A0A077Z4H3_TRITR Loading...

Phosphodiest domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z4H3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 392 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	37.7	Very low	61.4	Low	233 Å²	233	137.1 Å²	137.1	100%	1.148	75%	0.751	S	S	*	*				0	111.6	0	-75.9	167.5	168	0	0	107.5
2	T	46.9	Very low	63	Low	136 Å²	136	132.6 Å²	132.6	83%	0.834	72%	0.724	S	S	*	*			trans	-124.1	98.6	163.3	41.1	0	0	0	0	106	R4	T2-R4 PolarHBondContact O-N 2.66Å
3	D	49.7	Very low	64.4	Low	155 Å²	155	132.8 Å²	132.8	83%	0.829	71%	0.714	S	S	*	*			trans	-57.3	105.3	175.9	-71	-40	0	0	0	109	P5	D3-P5 WeakPolarHBondContact O-CD 3.34Å
4	R	53.7	Low	65.8	Low	235 Å²	235	128.7 Å²	128.7	89%	0.887	70%	0.696	S	S	*	*			trans	-78.7	117.9	163.3	-80.2	-170.4	-178.2	-174	2	107	T2 C6	T2-R4 PolarHBondContact O-N 2.66Å; R4-C6 PolarHBondContact O-N 3.15Å; R4-C6 VanDerWaalsContact O-N 3.14Å
5	P	56.9	Low	66.9	Low	121 Å²	121	123.3 Å²	123.3	79%	0.786	68%	0.675	S	S	*	*			trans	-64.5	120.2	-178	24	-29.7	0	0	0	108.9	D3 A7	D3-P5 WeakPolarHBondContact O-CD 3.34Å; P5-A7 PolarHBondContact O-N 3.44Å
6	C	59.8	Low	68.1	Low	125 Å²	125	123.2 Å²	123.2	85%	0.845	67%	0.669	S	S	*	*			trans	-56.1	103	169.2	-109	0	0	0	0	108	R4 T8	R4-C6 PolarHBondContact O-N 3.15Å; R4-C6 VanDerWaalsContact O-N 3.14Å; C6-T8 PolarHBondContact O-N 2.94Å
7	A	63.5	Low	69	Low	63 Å²	63	123.7 Å²	123.7	52%	0.521	66%	0.663	S	S	.	*			trans	-53.9	118.7	167.4	0	0	0	0	0	107.3	P5 R9 I12	P5-A7 PolarHBondContact O-N 3.44Å; A7-R9 PolarHBondContact O-N 3.22Å; A7-I12 HydrophobicContact CB-CD1 4.35Å; A7-I12 HydrophobicContact CB-CG1 4.03Å
8	T	72.2	Confident	69.9	Low	98 Å²	98	123.2 Å²	123.2	60%	0.601	66%	0.656	S	S	*	*			trans	-58.1	142.3	-179.4	44.4	0	0	0	0	108.9	C6 A10 A11 I12	C6-T8 PolarHBondContact O-N 2.94Å; T8-A10 PolarHBondContact O-N 3.13Å; T8-A11 WeakPolarHBondContact O-CA 3.42Å; T8-A11 WeakPolarHBondContact O-CB 3.47Å; T8-A11 PolarHBondContact O-N 3.41Å; T8-I12 PolarHBondContact O-N 3.28Å
9	R	76.5	Confident	70.7	Confident	227 Å²	227	121.2 Å²	121.2	86%	0.857	65%	0.649	S	S	*	*	H	α-helix	trans	-48.6	-32.8	-178.3	-166.9	176.1	-178.8	-176.5	0.4	112.9	A7 F13	A7-R9 PolarHBondContact O-N 3.22Å; R9-F13 WeakPolarHBondContact O-CB 3.28Å; R9-F13 PolarHBondContact O-N 3.34Å; R9-F13 VanDerWaalsContact O-N 3.08Å
10	A	77.4	Confident	71.3	Confident	67 Å²	67	119.9 Å²	119.9	55%	0.554	64%	0.641	S	S	*	*	H	α-helix	trans	-64.7	-41	173.9	0	0	0	0	0	113.7	T8 F13 T14	T8-A10 PolarHBondContact O-N 3.13Å; A10-F13 PolarHBondContact O-N 3.47Å; A10-T14 WeakPolarHBondContact O-CB 3.17Å; A10-T14 PolarHBondContact O-N 3.4Å; A10-T14 PolarHBondContact O-OG1 3.38Å
11	A	80.8	Confident	71.9	Confident	48 Å²	48	117.7 Å²	117.7	40%	0.397	63%	0.63	S	S	.	*	H	α-helix	trans	-66.4	-41.6	177.3	0	0	0	0	0	111.5	T8 T14 A15	T8-A11 WeakPolarHBondContact O-CA 3.42Å; T8-A11 WeakPolarHBondContact O-CB 3.47Å; T8-A11 PolarHBondContact O-N 3.41Å; A11-T14 PolarHBondContact O-N 3.27Å; A11-A15 WeakPolarHBondContact O-CB 3.34Å; A11-A15 PolarHBondContact O-N 3.17Å
12	I	80.6	Confident	74.1	Confident	83 Å²	83	116.1 Å²	116.1	43%	0.426	61%	0.611	S	S	.	*	H	α-helix	trans	-61.3	-47.2	175.3	-61.3	174.3	0	0	0	110.3	A7 T8 T14 A15 Q16	A7-I12 HydrophobicContact CB-CD1 4.35Å; A7-I12 HydrophobicContact CB-CG1 4.03Å; T8-I12 PolarHBondContact O-N 3.28Å; I12-T14 VanDerWaalsContact C-N 3.34Å; I12-T14 PolarHBondContact O-N 2.81Å; I12-A15 PolarHBondContact O-N 2.86Å; I12-Q16 HydrophobicContact CG2-CG 4.47Å; I12-Q16 WeakPolarHBondContact O-CB 3.49Å; I12-Q16 WeakPolarHBondContact O-CG 3.29Å; I12-Q16 PolarHBondContact O-N 3.41Å
13	F	80.9	Confident	75.8	Confident	136 Å²	136	113 Å²	113	60%	0.596	59%	0.592	S	S	*	*	H	α-helix	trans	-63.6	-40.3	-180	-169.2	-99.4	0	0	0	112.4	R9 A10 Q16 K17	R9-F13 WeakPolarHBondContact O-CB 3.28Å; R9-F13 PolarHBondContact O-N 3.34Å; R9-F13 VanDerWaalsContact O-N 3.08Å; A10-F13 PolarHBondContact O-N 3.47Å; F13-Q16 PolarHBondContact O-N 3.09Å; F13-K17 WeakPolarHBondContact O-CB 3.43Å; F13-K17 PolarHBondContact O-N 3.47Å
14	T	84.2	Confident	77.4	Confident	75 Å²	75	109.5 Å²	109.5	46%	0.46	57%	0.569	S	S	.	*	H	α-helix	trans	-64.7	-46.4	177.2	-51.9	0	0	0	0	110.8	A10 A11 I12 Q16 K17 E18	A10-T14 WeakPolarHBondContact O-CB 3.17Å; A10-T14 PolarHBondContact O-N 3.4Å; A10-T14 PolarHBondContact O-OG1 3.38Å; A11-T14 PolarHBondContact O-N 3.27Å; I12-T14 VanDerWaalsContact C-N 3.34Å; I12-T14 PolarHBondContact O-N 2.81Å; T14-Q16 PolarHBondContact O-N 3.29Å; T14-K17 PolarHBondContact O-N 2.9Å; T14-E18 PolarHBondContact O-N 3.4Å
15	A	83.1	Confident	79	Confident	47 Å²	47	105.2 Å²	105.2	39%	0.388	56%	0.559	S	S	.	*	H	α-helix	trans	-62.2	-39.2	176.7	0	0	0	0	0	112.7	A11 I12 E18 T19	A11-A15 WeakPolarHBondContact O-CB 3.34Å; A11-A15 PolarHBondContact O-N 3.17Å; I12-A15 PolarHBondContact O-N 2.86Å; A15-E18 PolarHBondContact O-N 3.34Å; A15-T19 WeakPolarHBondContact O-CB 3.49Å; A15-T19 PolarHBondContact O-N 2.92Å; A15-T19 PolarHBondContact O-OG1 3.3Å
16	Q	85.1	Confident	80.5	Confident	122 Å²	122	100.8 Å²	100.8	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-63.3	-42.6	174.2	-76.4	178.6	-36.2	0	0	111.8	I12 F13 T14 T19 L20	I12-Q16 HydrophobicContact CG2-CG 4.47Å; I12-Q16 WeakPolarHBondContact O-CB 3.49Å; I12-Q16 WeakPolarHBondContact O-CG 3.29Å; I12-Q16 PolarHBondContact O-N 3.41Å; F13-Q16 PolarHBondContact O-N 3.09Å; T14-Q16 PolarHBondContact O-N 3.29Å; Q16-T19 PolarHBondContact O-N 3.08Å; Q16-L20 WeakPolarHBondContact O-CB 3.36Å; Q16-L20 PolarHBondContact O-N 3.09Å
17	K	84.5	Confident	81.9	Confident	132 Å²	132	99.1 Å²	99.1	57%	0.574	52%	0.518	S	S	*	.	H	α-helix	trans	-66	-40.8	178.4	-166.4	175.3	-178.1	-179.5	0	111.8	F13 T14 N21	F13-K17 WeakPolarHBondContact O-CB 3.43Å; F13-K17 PolarHBondContact O-N 3.47Å; T14-K17 PolarHBondContact O-N 2.9Å; K17-N21 WeakPolarHBondContact O-CB 3.41Å; K17-N21 VanDerWaalsContact O-CG 3.32Å; K17-N21 PolarHBondContact O-N 3.33Å
