.39Å; F60-S78 PolarHBondContact O-N 3.13Å; F60-V112 HydrophobicContact CB-CG1 4.09Å; F60-V112 HydrophobicContact CD1-CG1 3.74Å; F60-V112 HydrophobicContact CG-CG1 4.28Å; F60-V113 HydrophobicContact CE1-CG2 4.3Å; F60-F116 HydrophobicContact CE1-CB 4.35Å; F60-F116 HydrophobicContact CE1-CD1 4.45Å; F60-F116 HydrophobicContact CE1-CG 4.22Å; F60-F116 AromaticContact CE2-CD2 3.99Å; F60-F116 HydrophobicContact CE2-CD2 3.99Å; F60-F116 AromaticContact CE2-CE2 3.95Å; F60-F116 HydrophobicContact CE2-CE2 3.95Å; F60-F116 HydrophobicContact CE2-CG 4.33Å; F60-F116 HydrophobicContact CE2-CZ 4.25Å; F60-F116 HydrophobicContact CZ-CB 4.44Å; F60-F116 AromaticContact CZ-CD1 3.91Å; F60-F116 HydrophobicContact CZ-CD1 3.91Å; F60-F116 AromaticContact CZ-CD2 3.96Å; F60-F116 HydrophobicContact CZ-CD2 3.96Å; F60-F116 HydrophobicContact CZ-CE1 4.09Å; F60-F116 HydrophobicContact CZ-CE2 4.13Å; F60-F116 AromaticContact CZ-CG 3.82Å; F60-F116 HydrophobicContact CZ-CG 3.82Å; F60-F116 HydrophobicContact CZ-CZ 4.18Å; F60-I182 HydrophobicContact CE1-CD1 3.82Å; F60-I182 HydrophobicContact CE1-CG1 4.45Å; F60-I182 HydrophobicContact CZ-CD1 3.69Å; F60-I182 HydrophobicContact CZ-CG1 4.35Å
61	P	95	Very high	88.8	Confident	26 Å²	26	36 Å²	36	17%	0.169	18%	0.176	C	C	.	.			trans	-80.6	143.9	169.3	35.4	-31.9	0	0	0	110.4	I38 D39 F76	I38-P61 WeakPolarHBondContact CA-O 3.4Å; D39-P61 HydrophobicContact CB-CG 4.14Å; D39-P61 PolarHBondContact N-O 3.04Å; D39-P61 WeakPolarHBondContact O-CD 3.24Å; D39-P61 WeakPolarHBondContact O-CG 3.23Å; P61-F76 CarbonylContact C-O 3.5Å; P61-F76 WeakPolarHBondContact CA-O 3.09Å
62	A	94.4	Very high	90	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	138	170.4	0	0	0	0	0	112.6	V37 I38 E75 F76 F116 W119	V37-A62 CarbonylContact O-C 3.58Å; V37-A62 WeakPolarHBondContact O-CA 3.15Å; I38-A62 HydrophobicContact CG1-CB 3.85Å; A62-E75 CarbonylContact O-C 3.59Å; A62-E75 WeakPolarHBondContact O-CA 3.37Å; A62-F76 HydrophobicContact CB-CB 4.22Å; A62-F76 PolarHBondContact N-O 3.48Å; A62-F76 PolarHBondContact O-N 3.15Å; A62-F116 HydrophobicContact CB-CD2 4.46Å; A62-F116 HydrophobicContact CB-CE2 3.68Å; A62-W119 HydrophobicContact CB-CH2 4.34Å; A62-W119 HydrophobicContact CB-CZ3 4.47Å
63	I	95.6	Very high	90.8	Very high	45 Å²	45	34.8 Å²	34.8	23%	0.231	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.3	176.3	-57	-63.1	0	0	0	109.4	C36 V37 I65 E72 E75	C36-I63 CarbonylContact C-O 3.59Å; C36-I63 WeakPolarHBondContact CA-O 3.07Å; V37-I63 PolarHBondContact N-O 3.23Å; V37-I63 PolarHBondContact O-N 3.22Å; I63-I65 HydrophobicContact CG2-CD1 4.46Å; I63-I65 HydrophobicContact CG2-CG1 3.93Å; I63-E72 HydrophobicContact CG2-CB 4.37Å; I63-E72 HydrophobicContact CG2-CG 3.82Å; I63-E75 HydrophobicContact CD1-CB 3.81Å; I63-E75 HydrophobicContact CD1-CG 3.56Å
64	L	94.5	Very high	91.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.2	174.2	-164.8	69.8	0	0	0	110.1	Y34 C36 E72 V73 D74 W119 L120 H123 V131	Y34-L64 HydrophobicContact CD1-CD1 4.41Å; Y34-L64 HydrophobicContact CD1-CD2 4.18Å; Y34-L64 HydrophobicContact CD1-CG 3.96Å; Y34-L64 HydrophobicContact CD2-CD1 4.48Å; Y34-L64 HydrophobicContact CD2-CD2 4.34Å; Y34-L64 HydrophobicContact CE1-CD2 4.41Å; Y34-L64 HydrophobicContact CE2-CD2 4.48Å; Y34-L64 HydrophobicContact CG-CD1 3.95Å; Y34-L64 HydrophobicContact CG-CD2 4.17Å; Y34-L64 HydrophobicContact CG-CG 3.98Å; C36-L64 HydrophobicContact CB-CD1 3.97Å; L64-E72 WeakPolarHBondContact O-CA 3.46Å; L64-V73 HydrophobicContact CB-CB 4.46Å; L64-V73 HydrophobicContact CD2-CB 4.39Å; L64-V73 HydrophobicContact CD2-CG1 4.26Å; L64-V73 HydrophobicContact CG-CB 4.49Å; L64-V73 WeakPolarHBondContact O-CB 3.43Å; L64-V73 PolarHBondContact O-N 3.25Å; L64-D74 PolarHBondContact N-O 2.99Å; L64-W119 HydrophobicContact CB-CH2 3.73Å; L64-W119 HydrophobicContact CB-CZ2 3.89Å; L64-W119 HydrophobicContact CD1-CH2 4.5Å; L64-L120 HydrophobicContact CD1-CD1 3.87Å; L64-H123 HydrophobicContact CD2-CB 3.61Å; L64-H123 VanDerWaalsContact CD2-CG 3.48Å; L64-V131 HydrophobicContact CD1-CG1 4.41Å
65	I	92.7	Very high	92.2	Very high	46 Å²	46	38 Å²	38	24%	0.236	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.6	-177	-56.5	176.3	0	0	0	109.5	Y34 Y35 V37 I63 S67 L71	Y34-I65 CarbonylContact C-O 3.53Å; Y34-I65 WeakPolarHBondContact CA-O 3.38Å; Y35-I65 PolarHBondContact N-O 3.19Å; Y35-I65 PolarHBondContact O-N 3.43Å; V37-I65 HydrophobicContact CG2-CD1 3.74Å; I63-I65 HydrophobicContact CG2-CD1 4.46Å; I63-I65 HydrophobicContact CG2-CG1 3.93Å; I65-S67 PolarHBondContact O-N 3.41Å; I65-L71 CarbonylContact C-O 3.52Å; I65-L71 WeakPolarHBondContact CA-O 3.4Å
66	D	91	Very high	92.8	Very high	32 Å²	32	37.9 Å²	37.9	17%	0.171	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	117	170.7	179.5	-65	0	0	0	109.6	Y34 R68 T69 R70 L71 V73	Y34-D66 HydrophobicContact CD1-CB 4.2Å; Y34-D66 HydrophobicContact CE1-CB 3.98Å; D66-R68 PolarHBondContact O-N 3.48Å; D66-R68 WeakPolarHBondContact OD1-CA 3.34Å; D66-R68 VanDerWaalsContact OD1-CB 3.31Å; D66-R68 WeakPolarHBondContact OD1-CB 3.21Å; D66-R68 PolarHBondContact OD1-N 3.24Å; D66-T69 WeakPolarHBondContact CB-OG1 3.4Å; D66-T69 PolarHBondContact O-N 3.49Å; D66-T69 WeakPolarHBondContact OD1-CG2 3.3Å; D66-T69 PolarHBondContact OD1-N 3.01Å; D66-T69 PolarHBondContact OD1-OG1 3.21Å; D66-R70 VanDerWaalsContact O-CA 3.23Å; D66-R70 WeakPolarHBondContact O-CA 3.35Å; D66-R70 PolarHBondContact O-N 3.26Å; D66-L71 PolarHBondContact N-O 3.43Å; D66-V73 HydrophobicContact CB-CG2 3.51Å
67	S	86.9	Confident	93.2	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.042	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.9	-176.1	60.8	0	0	0	0	114.4	V30 Y32 D33 I65	V30-S67 WeakPolarHBondContact CG1-OG 3.39Å; Y32-S67 WeakPolarHBondContact O-CB 3.47Å; Y32-S67 PolarHBondContact O-OG 3.38Å; D33-S67 VanDerWaalsContact C-OG 3.31Å; D33-S67 VanDerWaalsContact O-CB 3.25Å; D33-S67 WeakPolarHBondContact O-CB 3.3Å; D33-S67 PolarHBondContact O-N 3.34Å; D33-S67 PolarHBondContact O-OG 3.01Å; I65-S67 PolarHBondContact O-N 3.41Å
68	R	85	Confident	93.5	Very high	61 Å²	61	42.1 Å²	42.1	23%	0.23	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-42.8	-175.9	-54	171.6	76.2	161	13.4	110.7	R6 D66	R6-R68 PolarHBondContact O-NH2 3.05Å; D66-R68 PolarHBondContact O-N 3.48Å; D66-R68 WeakPolarHBondContact OD1-CA 3.34Å; D66-R68 VanDerWaalsContact OD1-CB 3.31Å; D66-R68 WeakPolarHBondContact OD1-CB 3.21Å; D66-R68 PolarHBondContact OD1-N 3.24Å
69	T	87.5	Confident	93.7	Very high	27 Å²	27	46 Å²	46	17%	0.166	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-21.3	-178	72.8	0	0	0	0	112.8	L16 D66 L71	L16-T69 HydrophobicContact CD1-CG2 4.04Å; L16-T69 HydrophobicContact CD2-CG2 3.87Å; L16-T69 HydrophobicContact CG-CG2 4.17Å; D66-T69 WeakPolarHBondContact CB-OG1 3.4Å; D66-T69 PolarHBondContact O-N 3.49Å; D66-T69 WeakPolarHBondContact OD1-CG2 3.3Å; D66-T69 PolarHBondContact OD1-N 3.01Å; D66-T69 PolarHBondContact OD1-OG1 3.21Å; T69-L71 PolarHBondContact O-N 3.42Å; T69-L71 WeakPolarHBondContact OG1-CB 3.37Å; T69-L71 WeakPolarHBondContact OG1-CG 3.41Å; T69-L71 PolarHBondContact OG1-N 3.16Å
70	R	87	Confident	93.7	Very high	115 Å²	115	44.4 Å²	44.4	43%	0.434	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	34.7	-169.2	-57.3	179.2	179.4	162	-3.6	112.8	D66 S198	D66-R70 VanDerWaalsContact O-CA 3.23Å; D66-R70 WeakPolarHBondContact O-CA 3.35Å; D66-R70 PolarHBondContact O-N 3.26Å; R70-S198 PolarHBondContact NH2-O 2.76Å
71	L	91.5	Very high	93.8	Very high	54 Å²	54	49.5 Å²	49.5	28%	0.283	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	146.5	177.9	-57.3	171.3	0	0	0	110.3	K21 I65 D66 T69 V73	K21-L71 HydrophobicContact CD-CD1 3.57Å; K21-L71 HydrophobicContact CD-CD2 3.52Å; K21-L71 HydrophobicContact CD-CG 3.89Å; K21-L71 HydrophobicContact CG-CD2 4.35Å; K21-L71 VanDerWaalsContact NZ-CD2 3.31Å; I65-L71 CarbonylContact C-O 3.52Å; I65-L71 WeakPolarHBondContact CA-O 3.4Å; D66-L71 PolarHBondContact N-O 3.43Å; T69-L71 PolarHBondContact O-N 3.42Å; T69-L71 WeakPolarHBondContact OG1-CB 3.37Å; T69-L71 WeakPolarHBondContact OG1-CG 3.41Å; T69-L71 PolarHBondContact OG1-N 3.16Å; L71-V73 PolarHBondContact O-N 3.18Å
72	E	95.4	Very high	93.8	Very high	116 Å²	116	48.5 Å²	48.5	54%	0.542	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	133.4	162.1	-175.5	179.8	146	0	0	110.6	I63 L64	I63-E72 HydrophobicContact CG2-CB 4.37Å; I63-E72 HydrophobicContact CG2-CG 3.82Å; L64-E72 WeakPolarHBondContact O-CA 3.46Å
73	V	94.7	Very high	93.8	Very high	57 Å²	57	52.9 Å²	52.9	35%	0.345	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-41.4	-178.4	175.9	0	0	0	0	109.7	Y34 L64 D66 L71	Y34-V73 HydrophobicContact CD1-CG2 4.1Å; Y34-V73 HydrophobicContact CE1-CB 4.36Å; Y34-V73 HydrophobicContact CE1-CG1 4.19Å; Y34-V73 HydrophobicContact CE1-CG2 3.65Å; L64-V73 HydrophobicContact CB-CB 4.46Å; L64-V73 HydrophobicContact CD2-CB 4.39Å; L64-V73 HydrophobicContact CD2-CG1 4.26Å; L64-V73 HydrophobicContact CG-CB 4.49Å; L64-V73 WeakPolarHBondContact O-CB 3.43Å; L64-V73 PolarHBondContact O-N 3.25Å; D66-V73 HydrophobicContact CB-CG2 3.51Å; L71-V73 PolarHBondContact O-N 3.18Å
74	D	97	Very high	93.5	Very high	41 Å²	41	55.9 Å²	55.9	22%	0.219	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	160.6	-178.7	-151.6	-4.9	0	0	0	109.2	L64 W119 R122 H123	L64-D74 PolarHBondContact N-O 2.99Å; D74-W119 HydrophobicContact CB-CZ2 4.06Å; D74-W119 PolarHBondContact OD2-NE1 3.37Å; D74-R122 IonicContact OD2-CZ 3.95Å; D74-R122 IonicContact OD2-NH1 3.83Å; D74-R122 IonicContact OD2-NH2 3.79Å; D74-R122 PolarHBondContact OD2-NH2 2.94Å; D74-H123 WeakPolarHBondContact CB-NE2 2.88Å; D74-H123 IonicContact OD2-CD2 2.75Å; D74-H123 IonicContact OD2-CE1 3.84Å; D74-H123 PolarHBondContact OD2-CE1 3.48Å; D74-H123 IonicContact OD2-NE2 3.91Å; D74-H123 PolarHBondContact OD2-NE2 3.41Å
75	E	97.6	Very high	93.4	Very high	103 Å²	103	57.8 Å²	57.8	48%	0.481	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.9	177.4	172.5	173.7	-170.4	0	0	108.8	A62 I63 W119	A62-E75 CarbonylContact O-C 3.59Å; A62-E75 WeakPolarHBondContact O-CA 3.37Å; I63-E75 HydrophobicContact CD1-CB 3.81Å; I63-E75 HydrophobicContact CD1-CG 3.56Å; E75-W119 PolarHBondContact O-NE1 3.24Å
76	F	97.5	Very high	93.6	Very high	19 Å²	19	58.7 Å²	58.7	8%	0.083	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137	167.4	177.3	-92	0	0	0	108.1	F60 P61 A62 V112 D115 F116 W119	F60-F76 HydrophobicContact CB-CE1 4.36Å; F60-F76 HydrophobicContact CD1-CE1 4.49Å; F60-F76 HydrophobicContact CD2-CE1 4.41Å; F60-F76 HydrophobicContact CG-CE1 4.15Å; F60-F76 VanDerWaalsContact O-CD1 3.27Å; F60-F76 WeakPolarHBondContact O-CD1 3.34Å; F60-F76 WeakPolarHBondContact O-CE1 3.46Å; P61-F76 CarbonylContact C-O 3.5Å; P61-F76 WeakPolarHBondContact CA-O 3.09Å; A62-F76 HydrophobicContact CB-CB 4.22Å; A62-F76 PolarHBondContact N-O 3.48Å; A62-F76 PolarHBondContact O-N 3.15Å; F76-V112 HydrophobicContact CE1-CG1 4.06Å; F76-V112 HydrophobicContact CZ-CG1 3.92Å; F76-D115 HydrophobicContact CE2-CB 4.1Å; F76-D115 HydrophobicContact CZ-CB 4.39Å; F76-F116 HydrophobicContact CB-CD2 4.4Å; F76-F116 HydrophobicContact CD1-CB 4.47Å; F76-F116 AromaticContact CD1-CD2 3.67Å; F76-F116 HydrophobicContact CD1-CD2 3.67Å; F76-F116 HydrophobicContact CD1-CE2 4.48Å; F76-F116 HydrophobicContact CD2-CD2 4.39Å; F76-F116 HydrophobicContact CE1-CB 3.97Å; F76-F116 AromaticContact CE1-CD2 3.97Å; F76-F116 HydrophobicContact CE1-CD2 3.97Å; F76-F116 HydrophobicContact CE1-CG 4.44Å; F76-F116 HydrophobicContact CE2-CB 4.09Å; F76-F116 AromaticContact CG-CD2 3.9Å; F76-F116 HydrophobicContact CG-CD2 3.9Å; F76-F116 HydrophobicContact CZ-CB 3.75Å; F76-F116 HydrophobicContact CZ-CD2 4.44Å; F76-W119 HydrophobicContact CB-CD2 3.7Å; F76-W119 HydrophobicContact CB-CE3 4Å; F76-W119 HydrophobicContact CB-CG 4.07Å; F76-W119 HydrophobicContact CB-CH2 4.2Å; F76-W119 HydrophobicContact CB-CZ2 3.92Å; F76-W119 HydrophobicContact CB-CZ3 4.24Å; F76-W119 HydrophobicContact CD2-CB 3.9Å; F76-W119 HydrophobicContact CD2-CD2 4.3Å; F76-W119 AromaticContact CD2-CG 3.9Å; F76-W119 HydrophobicContact CD2-CG 3.9Å; F76-W119 HydrophobicContact CE2-CB 4.5Å; F76-W119 HydrophobicContact CG-CD2 4.35Å; F76-W119 HydrophobicContact CG-CG 4.41Å
77	H	98.1	Very high	93.9	Very high	83 Å²	83	67.2 Å²	67.2	38%	0.384	32%	0.315	S	S	.	.			trans	-145.8	132.4	174.5	-175.2	-80	0	0	0	108.8	E59 Y79	E59-H77 IonicContact OE1-CD2 3.56Å; E59-H77 IonicContact OE1-CE1 2.73Å; E59-H77 IonicContact OE1-NE2 3.63Å; E59-H77 PolarHBondContact OE1-NE2 3.43Å; H77-Y79 AromaticContact CE1-CE2 3.71Å; H77-Y79 AromaticContact CE1-CZ 3.73Å
78	S	98	Very high	94.5	Very high	20 Å²	20	67.7 Å²	67.7	14%	0.14	32%	0.317	C	S	.	.			trans	-154.6	144.4	171.4	-168.4	0	0	0	0	110.5	F60 V112	F60-S78 PolarHBondContact N-O 3.39Å; F60-S78 PolarHBondContact O-N 3.13Å; S78-V112 WeakPolarHBondContact OG-CG2 3.36Å
79	Y	98.3	Very high	95	Very high	81 Å²	81	65.4 Å²	65.4	32%	0.318	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-84.4	154.4	163.2	-63.8	-73.7	0	0	0	109.9	I58 E59 H77 I98 T102	I58-Y79 CarbonylContact O-C 3.59Å; I58-Y79 VanDerWaalsContact O-CA 3.31Å; I58-Y79 WeakPolarHBondContact O-CA 3.4Å; I58-Y79 WeakPolarHBondContact O-CD1 3.46Å; E59-Y79 HydrophobicContact CB-CD1 4.21Å; E59-Y79 HydrophobicContact CB-CE1 4.42Å; E59-Y79 HydrophobicContact CG-CD1 3.87Å; E59-Y79 HydrophobicContact CG-CE1 3.8Å; H77-Y79 AromaticContact CE1-CE2 3.71Å; H77-Y79 AromaticContact CE1-CZ 3.73Å; Y79-I98 HydrophobicContact CD1-CD1 4.37Å; Y79-I98 HydrophobicContact CD1-CG2 4.34Å; Y79-I98 HydrophobicContact CE1-CD1 4.16Å; Y79-I98 HydrophobicContact CE1-CG1 4.08Å; Y79-I98 HydrophobicContact CE1-CG2 4.28Å; Y79-T102 HydrophobicContact CD1-CG2 3.69Å; Y79-T102 HydrophobicContact CD2-CG2 3.33Å; Y79-T102 HydrophobicContact CE1-CG2 3.81Å; Y79-T102 HydrophobicContact CE2-CG2 3.46Å; Y79-T102 VanDerWaalsContact CE2-CG2 3.46Å; Y79-T102 HydrophobicContact CG-CG2 3.44Å; Y79-T102 VanDerWaalsContact CG-CG2 3.44Å
80	C	95.6	Very high	95.5	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.337	C	S	.	.			trans	-119.7	137.4	177	-67.5	0	0	0	0	109.6	I57 I58 P82	I57-C80 HydrophobicContact CG2-CB 4.35Å; I57-C80 WeakPolarHBondContact O-CB 3.47Å; I58-C80 PolarHBondContact O-N 3.31Å; C80-P82 WeakPolarHBondContact O-CD 3.49Å
81	R	97	Very high	95.9	Very high	107 Å²	107	69.8 Å²	69.8	40%	0.404	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-86.3	117.9	175.1	-176.6	171.3	66.8	-172.5	-2.9	110.7	V103 A106 P107 L108	R81-V103 VanDerWaalsContact CB-O 3.27Å; R81-V103 WeakPolarHBondContact CB-O 3.14Å; R81-V103 VanDerWaalsContact CG-O 3.24Å; R81-V103 WeakPolarHBondContact CG-O 3.47Å; R81-A106 HydrophobicContact CB-CB 4.15Å; R81-A106 WeakPolarHBondContact CB-O 3.44Å; R81-P107 PolarHBondContact N-O 3.25Å; R81-L108 HydrophobicContact CB-CD2 4.46Å
82	P	94.8	Very high	96.1	Very high	5 Å²	5	67.2 Å²	67.2	3%	0.032	32%	0.319	C	S	.	.			trans	-71.2	148.9	174.8	25.4	-25.9	0	0	0	111.5	T43 E56 I58 C80 L88	T43-P82 HydrophobicContact CG2-CB 3.86Å; T43-P82 HydrophobicContact CG2-CG 4.04Å; E56-P82 HydrophobicContact CB-CB 3.98Å; E56-P82 HydrophobicContact CG-CB 4.47Å; E56-P82 WeakPolarHBondContact OE2-CB 3.31Å; I58-P82 HydrophobicContact CG2-CB 4.34Å; I58-P82 HydrophobicContact CG2-CG 3.93Å; C80-P82 WeakPolarHBondContact O-CD 3.49Å; P82-L88 HydrophobicContact CG-CD2 4.47Å
83	V	94	Very high	96.2	Very high	92 Å²	92	63 Å²	63	56%	0.558	30%	0.301	S	S	*	.	S	Bend	trans	-114.6	-42.4	-176.3	178	0	0	0	0	111.6	E56 L108	E56-V83 PolarHBondContact OE1-N 2.7Å; E56-V83 PolarHBondContact OE2-N 3.21Å; V83-L108 HydrophobicContact CG2-CD2 3.8Å
84	E	90	Very high	96.3	Very high	108 Å²	108	65.2 Å²	65.2	51%	0.505	32%	0.319	S	S	.	.	S	Bend	trans	-76.6	-44.5	180	-62.6	-65.6	159.4	0	0	111	E56 P86 F174	E56-E84 VanDerWaalsContact CD-N 3.33Å; E56-E84 PolarHBondContact OE1-N 2.93Å; E56-E84 PolarHBondContact OE2-N 3.07Å; E84-P86 VanDerWaalsContact O-CD 3.25Å; E84-P86 WeakPolarHBondContact O-CD 3.43Å; E84-F174 HydrophobicContact CG-CD1 4.45Å; E84-F174 HydrophobicContact CG-CE1 3.89Å; E84-F174 HydrophobicContact CG-CE2 4.21Å; E84-F174 HydrophobicContact CG-CZ 3.75Å
85	N	92.2	Very high	96.2	Very high	40 Å²	40	68.7 Å²	68.7	21%	0.214	34%	0.337	C	S	.	.	S	Bend	trans	-118.1	68.6	176	-62.9	-63	0	0	0	110.7	P54 E56 R87	P54-N85 PolarHBondContact O-ND2 3.3Å; E56-N85 PolarHBondContact OE2-N 3.27Å; N85-R87 PolarHBondContact O-N 3.44Å; N85-R87 VanDerWaalsContact O-N 3.09Å
86	P	96.6	Very high	96	Very high	66 Å²	66	65.1 Å²	65.1	43%	0.429	32%	0.322	S	S	.	.			trans	-66.8	-16.4	-173	27.5	-35.7	0	0	0	113.4	E84 Q100	E84-P86 VanDerWaalsContact O-CD 3.25Å; E84-P86 WeakPolarHBondContact O-CD 3.43Å; P86-Q100 PolarHBondContact O-NE2 3Å
87	R	98.1	Very high	96	Very high	211 Å²	211	66.5 Å²	66.5	80%	0.796	34%	0.342	S	S	*	.	S	Bend	trans	-102.6	117.3	177.8	-74.5	-176	152.8	-134.9	-7.3	110	N85	N85-R87 PolarHBondContact O-N 3.44Å; N85-R87 VanDerWaalsContact O-N 3.09Å
88	L	97.7	Very high	96	Very high	16 Å²	16	62.8 Å²	62.8	8%	0.084	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-69.1	135.1	175.5	-55.5	-177.1	0	0	0	110.2	T43 I58 P82 V93 I98 V103	T43-L88 HydrophobicContact CG2-CD2 3.98Å; I58-L88 HydrophobicContact CD1-CD2 4.08Å; I58-L88 HydrophobicContact CG2-CD2 4.25Å; P82-L88 HydrophobicContact CG-CD2 4.47Å; L88-V93 HydrophobicContact CB-CG2 3.76Å; L88-V93 HydrophobicContact CD1-CG2 4.28Å; L88-I98 HydrophobicContact CD1-CG2 4.24Å; L88-I98 WeakPolarHBondContact CD1-O 3.31Å; L88-V103 HydrophobicContact CD1-CG1 4.03Å; L88-V103 HydrophobicContact CD1-CG2 3.83Å; L88-V103 HydrophobicContact CD2-CG2 4.3Å; L88-V103 HydrophobicContact CG-CG2 3.92Å
89	S	96.9	Very high	96	Very high	12 Å²	12	67.6 Å²	67.6	8%	0.084	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-69.1	158	172.3	76.5	0	0	0	0	111.2	C44 E45 F91 C92 V93	C44-S89 WeakPolarHBondContact O-CB 3.27Å; C44-S89 PolarHBondContact O-OG 2.84Å; E45-S89 VanDerWaalsContact OE1-CB 3.27Å; E45-S89 WeakPolarHBondContact OE1-CB 3.41Å; E45-S89 WeakPolarHBondContact OE2-CB 3.5Å; S89-F91 PolarHBondContact O-N 2.74Å; S89-F91 PolarHBondContact OG-N 2.82Å; S89-C92 PolarHBondContact O-N 3Å; S89-C92 VanDerWaalsContact OG-CB 3.25Å; S89-C92 WeakPolarHBondContact OG-CB 3.46Å; S89-C92 PolarHBondContact OG-N 2.93Å; S89-V93 VanDerWaalsContact O-CG2 3.3Å; S89-V93 WeakPolarHBondContact O-CG2 3.14Å; S89-V93 PolarHBondContact O-N 2.74Å
90	Q	97.2	Very high	96	Very high	161 Å²	161	66.2 Å²	66.2	75%	0.752	34%	0.341	S	S	*	.	H	α-helix	trans	-61.5	-34.6	174.2	-68.9	-59.3	-51.8	0	0	111.8	S94	Q90-S94 WeakPolarHBondContact O-CB 3.21Å; Q90-S94 PolarHBondContact O-N 2.92Å
91	F	96.3	Very high	96.2	Very high	73 Å²	73	72.5 Å²	72.5	32%	0.32	37%	0.371	S	S	.	.	H	α-helix	trans	-62.1	-50.6	175	175.7	-100	0	0	0	111.5	C44 E46 S89 V93 S94 L95	C44-F91 HydrophobicContact CB-CD1 4.44Å; C44-F91 HydrophobicContact CB-CE1 4.34Å; E46-F91 HydrophobicContact CB-CB 3.82Å; E46-F91 HydrophobicContact CB-CD1 4.27Å; E46-F91 HydrophobicContact CB-CD2 3.65Å; E46-F91 HydrophobicContact CB-CE2 4.28Å; E46-F91 HydrophobicContact CB-CG 3.64Å; E46-F91 HydrophobicContact CG-CD2 3.62Å; E46-F91 HydrophobicContact CG-CE2 3.99Å; E46-F91 HydrophobicContact CG-CG 4.17Å; S89-F91 PolarHBondContact O-N 2.74Å; S89-F91 PolarHBondContact OG-N 2.82Å; F91-V93 PolarHBondContact O-N 2.79Å; F91-S94 PolarHBondContact O-N 2.77Å; F91-S94 VanDerWaalsContact O-N 3.14Å; F91-L95 HydrophobicContact CE1-CD2 4.03Å; F91-L95 HydrophobicContact CZ-CD2 4.2Å; F91-L95 WeakPolarHBondContact O-CB 3.4Å; F91-L95 PolarHBondContact O-N 2.87Å