18	E	85.1	Confident	83.2	Confident	114 Å²	114	101.2 Å²	101.2	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-64.6	-44.1	174.4	-74.8	-178.9	178.9	0	0	112.2	T14 A15 N21 R22	T14-E18 PolarHBondContact O-N 3.4Å; A15-E18 PolarHBondContact O-N 3.34Å; E18-N21 PolarHBondContact O-N 2.92Å; E18-R22 PolarHBondContact O-N 3.46Å
19	T	84.2	Confident	84.1	Confident	86 Å²	86	99.1 Å²	99.1	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-62.3	-46.6	177.2	-55.5	0	0	0	0	110.7	A15 Q16 N21 R22 V23	A15-T19 WeakPolarHBondContact O-CB 3.49Å; A15-T19 PolarHBondContact O-N 2.92Å; A15-T19 PolarHBondContact O-OG1 3.3Å; Q16-T19 PolarHBondContact O-N 3.08Å; T19-N21 VanDerWaalsContact C-N 3.3Å; T19-N21 PolarHBondContact O-N 3.12Å; T19-R22 PolarHBondContact O-N 3.14Å; T19-V23 WeakPolarHBondContact O-CG2 3.4Å; T19-V23 PolarHBondContact O-N 3.44Å
20	L	82.6	Confident	84.8	Confident	94 Å²	94	91.3 Å²	91.3	49%	0.492	49%	0.485	S	S	.	.	H	α-helix	trans	-61.2	-40	175.9	-176.3	65.6	0	0	0	111.7	Q16 V23 K24	Q16-L20 WeakPolarHBondContact O-CB 3.36Å; Q16-L20 PolarHBondContact O-N 3.09Å; L20-V23 PolarHBondContact O-N 3.13Å; L20-K24 HydrophobicContact CG-CD 4.38Å; L20-K24 WeakPolarHBondContact O-CB 3.42Å; L20-K24 VanDerWaalsContact O-CG 3.29Å; L20-K24 WeakPolarHBondContact O-CG 2.99Å; L20-K24 PolarHBondContact O-N 3.49Å
21	N	84.6	Confident	85.6	Confident	75 Å²	75	96 Å²	96	40%	0.401	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-42.6	175.4	-80.5	-11.5	0	0	0	111.7	K17 E18 T19 V23 K24 H25	K17-N21 WeakPolarHBondContact O-CB 3.41Å; K17-N21 VanDerWaalsContact O-CG 3.32Å; K17-N21 PolarHBondContact O-N 3.33Å; E18-N21 PolarHBondContact O-N 2.92Å; T19-N21 VanDerWaalsContact C-N 3.3Å; T19-N21 PolarHBondContact O-N 3.12Å; N21-V23 PolarHBondContact O-N 3.24Å; N21-K24 PolarHBondContact O-N 3.2Å; N21-H25 PolarHBondContact O-N 2.98Å; N21-H25 VanDerWaalsContact O-N 3.17Å; N21-H25 PolarHBondContact O-ND1 3.26Å
22	R	84	Confident	86.2	Confident	200 Å²	200	99.8 Å²	99.8	76%	0.755	50%	0.497	S	S	*	.	H	α-helix	trans	-60.7	-43.7	174.1	-75.6	-169.3	-170.6	-158.3	4.4	112.1	E18 T19 H25 S26	E18-R22 PolarHBondContact O-N 3.46Å; T19-R22 PolarHBondContact O-N 3.14Å; R22-H25 CarbonylContact O-C 3.53Å; R22-H25 PolarHBondContact O-N 3.43Å; R22-S26 PolarHBondContact O-N 3.48Å
23	V	82.9	Confident	86.8	Confident	70 Å²	70	102 Å²	102	42%	0.424	50%	0.5	S	S	.	.	H	α-helix	trans	-62.5	-43.7	175.7	174.1	0	0	0	0	110.6	T19 L20 N21 H25 S26 F29	T19-V23 WeakPolarHBondContact O-CG2 3.4Å; T19-V23 PolarHBondContact O-N 3.44Å; L20-V23 PolarHBondContact O-N 3.13Å; N21-V23 PolarHBondContact O-N 3.24Å; V23-H25 PolarHBondContact O-N 2.02Å; V23-H25 VanDerWaalsContact O-N 3.14Å; V23-S26 WeakPolarHBondContact O-CB 2.93Å; V23-S26 PolarHBondContact O-N 2.95Å; V23-S26 PolarHBondContact O-OG 2.86Å; V23-S26 VanDerWaalsContact O-OG 3.13Å; V23-F29 HydrophobicContact CG1-CD2 4.44Å; V23-F29 WeakPolarHBondContact O-CB 3.49Å
24	K	83.3	Confident	87.4	Confident	82 Å²	82	99.4 Å²	99.4	36%	0.357	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-25.3	177.9	-78.6	175.7	178.8	177.9	0	114.1	L20 N21 F29	L20-K24 HydrophobicContact CG-CD 4.38Å; L20-K24 WeakPolarHBondContact O-CB 3.42Å; L20-K24 VanDerWaalsContact O-CG 3.29Å; L20-K24 WeakPolarHBondContact O-CG 2.99Å; L20-K24 PolarHBondContact O-N 3.49Å; N21-K24 PolarHBondContact O-N 3.2Å; K24-F29 VanDerWaalsContact CA-CD1 3.43Å; K24-F29 HydrophobicContact CB-CD1 4.33Å; K24-F29 HydrophobicContact CB-CE1 4.08Å; K24-F29 HydrophobicContact CG-CD1 4.47Å; K24-F29 HydrophobicContact CG-CE1 3.8Å; K24-F29 HydrophobicContact CG-CZ 4.27Å; K24-F29 VanDerWaalsContact O-CD1 3.31Å; K24-F29 WeakPolarHBondContact O-CD1 3.12Å
25	H	86.1	Confident	87.9	Confident	144 Å²	144	98.5 Å²	98.5	67%	0.667	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	3.4	180	-62.6	66.5	0	0	0	112.2	N21 R22 V23	N21-H25 PolarHBondContact O-N 2.98Å; N21-H25 VanDerWaalsContact O-N 3.17Å; N21-H25 PolarHBondContact O-ND1 3.26Å; R22-H25 CarbonylContact O-C 3.53Å; R22-H25 PolarHBondContact O-N 3.43Å; V23-H25 PolarHBondContact O-N 2.02Å; V23-H25 VanDerWaalsContact O-N 3.14Å
26	S	88.7	Confident	88.5	Confident	29 Å²	29	98.5 Å²	98.5	20%	0.203	49%	0.488	C	S	.	.	S	Bend	trans	-65.7	142	174.7	81.3	0	0	0	0	108.9	R22 V23 T28 F29 V30	R22-S26 PolarHBondContact O-N 3.48Å; V23-S26 WeakPolarHBondContact O-CB 2.93Å; V23-S26 PolarHBondContact O-N 2.95Å; V23-S26 PolarHBondContact O-OG 2.86Å; V23-S26 VanDerWaalsContact O-OG 3.13Å; S26-T28 PolarHBondContact O-N 3.15Å; S26-T28 PolarHBondContact OG-OG1 3.41Å; S26-F29 PolarHBondContact O-N 3.33Å; S26-F29 WeakPolarHBondContact OG-CB 3.39Å; S26-F29 PolarHBondContact OG-N 3.22Å; S26-V30 WeakPolarHBondContact O-CG2 3.44Å; S26-V30 PolarHBondContact O-N 3.45Å
27	P	90.7	Very high	89.1	Confident	89 Å²	89	98.1 Å²	98.1	58%	0.578	49%	0.489	S	S	*	.	H	α-helix	trans	-51.7	-42.8	178	-27.8	34.1	0	0	0	112	F29 V30 Y31	P27-F29 PolarHBondContact O-N 2.84Å; P27-V30 PolarHBondContact O-N 2.54Å; P27-Y31 VanDerWaalsContact C-CD2 3.48Å; P27-Y31 HydrophobicContact CB-CD2 4.38Å; P27-Y31 HydrophobicContact CB-CE2 3.99Å; P27-Y31 WeakPolarHBondContact O-CD2 3.38Å; P27-Y31 PolarHBondContact O-N 3.05Å
28	T	90.5	Very high	89.6	Confident	107 Å²	107	97.1 Å²	97.1	66%	0.656	49%	0.489	S	S	*	.	H	α-helix	trans	-57.5	-44.7	177	41.3	0	0	0	0	113.7	S26 Y31 F32	S26-T28 PolarHBondContact O-N 3.15Å; S26-T28 PolarHBondContact OG-OG1 3.41Å; T28-Y31 PolarHBondContact O-N 2.98Å; T28-F32 WeakPolarHBondContact O-CB 3.25Å; T28-F32 PolarHBondContact O-N 2.88Å