92	C	94.9	Very high	96.2	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-58.4	-46.9	177.6	-175.8	0	0	0	0	111.7	C44 S89 S94 L95 T96	C44-C92 WeakPolarHBondContact O-CB 3.36Å; C44-C92 VanDerWaalsContact SG-CA 3.54Å; C44-C92 VanDerWaalsContact SG-CB 3.58Å; S89-C92 PolarHBondContact O-N 3Å; S89-C92 VanDerWaalsContact OG-CB 3.25Å; S89-C92 WeakPolarHBondContact OG-CB 3.46Å; S89-C92 PolarHBondContact OG-N 2.93Å; C92-S94 VanDerWaalsContact C-N 3.3Å; C92-S94 PolarHBondContact O-N 3.49Å; C92-L95 PolarHBondContact O-N 3.23Å; C92-T96 PolarHBondContact O-N 3.35Å; C92-T96 PolarHBondContact O-OG1 3Å; C92-T96 VanDerWaalsContact O-OG1 3.05Å
93	V	97.5	Very high	96.4	Very high	27 Å²	27	69.3 Å²	69.3	16%	0.164	36%	0.363	C	S	.	.	H	α-helix	trans	-61.2	-40.5	177.4	175.7	0	0	0	0	111.1	L88 S89 F91 G97 I98	L88-V93 HydrophobicContact CB-CG2 3.76Å; L88-V93 HydrophobicContact CD1-CG2 4.28Å; S89-V93 VanDerWaalsContact O-CG2 3.3Å; S89-V93 WeakPolarHBondContact O-CG2 3.14Å; S89-V93 PolarHBondContact O-N 2.74Å; F91-V93 PolarHBondContact O-N 2.79Å; V93-G97 VanDerWaalsContact O-CA 3.23Å; V93-G97 WeakPolarHBondContact O-CA 3.47Å; V93-G97 PolarHBondContact O-N 3.23Å; V93-I98 WeakPolarHBondContact CG2-O 2.99Å
94	S	97	Very high	96.6	Very high	105 Å²	105	68.9 Å²	68.9	73%	0.734	36%	0.358	S	S	*	.	H	α-helix	trans	-69.4	-32.9	178	-173.3	0	0	0	0	112.9	Q90 F91 C92	Q90-S94 WeakPolarHBondContact O-CB 3.21Å; Q90-S94 PolarHBondContact O-N 2.92Å; F91-S94 PolarHBondContact O-N 2.77Å; F91-S94 VanDerWaalsContact O-N 3.14Å; C92-S94 VanDerWaalsContact C-N 3.3Å; C92-S94 PolarHBondContact O-N 3.49Å
95	L	94.4	Very high	97	Very high	114 Å²	114	71.5 Å²	71.5	60%	0.597	37%	0.368	S	S	*	.	H	α-helix	trans	-78.4	-48.6	-177.2	-176.1	64.2	0	0	0	111.5	F91 C92	F91-L95 HydrophobicContact CE1-CD2 4.03Å; F91-L95 HydrophobicContact CZ-CD2 4.2Å; F91-L95 WeakPolarHBondContact O-CB 3.4Å; F91-L95 PolarHBondContact O-N 2.87Å; C92-L95 PolarHBondContact O-N 3.23Å
96	T	94.1	Very high	97.3	Very high	27 Å²	27	70 Å²	70	17%	0.166	36%	0.361	C	S	.	.	H	α-helix	trans	-93.5	-20	-173.4	71	0	0	0	0	113	E41 C92 I98	E41-T96 HydrophobicContact CB-CG2 4.25Å; E41-T96 HydrophobicContact CG-CG2 4.43Å; E41-T96 VanDerWaalsContact OE2-CG2 3.31Å; E41-T96 WeakPolarHBondContact OE2-CG2 3.33Å; C92-T96 PolarHBondContact O-N 3.35Å; C92-T96 PolarHBondContact O-OG1 3Å; C92-T96 VanDerWaalsContact O-OG1 3.05Å; T96-I98 PolarHBondContact O-N 3.26Å; T96-I98 WeakPolarHBondContact OG1-CB 3.16Å; T96-I98 WeakPolarHBondContact OG1-CG1 3.45Å; T96-I98 PolarHBondContact OG1-N 3.07Å
97	G	97.4	Very high	97.4	Very high	49 Å²	49	69.3 Å²	69.3	51%	0.505	36%	0.356	S	S	.	.			trans	74.3	2.5	-171.8	0	0	0	0	0	114.3	V93	V93-G97 VanDerWaalsContact O-CA 3.23Å; V93-G97 WeakPolarHBondContact O-CA 3.47Å; V93-G97 PolarHBondContact O-N 3.23Å
98	I	97.9	Very high	97.2	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.026	33%	0.333	C	S	.	.			trans	-83	122.7	-178.8	-56	169.7	0	0	0	109.6	E41 I58 E59 Y79 L88 V93 T96 T102 V103	E41-I98 HydrophobicContact CB-CD1 3.97Å; E41-I98 HydrophobicContact CG-CD1 4.32Å; I58-I98 HydrophobicContact CD1-CD1 3.86Å; I58-I98 HydrophobicContact CG1-CD1 3.89Å; E59-I98 HydrophobicContact CB-CD1 3.87Å; E59-I98 WeakPolarHBondContact OE2-CD1 3.26Å; Y79-I98 HydrophobicContact CD1-CD1 4.37Å; Y79-I98 HydrophobicContact CD1-CG2 4.34Å; Y79-I98 HydrophobicContact CE1-CD1 4.16Å; Y79-I98 HydrophobicContact CE1-CG1 4.08Å; Y79-I98 HydrophobicContact CE1-CG2 4.28Å; L88-I98 HydrophobicContact CD1-CG2 4.24Å; L88-I98 WeakPolarHBondContact CD1-O 3.31Å; V93-I98 WeakPolarHBondContact CG2-O 2.99Å; T96-I98 PolarHBondContact O-N 3.26Å; T96-I98 WeakPolarHBondContact OG1-CB 3.16Å; T96-I98 WeakPolarHBondContact OG1-CG1 3.45Å; T96-I98 PolarHBondContact OG1-N 3.07Å; I98-T102 HydrophobicContact CG2-CG2 4.22Å; I98-V103 HydrophobicContact CG2-CG1 3.83Å
99	H	98	Very high	96.8	Very high	121 Å²	121	62.1 Å²	62.1	56%	0.56	33%	0.333	S	S	*	.			trans	-87.7	153.1	178	-63.8	-62.6	0	0	0	112.6	E101 T102	H99-E101 VanDerWaalsContact C-N 3.25Å; H99-E101 PolarHBondContact O-N 3.12Å; H99-T102 VanDerWaalsContact O-CB 3.24Å; H99-T102 WeakPolarHBondContact O-CB 3.49Å; H99-T102 PolarHBondContact O-N 3.18Å
100	Q	98.6	Very high	96.3	Very high	51 Å²	51	68.8 Å²	68.8	24%	0.238	36%	0.362	C	S	.	.	H	α-helix	trans	-51	-42.6	179.8	-174.5	63.8	56.6	0	0	113.2	P86 T102 V103 D104	P86-Q100 PolarHBondContact O-NE2 3Å; Q100-T102 PolarHBondContact O-N 3.16Å; Q100-T102 VanDerWaalsContact O-N 3.17Å; Q100-V103 VanDerWaalsContact O-CG2 3.23Å; Q100-V103 WeakPolarHBondContact O-CG2 3.48Å; Q100-V103 PolarHBondContact O-N 2.96Å; Q100-D104 PolarHBondContact NE2-OD1 2.93Å; Q100-D104 WeakPolarHBondContact O-CB 3.07Å; Q100-D104 PolarHBondContact O-N 3.36Å
101	E	98.4	Very high	96.1	Very high	132 Å²	132	64.9 Å²	64.9	62%	0.617	35%	0.346	S	S	*	.	H	α-helix	trans	-62.8	-24.4	-179	-61.2	-176.9	-166	0	0	113.7	H99 K105	H99-E101 VanDerWaalsContact C-N 3.25Å; H99-E101 PolarHBondContact O-N 3.12Å; E101-K105 WeakPolarHBondContact O-CD 3.2Å; E101-K105 WeakPolarHBondContact O-CG 3.37Å; E101-K105 IonicContact OE2-NZ 2.72Å
102	T	98.6	Very high	95.9	Very high	45 Å²	45	61.4 Å²	61.4	28%	0.276	33%	0.331	S	S	.	.	H	α-helix	trans	-71.7	-52.2	177.2	-58.5	0	0	0	0	109.9	Y79 I98 H99 Q100 D104 K105 A106	Y79-T102 HydrophobicContact CD1-CG2 3.69Å; Y79-T102 HydrophobicContact CD2-CG2 3.33Å; Y79-T102 HydrophobicContact CE1-CG2 3.81Å; Y79-T102 HydrophobicContact CE2-CG2 3.46Å; Y79-T102 VanDerWaalsContact CE2-CG2 3.46Å; Y79-T102 HydrophobicContact CG-CG2 3.44Å; Y79-T102 VanDerWaalsContact CG-CG2 3.44Å; I98-T102 HydrophobicContact CG2-CG2 4.22Å; H99-T102 VanDerWaalsContact O-CB 3.24Å; H99-T102 WeakPolarHBondContact O-CB 3.49Å; H99-T102 PolarHBondContact O-N 3.18Å; Q100-T102 PolarHBondContact O-N 3.16Å; Q100-T102 VanDerWaalsContact O-N 3.17Å; T102-D104 VanDerWaalsContact C-N 3.34Å; T102-D104 PolarHBondContact O-N 3.16Å; T102-K105 PolarHBondContact O-N 2.83Å; T102-A106 PolarHBondContact O-N 3.21Å
103	V	98.3	Very high	95.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-70.3	-30.3	179.6	-61.8	0	0	0	0	112.4	I58 R81 L88 I98 Q100 K105 A106	I58-V103 HydrophobicContact CB-CG1 3.99Å; I58-V103 HydrophobicContact CG2-CG1 4.16Å; R81-V103 VanDerWaalsContact CB-O 3.27Å; R81-V103 WeakPolarHBondContact CB-O 3.14Å; R81-V103 VanDerWaalsContact CG-O 3.24Å; R81-V103 WeakPolarHBondContact CG-O 3.47Å; L88-V103 HydrophobicContact CD1-CG1 4.03Å; L88-V103 HydrophobicContact CD1-CG2 3.83Å; L88-V103 HydrophobicContact CD2-CG2 4.3Å; L88-V103 HydrophobicContact CG-CG2 3.92Å; I98-V103 HydrophobicContact CG2-CG1 3.83Å; Q100-V103 VanDerWaalsContact O-CG2 3.23Å; Q100-V103 WeakPolarHBondContact O-CG2 3.48Å; Q100-V103 PolarHBondContact O-N 2.96Å; V103-K105 VanDerWaalsContact C-N 3.25Å; V103-K105 PolarHBondContact O-N 3.1Å; V103-A106 WeakPolarHBondContact O-CB 3.34Å; V103-A106 PolarHBondContact O-N 3.25Å
104	D	98.5	Very high	95.1	Very high	84 Å²	84	64.2 Å²	64.2	45%	0.449	35%	0.345	S	S	.	.	H	α-helix	trans	-60.9	-35.6	175.9	-75.1	-12.5	0	0	0	112.5	Q100 T102	Q100-D104 PolarHBondContact NE2-OD1 2.93Å; Q100-D104 WeakPolarHBondContact O-CB 3.07Å; Q100-D104 PolarHBondContact O-N 3.36Å; T102-D104 VanDerWaalsContact C-N 3.34Å; T102-D104 PolarHBondContact O-N 3.16Å
105	K	98.4	Very high	95	Very high	163 Å²	163	63.7 Å²	63.7	71%	0.709	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-7	-178.8	-65.8	169.5	-168.8	152.7	0	113	E101 T102 V103	E101-K105 WeakPolarHBondContact O-CD 3.2Å; E101-K105 WeakPolarHBondContact O-CG 3.37Å; E101-K105 IonicContact OE2-NZ 2.72Å; T102-K105 PolarHBondContact O-N 2.83Å; V103-K105 VanDerWaalsContact C-N 3.25Å; V103-K105 PolarHBondContact O-N 3.1Å
106	A	98.4	Very high	94.9	Very high	9 Å²	9	58.2 Å²	58.2	7%	0.074	31%	0.306	C	S	.	.	S	Bend	trans	-73	152.4	-176.6	0	0	0	0	0	112.1	R81 T102 V103	R81-A106 HydrophobicContact CB-CB 4.15Å; R81-A106 WeakPolarHBondContact CB-O 3.44Å; T102-A106 PolarHBondContact O-N 3.21Å; V103-A106 WeakPolarHBondContact O-CB 3.34Å; V103-A106 PolarHBondContact O-N 3.25Å
107	P	97.8	Very high	94.6	Very high	50 Å²	50	58.9 Å²	58.9	33%	0.325	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-61.4	161.2	166.6	26.8	-35.5	0	0	0	112	R81 D111 V112	R81-P107 PolarHBondContact N-O 3.25Å; P107-D111 HydrophobicContact CB-CB 4.08Å; P107-V112 HydrophobicContact CB-CG2 4.03Å; P107-V112 HydrophobicContact CG-CG2 3.42Å; P107-V112 VanDerWaalsContact CG-CG2 3.42Å
108	L	94.7	Very high	94.3	Very high	60 Å²	60	59.3 Å²	59.3	31%	0.314	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-70.5	154	170.8	-67.7	174.1	0	0	0	109.7	R81 V83 E110 D111 V112	R81-L108 HydrophobicContact CB-CD2 4.46Å; V83-L108 HydrophobicContact CG2-CD2 3.8Å; L108-E110 PolarHBondContact O-N 3.4Å; L108-D111 WeakPolarHBondContact O-CB 3.29Å; L108-D111 PolarHBondContact O-N 3.26Å; L108-V112 PolarHBondContact O-N 3.19Å; L108-V112 VanDerWaalsContact O-N 3.12Å
109	F	89.4	Confident	94.2	Very high	17 Å²	17	60 Å²	60	8%	0.075	31%	0.308	C	S	.	.	H	α-helix	trans	-53.9	-39.3	-179.1	175.4	-95.2	0	0	0	113.4	I57 D111 V112 V113 Q178	I57-F109 HydrophobicContact CB-CD2 4.19Å; I57-F109 HydrophobicContact CB-CE2 4.28Å; I57-F109 HydrophobicContact CD1-CD2 4.26Å; I57-F109 HydrophobicContact CD1-CE2 3.51Å; I57-F109 HydrophobicContact CD1-CZ 4.19Å; I57-F109 HydrophobicContact CG1-CE2 4.45Å; I57-F109 HydrophobicContact CG2-CD2 4.49Å; F109-D111 VanDerWaalsContact C-N 3.29Å; F109-D111 PolarHBondContact O-N 2.95Å; F109-V112 PolarHBondContact O-N 3.47Å; F109-V112 VanDerWaalsContact O-N 3.14Å; F109-V113 HydrophobicContact CD1-CG2 3.89Å; F109-V113 HydrophobicContact CD2-CG2 4.22Å; F109-V113 HydrophobicContact CE1-CG2 3.25Å; F109-V113 HydrophobicContact CE2-CG2 3.66Å; F109-V113 HydrophobicContact CG-CG2 4.32Å; F109-V113 HydrophobicContact CZ-CG2 3.14Å; F109-V113 WeakPolarHBondContact O-CG2 3.49Å; F109-V113 PolarHBondContact O-N 3.44Å; F109-Q178 HydrophobicContact CD1-CB 3.68Å; F109-Q178 HydrophobicContact CD1-CG 3.51Å; F109-Q178 VanDerWaalsContact CE1-C 3.5Å; F109-Q178 HydrophobicContact CE1-CB 3.21Å; F109-Q178 HydrophobicContact CE1-CG 3.64Å; F109-Q178 WeakPolarHBondContact CE1-O 3.42Å; F109-Q178 HydrophobicContact CE2-CB 4.28Å; F109-Q178 HydrophobicContact CG-CB 4.38Å; F109-Q178 HydrophobicContact CG-CG 4.09Å; F109-Q178 HydrophobicContact CZ-CB 3.54Å; F109-Q178 HydrophobicContact CZ-CG 4.29Å; F109-Q178 WeakPolarHBondContact CZ-O 3.32Å