29	F	90.8	Very high	90.1	Very high	54 Å²	54	95 Å²	95	24%	0.237	49%	0.487	C	S	.	.	H	α-helix	trans	-73.7	-33.8	179.6	-172.6	-98	0	0	0	112.1	V23 K24 S26 P27 F32 R33	V23-F29 HydrophobicContact CG1-CD2 4.44Å; V23-F29 WeakPolarHBondContact O-CB 3.49Å; K24-F29 VanDerWaalsContact CA-CD1 3.43Å; K24-F29 HydrophobicContact CB-CD1 4.33Å; K24-F29 HydrophobicContact CB-CE1 4.08Å; K24-F29 HydrophobicContact CG-CD1 4.47Å; K24-F29 HydrophobicContact CG-CE1 3.8Å; K24-F29 HydrophobicContact CG-CZ 4.27Å; K24-F29 VanDerWaalsContact O-CD1 3.31Å; K24-F29 WeakPolarHBondContact O-CD1 3.12Å; S26-F29 PolarHBondContact O-N 3.33Å; S26-F29 WeakPolarHBondContact OG-CB 3.39Å; S26-F29 PolarHBondContact OG-N 3.22Å; P27-F29 PolarHBondContact O-N 2.84Å; F29-F32 PolarHBondContact O-N 3.4Å; F29-R33 HydrophobicContact CD1-CG 4.28Å; F29-R33 HydrophobicContact CE1-CG 4.09Å; F29-R33 WeakPolarHBondContact O-CG 3.18Å; F29-R33 PolarHBondContact O-N 3.09Å
30	V	91.3	Very high	90.6	Very high	63 Å²	63	95.7 Å²	95.7	38%	0.382	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-47.2	171.4	174.6	0	0	0	0	110.3	S26 P27 F32 R33 I34	S26-V30 WeakPolarHBondContact O-CG2 3.44Å; S26-V30 PolarHBondContact O-N 3.45Å; P27-V30 PolarHBondContact O-N 2.54Å; V30-F32 PolarHBondContact O-N 3.43Å; V30-R33 PolarHBondContact O-N 3.31Å; V30-I34 HydrophobicContact CG1-CD1 3.88Å; V30-I34 WeakPolarHBondContact O-CG1 3.19Å; V30-I34 PolarHBondContact O-N 3.4Å
31	Y	93.5	Very high	91.1	Very high	166 Å²	166	93.6 Å²	93.6	65%	0.651	48%	0.482	S	S	*	.	H	α-helix	trans	-61.3	-42	175.2	-69.8	-57.2	0	0	0	112.5	P27 T28 R33 I34 A35	P27-Y31 VanDerWaalsContact C-CD2 3.48Å; P27-Y31 HydrophobicContact CB-CD2 4.38Å; P27-Y31 HydrophobicContact CB-CE2 3.99Å; P27-Y31 WeakPolarHBondContact O-CD2 3.38Å; P27-Y31 PolarHBondContact O-N 3.05Å; T28-Y31 PolarHBondContact O-N 2.98Å; Y31-R33 PolarHBondContact O-N 2.87Å; Y31-I34 PolarHBondContact O-N 3.07Å; Y31-A35 WeakPolarHBondContact O-CB 3.33Å; Y31-A35 PolarHBondContact O-N 3.16Å
32	F	93.3	Very high	91.5	Very high	128 Å²	128	93.4 Å²	93.4	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-59.4	-45.5	174.4	177.5	-101.5	0	0	0	111.8	T28 F29 V30 I34 A35 C36	T28-F32 WeakPolarHBondContact O-CB 3.25Å; T28-F32 PolarHBondContact O-N 2.88Å; F29-F32 PolarHBondContact O-N 3.4Å; V30-F32 PolarHBondContact O-N 3.43Å; F32-I34 PolarHBondContact O-N 3.48Å; F32-A35 PolarHBondContact O-N 2.86Å; F32-C36 PolarHBondContact O-N 3.35Å; F32-C36 PolarHBondContact O-SG 3.14Å; F32-C36 VanDerWaalsContact O-SG 3.33Å
33	R	92.7	Very high	91.8	Very high	130 Å²	130	89.6 Å²	89.6	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-43.9	175.3	-78.5	-168.9	174.9	-148	-0.3	112.5	F29 V30 Y31 A35 C36 I37	F29-R33 HydrophobicContact CD1-CG 4.28Å; F29-R33 HydrophobicContact CE1-CG 4.09Å; F29-R33 WeakPolarHBondContact O-CG 3.18Å; F29-R33 PolarHBondContact O-N 3.09Å; V30-R33 PolarHBondContact O-N 3.31Å; Y31-R33 PolarHBondContact O-N 2.87Å; R33-A35 VanDerWaalsContact C-N 3.33Å; R33-C36 PolarHBondContact O-N 3.48Å; R33-I37 WeakPolarHBondContact O-CB 3.2Å; R33-I37 VanDerWaalsContact O-CG1 3.24Å; R33-I37 WeakPolarHBondContact O-CG1 3.39Å; R33-I37 PolarHBondContact O-N 3.45Å
34	I	94.9	Very high	92	Very high	81 Å²	81	91.7 Å²	91.7	42%	0.415	49%	0.487	S	S	.	.	H	α-helix	trans	-60.9	-45.8	176.7	-68.1	166.6	0	0	0	109.7	V30 Y31 F32 C36 I37 L38	V30-I34 HydrophobicContact CG1-CD1 3.88Å; V30-I34 WeakPolarHBondContact O-CG1 3.19Å; V30-I34 PolarHBondContact O-N 3.4Å; Y31-I34 PolarHBondContact O-N 3.07Å; F32-I34 PolarHBondContact O-N 3.48Å; I34-C36 PolarHBondContact O-N 3.37Å; I34-I37 PolarHBondContact O-N 3.29Å; I34-L38 HydrophobicContact CG2-CD1 3.83Å; I34-L38 HydrophobicContact CG2-CG 4.23Å; I34-L38 WeakPolarHBondContact O-CB 3.37Å; I34-L38 VanDerWaalsContact O-CG 3.3Å; I34-L38 WeakPolarHBondContact O-CG 3.34Å; I34-L38 PolarHBondContact O-N 2.92Å
35	A	94.8	Very high	92.2	Very high	55 Å²	55	96.5 Å²	96.5	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-60.9	-42.4	176.9	0	0	0	0	0	112.3	Y31 F32 R33 L38 S39	Y31-A35 WeakPolarHBondContact O-CB 3.33Å; Y31-A35 PolarHBondContact O-N 3.16Å; F32-A35 PolarHBondContact O-N 2.86Å; R33-A35 VanDerWaalsContact C-N 3.33Å; A35-L38 PolarHBondContact O-N 3.4Å; A35-S39 VanDerWaalsContact O-CB 3.3Å; A35-S39 WeakPolarHBondContact O-CB 3.48Å; A35-S39 PolarHBondContact O-N 2.8Å
36	C	96	Very high	92.1	Very high	48 Å²	48	95.2 Å²	95.2	32%	0.324	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-45.4	173.6	-69.2	0	0	0	0	112	F32 R33 I34 S39 I40	F32-C36 PolarHBondContact O-N 3.35Å; F32-C36 PolarHBondContact O-SG 3.14Å; F32-C36 VanDerWaalsContact O-SG 3.33Å; R33-C36 PolarHBondContact O-N 3.48Å; I34-C36 PolarHBondContact O-N 3.37Å; C36-S39 PolarHBondContact O-N 3.33Å; C36-I40 WeakPolarHBondContact O-CB 3.38Å; C36-I40 VanDerWaalsContact O-CG1 3.24Å; C36-I40 WeakPolarHBondContact O-CG1 3.5Å; C36-I40 PolarHBondContact O-N 3.44Å
37	I	96.1	Very high	91.5	Very high	113 Å²	113	96.7 Å²	96.7	58%	0.579	50%	0.504	S	S	*	.	H	α-helix	trans	-62.9	-43.9	178.3	-69	165.4	0	0	0	110.7	R33 I34 I40 A41	R33-I37 WeakPolarHBondContact O-CB 3.2Å; R33-I37 VanDerWaalsContact O-CG1 3.24Å; R33-I37 WeakPolarHBondContact O-CG1 3.39Å; R33-I37 PolarHBondContact O-N 3.45Å; I34-I37 PolarHBondContact O-N 3.29Å; I37-I40 PolarHBondContact O-N 3.42Å; I37-A41 VanDerWaalsContact O-CB 3.26Å; I37-A41 WeakPolarHBondContact O-CB 3.44Å; I37-A41 PolarHBondContact O-N 3.46Å
38	L	96	Very high	90.7	Very high	112 Å²	112	95.5 Å²	95.5	59%	0.586	50%	0.498	S	S	*	.	H	α-helix	trans	-65.2	-39.8	177.1	-71	174.8	0	0	0	111.9	I34 A35 A41 S42	I34-L38 HydrophobicContact CG2-CD1 3.83Å; I34-L38 HydrophobicContact CG2-CG 4.23Å; I34-L38 WeakPolarHBondContact O-CB 3.37Å; I34-L38 VanDerWaalsContact O-CG 3.3Å; I34-L38 WeakPolarHBondContact O-CG 3.34Å; I34-L38 PolarHBondContact O-N 2.92Å; A35-L38 PolarHBondContact O-N 3.4Å; L38-A41 PolarHBondContact O-N 3.23Å; L38-S42 VanDerWaalsContact O-CB 3.26Å; L38-S42 WeakPolarHBondContact O-CB 3.42Å; L38-S42 PolarHBondContact O-N 2.98Å
39	S	94.3	Very high	89.9	Confident	70 Å²	70	92.5 Å²	92.5	49%	0.49	48%	0.481	S	S	.	.	H	α-helix	trans	-63.8	-45.6	174.9	-177.9	0	0	0	0	111.4	A35 C36 S42 M43	A35-S39 VanDerWaalsContact O-CB 3.3Å; A35-S39 WeakPolarHBondContact O-CB 3.48Å; A35-S39 PolarHBondContact O-N 2.8Å; C36-S39 PolarHBondContact O-N 3.33Å; S39-S42 PolarHBondContact O-N 3.28Å; S39-M43 WeakPolarHBondContact O-CB 3.26Å; S39-M43 PolarHBondContact O-N 3.42Å
40	I	95.1	Very high	88.8	Confident	100 Å²	100	94.9 Å²	94.9	51%	0.513	49%	0.491	S	S	.	.	H	α-helix	trans	-62.1	-45.3	174.5	-68.1	164.9	0	0	0	110.5	C36 I37 S42 M43 L44	C36-I40 WeakPolarHBondContact O-CB 3.38Å; C36-I40 VanDerWaalsContact O-CG1 3.24Å; C36-I40 WeakPolarHBondContact O-CG1 3.5Å; C36-I40 PolarHBondContact O-N 3.44Å; I37-I40 PolarHBondContact O-N 3.42Å; I40-S42 PolarHBondContact O-N 3.17Å; I40-M43 PolarHBondContact O-N 2.95Å; I40-L44 HydrophobicContact CG2-CD1 3.83Å; I40-L44 HydrophobicContact CG2-CG 4.23Å; I40-L44 WeakPolarHBondContact O-CB 3.22Å; I40-L44 VanDerWaalsContact O-CG 3.26Å; I40-L44 WeakPolarHBondContact O-CG 3.44Å; I40-L44 PolarHBondContact O-N 3.45Å
41	A	94.4	Very high	87.3	Confident	49 Å²	49	93 Å²	93	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-63.3	-40.9	178.1	0	0	0	0	0	111.9	I37 L38 L44 W45	I37-A41 VanDerWaalsContact O-CB 3.26Å; I37-A41 WeakPolarHBondContact O-CB 3.44Å; I37-A41 PolarHBondContact O-N 3.46Å; L38-A41 PolarHBondContact O-N 3.23Å; A41-L44 PolarHBondContact O-N 2.92Å; A41-W45 VanDerWaalsContact O-CB 3.24Å; A41-W45 WeakPolarHBondContact O-CB 3.36Å; A41-W45 PolarHBondContact O-N 3.29Å
42	S	92.6	Very high	85.5	Confident	72 Å²	72	91.4 Å²	91.4	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-41.7	174	-175.3	0	0	0	0	111.4	L38 S39 I40 W45 F46	L38-S42 VanDerWaalsContact O-CB 3.26Å; L38-S42 WeakPolarHBondContact O-CB 3.42Å; L38-S42 PolarHBondContact O-N 2.98Å; S39-S42 PolarHBondContact O-N 3.28Å; I40-S42 PolarHBondContact O-N 3.17Å; S42-W45 PolarHBondContact O-N 3Å; S42-F46 VanDerWaalsContact O-CB 3.32Å; S42-F46 WeakPolarHBondContact O-CB 3.43Å; S42-F46 PolarHBondContact O-N 2.97Å
43	M	89.9	Confident	83.5	Confident	120 Å²	120	90.6 Å²	90.6	59%	0.591	48%	0.477	S	S	*	.	H	α-helix	trans	-66.9	-43.9	177.3	-161.7	110.6	71.1	0	0	111.1	S39 I40 F46 V47	S39-M43 WeakPolarHBondContact O-CB 3.26Å; S39-M43 PolarHBondContact O-N 3.42Å; I40-M43 PolarHBondContact O-N 2.95Å; M43-F46 PolarHBondContact O-N 2.73Å; M43-V47 WeakPolarHBondContact O-CB 3.39Å; M43-V47 WeakPolarHBondContact O-CG2 3.4Å; M43-V47 PolarHBondContact O-N 3.1Å
44	L	87.5	Confident	81.3	Confident	113 Å²	113	87.3 Å²	87.3	59%	0.592	47%	0.469	S	S	*	.	H	α-helix	trans	-64.3	-39.6	175.3	-72	173.6	0	0	0	111.7	I40 A41 S48	I40-L44 HydrophobicContact CG2-CD1 3.83Å; I40-L44 HydrophobicContact CG2-CG 4.23Å; I40-L44 WeakPolarHBondContact O-CB 3.22Å; I40-L44 VanDerWaalsContact O-CG 3.26Å; I40-L44 WeakPolarHBondContact O-CG 3.44Å; I40-L44 PolarHBondContact O-N 3.45Å; A41-L44 PolarHBondContact O-N 2.92Å; L44-S48 WeakPolarHBondContact O-CB 3.32Å; L44-S48 PolarHBondContact O-N 3.2Å
45	W	86.8	Confident	79.1	Confident	184 Å²	184	85.9 Å²	85.9	70%	0.697	46%	0.464	S	S	*	.	H	α-helix	trans	-67.6	-40.3	175.5	-177.5	60.5	0	0	0	111.7	A41 S42 S48 S49	A41-W45 VanDerWaalsContact O-CB 3.24Å; A41-W45 WeakPolarHBondContact O-CB 3.36Å; A41-W45 PolarHBondContact O-N 3.29Å; S42-W45 PolarHBondContact O-N 3Å; W45-S48 PolarHBondContact O-N 3.31Å; W45-S49 PolarHBondContact NE1-OG 3.09Å; W45-S49 WeakPolarHBondContact O-CB 3.22Å; W45-S49 PolarHBondContact O-N 3.13Å; W45-S49 PolarHBondContact O-OG 3.3Å
46	F	84.7	Confident	76.5	Confident	116 Å²	116	90.3 Å²	90.3	51%	0.509	48%	0.475	S	S	.	.	H	α-helix	trans	-62.7	-50.3	173	177	-97.7	0	0	0	111.1	S42 M43 S48 S49 F50	S42-F46 VanDerWaalsContact O-CB 3.32Å; S42-F46 WeakPolarHBondContact O-CB 3.43Å; S42-F46 PolarHBondContact O-N 2.97Å; M43-F46 PolarHBondContact O-N 2.73Å; F46-S48 VanDerWaalsContact C-N 3.34Å; F46-S48 PolarHBondContact O-N 3.08Å; F46-S49 PolarHBondContact O-N 2.78Å; F46-F50 HydrophobicContact CD1-CB 4.49Å; F46-F50 HydrophobicContact CD2-CB 4.13Å; F46-F50 HydrophobicContact CE1-CB 4.24Å; F46-F50 HydrophobicContact CE1-CD1 4.27Å; F46-F50 HydrophobicContact CE1-CG 4.32Å; F46-F50 HydrophobicContact CE2-CB 3.86Å; F46-F50 HydrophobicContact CE2-CD2 4.05Å; F46-F50 AromaticContact CE2-CG 3.89Å; F46-F50 HydrophobicContact CE2-CG 3.89Å; F46-F50 HydrophobicContact CG-CB 4.44Å; F46-F50 HydrophobicContact CZ-CB 3.92Å; F46-F50 AromaticContact CZ-CD1 3.88Å; F46-F50 HydrophobicContact CZ-CD1 3.88Å; F46-F50 HydrophobicContact CZ-CD2 4.14Å; F46-F50 HydrophobicContact CZ-CE1 4.45Å; F46-F50 AromaticContact CZ-CG 3.71Å; F46-F50 HydrophobicContact CZ-CG 3.71Å; F46-F50 WeakPolarHBondContact O-CA 3.2Å; F46-F50 WeakPolarHBondContact O-CB 3.32Å; F46-F50 PolarHBondContact O-N 2.82Å
47	V	76.8	Confident	74	Confident	61 Å²	61	91.7 Å²	91.7	37%	0.37	48%	0.479	S	S	.	.	I	π-helix	trans	-58.9	-46.1	176.1	170.3	0	0	0	0	110.5	M43 S49 L51	M43-V47 WeakPolarHBondContact O-CB 3.39Å; M43-V47 WeakPolarHBondContact O-CG2 3.4Å; M43-V47 PolarHBondContact O-N 3.1Å; V47-S49 PolarHBondContact O-N 3.4Å; V47-L51 HydrophobicContact CB-CD1 4.46Å; V47-L51 HydrophobicContact CG1-CD1 3.7Å; V47-L51 HydrophobicContact CG1-CG 4.46Å; V47-L51 WeakPolarHBondContact O-CB 3.39Å; V47-L51 WeakPolarHBondContact O-CG 3.08Å; V47-L51 PolarHBondContact O-N 2.66Å
48	S	73.6	Confident	71.4	Confident	64 Å²	64	90.3 Å²	90.3	45%	0.448	47%	0.47	S	S	.	.	I	π-helix	trans	-65.2	-36.3	179	-175.5	0	0	0	0	112.9	L44 W45 F46 F52	L44-S48 WeakPolarHBondContact O-CB 3.32Å; L44-S48 PolarHBondContact O-N 3.2Å; W45-S48 PolarHBondContact O-N 3.31Å; F46-S48 VanDerWaalsContact C-N 3.34Å; F46-S48 PolarHBondContact O-N 3.08Å; S48-F52 VanDerWaalsContact O-CB 3.28Å; S48-F52 WeakPolarHBondContact O-CB 3.23Å; S48-F52 WeakPolarHBondContact O-CD2 3.25Å
49	S	72.4	Confident	68.8	Low	44 Å²	44	87.7 Å²	87.7	31%	0.308	46%	0.464	S	S	.	.	I	π-helix	trans	-90.4	-49.4	-175.2	-54.1	0	0	0	0	110.8	W45 F46 V47 L53	W45-S49 PolarHBondContact NE1-OG 3.09Å; W45-S49 WeakPolarHBondContact O-CB 3.22Å; W45-S49 PolarHBondContact O-N 3.13Å; W45-S49 PolarHBondContact O-OG 3.3Å; F46-S49 PolarHBondContact O-N 2.78Å; V47-S49 PolarHBondContact O-N 3.4Å; S49-L53 WeakPolarHBondContact O-CB 3.23Å; S49-L53 PolarHBondContact O-N 3.12Å; S49-L53 VanDerWaalsContact O-N 3.1Å