110	E	87.2	Confident	93.8	Very high	151 Å²	151	54.2 Å²	54.2	71%	0.706	28%	0.281	S	S	*	.	H	α-helix	trans	-58.5	-41.1	178.1	-64.5	-174.3	175	0	0	112.4	L108 N114	L108-E110 PolarHBondContact O-N 3.4Å; E110-N114 VanDerWaalsContact O-CG 3.24Å; E110-N114 PolarHBondContact O-N 3.45Å; E110-N114 VanDerWaalsContact O-N 3.14Å; E110-N114 PolarHBondContact O-ND2 3.4Å; E110-N114 VanDerWaalsContact O-ND2 3.09Å
111	D	91.7	Very high	93.3	Very high	79 Å²	79	52.8 Å²	52.8	42%	0.422	28%	0.279	S	S	.	.	H	α-helix	trans	-66.9	-43.4	176.4	-60.4	-46	0	0	0	110.5	P107 L108 F109 V113 N114 D115	P107-D111 HydrophobicContact CB-CB 4.08Å; L108-D111 WeakPolarHBondContact O-CB 3.29Å; L108-D111 PolarHBondContact O-N 3.26Å; F109-D111 VanDerWaalsContact C-N 3.29Å; F109-D111 PolarHBondContact O-N 2.95Å; D111-V113 VanDerWaalsContact C-N 3.34Å; D111-V113 PolarHBondContact O-N 3.4Å; D111-N114 WeakPolarHBondContact O-CB 3.4Å; D111-N114 PolarHBondContact O-N 3.06Å; D111-N114 VanDerWaalsContact O-N 3.16Å; D111-D115 PolarHBondContact O-N 3.11Å
112	V	92.8	Very high	93	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-41.8	177.8	179.8	0	0	0	0	111.8	F60 F76 S78 P107 L108 F109 N114 D115 F116	F60-V112 HydrophobicContact CB-CG1 4.09Å; F60-V112 HydrophobicContact CD1-CG1 3.74Å; F60-V112 HydrophobicContact CG-CG1 4.28Å; F76-V112 HydrophobicContact CE1-CG1 4.06Å; F76-V112 HydrophobicContact CZ-CG1 3.92Å; S78-V112 WeakPolarHBondContact OG-CG2 3.36Å; P107-V112 HydrophobicContact CB-CG2 4.03Å; P107-V112 HydrophobicContact CG-CG2 3.42Å; P107-V112 VanDerWaalsContact CG-CG2 3.42Å; L108-V112 PolarHBondContact O-N 3.19Å; L108-V112 VanDerWaalsContact O-N 3.12Å; F109-V112 PolarHBondContact O-N 3.47Å; F109-V112 VanDerWaalsContact O-N 3.14Å; V112-N114 VanDerWaalsContact C-N 3.35Å; V112-D115 PolarHBondContact O-N 3.32Å; V112-F116 WeakPolarHBondContact O-CB 3.27Å; V112-F116 PolarHBondContact O-N 2.82Å
113	V	88.7	Confident	92.5	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-68.3	-36.8	177.5	-174	0	0	0	0	111.5	F60 F109 D111 D115 F116 Q117 S181 I182	F60-V113 HydrophobicContact CE1-CG2 4.3Å; F109-V113 HydrophobicContact CD1-CG2 3.89Å; F109-V113 HydrophobicContact CD2-CG2 4.22Å; F109-V113 HydrophobicContact CE1-CG2 3.25Å; F109-V113 HydrophobicContact CE2-CG2 3.66Å; F109-V113 HydrophobicContact CG-CG2 4.32Å; F109-V113 HydrophobicContact CZ-CG2 3.14Å; F109-V113 WeakPolarHBondContact O-CG2 3.49Å; F109-V113 PolarHBondContact O-N 3.44Å; D111-V113 VanDerWaalsContact C-N 3.34Å; D111-V113 PolarHBondContact O-N 3.4Å; V113-D115 VanDerWaalsContact C-N 3.31Å; V113-D115 PolarHBondContact O-N 2.83Å; V113-F116 PolarHBondContact O-N 3.46Å; V113-Q117 HydrophobicContact CG1-CG 4.13Å; V113-Q117 WeakPolarHBondContact O-CB 3.09Å; V113-Q117 VanDerWaalsContact O-CG 3.26Å; V113-Q117 WeakPolarHBondContact O-CG 3.27Å; V113-Q117 PolarHBondContact O-N 2.86Å; V113-S181 WeakPolarHBondContact CG1-OG 3.25Å; V113-I182 HydrophobicContact CG1-CG1 3.76Å; V113-I182 HydrophobicContact CG2-CG1 4.29Å
114	N	87.6	Confident	91.8	Very high	85 Å²	85	52.8 Å²	52.8	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-44.1	174.5	-69.5	-33.5	0	0	0	110.9	E110 D111 V112 Q117 A118	E110-N114 VanDerWaalsContact O-CG 3.24Å; E110-N114 PolarHBondContact O-N 3.45Å; E110-N114 VanDerWaalsContact O-N 3.14Å; E110-N114 PolarHBondContact O-ND2 3.4Å; E110-N114 VanDerWaalsContact O-ND2 3.09Å; D111-N114 WeakPolarHBondContact O-CB 3.4Å; D111-N114 PolarHBondContact O-N 3.06Å; D111-N114 VanDerWaalsContact O-N 3.16Å; V112-N114 VanDerWaalsContact C-N 3.35Å; N114-Q117 PolarHBondContact O-N 2.89Å; N114-A118 WeakPolarHBondContact O-CB 3.36Å; N114-A118 PolarHBondContact O-N 2.68Å
115	D	93.8	Very high	90.8	Very high	94 Å²	94	52.6 Å²	52.6	50%	0.503	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-42.6	176.3	-71.8	-19.8	0	0	0	111.6	F76 D111 V112 V113 A118 W119	F76-D115 HydrophobicContact CE2-CB 4.1Å; F76-D115 HydrophobicContact CZ-CB 4.39Å; D111-D115 PolarHBondContact O-N 3.11Å; V112-D115 PolarHBondContact O-N 3.32Å; V113-D115 VanDerWaalsContact C-N 3.31Å; V113-D115 PolarHBondContact O-N 2.83Å; D115-A118 PolarHBondContact O-N 3.43Å; D115-W119 VanDerWaalsContact O-CB 3.29Å; D115-W119 WeakPolarHBondContact O-CB 3.26Å; D115-W119 PolarHBondContact O-N 3.1Å
116	F	92.8	Very high	89.5	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-46.2	175.1	176.3	-102.5	0	0	0	112.3	I38 F60 A62 F76 V112 V113 A118 W119 L120 F133 I182	I38-F116 HydrophobicContact CD1-CZ 3.97Å; F60-F116 HydrophobicContact CE1-CB 4.35Å; F60-F116 HydrophobicContact CE1-CD1 4.45Å; F60-F116 HydrophobicContact CE1-CG 4.22Å; F60-F116 AromaticContact CE2-CD2 3.99Å; F60-F116 HydrophobicContact CE2-CD2 3.99Å; F60-F116 AromaticContact CE2-CE2 3.95Å; F60-F116 HydrophobicContact CE2-CE2 3.95Å; F60-F116 HydrophobicContact CE2-CG 4.33Å; F60-F116 HydrophobicContact CE2-CZ 4.25Å; F60-F116 HydrophobicContact CZ-CB 4.44Å; F60-F116 AromaticContact CZ-CD1 3.91Å; F60-F116 HydrophobicContact CZ-CD1 3.91Å; F60-F116 AromaticContact CZ-CD2 3.96Å; F60-F116 HydrophobicContact CZ-CD2 3.96Å; F60-F116 HydrophobicContact CZ-CE1 4.09Å; F60-F116 HydrophobicContact CZ-CE2 4.13Å; F60-F116 AromaticContact CZ-CG 3.82Å; F60-F116 HydrophobicContact CZ-CG 3.82Å; F60-F116 HydrophobicContact CZ-CZ 4.18Å; A62-F116 HydrophobicContact CB-CD2 4.46Å; A62-F116 HydrophobicContact CB-CE2 3.68Å; F76-F116 HydrophobicContact CB-CD2 4.4Å; F76-F116 HydrophobicContact CD1-CB 4.47Å; F76-F116 AromaticContact CD1-CD2 3.67Å; F76-F116 HydrophobicContact CD1-CD2 3.67Å; F76-F116 HydrophobicContact CD1-CE2 4.48Å; F76-F116 HydrophobicContact CD2-CD2 4.39Å; F76-F116 HydrophobicContact CE1-CB 3.97Å; F76-F116 AromaticContact CE1-CD2 3.97Å; F76-F116 HydrophobicContact CE1-CD2 3.97Å; F76-F116 HydrophobicContact CE1-CG 4.44Å; F76-F116 HydrophobicContact CE2-CB 4.09Å; F76-F116 AromaticContact CG-CD2 3.9Å; F76-F116 HydrophobicContact CG-CD2 3.9Å; F76-F116 HydrophobicContact CZ-CB 3.75Å; F76-F116 HydrophobicContact CZ-CD2 4.44Å; V112-F116 WeakPolarHBondContact O-CB 3.27Å; V112-F116 PolarHBondContact O-N 2.82Å; V113-F116 PolarHBondContact O-N 3.46Å; F116-A118 VanDerWaalsContact C-N 3.34Å; F116-A118 PolarHBondContact O-N 3.33Å; F116-W119 AromaticContact CD2-CE3 3.94Å; F116-W119 HydrophobicContact CD2-CE3 3.94Å; F116-W119 HydrophobicContact CD2-CZ3 4.14Å; F116-W119 AromaticContact CE2-CE3 3.86Å; F116-W119 HydrophobicContact CE2-CE3 3.86Å; F116-W119 AromaticContact CE2-CZ3 3.59Å; F116-W119 HydrophobicContact CE2-CZ3 3.59Å; F116-W119 HydrophobicContact CZ-CZ3 4.24Å; F116-W119 WeakPolarHBondContact O-CB 3.45Å; F116-W119 PolarHBondContact O-N 3.18Å; F116-L120 HydrophobicContact CE1-CD2 4.39Å; F116-L120 HydrophobicContact CZ-CD2 4.49Å; F116-L120 WeakPolarHBondContact O-CB 3.41Å; F116-L120 PolarHBondContact O-N 3.08Å; F116-F133 HydrophobicContact CE1-CE1 4.13Å; F116-F133 HydrophobicContact CE1-CZ 4.35Å; F116-F133 AromaticContact CZ-CE1 3.78Å; F116-F133 HydrophobicContact CZ-CE1 3.78Å; F116-F133 HydrophobicContact CZ-CZ 4.43Å; F116-I182 HydrophobicContact CE1-CG2 4.19Å
117	Q	88.4	Confident	88.1	Confident	41 Å²	41	54.1 Å²	54.1	19%	0.192	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-41.8	177.3	-76.5	177.9	-14.9	0	0	111.8	V113 N114 L120 A121 S181	V113-Q117 HydrophobicContact CG1-CG 4.13Å; V113-Q117 WeakPolarHBondContact O-CB 3.09Å; V113-Q117 VanDerWaalsContact O-CG 3.26Å; V113-Q117 WeakPolarHBondContact O-CG 3.27Å; V113-Q117 PolarHBondContact O-N 2.86Å; N114-Q117 PolarHBondContact O-N 2.89Å; Q117-L120 PolarHBondContact O-N 2.77Å; Q117-A121 WeakPolarHBondContact O-CB 3.47Å; Q117-A121 PolarHBondContact O-N 2.66Å; Q117-S181 PolarHBondContact NE2-O 2.64Å; Q117-S181 PolarHBondContact NE2-OG 3.49Å
118	A	91	Very high	87	Confident	58 Å²	58	58.8 Å²	58.8	48%	0.479	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-42	175.8	0	0	0	0	0	111	N114 D115 F116 A121 R122	N114-A118 WeakPolarHBondContact O-CB 3.36Å; N114-A118 PolarHBondContact O-N 2.68Å; D115-A118 PolarHBondContact O-N 3.43Å; F116-A118 VanDerWaalsContact C-N 3.34Å; F116-A118 PolarHBondContact O-N 3.33Å; A118-A121 PolarHBondContact O-N 2.83Å; A118-R122 WeakPolarHBondContact O-CG 2.95Å; A118-R122 PolarHBondContact O-N 3.41Å
119	W	94.5	Very high	86.5	Confident	18 Å²	18	59.4 Å²	59.4	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-57.2	-50.8	173.8	168.1	96.9	0	0	0	111.3	A62 L64 D74 E75 F76 D115 F116 R122 H123	A62-W119 HydrophobicContact CB-CH2 4.34Å; A62-W119 HydrophobicContact CB-CZ3 4.47Å; L64-W119 HydrophobicContact CB-CH2 3.73Å; L64-W119 HydrophobicContact CB-CZ2 3.89Å; L64-W119 HydrophobicContact CD1-CH2 4.5Å; D74-W119 HydrophobicContact CB-CZ2 4.06Å; D74-W119 PolarHBondContact OD2-NE1 3.37Å; E75-W119 PolarHBondContact O-NE1 3.24Å; F76-W119 HydrophobicContact CB-CD2 3.7Å; F76-W119 HydrophobicContact CB-CE3 4Å; F76-W119 HydrophobicContact CB-CG 4.07Å; F76-W119 HydrophobicContact CB-CH2 4.2Å; F76-W119 HydrophobicContact CB-CZ2 3.92Å; F76-W119 HydrophobicContact CB-CZ3 4.24Å; F76-W119 HydrophobicContact CD2-CB 3.9Å; F76-W119 HydrophobicContact CD2-CD2 4.3Å; F76-W119 AromaticContact CD2-CG 3.9Å; F76-W119 HydrophobicContact CD2-CG 3.9Å; F76-W119 HydrophobicContact CE2-CB 4.5Å; F76-W119 HydrophobicContact CG-CD2 4.35Å; F76-W119 HydrophobicContact CG-CG 4.41Å; D115-W119 VanDerWaalsContact O-CB 3.29Å; D115-W119 WeakPolarHBondContact O-CB 3.26Å; D115-W119 PolarHBondContact O-N 3.1Å; F116-W119 AromaticContact CD2-CE3 3.94Å; F116-W119 HydrophobicContact CD2-CE3 3.94Å; F116-W119 HydrophobicContact CD2-CZ3 4.14Å; F116-W119 AromaticContact CE2-CE3 3.86Å; F116-W119 HydrophobicContact CE2-CE3 3.86Å; F116-W119 AromaticContact CE2-CZ3 3.59Å; F116-W119 HydrophobicContact CE2-CZ3 3.59Å; F116-W119 HydrophobicContact CZ-CZ3 4.24Å; F116-W119 WeakPolarHBondContact O-CB 3.45Å; F116-W119 PolarHBondContact O-N 3.18Å; W119-R122 PolarHBondContact O-N 2.9Å; W119-R122 PolarHBondContact O-NE 3.49Å; W119-H123 PolarHBondContact O-CD2 3.47Å