50	F	68	Low	66.4	Low	103 Å²	103	86.4 Å²	86.4	45%	0.452	46%	0.455	S	S	.	.	I	π-helix	trans	-70.2	-44.1	-178.2	-170.5	-98	0	0	0	112.2	F46 N54	F46-F50 HydrophobicContact CD1-CB 4.49Å; F46-F50 HydrophobicContact CD2-CB 4.13Å; F46-F50 HydrophobicContact CE1-CB 4.24Å; F46-F50 HydrophobicContact CE1-CD1 4.27Å; F46-F50 HydrophobicContact CE1-CG 4.32Å; F46-F50 HydrophobicContact CE2-CB 3.86Å; F46-F50 HydrophobicContact CE2-CD2 4.05Å; F46-F50 AromaticContact CE2-CG 3.89Å; F46-F50 HydrophobicContact CE2-CG 3.89Å; F46-F50 HydrophobicContact CG-CB 4.44Å; F46-F50 HydrophobicContact CZ-CB 3.92Å; F46-F50 AromaticContact CZ-CD1 3.88Å; F46-F50 HydrophobicContact CZ-CD1 3.88Å; F46-F50 HydrophobicContact CZ-CD2 4.14Å; F46-F50 HydrophobicContact CZ-CE1 4.45Å; F46-F50 AromaticContact CZ-CG 3.71Å; F46-F50 HydrophobicContact CZ-CG 3.71Å; F46-F50 WeakPolarHBondContact O-CA 3.2Å; F46-F50 WeakPolarHBondContact O-CB 3.32Å; F46-F50 PolarHBondContact O-N 2.82Å; F50-N54 WeakPolarHBondContact O-CB 3.46Å; F50-N54 PolarHBondContact O-N 2.87Å; F50-N54 PolarHBondContact O-ND2 3.26Å
51	L	59.5	Low	63.7	Low	25 Å²	25	88.2 Å²	88.2	13%	0.131	46%	0.462	C	S	.	.	I	π-helix	trans	-76.3	-49.3	-178.9	-57.8	179.9	0	0	0	111.5	V47 N54 V55 V153 L156	V47-L51 HydrophobicContact CB-CD1 4.46Å; V47-L51 HydrophobicContact CG1-CD1 3.7Å; V47-L51 HydrophobicContact CG1-CG 4.46Å; V47-L51 WeakPolarHBondContact O-CB 3.39Å; V47-L51 WeakPolarHBondContact O-CG 3.08Å; V47-L51 PolarHBondContact O-N 2.66Å; L51-N54 PolarHBondContact O-N 2.82Å; L51-V55 VanDerWaalsContact O-CG2 3.29Å; L51-V55 WeakPolarHBondContact O-CG2 3.32Å; L51-V55 PolarHBondContact O-N 3.2Å; L51-V153 HydrophobicContact CB-CB 4.41Å; L51-V153 HydrophobicContact CB-CG2 3.99Å; L51-V153 HydrophobicContact CD1-CG2 4.32Å; L51-V153 HydrophobicContact CD2-CB 4.3Å; L51-V153 HydrophobicContact CD2-CG2 4.48Å; L51-L156 HydrophobicContact CD1-CD1 3.81Å; L51-L156 HydrophobicContact CD2-CD1 4.18Å
52	F	56.6	Low	61.2	Low	132 Å²	132	90 Å²	90	58%	0.579	47%	0.469	S	S	*	.	H	α-helix	trans	-72.7	-31.8	-175.8	-64.6	-98.8	0	0	0	113.5	S48 N54 V55 H56	S48-F52 VanDerWaalsContact O-CB 3.28Å; S48-F52 WeakPolarHBondContact O-CB 3.23Å; S48-F52 WeakPolarHBondContact O-CD2 3.25Å; F52-N54 VanDerWaalsContact C-N 3.35Å; F52-V55 PolarHBondContact O-N 3.07Å; F52-H56 PolarHBondContact O-N 2.91Å
53	L	50.2	Low	59	Low	111 Å²	111	88.4 Å²	88.4	58%	0.581	46%	0.46	S	S	*	.	H	α-helix	trans	-68.6	-36.5	175.5	-165.1	77.1	0	0	0	111.1	S49 H56 L57	S49-L53 WeakPolarHBondContact O-CB 3.23Å; S49-L53 PolarHBondContact O-N 3.12Å; S49-L53 VanDerWaalsContact O-N 3.1Å; L53-H56 PolarHBondContact O-N 2.92Å; L53-L57 HydrophobicContact CG-CD1 4.27Å; L53-L57 WeakPolarHBondContact O-CB 3.44Å; L53-L57 WeakPolarHBondContact O-CG 3.44Å; L53-L57 PolarHBondContact O-N 3.24Å
54	N	46.7	Very low	56.9	Low	60 Å²	60	85.1 Å²	85.1	32%	0.321	46%	0.457	S	S	.	.	H	α-helix	trans	-69.2	-37.5	173.5	-75.9	-42.4	0	0	0	111.9	F50 L51 F52 H56 L57 Q58	F50-N54 WeakPolarHBondContact O-CB 3.46Å; F50-N54 PolarHBondContact O-N 2.87Å; F50-N54 PolarHBondContact O-ND2 3.26Å; L51-N54 PolarHBondContact O-N 2.82Å; F52-N54 VanDerWaalsContact C-N 3.35Å; N54-H56 VanDerWaalsContact C-N 3.31Å; N54-H56 PolarHBondContact O-N 3.15Å; N54-L57 PolarHBondContact O-N 2.98Å; N54-Q58 PolarHBondContact O-N 3.46Å; N54-Q58 VanDerWaalsContact O-N 3.09Å; N54-Q58 PolarHBondContact O-OE1 3.02Å
55	V	49.8	Very low	54.6	Low	52 Å²	52	90.3 Å²	90.3	32%	0.315	48%	0.475	S	S	.	.	H	α-helix	trans	-56.7	-45.2	170	175.5	0	0	0	0	110.8	L51 F52 Q58 A59 V153	L51-V55 VanDerWaalsContact O-CG2 3.29Å; L51-V55 WeakPolarHBondContact O-CG2 3.32Å; L51-V55 PolarHBondContact O-N 3.2Å; F52-V55 PolarHBondContact O-N 3.07Å; V55-Q58 PolarHBondContact O-N 3.01Å; V55-A59 WeakPolarHBondContact O-CB 3.44Å; V55-A59 PolarHBondContact O-N 3.15Å; V55-V153 HydrophobicContact CG2-CB 4.19Å; V55-V153 HydrophobicContact CG2-CG1 3.37Å; V55-V153 HydrophobicContact CG2-CG2 4.17Å
56	H	39.2	Very low	52.6	Low	148 Å²	148	83.5 Å²	83.5	69%	0.685	46%	0.462	S	S	*	.	H	α-helix	trans	-73.4	-28.8	-179.6	-99.6	55	0	0	0	114.3	F52 L53 N54 Q58	F52-H56 PolarHBondContact O-N 2.91Å; L53-H56 PolarHBondContact O-N 2.92Å; N54-H56 VanDerWaalsContact C-N 3.31Å; N54-H56 PolarHBondContact O-N 3.15Å; H56-Q58 VanDerWaalsContact C-N 3.32Å
57	L	43.8	Very low	50.9	Low	77 Å²	77	86.4 Å²	86.4	40%	0.403	48%	0.477	S	S	.	.	H	α-helix	trans	-74.9	-23.2	174.8	-76.6	164.8	0	0	0	112.6	L53 N54	L53-L57 HydrophobicContact CG-CD1 4.27Å; L53-L57 WeakPolarHBondContact O-CB 3.44Å; L53-L57 WeakPolarHBondContact O-CG 3.44Å; L53-L57 PolarHBondContact O-N 3.24Å; N54-L57 PolarHBondContact O-N 2.98Å
58	Q	41	Very low	49.7	Very low	83 Å²	83	87.7 Å²	87.7	39%	0.388	49%	0.489	S	S	.	.	H	α-helix	trans	-100	-24.5	178	-69.7	174.5	-68.6	0	0	113.6	N54 V55 H56 S60	N54-Q58 PolarHBondContact O-N 3.46Å; N54-Q58 VanDerWaalsContact O-N 3.09Å; N54-Q58 PolarHBondContact O-OE1 3.02Å; V55-Q58 PolarHBondContact O-N 3.01Å; H56-Q58 VanDerWaalsContact C-N 3.32Å; Q58-S60 PolarHBondContact O-N 3.31Å
59	A	43	Very low	48.9	Very low	57 Å²	57	86.5 Å²	86.5	47%	0.471	48%	0.482	S	S	.	.	S	Bend	trans	-69.1	83	164.8	0	0	0	0	0	108.7	V55 Q61	V55-A59 WeakPolarHBondContact O-CB 3.44Å; V55-A59 PolarHBondContact O-N 3.15Å; A59-Q61 PolarHBondContact O-N 3.45Å; A59-Q61 VanDerWaalsContact O-N 3.13Å
60	S	42.6	Very low	48.3	Very low	43 Å²	43	86.9 Å²	86.9	30%	0.301	49%	0.485	S	S	.	.			trans	-30.5	109.6	173.1	26.7	0	0	0	0	113	Q58	Q58-S60 PolarHBondContact O-N 3.31Å
61	Q	38.8	Very low	48.1	Very low	139 Å²	139	88.4 Å²	88.4	65%	0.65	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-80.1	128	148.1	-69.8	-68	-34	0	0	106.3	A59 A63 V380	A59-Q61 PolarHBondContact O-N 3.45Å; A59-Q61 VanDerWaalsContact O-N 3.13Å; Q61-A63 PolarHBondContact O-N 3.39Å; Q61-V380 HydrophobicContact CB-CG2 4.17Å
62	P	41.7	Very low	48.5	Very low	87 Å²	87	89.7 Å²	89.7	57%	0.565	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-54.8	140	177.2	18.2	-27.8	0	0	0	110.3	G64	P62-G64 PolarHBondContact O-N 2.98Å
63	A	46.9	Very low	49.1	Very low	37 Å²	37	86.7 Å²	86.7	31%	0.306	49%	0.485	S	S	.	.	S	Bend	trans	-49.8	137.2	180	0	0	0	0	0	110.9	Q61	Q61-A63 PolarHBondContact O-N 3.39Å
64	G	45.2	Very low	50.3	Low	52 Å²	52	88.6 Å²	88.6	54%	0.536	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-51.8	154.2	-157.5	0	0	0	0	0	117.5	P62 G66 A69	P62-G64 PolarHBondContact O-N 2.98Å; G64-G66 PolarHBondContact O-N 2.91Å; G64-A69 WeakPolarHBondContact O-CB 3.39Å
65	K	39.6	Very low	51.6	Low	222 Å²	222	92.9 Å²	92.9	97%	0.965	50%	0.496	S	S	*	.			trans	-68.8	62.1	179.3	-63.4	-179.3	177.6	179.5	0	113.3
66	G	45.1	Very low	53.1	Low	40 Å²	40	91 Å²	91	41%	0.412	49%	0.485	S	S	.	.			trans	-87.6	158.8	167.1	0	0	0	0	0	112	G64 S68 A69 S70	G64-G66 PolarHBondContact O-N 2.91Å; G66-S68 PolarHBondContact O-N 3.31Å; G66-A69 WeakPolarHBondContact O-CA 3.41Å; G66-A69 VanDerWaalsContact O-CB 3.28Å; G66-A69 WeakPolarHBondContact O-CB 3.19Å; G66-A69 PolarHBondContact O-N 2.92Å; G66-S70 PolarHBondContact O-N 2.87Å
67	E	49	Very low	54.8	Low	177 Å²	177	89.8 Å²	89.8	83%	0.827	48%	0.48	S	S	*	.	H	α-helix	trans	-56.4	-36	177.4	-69	-174.5	156.6	0	0	112.8	A69 S70 W71	E67-A69 VanDerWaalsContact C-N 3.33Å; E67-A69 PolarHBondContact O-N 3.43Å; E67-S70 WeakPolarHBondContact O-CB 3.27Å; E67-S70 PolarHBondContact O-N 3.19Å; E67-S70 VanDerWaalsContact O-N 3.13Å; E67-S70 PolarHBondContact O-OG 2.98Å; E67-W71 PolarHBondContact O-N 2.92Å
68	S	51.3	Low	56.3	Low	89 Å²	89	93.1 Å²	93.1	62%	0.622	50%	0.497	S	S	*	.	H	α-helix	trans	-60.3	-38.6	172.9	178	0	0	0	0	112.7	G66 S70 W71 L72	G66-S68 PolarHBondContact O-N 3.31Å; S68-S70 VanDerWaalsContact C-N 3.29Å; S68-S70 PolarHBondContact O-N 3.4Å; S68-W71 PolarHBondContact O-N 3.16Å; S68-L72 PolarHBondContact O-N 2.71Å
69	A	55.9	Low	57.8	Low	38 Å²	38	91.4 Å²	91.4	31%	0.314	49%	0.49	S	S	.	.	H	α-helix	trans	-65	-33.6	175.7	0	0	0	0	0	111.7	G64 G66 E67 W71 D73	G64-A69 WeakPolarHBondContact O-CB 3.39Å; G66-A69 WeakPolarHBondContact O-CA 3.41Å; G66-A69 VanDerWaalsContact O-CB 3.28Å; G66-A69 WeakPolarHBondContact O-CB 3.19Å; G66-A69 PolarHBondContact O-N 2.92Å; E67-A69 VanDerWaalsContact C-N 3.33Å; E67-A69 PolarHBondContact O-N 3.43Å; A69-W71 PolarHBondContact O-N 3.44Å; A69-D73 WeakPolarHBondContact O-CB 3.39Å; A69-D73 PolarHBondContact O-N 2.91Å
70	S	61.2	Low	58.8	Low	52 Å²	52	93 Å²	93	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-69.1	-30.1	178.6	83.1	0	0	0	0	114.1	G66 E67 S68 R74	G66-S70 PolarHBondContact O-N 2.87Å; E67-S70 WeakPolarHBondContact O-CB 3.27Å; E67-S70 PolarHBondContact O-N 3.19Å; E67-S70 VanDerWaalsContact O-N 3.13Å; E67-S70 PolarHBondContact O-OG 2.98Å; S68-S70 VanDerWaalsContact C-N 3.29Å; S68-S70 PolarHBondContact O-N 3.4Å; S70-R74 PolarHBondContact O-N 2.95Å; S70-R74 PolarHBondContact O-NE 3.47Å; S70-R74 VanDerWaalsContact O-NE 3.15Å
71	W	63.4	Low	60	Low	135 Å²	135	95.4 Å²	95.4	51%	0.511	51%	0.509	S	S	.	.	H	α-helix	trans	-76.8	-44.9	177.4	175.4	91.9	0	0	0	110.9	E67 S68 A69 R75	E67-W71 PolarHBondContact O-N 2.92Å; S68-W71 PolarHBondContact O-N 3.16Å; A69-W71 PolarHBondContact O-N 3.44Å; W71-R75 PolarHBondContact O-N 3.32Å
72	L	66.9	Low	61.4	Low	53 Å²	53	89.3 Å²	89.3	28%	0.277	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-48.3	174.7	-80.3	165.7	0	0	0	110.6	S68 R74 R75 C76 L375	S68-L72 PolarHBondContact O-N 2.71Å; L72-R74 VanDerWaalsContact C-N 3.35Å; L72-R74 PolarHBondContact O-N 3.09Å; L72-R75 PolarHBondContact O-N 2.95Å; L72-R75 VanDerWaalsContact O-N 3.09Å; L72-C76 WeakPolarHBondContact O-CB 3.45Å; L72-C76 PolarHBondContact O-N 3.34Å; L72-C76 PolarHBondContact O-SG 3.12Å; L72-L375 HydrophobicContact CD1-CD1 4.03Å; L72-L375 HydrophobicContact CD2-CD1 4.4Å
73	D	70	Confident	63	Low	69 Å²	69	92.3 Å²	92.3	37%	0.369	49%	0.494	S	S	.	.	H	α-helix	trans	-57.2	-45	-178.8	-176.8	40.1	0	0	0	112.4	A69 R75 C76 Q77	A69-D73 WeakPolarHBondContact O-CB 3.39Å; A69-D73 PolarHBondContact O-N 2.91Å; D73-R75 PolarHBondContact O-N 2.96Å; D73-C76 WeakPolarHBondContact O-CB 3.35Å; D73-C76 PolarHBondContact O-N 2.95Å; D73-Q77 VanDerWaalsContact CG-NE2 3.25Å; D73-Q77 VanDerWaalsContact O-CG 3.29Å; D73-Q77 WeakPolarHBondContact O-CG 3.16Å; D73-Q77 PolarHBondContact O-N 2.88Å; D73-Q77 PolarHBondContact OD1-NE2 3.35Å; D73-Q77 VanDerWaalsContact OD1-NE2 3.12Å; D73-Q77 PolarHBondContact OD2-NE2 2.79Å
74	R	74.5	Confident	64.8	Low	151 Å²	151	91.2 Å²	91.2	57%	0.57	48%	0.483	S	S	*	.	H	α-helix	trans	-59.7	-42.8	175.1	-82.9	-177.7	-76.3	-159.8	-3.3	113	S70 L72 Q77 L78	S70-R74 PolarHBondContact O-N 2.95Å; S70-R74 PolarHBondContact O-NE 3.47Å; S70-R74 VanDerWaalsContact O-NE 3.15Å; L72-R74 VanDerWaalsContact C-N 3.35Å; L72-R74 PolarHBondContact O-N 3.09Å; R74-Q77 PolarHBondContact O-N 3.38Å; R74-L78 WeakPolarHBondContact O-CG 3.17Å; R74-L78 PolarHBondContact O-N 2.97Å
75	R	75.8	Confident	66.5	Low	150 Å²	150	90.2 Å²	90.2	57%	0.566	47%	0.467	S	S	*	.	H	α-helix	trans	-65.9	-42.2	174.9	-78.7	-164.5	176.6	-143.1	2.5	111.5	W71 L72 D73 Q77 L78 L79	W71-R75 PolarHBondContact O-N 3.32Å; L72-R75 PolarHBondContact O-N 2.95Å; L72-R75 VanDerWaalsContact O-N 3.09Å; D73-R75 PolarHBondContact O-N 2.96Å; R75-Q77 VanDerWaalsContact C-N 3.25Å; R75-Q77 PolarHBondContact O-N 3.39Å; R75-L78 PolarHBondContact O-N 3.08Å; R75-L78 VanDerWaalsContact O-N 3.09Å; R75-L79 PolarHBondContact O-N 3.05Å
76	C	80.8	Confident	68.6	Low	13 Å²	13	83.4 Å²	83.4	9%	0.088	45%	0.452	C	S	.	.	H	α-helix	trans	-63.3	-29.8	179.2	-64.6	0	0	0	0	113.3	L72 D73 C372 R376	L72-C76 WeakPolarHBondContact O-CB 3.45Å; L72-C76 PolarHBondContact O-N 3.34Å; L72-C76 PolarHBondContact O-SG 3.12Å; D73-C76 WeakPolarHBondContact O-CB 3.35Å; D73-C76 PolarHBondContact O-N 2.95Å; C76-C372 WeakPolarHBondContact CA-SG 3.09Å; C76-C372 HydrophobicContact CB-CB 3.51Å; C76-C372 WeakPolarHBondContact CB-SG 3.34Å; C76-C372 WeakPolarHBondContact SG-CA 3.48Å; C76-C372 WeakPolarHBondContact SG-CB 3.44Å; C76-C372 CovalentContact SG-SG 2.02Å; C76-C372 PolarHBondContact SG-SG 3.41Å; C76-R376 PolarHBondContact O-NH2 2.69Å