120	L	90.7	Very high	86.2	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-67.8	-40.7	-178.4	-171.8	58.2	0	0	0	111.9	L64 F116 Q117 R122 H123 V124 V131 F133 Y185	L64-L120 HydrophobicContact CD1-CD1 3.87Å; F116-L120 HydrophobicContact CE1-CD2 4.39Å; F116-L120 HydrophobicContact CZ-CD2 4.49Å; F116-L120 WeakPolarHBondContact O-CB 3.41Å; F116-L120 PolarHBondContact O-N 3.08Å; Q117-L120 PolarHBondContact O-N 2.77Å; L120-R122 PolarHBondContact O-N 3.03Å; L120-H123 PolarHBondContact O-N 3.24Å; L120-V124 HydrophobicContact CD1-CG1 3.84Å; L120-V124 HydrophobicContact CG-CG1 4.06Å; L120-V124 HydrophobicContact CG-CG2 4.26Å; L120-V124 WeakPolarHBondContact O-CG2 3.44Å; L120-V124 PolarHBondContact O-N 3.05Å; L120-V124 VanDerWaalsContact O-N 3.16Å; L120-V131 HydrophobicContact CD1-CG2 4.32Å; L120-F133 HydrophobicContact CD2-CE1 4.04Å; L120-F133 HydrophobicContact CD2-CZ 3.63Å; L120-Y185 HydrophobicContact CB-CE2 4.46Å; L120-Y185 HydrophobicContact CD2-CD2 3.53Å; L120-Y185 HydrophobicContact CD2-CE2 3.9Å; L120-Y185 HydrophobicContact CD2-CG 3.86Å; L120-Y185 HydrophobicContact CG-CD2 4.42Å; L120-Y185 HydrophobicContact CG-CE2 4.38Å
121	A	88.5	Confident	86	Confident	22 Å²	22	54.4 Å²	54.4	18%	0.182	29%	0.294	C	S	.	.	H	α-helix	trans	-55	-35.2	179.4	0	0	0	0	0	112.9	Q117 A118 H123 V124 D125	Q117-A121 WeakPolarHBondContact O-CB 3.47Å; Q117-A121 PolarHBondContact O-N 2.66Å; A118-A121 PolarHBondContact O-N 2.83Å; A121-H123 PolarHBondContact O-N 3.37Å; A121-H123 VanDerWaalsContact O-N 3.16Å; A121-V124 PolarHBondContact O-N 3.46Å; A121-D125 PolarHBondContact O-N 2.75Å; A121-D125 VanDerWaalsContact O-N 3.1Å
122	R	90.6	Very high	85.7	Confident	140 Å²	140	50.6 Å²	50.6	53%	0.528	27%	0.274	S	S	.	.	H	α-helix	trans	-57.6	-29.3	176.7	-68.2	-179	-59.3	127.4	8.7	112.9	D74 A118 W119 L120	D74-R122 IonicContact OD2-CZ 3.95Å; D74-R122 IonicContact OD2-NH1 3.83Å; D74-R122 IonicContact OD2-NH2 3.79Å; D74-R122 PolarHBondContact OD2-NH2 2.94Å; A118-R122 WeakPolarHBondContact O-CG 2.95Å; A118-R122 PolarHBondContact O-N 3.41Å; W119-R122 PolarHBondContact O-N 2.9Å; W119-R122 PolarHBondContact O-NE 3.49Å; L120-R122 PolarHBondContact O-N 3.03Å
123	H	89.8	Confident	85.3	Confident	32 Å²	32	50.8 Å²	50.8	15%	0.148	28%	0.275	C	S	.	.	H	α-helix	trans	-97	-31.1	-177.3	-62.3	-70.9	0	0	0	113.3	Y34 L64 D74 W119 L120 A121	Y34-H123 HydrophobicContact CE2-CB 4.18Å; L64-H123 HydrophobicContact CD2-CB 3.61Å; L64-H123 VanDerWaalsContact CD2-CG 3.48Å; D74-H123 WeakPolarHBondContact CB-NE2 2.88Å; D74-H123 IonicContact OD2-CD2 2.75Å; D74-H123 IonicContact OD2-CE1 3.84Å; D74-H123 PolarHBondContact OD2-CE1 3.48Å; D74-H123 IonicContact OD2-NE2 3.91Å; D74-H123 PolarHBondContact OD2-NE2 3.41Å; W119-H123 PolarHBondContact O-CD2 3.47Å; L120-H123 PolarHBondContact O-N 3.24Å; A121-H123 PolarHBondContact O-N 3.37Å; A121-H123 VanDerWaalsContact O-N 3.16Å
124	V	83.4	Confident	85.2	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-105.6	-44.2	-166.6	-52.1	0	0	0	0	114.1	Y34 L120 A121 A127 N128 K129 V131 Y185	Y34-V124 HydrophobicContact CD2-CG1 4.37Å; L120-V124 HydrophobicContact CD1-CG1 3.84Å; L120-V124 HydrophobicContact CG-CG1 4.06Å; L120-V124 HydrophobicContact CG-CG2 4.26Å; L120-V124 WeakPolarHBondContact O-CG2 3.44Å; L120-V124 PolarHBondContact O-N 3.05Å; L120-V124 VanDerWaalsContact O-N 3.16Å; A121-V124 PolarHBondContact O-N 3.46Å; V124-A127 PolarHBondContact O-N 2.94Å; V124-N128 PolarHBondContact O-N 3.17Å; V124-N128 VanDerWaalsContact O-N 3.16Å; V124-K129 PolarHBondContact O-N 3.07Å; V124-K129 VanDerWaalsContact O-N 3.07Å; V124-V131 HydrophobicContact CB-CG2 4.31Å; V124-V131 HydrophobicContact CG1-CG2 3.24Å; V124-Y185 HydrophobicContact CG2-CD1 3.88Å; V124-Y185 HydrophobicContact CG2-CE1 3.43Å; V124-Y185 VanDerWaalsContact CG2-CE1 3.43Å
125	D	77.3	Confident	84.9	Confident	81 Å²	81	50.1 Å²	50.1	43%	0.433	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-71.5	-44.1	-168.1	-79.7	-3.7	0	0	0	111.1	A121 A127 K184	A121-D125 PolarHBondContact O-N 2.75Å; A121-D125 VanDerWaalsContact O-N 3.1Å; D125-A127 PolarHBondContact O-N 2.93Å; D125-K184 IonicContact OD2-NZ 2.58Å; D125-K184 PolarHBondContact OD2-NZ 3.42Å
126	N	69.9	Low	84.2	Confident	149 Å²	149	51.9 Å²	51.9	80%	0.797	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-67.8	-18.6	-177.5	-70.9	-32.5	0	0	0	114.1
127	A	69.8	Low	82.9	Confident	54 Å²	54	53.8 Å²	53.8	45%	0.446	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-119	5.4	-173.4	0	0	0	0	0	113.6	V124 D125 K129	V124-A127 PolarHBondContact O-N 2.94Å; D125-A127 PolarHBondContact O-N 2.93Å; A127-K129 HydrophobicContact CB-CD 3.83Å; A127-K129 HydrophobicContact CB-CG 3.67Å; A127-K129 PolarHBondContact O-N 2.88Å
128	N	75	Confident	81.6	Confident	149 Å²	149	53.8 Å²	53.8	80%	0.797	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	40.9	-173.4	-164	34.8	0	0	0	112	V124	V124-N128 PolarHBondContact O-N 3.17Å; V124-N128 VanDerWaalsContact O-N 3.16Å
129	K	83.4	Confident	80.3	Confident	73 Å²	73	55 Å²	55	32%	0.317	30%	0.302	S	S	.	.			trans	-86.2	148.7	-176.2	-74.8	179.7	-177.1	172	0	110.9	D33 Y34 V124 A127	D33-K129 HydrophobicContact CB-CB 3.84Å; D33-K129 HydrophobicContact CB-CD 4.15Å; D33-K129 HydrophobicContact CB-CG 3.99Å; D33-K129 WeakPolarHBondContact OD2-CA 3.37Å; D33-K129 VanDerWaalsContact OD2-CB 3.29Å; D33-K129 WeakPolarHBondContact OD2-CB 3.5Å; D33-K129 WeakPolarHBondContact OD2-CG 3.29Å; Y34-K129 HydrophobicContact CD2-CB 4.39Å; Y34-K129 HydrophobicContact CD2-CD 4.21Å; Y34-K129 HydrophobicContact CE2-CB 4.19Å; Y34-K129 HydrophobicContact CE2-CD 3.31Å; Y34-K129 HydrophobicContact CE2-CG 4.38Å; Y34-K129 PolarHBondContact OH-NZ 3.44Å; V124-K129 PolarHBondContact O-N 3.07Å; V124-K129 VanDerWaalsContact O-N 3.07Å; A127-K129 HydrophobicContact CB-CD 3.83Å; A127-K129 HydrophobicContact CB-CG 3.67Å; A127-K129 PolarHBondContact O-N 2.88Å
130	T	83.1	Confident	79	Confident	47 Å²	47	55.5 Å²	55.5	29%	0.288	31%	0.305	S	S	.	.			trans	-99.3	140.8	178.3	55.4	0	0	0	0	111.1	K5 Y32 D33 Y34	K5-T130 PolarHBondContact NZ-OG1 2.72Å; Y32-T130 WeakPolarHBondContact CA-OG1 3.24Å; D33-T130 WeakPolarHBondContact CA-O 3.36Å; D33-T130 WeakPolarHBondContact CB-O 3.44Å; D33-T130 PolarHBondContact N-O 2.81Å; D33-T130 PolarHBondContact N-OG1 3.45Å; D33-T130 PolarHBondContact OD2-N 3.28Å; D33-T130 PolarHBondContact OD2-OG1 2.92Å; Y34-T130 PolarHBondContact N-O 2.73Å
131	V	84	Confident	77.5	Confident	15 Å²	15	59.9 Å²	59.9	9%	0.091	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.3	177	-173.9	0	0	0	0	109.2	Y34 C36 L64 L120 V124	Y34-V131 HydrophobicContact CD2-CG2 4.22Å; Y34-V131 WeakPolarHBondContact O-CA 3.34Å; C36-V131 HydrophobicContact CB-CG1 3.61Å; L64-V131 HydrophobicContact CD1-CG1 4.41Å; L120-V131 HydrophobicContact CD1-CG2 4.32Å; V124-V131 HydrophobicContact CB-CG2 4.31Å; V124-V131 HydrophobicContact CG1-CG2 3.24Å
132	A	84.5	Confident	76.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.5	160.9	0	0	0	0	0	109.1	Y32 Y34 Y35 C36 V190	Y32-A132 HydrophobicContact CD1-CB 3.83Å; Y32-A132 HydrophobicContact CD2-CB 3.42Å; Y32-A132 VanDerWaalsContact CD2-CB 3.42Å; Y32-A132 HydrophobicContact CE1-CB 4.04Å; Y32-A132 HydrophobicContact CE2-CB 3.65Å; Y32-A132 HydrophobicContact CG-CB 3.53Å; Y34-A132 PolarHBondContact O-N 2.61Å; Y35-A132 CarbonylContact C-O 3.55Å; Y35-A132 WeakPolarHBondContact CA-O 3.45Å; Y35-A132 HydrophobicContact CD1-CB 4.02Å; Y35-A132 HydrophobicContact CE1-CB 4.28Å; C36-A132 PolarHBondContact N-O 3.49Å; A132-V190 HydrophobicContact CB-CG2 4.3Å
133	F	85.7	Confident	74.7	Confident	3 Å²	3	55.5 Å²	55.5	1%	0.013	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.9	171.2	-66.6	-74.2	0	0	0	109.8	C36 I38 F116 L120 L144 I182 Y185 V187	C36-F133 HydrophobicContact CB-CD1 3.59Å; C36-F133 HydrophobicContact CB-CE1 3.74Å; C36-F133 CarbonylContact O-C 3.56Å; C36-F133 VanDerWaalsContact O-CA 3.3Å; C36-F133 WeakPolarHBondContact O-CA 3.48Å; I38-F133 HydrophobicContact CD1-CD1 3.43Å; I38-F133 VanDerWaalsContact CD1-CD1 3.43Å; I38-F133 HydrophobicContact CD1-CE1 3.88Å; I38-F133 HydrophobicContact CD1-CG 4.33Å; I38-F133 HydrophobicContact CG1-CD1 4.31Å; F116-F133 HydrophobicContact CE1-CE1 4.13Å; F116-F133 HydrophobicContact CE1-CZ 4.35Å; F116-F133 AromaticContact CZ-CE1 3.78Å; F116-F133 HydrophobicContact CZ-CE1 3.78Å; F116-F133 HydrophobicContact CZ-CZ 4.43Å; L120-F133 HydrophobicContact CD2-CE1 4.04Å; L120-F133 HydrophobicContact CD2-CZ 3.63Å; F133-L144 HydrophobicContact CB-CD1 4.01Å; F133-I182 HydrophobicContact CZ-CG2 4.47Å; F133-Y185 WeakPolarHBondContact CE2-O 3.44Å; F133-V187 HydrophobicContact CB-CG1 4.42Å; F133-V187 HydrophobicContact CD2-CB 4.32Å; F133-V187 HydrophobicContact CD2-CG2 3.67Å; F133-V187 HydrophobicContact CE2-CG2 4.22Å; F133-V187 HydrophobicContact CG-CG2 4.42Å
134	V	85.5	Confident	73.1	Confident	34 Å²	34	54.2 Å²	54.2	21%	0.206	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	128.6	179.3	-174.2	0	0	0	0	106.6	Y35 C36 V37 I38 V190	Y35-V134 HydrophobicContact CD1-CG2 3.93Å; Y35-V134 HydrophobicContact CG-CG2 4.37Å; C36-V134 PolarHBondContact O-N 3.4Å; V37-V134 CarbonylContact C-O 3.57Å; V37-V134 VanDerWaalsContact CA-O 3.27Å; V37-V134 WeakPolarHBondContact CA-O 3.16Å; V37-V134 HydrophobicContact CG2-CB 4.15Å; I38-V134 PolarHBondContact N-O 2.76Å; V134-V190 HydrophobicContact CG2-CG2 3.93Å
135	V	82.1	Confident	71.7	Confident	38 Å²	38	57 Å²	57	23%	0.23	31%	0.309	C	S	.	.			trans	-136.1	156.3	178.8	-70.3	0	0	0	0	108.4	I38 Q140 R141 L144	I38-V135 HydrophobicContact CB-CG1 4.09Å; V135-Q140 HydrophobicContact CB-CB 3.77Å; V135-Q140 HydrophobicContact CG1-CB 4.3Å; V135-Q140 HydrophobicContact CG2-CB 4.17Å; V135-R141 HydrophobicContact CG2-CB 4.17Å; V135-L144 HydrophobicContact CB-CD1 4.49Å; V135-L144 HydrophobicContact CG1-CD1 3.32Å; V135-L144 HydrophobicContact CG1-CG 4.22Å; V135-L144 HydrophobicContact CG2-CD1 4.36Å
136	D	77.7	Confident	70.2	Confident	132 Å²	132	58.9 Å²	58.9	71%	0.706	32%	0.315	S	S	*	.	S	Bend	trans	-95	124.4	177.5	-161.3	5.1	0	0	0	110.7	Q140	D136-Q140 VanDerWaalsContact N-OE1 3.13Å; D136-Q140 WeakPolarHBondContact O-CB 3.38Å; D136-Q140 WeakPolarHBondContact O-CG 3.45Å; D136-Q140 PolarHBondContact O-OE1 3.46Å
137	G	65.7	Low	69.1	Low	39 Å²	39	54.3 Å²	54.3	40%	0.402	29%	0.294	S	S	.	.	H	α-helix	trans	77.3	165.8	177.7	0	0	0	0	0	116.9	R141	G137-R141 PolarHBondContact O-N 3.18Å
138	I	62.4	Low	67.9	Low	42 Å²	42	62 Å²	62	22%	0.215	31%	0.311	C	S	.	.	H	α-helix	trans	-71.7	-32.1	-178.3	-164	162.8	0	0	0	112.5	Q140 R141 L142 C155	I138-Q140 PolarHBondContact O-N 2.93Å; I138-R141 CarbonylContact O-C 3.56Å; I138-R141 WeakPolarHBondContact O-CA 3.35Å; I138-R141 VanDerWaalsContact O-CB 3.3Å; I138-R141 WeakPolarHBondContact O-CB 3.31Å; I138-R141 PolarHBondContact O-N 3.27Å; I138-L142 WeakPolarHBondContact O-CG 3.44Å; I138-L142 PolarHBondContact O-N 3.49Å; I138-C155 WeakPolarHBondContact CD1-O 3.31Å
139	N	63.9	Low	66.3	Low	84 Å²	84	63.6 Å²	63.6	45%	0.449	31%	0.314	S	S	.	.	H	α-helix	trans	-61.5	-45	-179.6	-68.5	-37.1	0	0	0	111.3	R141 L142	N139-R141 VanDerWaalsContact C-N 3.31Å; N139-R141 PolarHBondContact O-N 2.79Å; N139-L142 WeakPolarHBondContact O-CB 3.37Å; N139-L142 PolarHBondContact O-N 2.94Å
140	Q	65.2	Low	64.7	Low	28 Å²	28	64.5 Å²	64.5	13%	0.131	32%	0.322	C	S	.	.	H	α-helix	trans	-69.3	-31.8	174.2	-61.5	-169.1	3.4	0	0	112.3	I38 D39 V135 D136 I138 L142 L143 L144	I38-Q140 PolarHBondContact O-OE1 3.03Å; D39-Q140 PolarHBondContact OD1-NE2 2.82Å; V135-Q140 HydrophobicContact CB-CB 3.77Å; V135-Q140 HydrophobicContact CG1-CB 4.3Å; V135-Q140 HydrophobicContact CG2-CB 4.17Å; D136-Q140 VanDerWaalsContact N-OE1 3.13Å; D136-Q140 WeakPolarHBondContact O-CB 3.38Å; D136-Q140 WeakPolarHBondContact O-CG 3.45Å; D136-Q140 PolarHBondContact O-OE1 3.46Å; I138-Q140 PolarHBondContact O-N 2.93Å; Q140-L142 VanDerWaalsContact C-N 3.28Å; Q140-L142 PolarHBondContact O-N 3.34Å; Q140-L143 VanDerWaalsContact O-CB 3.31Å; Q140-L143 WeakPolarHBondContact O-CB 3.27Å; Q140-L143 PolarHBondContact O-N 3.33Å; Q140-L143 VanDerWaalsContact O-N 3.11Å; Q140-L144 PolarHBondContact O-N 3.14Å
141	R	60.8	Low	62.9	Low	92 Å²	92	68.8 Å²	68.8	35%	0.347	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-35.7	174.1	-178	174.9	170.4	167.8	-8.8	111.8	V135 G137 I138 N139 L143 L144 R145 P189	V135-R141 HydrophobicContact CG2-CB 4.17Å; G137-R141 PolarHBondContact O-N 3.18Å; I138-R141 CarbonylContact O-C 3.56Å; I138-R141 WeakPolarHBondContact O-CA 3.35Å; I138-R141 VanDerWaalsContact O-CB 3.3Å; I138-R141 WeakPolarHBondContact O-CB 3.31Å; I138-R141 PolarHBondContact O-N 3.27Å; N139-R141 VanDerWaalsContact C-N 3.31Å; N139-R141 PolarHBondContact O-N 2.79Å; R141-L143 VanDerWaalsContact C-N 3.27Å; R141-L143 PolarHBondContact O-N 3.29Å; R141-L144 PolarHBondContact O-N 2.91Å; R141-R145 WeakPolarHBondContact O-CG 3.46Å; R141-R145 PolarHBondContact O-N 2.84Å; R141-P189 VanDerWaalsContact CZ-CG 3.48Å
142	L	58.8	Low	60.7	Low	56 Å²	56	73.5 Å²	73.5	29%	0.293	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-35.6	174.5	-66.1	174.7	0	0	0	111.6	I138 N139 Q140 L144 R145	I138-L142 WeakPolarHBondContact O-CG 3.44Å; I138-L142 PolarHBondContact O-N 3.49Å; N139-L142 WeakPolarHBondContact O-CB 3.37Å; N139-L142 PolarHBondContact O-N 2.94Å; Q140-L142 VanDerWaalsContact C-N 3.28Å; Q140-L142 PolarHBondContact O-N 3.34Å; L142-L144 PolarHBondContact O-N 3.16Å; L142-R145 PolarHBondContact O-N 3.14Å
143	L	60.5	Low	58.7	Low	14 Å²	14	77.3 Å²	77.3	7%	0.073	41%	0.409	C	S	.	.	H	α-helix	trans	-64.2	-23.2	176.3	-56.5	177.5	0	0	0	113.5	F40 Q140 R141 F175 A179	F40-L143 HydrophobicContact CB-CD1 3.71Å; F40-L143 HydrophobicContact CD2-CB 4.03Å; F40-L143 HydrophobicContact CD2-CD1 3.55Å; F40-L143 HydrophobicContact CD2-CG 4.44Å; F40-L143 HydrophobicContact CE2-CB 4.1Å; F40-L143 HydrophobicContact CE2-CD1 4.42Å; F40-L143 HydrophobicContact CG-CD1 3.92Å; Q140-L143 VanDerWaalsContact O-CB 3.31Å; Q140-L143 WeakPolarHBondContact O-CB 3.27Å; Q140-L143 PolarHBondContact O-N 3.33Å; Q140-L143 VanDerWaalsContact O-N 3.11Å; R141-L143 VanDerWaalsContact C-N 3.27Å; R141-L143 PolarHBondContact O-N 3.29Å; L143-F175 HydrophobicContact CD2-CB 4.11Å; L143-F175 HydrophobicContact CD2-CD1 3.12Å; L143-F175 HydrophobicContact CD2-CD2 4.44Å; L143-F175 HydrophobicContact CD2-CE1 3.32Å; L143-F175 HydrophobicContact CD2-CG 3.7Å; L143-F175 HydrophobicContact CD2-CZ 4.07Å; L143-A179 WeakPolarHBondContact O-CB 3.23Å
144	L	57	Low	56.9	Low	4 Å²	4	81.8 Å²	81.8	2%	0.021	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-2.7	178.8	-66	-175.7	0	0	0	113.7	I38 F40 F133 V135 Q140 R141 L142 I182 V187	I38-L144 HydrophobicContact CD1-CD2 4.48Å; F40-L144 HydrophobicContact CE2-CD2 3.76Å; F40-L144 HydrophobicContact CE2-CG 4.17Å; F40-L144 HydrophobicContact CZ-CD2 4.08Å; F133-L144 HydrophobicContact CB-CD1 4.01Å; V135-L144 HydrophobicContact CB-CD1 4.49Å; V135-L144 HydrophobicContact CG1-CD1 3.32Å; V135-L144 HydrophobicContact CG1-CG 4.22Å; V135-L144 HydrophobicContact CG2-CD1 4.36Å; Q140-L144 PolarHBondContact O-N 3.14Å; R141-L144 PolarHBondContact O-N 2.91Å; L142-L144 PolarHBondContact O-N 3.16Å; L144-I182 HydrophobicContact CD2-CD1 4.2Å; L144-I182 HydrophobicContact CD2-CG2 4.06Å; L144-V187 HydrophobicContact CB-CG1 3.94Å; L144-V187 HydrophobicContact CB-CG2 4.17Å; L144-V187 HydrophobicContact CD1-CG1 4.27Å
145	R	53.7	Low	54.5	Low	64 Å²	64	83.6 Å²	83.6	24%	0.242	44%	0.443	C	S	.	.	S	Bend	trans	-81	143.8	-178.5	-81.9	-176.9	-171.6	-147.1	6	111.4	R141 L142 E154	R141-R145 WeakPolarHBondContact O-CG 3.46Å; R141-R145 PolarHBondContact O-N 2.84Å; L142-R145 PolarHBondContact O-N 3.14Å; R145-E154 IonicContact CZ-OE2 2.7Å; R145-E154 IonicContact NH1-OE1 3.68Å; R145-E154 IonicContact NH1-OE2 3.6Å; R145-E154 PolarHBondContact NH1-OE2 2.85Å
146	Q	45.7	Very low	52.6	Low	119 Å²	119	87 Å²	87	56%	0.556	46%	0.464	S	S	*	.			trans	-62.2	144.2	162.2	-82	-176	8.4	0	0	109.6	R148 L183	Q146-R148 PolarHBondContact O-N 2.91Å; Q146-L183 HydrophobicContact CB-CD1 4.2Å; Q146-L183 HydrophobicContact CG-CD1 3.2Å; Q146-L183 HydrophobicContact CG-CD2 3.92Å; Q146-L183 HydrophobicContact CG-CG 4.08Å
147	P	45.7	Very low	50.6	Low	54 Å²	54	86.2 Å²	86.2	35%	0.351	46%	0.46	S	S	.	.			trans	-47.5	115.6	163.9	-4	-0.9	0	0	0	109.7	V176 K180	P147-V176 HydrophobicContact CB-CG1 3.2Å; P147-V176 HydrophobicContact CG-CG1 3.22Å; P147-K180 HydrophobicContact CG-CD 4.41Å; P147-K180 HydrophobicContact CG-CG 4.29Å
148	R	44.5	Very low	49.5	Very low	214 Å²	214	89.3 Å²	89.3	81%	0.808	47%	0.467	S	S	*	.			trans	-141.8	148.5	161.7	-75.4	-162.2	-76.1	-166.8	-0.7	107.3	Q146 L150	Q146-R148 PolarHBondContact O-N 2.91Å; R148-L150 PolarHBondContact O-N 3.03Å; R148-L150 VanDerWaalsContact O-N 3.15Å
149	E	43.5	Very low	48.6	Very low	183 Å²	183	93.4 Å²	93.4	86%	0.855	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-53.7	120.5	164.1	-70.5	174	171.7	0	0	107.1	E151	E149-E151 PolarHBondContact O-N 3.38Å
150	L	49.6	Very low	47.6	Very low	92 Å²	92	98.1 Å²	98.1	48%	0.482	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-71	122.9	170.2	-70.7	168.8	0	0	0	106.4	R148 E154	R148-L150 PolarHBondContact O-N 3.03Å; R148-L150 VanDerWaalsContact O-N 3.15Å; L150-E154 WeakPolarHBondContact CD2-OE2 3.22Å
151	E	44.6	Very low	46.5	Very low	137 Å²	137	102.7 Å²	102.7	64%	0.64	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-64	138.8	172.8	-65	-72.4	169.3	0	0	108.5	E149 G153 E154	E149-E151 PolarHBondContact O-N 3.38Å; E151-G153 PolarHBondContact O-N 2.96Å; E151-G153 VanDerWaalsContact O-N 3.14Å; E151-E154 PolarHBondContact O-N 2.88Å; E151-E154 VanDerWaalsContact O-N 3.14Å
152	P	38.5	Very low	45.4	Very low	115 Å²	115	106.6 Å²	106.6	75%	0.747	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.4	122.5	173.6	-24	32.7	0	0	0	110.4
153	G	42.6	Very low	44.6	Very low	79 Å²	79	109.7 Å²	109.7	81%	0.814	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	94	9.3	-179.3	0	0	0	0	0	116.5	E151 C155	E151-G153 PolarHBondContact O-N 2.96Å; E151-G153 VanDerWaalsContact O-N 3.14Å; G153-C155 PolarHBondContact O-N 3.4Å; G153-C155 VanDerWaalsContact O-N 3.09Å
154	E	46.9	Very low	43.6	Very low	97 Å²	97	118.5 Å²	118.5	45%	0.453	63%	0.625	S	S	.	*			trans	-65.5	107.3	159.6	-84.7	-158.9	161.1	0	0	109.1	R145 L150 E151 T156	R145-E154 IonicContact CZ-OE2 2.7Å; R145-E154 IonicContact NH1-OE1 3.68Å; R145-E154 IonicContact NH1-OE2 3.6Å; R145-E154 PolarHBondContact NH1-OE2 2.85Å; L150-E154 WeakPolarHBondContact CD2-OE2 3.22Å; E151-E154 PolarHBondContact O-N 2.88Å; E151-E154 VanDerWaalsContact O-N 3.14Å; E154-T156 PolarHBondContact O-N 2.79Å
155	C	36.2	Very low	42.8	Very low	73 Å²	73	123.9 Å²	123.9	49%	0.493	65%	0.653	S	S	.	*			trans	-36.1	115.1	179.6	-82	0	0	0	0	113.6	I138 G153 D157	I138-C155 WeakPolarHBondContact CD1-O 3.31Å; G153-C155 PolarHBondContact O-N 3.4Å; G153-C155 VanDerWaalsContact O-N 3.09Å; C155-D157 VanDerWaalsContact C-N 3.25Å; C155-D157 HydrophobicContact CB-CB 4.3Å; C155-D157 VanDerWaalsContact CB-CG 3.48Å; C155-D157 WeakPolarHBondContact CB-OD1 3.05Å; C155-D157 WeakPolarHBondContact CB-OD2 3.41Å; C155-D157 PolarHBondContact SG-OD1 3.36Å; C155-D157 PolarHBondContact SG-OD2 2.74Å
156	T	41.2	Very low	42.1	Very low	108 Å²	108	129.5 Å²	129.5	66%	0.663	68%	0.682	S	S	*	*			trans	-94.9	58.1	154.7	54.4	0	0	0	0	107.3	E154 D158	E154-T156 PolarHBondContact O-N 2.79Å; T156-D158 VanDerWaalsContact C-N 3.26Å; T156-D158 PolarHBondContact O-N 2.79Å