77	Q	74.9	Confident	70.8	Confident	122 Å²	122	82.3 Å²	82.3	57%	0.57	44%	0.439	S	S	*	.	H	α-helix	trans	-75.2	-25.4	174.4	-71.3	170.5	13	0	0	113.3	D73 R74 R75	D73-Q77 VanDerWaalsContact CG-NE2 3.25Å; D73-Q77 VanDerWaalsContact O-CG 3.29Å; D73-Q77 WeakPolarHBondContact O-CG 3.16Å; D73-Q77 PolarHBondContact O-N 2.88Å; D73-Q77 PolarHBondContact OD1-NE2 3.35Å; D73-Q77 VanDerWaalsContact OD1-NE2 3.12Å; D73-Q77 PolarHBondContact OD2-NE2 2.79Å; R74-Q77 PolarHBondContact O-N 3.38Å; R75-Q77 VanDerWaalsContact C-N 3.25Å; R75-Q77 PolarHBondContact O-N 3.39Å
78	L	73.9	Confident	73	Confident	146 Å²	146	78.1 Å²	78.1	76%	0.764	42%	0.416	S	S	*	.	H	α-helix	trans	-89.4	-9.7	-178.9	-67.4	171.8	0	0	0	113.6	R74 R75 P80	R74-L78 WeakPolarHBondContact O-CG 3.17Å; R74-L78 PolarHBondContact O-N 2.97Å; R75-L78 PolarHBondContact O-N 3.08Å; R75-L78 VanDerWaalsContact O-N 3.09Å; L78-P80 WeakPolarHBondContact O-CD 3.4Å
79	L	72.5	Confident	75.1	Confident	47 Å²	47	74.1 Å²	74.1	25%	0.246	39%	0.388	C	S	.	.	S	Bend	trans	-72.3	124.1	179.2	-71.6	172	0	0	0	109.9	R75 V81 M368 V369 C372	R75-L79 PolarHBondContact O-N 3.05Å; L79-V81 PolarHBondContact O-N 2.69Å; L79-M368 HydrophobicContact CD1-CB 3.84Å; L79-M368 HydrophobicContact CD2-CB 4.35Å; L79-V369 HydrophobicContact CB-CG2 4.22Å; L79-V369 HydrophobicContact CD1-CG2 4.18Å; L79-C372 HydrophobicContact CD1-CB 4.47Å
80	P	65.7	Low	77	Confident	91 Å²	91	78.6 Å²	78.6	59%	0.591	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-63.3	124.3	169.7	26.6	-31.4	0	0	0	108.6	L78	L78-P80 WeakPolarHBondContact O-CD 3.4Å
81	V	67.6	Low	78.8	Confident	94 Å²	94	77.9 Å²	77.9	57%	0.57	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-84.6	118.6	172.5	-177.4	0	0	0	0	107.4	L79 P339	L79-V81 PolarHBondContact O-N 2.69Å; V81-P339 HydrophobicContact CG1-CB 3.93Å; V81-P339 HydrophobicContact CG1-CG 4.21Å
82	G	66.9	Low	80.5	Confident	11 Å²	11	71.4 Å²	71.4	11%	0.113	37%	0.365	C	S	.	.	S	Bend	trans	78.6	-178.4	-176	0	0	0	0	0	113.9
83	N	76.4	Confident	82	Confident	149 Å²	149	69 Å²	69	80%	0.797	35%	0.352	S	S	*	.			trans	68.7	39.9	-172.3	-156.3	25.9	0	0	0	114	N337	N83-N337 PolarHBondContact N-OD1 3.31Å
84	F	84.2	Confident	83.4	Confident	15 Å²	15	66.2 Å²	66.2	7%	0.066	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-71.3	160.4	163.3	-52.6	-70.6	0	0	0	110.1	M334 N337 D362 K365 M366 V369	F84-M334 HydrophobicContact CD2-SD 4.43Å; F84-M334 HydrophobicContact CE2-CE 4.09Å; F84-M334 HydrophobicContact CE2-SD 3.42Å; F84-M334 WeakPolarHBondContact CE2-SD 2.89Å; F84-M334 HydrophobicContact CZ-SD 3.68Å; F84-N337 WeakPolarHBondContact CD2-OD1 3.45Å; F84-N337 PolarHBondContact N-OD1 2.94Å; F84-N337 VanDerWaalsContact N-OD1 3.15Å; F84-D362 HydrophobicContact CB-CB 4.36Å; F84-D362 HydrophobicContact CD1-CB 4.2Å; F84-K365 HydrophobicContact CD1-CB 4.44Å; F84-K365 HydrophobicContact CE1-CB 3.81Å; F84-M366 HydrophobicContact CB-CE 3.76Å; F84-M366 HydrophobicContact CD1-CE 4.07Å; F84-M366 HydrophobicContact CD1-CG 3.92Å; F84-M366 HydrophobicContact CD2-CE 3.46Å; F84-M366 VanDerWaalsContact CD2-CE 3.46Å; F84-M366 HydrophobicContact CD2-CG 4.27Å; F84-M366 HydrophobicContact CE1-CG 3.66Å; F84-M366 HydrophobicContact CE2-CE 4.05Å; F84-M366 HydrophobicContact CE2-CG 4.04Å; F84-M366 HydrophobicContact CG-CE 3.47Å; F84-M366 VanDerWaalsContact CG-CE 3.47Å; F84-M366 HydrophobicContact CG-CG 4.21Å; F84-M366 HydrophobicContact CZ-CG 3.73Å; F84-V369 HydrophobicContact CZ-CG2 4.38Å
85	S	81.9	Confident	84.5	Confident	30 Å²	30	59 Å²	59	21%	0.21	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-60.6	156.7	166.4	64.4	0	0	0	0	110.8	S87 K359 D362	S85-S87 PolarHBondContact O-N 2.83Å; S85-S87 VanDerWaalsContact O-N 3.17Å; S85-K359 WeakPolarHBondContact OG-CD 3.39Å; S85-D362 WeakPolarHBondContact CB-OD2 3.34Å; S85-D362 PolarHBondContact N-OD2 3.23Å; S85-D362 PolarHBondContact OG-OD2 2.98Å
86	A	82.8	Confident	85.6	Confident	79 Å²	79	52 Å²	52	65%	0.653	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-54.6	123.8	-179.3	0	0	0	0	0	110.6
87	S	91.2	Very high	86.5	Confident	18 Å²	18	51.4 Å²	51.4	13%	0.126	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-69.6	169.1	167.1	71.9	0	0	0	0	109.7	S85 V89 L335	S85-S87 PolarHBondContact O-N 2.83Å; S85-S87 VanDerWaalsContact O-N 3.17Å; S87-V89 PolarHBondContact O-N 2.82Å; S87-V89 VanDerWaalsContact O-N 3.16Å; S87-V89 PolarHBondContact OG-N 2.97Å; S87-V89 PolarHBondContact OG-O 3.09Å; S87-V89 VanDerWaalsContact OG-O 3.08Å; S87-L335 WeakPolarHBondContact CB-O 3.24Å; S87-L335 PolarHBondContact OG-O 3.2Å
88	Y	94.3	Very high	87.6	Confident	88 Å²	88	45.8 Å²	45.8	35%	0.345	25%	0.254	S	S	.	.	S	Bend	trans	-75.2	15.7	167	-65	-52.7	0	0	0	113.3	D278 H313 L356 P358	Y88-D278 CarbonylContact O-C 3.54Å; Y88-D278 VanDerWaalsContact O-C 3.28Å; Y88-D278 WeakPolarHBondContact O-CA 3.44Å; Y88-H313 AromaticContact CD1-CE1 3.58Å; Y88-H313 AromaticContact CD1-ND1 3.79Å; Y88-H313 AromaticContact CD1-NE2 3.78Å; Y88-H313 HydrophobicContact CD2-CB 4.02Å; Y88-H313 AromaticContact CD2-CG 3.89Å; Y88-H313 AromaticContact CD2-ND1 3.88Å; Y88-H313 AromaticContact CE1-CE1 3.86Å; Y88-H313 HydrophobicContact CG-CB 4.18Å; Y88-H313 AromaticContact CG-CD2 3.85Å; Y88-H313 AromaticContact CG-CE1 3.94Å; Y88-H313 AromaticContact CG-CG 3.65Å; Y88-H313 AromaticContact CG-ND1 3.73Å; Y88-L356 PolarHBondContact N-O 2.91Å; Y88-P358 HydrophobicContact CD1-CG 4.35Å; Y88-P358 HydrophobicContact CD2-CG 4.16Å; Y88-P358 HydrophobicContact CE1-CG 3.92Å; Y88-P358 HydrophobicContact CE2-CB 4.15Å; Y88-P358 HydrophobicContact CE2-CG 3.71Å; Y88-P358 HydrophobicContact CG-CG 4.46Å