157	D	36.4	Very low	41.6	Very low	117 Å²	117	127.3 Å²	127.3	63%	0.626	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	81.4	-176.8	-64.6	-8	0	0	0	108.5	C155	C155-D157 VanDerWaalsContact C-N 3.25Å; C155-D157 HydrophobicContact CB-CB 4.3Å; C155-D157 VanDerWaalsContact CB-CG 3.48Å; C155-D157 WeakPolarHBondContact CB-OD1 3.05Å; C155-D157 WeakPolarHBondContact CB-OD2 3.41Å; C155-D157 PolarHBondContact SG-OD1 3.36Å; C155-D157 PolarHBondContact SG-OD2 2.74Å
158	D	42	Very low	41.2	Very low	104 Å²	104	132.7 Å²	132.7	56%	0.556	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.6	11.7	161	-88.5	-36.4	0	0	0	112.3	T156	T156-D158 VanDerWaalsContact C-N 3.26Å; T156-D158 PolarHBondContact O-N 2.79Å
159	D	43.1	Very low	41.1	Very low	128 Å²	128	130.1 Å²	130.1	68%	0.684	71%	0.713	S	S	*	*			trans	-124.7	117	169.2	-73	-45.7	0	0	0	109.7	D161	D159-D161 PolarHBondContact O-N 3.47Å
160	D	42.2	Very low	41	Very low	182 Å²	182	124.8 Å²	124.8	97%	0.973	69%	0.693	S	S	*	*			trans	-62.3	35.1	168	-82.6	-47.3	0	0	0	112.9
161	D	43.8	Very low	40.5	Very low	125 Å²	125	125 Å²	125	67%	0.668	70%	0.699	S	S	*	*			trans	-125.6	104.5	175.8	-112.5	-28.2	0	0	0	110.2	D159 N163	D159-D161 PolarHBondContact O-N 3.47Å; D161-N163 PolarHBondContact O-N 3.22Å
162	D	38	Very low	40.3	Very low	173 Å²	173	126 Å²	126	93%	0.925	71%	0.709	S	S	*	*			trans	-61	57.2	175.1	-72.6	-44.4	0	0	0	113.3
163	N	40.5	Very low	40.8	Very low	122 Å²	122	122.9 Å²	122.9	65%	0.652	68%	0.683	S	S	*	*			trans	-105.4	98	169.9	-73.9	-53.3	0	0	0	109.9	D161 I165	D161-N163 PolarHBondContact O-N 3.22Å; N163-I165 PolarHBondContact O-N 3.21Å
164	E	39.1	Very low	40.8	Very low	198 Å²	198	122.3 Å²	122.3	93%	0.925	66%	0.658	S	S	*	*			trans	-51.9	104.2	159.9	-91	-180	146.3	0	0	109.1
165	I	42	Very low	40.9	Very low	118 Å²	118	119.1 Å²	119.1	61%	0.605	64%	0.643	S	S	*	*			trans	-91.7	108.2	169	-60.1	175.6	0	0	0	107.8	N163 G167	N163-I165 PolarHBondContact O-N 3.21Å; I165-G167 PolarHBondContact O-N 2.7Å
166	E	37.4	Very low	41.4	Very low	182 Å²	182	117.5 Å²	117.5	85%	0.85	63%	0.631	S	S	*	*			trans	-60.1	118	170.6	-71.8	-172.9	149.9	0	0	111	E168	E166-E168 VanDerWaalsContact C-N 3.29Å; E166-E168 PolarHBondContact O-N 3.37Å
167	G	36.7	Very low	41.5	Very low	72 Å²	72	120.1 Å²	120.1	74%	0.742	63%	0.633	S	S	*	*			trans	56.2	17.2	135.6	0	0	0	0	0	120.5	I165	I165-G167 PolarHBondContact O-N 2.7Å
168	E	37.4	Very low	42.1	Very low	168 Å²	168	115.9 Å²	115.9	79%	0.785	61%	0.609	S	S	*	*			trans	-91.3	119.7	178.6	-147.4	166.2	-157.1	0	0	110.7	E166 V170	E166-E168 VanDerWaalsContact C-N 3.29Å; E166-E168 PolarHBondContact O-N 3.37Å; E168-V170 PolarHBondContact O-N 3.18Å
169	L	41.1	Very low	42.5	Very low	160 Å²	160	111 Å²	111	84%	0.838	58%	0.584	S	S	*	*			trans	-49.5	104.4	176.1	-76.6	155.9	0	0	0	109.7	P171	L169-P171 WeakPolarHBondContact O-CD 3.41Å
170	V	40.8	Very low	42.7	Very low	71 Å²	71	111.4 Å²	111.4	43%	0.43	58%	0.579	S	S	.	*			trans	-60.2	110.2	171.4	-173.8	0	0	0	0	106.5	E168 D172 Y173	E168-V170 PolarHBondContact O-N 3.18Å; V170-D172 PolarHBondContact O-N 3.33Å; V170-D172 VanDerWaalsContact O-N 3.1Å; V170-Y173 HydrophobicContact CG1-CD2 3.56Å; V170-Y173 HydrophobicContact CG1-CE2 3.47Å; V170-Y173 VanDerWaalsContact CG1-CE2 3.47Å
171	P	40.4	Very low	43	Very low	95 Å²	95	104.7 Å²	104.7	62%	0.617	55%	0.547	S	S	*	.			trans	-59.5	122.2	-172.8	-21.1	32.2	0	0	0	108.4	L169 Y173	L169-P171 WeakPolarHBondContact O-CD 3.41Å; P171-Y173 VanDerWaalsContact C-N 3.33Å; P171-Y173 PolarHBondContact O-N 2.95Å
172	D	40.3	Very low	43.4	Very low	159 Å²	159	98.8 Å²	98.8	85%	0.85	52%	0.515	S	S	*	.			trans	-20.7	90.6	177	-82.1	-35.6	0	0	0	112.1	V170 F174	V170-D172 PolarHBondContact O-N 3.33Å; V170-D172 VanDerWaalsContact O-N 3.1Å; D172-F174 PolarHBondContact O-N 3.02Å; D172-F174 VanDerWaalsContact O-N 3.17Å
173	Y	48.1	Very low	44.1	Very low	49 Å²	49	92 Å²	92	19%	0.192	48%	0.479	C	S	.	.			trans	-56	127.1	-179.3	-98.1	-78.9	0	0	0	108.4	I50 R51 V170 P171 F175 V176	I50-Y173 VanDerWaalsContact C-OH 3.31Å; I50-Y173 VanDerWaalsContact O-CE1 3.27Å; I50-Y173 WeakPolarHBondContact O-CE1 3.01Å; I50-Y173 VanDerWaalsContact O-CZ 3.29Å; I50-Y173 PolarHBondContact O-OH 3.17Å; R51-Y173 VanDerWaalsContact CA-CZ 3.44Å; R51-Y173 WeakPolarHBondContact CA-OH 3.45Å; R51-Y173 PolarHBondContact N-OH 3.4Å; R51-Y173 WeakPolarHBondContact O-CE1 3.07Å; R51-Y173 WeakPolarHBondContact O-CE2 3.48Å; R51-Y173 VanDerWaalsContact O-CZ 3.22Å; V170-Y173 HydrophobicContact CG1-CD2 3.56Å; V170-Y173 HydrophobicContact CG1-CE2 3.47Å; V170-Y173 VanDerWaalsContact CG1-CE2 3.47Å; P171-Y173 VanDerWaalsContact C-N 3.33Å; P171-Y173 PolarHBondContact O-N 2.95Å; Y173-F175 AromaticContact CD1-CD2 3.29Å; Y173-F175 HydrophobicContact CD1-CD2 3.29Å; Y173-F175 AromaticContact CD1-CE2 3.5Å; Y173-F175 HydrophobicContact CD1-CE2 3.5Å; Y173-F175 VanDerWaalsContact CD1-CE2 3.5Å; Y173-F175 AromaticContact CE1-CD2 3.84Å; Y173-F175 HydrophobicContact CE1-CD2 3.84Å; Y173-F175 AromaticContact CE1-CE2 3.56Å; Y173-F175 HydrophobicContact CE1-CE2 3.56Å; Y173-F175 AromaticContact CG-CD2 3.82Å; Y173-F175 HydrophobicContact CG-CD2 3.82Å; Y173-F175 HydrophobicContact CG-CE2 4.41Å; Y173-F175 PolarHBondContact O-N 3.34Å; Y173-V176 WeakPolarHBondContact O-CB 3.42Å; Y173-V176 WeakPolarHBondContact O-CG2 3.48Å; Y173-V176 PolarHBondContact O-N 3.09Å
174	F	43.9	Very low	44.7	Very low	67 Å²	67	92.7 Å²	92.7	29%	0.294	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-23.5	178.2	-169.6	-102	0	0	0	113	E56 E84 D172 V176 K177	E56-F174 HydrophobicContact CG-CD1 4.49Å; E56-F174 HydrophobicContact CG-CE1 4.41Å; E84-F174 HydrophobicContact CG-CD1 4.45Å; E84-F174 HydrophobicContact CG-CE1 3.89Å; E84-F174 HydrophobicContact CG-CE2 4.21Å; E84-F174 HydrophobicContact CG-CZ 3.75Å; D172-F174 PolarHBondContact O-N 3.02Å; D172-F174 VanDerWaalsContact O-N 3.17Å; F174-V176 PolarHBondContact O-N 2.99Å; F174-V176 VanDerWaalsContact O-N 3.07Å; F174-K177 PolarHBondContact O-N 2.76Å
175	F	48.6	Very low	45.2	Very low	31 Å²	31	84.6 Å²	84.6	14%	0.136	44%	0.437	C	S	.	.	H	α-helix	trans	-47.7	-33.1	170.1	-67	-62.1	0	0	0	114.8	H55 L143 Y173 K177 Q178 A179	H55-F175 HydrophobicContact CB-CE1 3.52Å; H55-F175 HydrophobicContact CB-CE2 4.13Å; H55-F175 HydrophobicContact CB-CZ 3.19Å; H55-F175 AromaticContact CD2-CE2 3.58Å; H55-F175 AromaticContact CD2-CZ 3.36Å; H55-F175 WeakPolarHBondContact CD2-CZ 3.43Å; H55-F175 AromaticContact CG-CZ 3.44Å; H55-F175 VanDerWaalsContact CG-CZ 3.44Å; H55-F175 WeakPolarHBondContact O-CD1 3.47Å; H55-F175 VanDerWaalsContact O-CE1 3.26Å; H55-F175 WeakPolarHBondContact O-CE1 3.25Å; L143-F175 HydrophobicContact CD2-CB 4.11Å; L143-F175 HydrophobicContact CD2-CD1 3.12Å; L143-F175 HydrophobicContact CD2-CD2 4.44Å; L143-F175 HydrophobicContact CD2-CE1 3.32Å; L143-F175 HydrophobicContact CD2-CG 3.7Å; L143-F175 HydrophobicContact CD2-CZ 4.07Å; Y173-F175 AromaticContact CD1-CD2 3.29Å; Y173-F175 HydrophobicContact CD1-CD2 3.29Å; Y173-F175 AromaticContact CD1-CE2 3.5Å; Y173-F175 HydrophobicContact CD1-CE2 3.5Å; Y173-F175 VanDerWaalsContact CD1-CE2 3.5Å; Y173-F175 AromaticContact CE1-CD2 3.84Å; Y173-F175 HydrophobicContact CE1-CD2 3.84Å; Y173-F175 AromaticContact CE1-CE2 3.56Å; Y173-F175 HydrophobicContact CE1-CE2 3.56Å; Y173-F175 AromaticContact CG-CD2 3.82Å; Y173-F175 HydrophobicContact CG-CD2 3.82Å; Y173-F175 HydrophobicContact CG-CE2 4.41Å; Y173-F175 PolarHBondContact O-N 3.34Å; F175-K177 VanDerWaalsContact C-N 3.32Å; F175-K177 PolarHBondContact O-N 3.12Å; F175-Q178 PolarHBondContact O-N 2.99Å; F175-A179 PolarHBondContact O-N 2.79Å
176	V	47.3	Very low	45.4	Very low	39 Å²	39	81.4 Å²	81.4	24%	0.236	43%	0.433	C	S	.	.	H	α-helix	trans	-75.3	-17.9	-172.8	173.8	0	0	0	0	113	P147 Y173 F174	P147-V176 HydrophobicContact CB-CG1 3.2Å; P147-V176 HydrophobicContact CG-CG1 3.22Å; Y173-V176 WeakPolarHBondContact O-CB 3.42Å; Y173-V176 WeakPolarHBondContact O-CG2 3.48Å; Y173-V176 PolarHBondContact O-N 3.09Å; F174-V176 PolarHBondContact O-N 2.99Å; F174-V176 VanDerWaalsContact O-N 3.07Å
177	K	42.8	Very low	45.9	Very low	162 Å²	162	74.5 Å²	74.5	70%	0.704	40%	0.403	S	S	*	.	H	α-helix	trans	-77.4	-35.8	171.7	-81.1	-176.1	179.9	175.9	0	112.4	F174 F175	F174-K177 PolarHBondContact O-N 2.76Å; F175-K177 VanDerWaalsContact C-N 3.32Å; F175-K177 PolarHBondContact O-N 3.12Å
178	Q	48.5	Very low	46.3	Very low	28 Å²	28	73.7 Å²	73.7	13%	0.131	38%	0.384	C	S	.	.	H	α-helix	trans	-75.7	-39.1	-176.7	-74.9	-168.6	77	0	0	111.3	F109 F175 K180	F109-Q178 HydrophobicContact CD1-CB 3.68Å; F109-Q178 HydrophobicContact CD1-CG 3.51Å; F109-Q178 VanDerWaalsContact CE1-C 3.5Å; F109-Q178 HydrophobicContact CE1-CB 3.21Å; F109-Q178 HydrophobicContact CE1-CG 3.64Å; F109-Q178 WeakPolarHBondContact CE1-O 3.42Å; F109-Q178 HydrophobicContact CE2-CB 4.28Å; F109-Q178 HydrophobicContact CG-CB 4.38Å; F109-Q178 HydrophobicContact CG-CG 4.09Å; F109-Q178 HydrophobicContact CZ-CB 3.54Å; F109-Q178 HydrophobicContact CZ-CG 4.29Å; F109-Q178 WeakPolarHBondContact CZ-O 3.32Å; F175-Q178 PolarHBondContact O-N 2.99Å; Q178-K180 VanDerWaalsContact C-N 3.34Å; Q178-K180 PolarHBondContact O-N 3.27Å
179	A	51	Low	46.6	Very low	3 Å²	3	68.1 Å²	68.1	3%	0.025	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-27.9	-178.8	0	0	0	0	0	115.6	L143 F175 S181 I182 L183	L143-A179 WeakPolarHBondContact O-CB 3.23Å; F175-A179 PolarHBondContact O-N 2.79Å; A179-S181 PolarHBondContact O-N 2.91Å; A179-I182 PolarHBondContact O-N 2.91Å; A179-I182 VanDerWaalsContact O-N 3.08Å; A179-L183 WeakPolarHBondContact O-CD1 3.24Å
180	K	46.3	Very low	46.8	Very low	135 Å²	135	62.4 Å²	62.4	59%	0.587	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-30.1	-172.4	-80.1	-175.9	-177.3	-179.6	0	113.8	P147 Q178	P147-K180 HydrophobicContact CG-CD 4.41Å; P147-K180 HydrophobicContact CG-CG 4.29Å; Q178-K180 VanDerWaalsContact C-N 3.34Å; Q178-K180 PolarHBondContact O-N 3.27Å
181	S	48.6	Very low	47.3	Very low	41 Å²	41	61.2 Å²	61.2	29%	0.287	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-39.2	-178.9	179.5	0	0	0	0	112.2	V113 Q117 A179 L183	V113-S181 WeakPolarHBondContact CG1-OG 3.25Å; Q117-S181 PolarHBondContact NE2-O 2.64Å; Q117-S181 PolarHBondContact NE2-OG 3.49Å; A179-S181 PolarHBondContact O-N 2.91Å; S181-L183 PolarHBondContact O-N 3.05Å; S181-L183 VanDerWaalsContact O-N 3.12Å
182	I	53.4	Low	47.8	Very low	2 Å²	2	64.4 Å²	64.4	1%	0.01	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-64.8	-25.8	-175.3	-63	170.1	0	0	0	112.4	F40 F60 V113 F116 F133 L144 A179 K184	F40-I182 HydrophobicContact CZ-CD1 4.03Å; F60-I182 HydrophobicContact CE1-CD1 3.82Å; F60-I182 HydrophobicContact CE1-CG1 4.45Å; F60-I182 HydrophobicContact CZ-CD1 3.69Å; F60-I182 HydrophobicContact CZ-CG1 4.35Å; V113-I182 HydrophobicContact CG1-CG1 3.76Å; V113-I182 HydrophobicContact CG2-CG1 4.29Å; F116-I182 HydrophobicContact CE1-CG2 4.19Å; F133-I182 HydrophobicContact CZ-CG2 4.47Å; L144-I182 HydrophobicContact CD2-CD1 4.2Å; L144-I182 HydrophobicContact CD2-CG2 4.06Å; A179-I182 PolarHBondContact O-N 2.91Å; A179-I182 VanDerWaalsContact O-N 3.08Å; I182-K184 VanDerWaalsContact C-N 3.27Å; I182-K184 PolarHBondContact O-N 3Å
183	L	51.6	Low	48.4	Very low	30 Å²	30	59.2 Å²	59.2	16%	0.157	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-73.7	4.1	-168.8	-72.9	153.6	0	0	0	116.9	Q146 A179 S181 Y185 V187	Q146-L183 HydrophobicContact CB-CD1 4.2Å; Q146-L183 HydrophobicContact CG-CD1 3.2Å; Q146-L183 HydrophobicContact CG-CD2 3.92Å; Q146-L183 HydrophobicContact CG-CG 4.08Å; A179-L183 WeakPolarHBondContact O-CD1 3.24Å; S181-L183 PolarHBondContact O-N 3.05Å; S181-L183 VanDerWaalsContact O-N 3.12Å; L183-Y185 PolarHBondContact O-N 3.18Å; L183-V187 HydrophobicContact CD2-CB 4.25Å; L183-V187 HydrophobicContact CD2-CG2 3.77Å
184	K	52.5	Low	48.6	Very low	136 Å²	136	59.5 Å²	59.5	59%	0.591	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-56.6	-32.8	170.7	-174.3	-173.5	171.3	-152.4	0	111	D125 I182	D125-K184 IonicContact OD2-NZ 2.58Å; D125-K184 PolarHBondContact OD2-NZ 3.42Å; I182-K184 VanDerWaalsContact C-N 3.27Å; I182-K184 PolarHBondContact O-N 3Å
185	Y	50.8	Low	48.9	Very low	28 Å²	28	59.8 Å²	59.8	11%	0.11	32%	0.32	C	S	.	.	S	Bend	trans	-102.9	110.6	174.7	-47.5	-76.8	0	0	0	106.2	L120 V124 F133 L183 V187	L120-Y185 HydrophobicContact CB-CE2 4.46Å; L120-Y185 HydrophobicContact CD2-CD2 3.53Å; L120-Y185 HydrophobicContact CD2-CE2 3.9Å; L120-Y185 HydrophobicContact CD2-CG 3.86Å; L120-Y185 HydrophobicContact CG-CD2 4.42Å; L120-Y185 HydrophobicContact CG-CE2 4.38Å; V124-Y185 HydrophobicContact CG2-CD1 3.88Å; V124-Y185 HydrophobicContact CG2-CE1 3.43Å; V124-Y185 VanDerWaalsContact CG2-CE1 3.43Å; F133-Y185 WeakPolarHBondContact CE2-O 3.44Å; L183-Y185 PolarHBondContact O-N 3.18Å; Y185-V187 PolarHBondContact O-N 3.41Å; Y185-V187 VanDerWaalsContact O-N 3.13Å
186	G	46.1	Very low	49.1	Very low	51 Å²	51	64.1 Å²	64.1	53%	0.526	34%	0.341	S	S	.	.			trans	-51.7	123.6	-172.5	0	0	0	0	0	112.4	V188	G186-V188 PolarHBondContact O-N 3.22Å
187	V	47.1	Very low	49.4	Very low	37 Å²	37	70.8 Å²	70.8	22%	0.224	36%	0.362	C	S	.	.			trans	-74.7	111.8	172.4	177	0	0	0	0	107.5	F133 L144 L183 Y185	F133-V187 HydrophobicContact CB-CG1 4.42Å; F133-V187 HydrophobicContact CD2-CB 4.32Å; F133-V187 HydrophobicContact CD2-CG2 3.67Å; F133-V187 HydrophobicContact CE2-CG2 4.22Å; F133-V187 HydrophobicContact CG-CG2 4.42Å; L144-V187 HydrophobicContact CB-CG1 3.94Å; L144-V187 HydrophobicContact CB-CG2 4.17Å; L144-V187 HydrophobicContact CD1-CG1 4.27Å; L183-V187 HydrophobicContact CD2-CB 4.25Å; L183-V187 HydrophobicContact CD2-CG2 3.77Å; Y185-V187 PolarHBondContact O-N 3.41Å; Y185-V187 VanDerWaalsContact O-N 3.13Å
188	V	45.2	Very low	49.6	Very low	56 Å²	56	65.6 Å²	65.6	34%	0.339	35%	0.346	S	S	.	.			trans	-105.1	110.9	167.5	-171.8	0	0	0	0	107.4	Y32 G186 V190	Y32-V188 HydrophobicContact CE1-CB 4.47Å; Y32-V188 HydrophobicContact CE1-CG2 4.16Å; Y32-V188 WeakPolarHBondContact OH-CB 3.44Å; Y32-V188 VanDerWaalsContact OH-CG1 3.23Å; Y32-V188 WeakPolarHBondContact OH-CG1 3.27Å; Y32-V188 WeakPolarHBondContact OH-CG2 3.27Å; G186-V188 PolarHBondContact O-N 3.22Å; V188-V190 PolarHBondContact O-N 2.86Å
189	P	44.8	Very low	49.5	Very low	51 Å²	51	71.3 Å²	71.3	33%	0.331	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-60.7	128.8	174.4	23.9	-30.1	0	0	0	108.9	R141	R141-P189 VanDerWaalsContact CZ-CG 3.48Å
190	V	45.4	Very low	48.9	Very low	39 Å²	39	81 Å²	81	24%	0.236	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-83.8	120.1	174	-178	0	0	0	0	107.2	A132 V134 V188 D194 I195	A132-V190 HydrophobicContact CB-CG2 4.3Å; V134-V190 HydrophobicContact CG2-CG2 3.93Å; V188-V190 PolarHBondContact O-N 2.86Å; V190-D194 HydrophobicContact CG1-CB 3.63Å; V190-I195 HydrophobicContact CG1-CG1 3.77Å
191	S	51.5	Low	49	Very low	46 Å²	46	78.3 Å²	78.3	32%	0.322	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-76.4	158.2	175.4	67.5	0	0	0	0	111	S193 D194 I195	S191-S193 PolarHBondContact O-N 2.96Å; S191-S193 VanDerWaalsContact O-N 3.16Å; S191-S193 PolarHBondContact OG-OG 3.14Å; S191-D194 WeakPolarHBondContact CB-OD2 3.23Å; S191-D194 PolarHBondContact N-OD2 3.09Å; S191-D194 WeakPolarHBondContact O-CA 3.48Å; S191-D194 WeakPolarHBondContact O-CB 3.45Å; S191-D194 PolarHBondContact O-N 3.32Å; S191-D194 PolarHBondContact OG-N 2.93Å; S191-D194 VanDerWaalsContact OG-N 3.16Å; S191-D194 PolarHBondContact OG-OD2 3.22Å; S191-I195 PolarHBondContact O-N 3.23Å; S191-I195 VanDerWaalsContact O-N 3.08Å
192	E	50.8	Low	49.1	Very low	163 Å²	163	80.3 Å²	80.3	76%	0.762	41%	0.413	S	S	*	.	H	α-helix	trans	-51.4	-38.5	169.5	-68.7	-171.1	153.5	0	0	111.6	D194 I195 E196	E192-D194 VanDerWaalsContact C-N 3.29Å; E192-D194 PolarHBondContact O-N 2.85Å; E192-I195 CarbonylContact O-C 3.6Å; E192-I195 WeakPolarHBondContact O-CB 3.47Å; E192-I195 PolarHBondContact O-N 3.31Å; E192-I195 VanDerWaalsContact O-N 3.13Å; E192-E196 WeakPolarHBondContact O-CG 3.24Å; E192-E196 PolarHBondContact O-N 3.48Å
193	S	52	Low	48.8	Very low	49 Å²	49	84.6 Å²	84.6	34%	0.343	44%	0.435	S	S	.	.	H	α-helix	trans	-64.6	-31.1	177.1	83.8	0	0	0	0	113.3	S191 R197	S191-S193 PolarHBondContact O-N 2.96Å; S191-S193 VanDerWaalsContact O-N 3.16Å; S191-S193 PolarHBondContact OG-OG 3.14Å; S193-R197 VanDerWaalsContact O-CG 3.24Å; S193-R197 WeakPolarHBondContact O-CG 3.3Å; S193-R197 PolarHBondContact O-N 3.02Å; S193-R197 VanDerWaalsContact O-N 3.07Å
194	D	51.6	Low	48.6	Very low	56 Å²	56	87.8 Å²	87.8	30%	0.299	45%	0.451	S	S	.	.	H	α-helix	trans	-72	-38.7	174	-63.3	-51.1	0	0	0	110.4	V190 S191 E192 S198	V190-D194 HydrophobicContact CG1-CB 3.63Å; S191-D194 WeakPolarHBondContact CB-OD2 3.23Å; S191-D194 PolarHBondContact N-OD2 3.09Å; S191-D194 WeakPolarHBondContact O-CA 3.48Å; S191-D194 WeakPolarHBondContact O-CB 3.45Å; S191-D194 PolarHBondContact O-N 3.32Å; S191-D194 PolarHBondContact OG-N 2.93Å; S191-D194 VanDerWaalsContact OG-N 3.16Å; S191-D194 PolarHBondContact OG-OD2 3.22Å; E192-D194 VanDerWaalsContact C-N 3.29Å; E192-D194 PolarHBondContact O-N 2.85Å; D194-S198 PolarHBondContact O-N 2.95Å
195	I	51.2	Low	48.4	Very low	72 Å²	72	84.8 Å²	84.8	37%	0.369	44%	0.442	S	S	.	.	H	α-helix	trans	-62.6	-48.3	173.7	-60.6	174.6	0	0	0	109.9	V190 S191 E192 R197 S198 K199	V190-I195 HydrophobicContact CG1-CG1 3.77Å; S191-I195 PolarHBondContact O-N 3.23Å; S191-I195 VanDerWaalsContact O-N 3.08Å; E192-I195 CarbonylContact O-C 3.6Å; E192-I195 WeakPolarHBondContact O-CB 3.47Å; E192-I195 PolarHBondContact O-N 3.31Å; E192-I195 VanDerWaalsContact O-N 3.13Å; I195-R197 PolarHBondContact O-N 3.26Å; I195-S198 WeakPolarHBondContact O-CB 3.36Å; I195-S198 PolarHBondContact O-N 3.33Å; I195-S198 VanDerWaalsContact O-N 3.09Å; I195-S198 PolarHBondContact O-OG 3.17Å; I195-K199 PolarHBondContact O-N 2.78Å
196	E	52.2	Low	48.2	Very low	122 Å²	122	88.6 Å²	88.6	57%	0.57	47%	0.465	S	S	*	.	H	α-helix	trans	-60.2	-44.3	178.6	-74.4	-169.5	153	0	0	112.7	E192 S198 K199	E192-E196 WeakPolarHBondContact O-CG 3.24Å; E192-E196 PolarHBondContact O-N 3.48Å; E196-S198 PolarHBondContact O-N 3.35Å; E196-K199 WeakPolarHBondContact O-CB 3.37Å; E196-K199 PolarHBondContact O-N 2.94Å
197	R	54.1	Low	48.4	Very low	180 Å²	180	91.3 Å²	91.3	68%	0.679	46%	0.46	S	S	*	.	H	α-helix	trans	-59.9	-30.7	175.2	-73.8	175.7	-150	-146.5	7.5	112.6	S193 I195 K199	S193-R197 VanDerWaalsContact O-CG 3.24Å; S193-R197 WeakPolarHBondContact O-CG 3.3Å; S193-R197 PolarHBondContact O-N 3.02Å; S193-R197 VanDerWaalsContact O-N 3.07Å; I195-R197 PolarHBondContact O-N 3.26Å; R197-K199 VanDerWaalsContact C-N 3.3Å; R197-K199 PolarHBondContact O-N 3.17Å
198	S	48	Very low	48.5	Very low	53 Å²	53	95.5 Å²	95.5	37%	0.371	48%	0.478	S	S	.	.	H	α-helix	trans	-75.1	-17.3	177.9	83.8	0	0	0	0	113.9	R70 D194 I195 E196 H200	R70-S198 PolarHBondContact NH2-O 2.76Å; D194-S198 PolarHBondContact O-N 2.95Å; I195-S198 WeakPolarHBondContact O-CB 3.36Å; I195-S198 PolarHBondContact O-N 3.33Å; I195-S198 VanDerWaalsContact O-N 3.09Å; I195-S198 PolarHBondContact O-OG 3.17Å; E196-S198 PolarHBondContact O-N 3.35Å; S198-H200 VanDerWaalsContact C-N 3.33Å
199	K	45.6	Very low	48.8	Very low	147 Å²	147	98.8 Å²	98.8	64%	0.639	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.4	-180	-69.5	174.9	-180	168.6	0	113.1	I195 E196 R197	I195-K199 PolarHBondContact O-N 2.78Å; E196-K199 WeakPolarHBondContact O-CB 3.37Å; E196-K199 PolarHBondContact O-N 2.94Å; R197-K199 VanDerWaalsContact C-N 3.3Å; R197-K199 PolarHBondContact O-N 3.17Å
200	H	38.2	Very low	49.1	Very low	207 Å²	207	103.1 Å²	103.1	96%	0.958	50%	0.504	S	S	*	.			trans	-102.1	0	179.5	-66.2	-56.2	0	0	0	113.3	S198	S198-H200 VanDerWaalsContact C-N 3.33Å

Retrieved 200 of 200 residues in 123.8 ms (Link to these results)

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