89	V	96.6	Very high	88.7	Confident	6 Å²	6	39.2 Å²	39.2	4%	0.036	22%	0.22	C	C	.	.			trans	-126.7	105.9	-175.7	-175.8	0	0	0	0	110.3	S87 V92 L280 L335 L336 L356	S87-V89 PolarHBondContact O-N 2.82Å; S87-V89 VanDerWaalsContact O-N 3.16Å; S87-V89 PolarHBondContact OG-N 2.97Å; S87-V89 PolarHBondContact OG-O 3.09Å; S87-V89 VanDerWaalsContact OG-O 3.08Å; V89-V92 HydrophobicContact CG1-CG2 3.61Å; V89-L280 HydrophobicContact CB-CB 4.5Å; V89-L280 HydrophobicContact CG1-CB 3.72Å; V89-L280 HydrophobicContact CG2-CB 3.91Å; V89-L335 HydrophobicContact CB-CB 4.35Å; V89-L335 HydrophobicContact CG2-CB 4.49Å; V89-L335 HydrophobicContact CG2-CD1 4.43Å; V89-L335 HydrophobicContact CG2-CD2 4.28Å; V89-L336 HydrophobicContact CG1-CD2 4.47Å; V89-L356 HydrophobicContact CG2-CB 4.29Å; V89-L356 HydrophobicContact CG2-CD1 3.79Å; V89-L356 HydrophobicContact CG2-CD2 4.31Å; V89-L356 HydrophobicContact CG2-CG 4.36Å
90	K	96.2	Very high	90	Very high	132 Å²	132	37.1 Å²	37.1	57%	0.574	21%	0.209	S	C	*	.	S	Bend	trans	-106.5	-25.9	168.6	-63.7	-162.9	-164.3	129.9	0	113.1	T231 D278	K90-T231 WeakPolarHBondContact O-CG2 3.29Å; K90-D278 HydrophobicContact CB-CB 4.41Å; K90-D278 WeakPolarHBondContact CD-OD2 3.38Å; K90-D278 WeakPolarHBondContact CE-OD2 3.42Å; K90-D278 HydrophobicContact CG-CB 4.17Å; K90-D278 WeakPolarHBondContact CG-OD2 3.11Å; K90-D278 PolarHBondContact N-O 3.07Å; K90-D278 IonicContact NZ-OD2 3.8Å; K90-D278 PolarHBondContact NZ-OD2 2.82Å
91	R	97.9	Very high	91.5	Very high	36 Å²	36	33.9 Å²	33.9	14%	0.136	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141	174.5	-64.8	-158.5	-164.9	171.3	7.9	111.4	Q227 D228 W230 T231 L276 D278 F279 L280	R91-Q227 PolarHBondContact NH1-O 3.35Å; R91-D228 VanDerWaalsContact NH2-CB 3.32Å; R91-W230 HydrophobicContact CB-CH2 4.25Å; R91-W230 HydrophobicContact CB-CZ3 3.83Å; R91-W230 HydrophobicContact CG-CZ3 4.17Å; R91-T231 CarbonylContact C-O 3.28Å; R91-T231 WeakPolarHBondContact CA-O 3.36Å; R91-L276 HydrophobicContact CG-CD1 4.44Å; R91-D278 PolarHBondContact N-O 2.88Å; R91-F279 HydrophobicContact CB-CB 4.26Å; R91-F279 CarbonylContact O-C 3.59Å; R91-F279 VanDerWaalsContact O-CA 3.24Å; R91-F279 WeakPolarHBondContact O-CA 3.44Å; R91-L280 PolarHBondContact O-N 3.34Å
92	V	98.7	Very high	92.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.2	175.1	-179.8	0	0	0	0	109.1	V89 L94 T231 M232 M233 L280 L332 L336	V89-V92 HydrophobicContact CG1-CG2 3.61Å; V92-L94 HydrophobicContact CG1-CD2 3.6Å; V92-L94 HydrophobicContact CG1-CG 3.91Å; V92-T231 PolarHBondContact N-O 2.62Å; V92-M232 HydrophobicContact CB-CE 4.33Å; V92-M232 HydrophobicContact CB-CG 4.31Å; V92-M232 HydrophobicContact CG1-CE 4.32Å; V92-M232 HydrophobicContact CG1-CG 4.47Å; V92-M232 CarbonylContact O-C 3.57Å; V92-M232 VanDerWaalsContact O-CA 3.26Å; V92-M232 WeakPolarHBondContact O-CA 3.18Å; V92-M233 PolarHBondContact O-N 3.32Å; V92-L280 CarbonylContact C-O 3.56Å; V92-L280 VanDerWaalsContact CA-O 3.24Å; V92-L280 WeakPolarHBondContact CA-O 3.37Å; V92-L280 HydrophobicContact CG2-CB 4.42Å; V92-L332 HydrophobicContact CG1-CD2 4.03Å; V92-L332 HydrophobicContact CG2-CD2 4.4Å; V92-L336 HydrophobicContact CG2-CD1 4.23Å; V92-L336 HydrophobicContact CG2-CD2 3.95Å; V92-L336 HydrophobicContact CG2-CG 4.26Å
93	V	98.9	Very high	94.4	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122.8	163.5	-178	0	0	0	0	107.9	W230 M233 L235 I268 L272 L280 F281 V282	V93-W230 HydrophobicContact CG2-CH2 3.81Å; V93-W230 HydrophobicContact CG2-CZ3 4.1Å; V93-M233 CarbonylContact C-O 3.56Å; V93-M233 WeakPolarHBondContact CA-O 3.42Å; V93-M233 HydrophobicContact CG1-CB 4.43Å; V93-M233 HydrophobicContact CG1-SD 4.35Å; V93-M233 HydrophobicContact CG2-CB 4.18Å; V93-L235 HydrophobicContact CG1-CD1 4.13Å; V93-I268 HydrophobicContact CB-CG2 4.49Å; V93-I268 HydrophobicContact CG1-CG2 4.09Å; V93-L272 HydrophobicContact CB-CD1 4.49Å; V93-L272 HydrophobicContact CG2-CD1 3.74Å; V93-L272 HydrophobicContact CG2-CD2 4.49Å; V93-L280 PolarHBondContact N-O 3.01Å; V93-F281 HydrophobicContact CB-CD2 3.76Å; V93-F281 HydrophobicContact CB-CE2 4.38Å; V93-F281 HydrophobicContact CG1-CD2 3.84Å; V93-F281 HydrophobicContact CG1-CE2 3.94Å; V93-V282 PolarHBondContact O-N 2.65Å
94	L	98.9	Very high	95.3	Very high	12 Å²	12	25.3 Å²	25.3	6%	0.063	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	106.3	171.8	-59.2	-175.7	0	0	0	108	V92 M232 M233 I234 L235 V282 L332	V92-L94 HydrophobicContact CG1-CD2 3.6Å; V92-L94 HydrophobicContact CG1-CG 3.91Å; L94-M232 HydrophobicContact CD1-CE 4.43Å; L94-M232 HydrophobicContact CD1-SD 3.86Å; L94-M232 HydrophobicContact CG-SD 4.42Å; L94-M233 PolarHBondContact N-O 3.17Å; L94-I234 HydrophobicContact CB-CG1 4.42Å; L94-I234 HydrophobicContact CD1-CG1 4.36Å; L94-I234 WeakPolarHBondContact O-CA 3.2Å; L94-L235 PolarHBondContact O-N 3.01Å; L94-V282 HydrophobicContact CD2-CB 3.79Å; L94-V282 HydrophobicContact CD2-CG2 3.97Å; L94-L332 HydrophobicContact CD1-CD1 3.98Å; L94-L332 HydrophobicContact CD2-CD1 3.95Å
95	M	98.9	Very high	95.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	97.6	172.4	178.1	-179.8	-177.5	0	0	109.2	I97 Y237 M261 V264 S265 I268 F281 V282 I283 L284	M95-I97 HydrophobicContact CE-CD1 3.93Å; M95-I97 HydrophobicContact CE-CG1 4.03Å; M95-I97 HydrophobicContact CG-CG1 4.26Å; M95-Y237 HydrophobicContact CE-CD2 3.82Å; M95-Y237 HydrophobicContact CE-CE2 3.67Å; M95-Y237 HydrophobicContact CE-CG 4.49Å; M95-Y237 HydrophobicContact CG-CD2 3.97Å; M95-Y237 HydrophobicContact CG-CE2 3.94Å; M95-Y237 HydrophobicContact SD-CE2 4.37Å; M95-M261 HydrophobicContact CE-CB 4.23Å; M95-M261 HydrophobicContact CE-SD 3.71Å; M95-V264 HydrophobicContact CE-CB 3.92Å; M95-V264 HydrophobicContact CE-CG1 3.57Å; M95-V264 HydrophobicContact SD-CG1 4.07Å; M95-S265 PolarHBondContact SD-OG 3.41Å; M95-I268 HydrophobicContact SD-CD1 4.12Å; M95-F281 HydrophobicContact CB-CE2 3.59Å; M95-F281 HydrophobicContact CB-CZ 4.11Å; M95-F281 HydrophobicContact SD-CE2 4.41Å; M95-F281 HydrophobicContact SD-CZ 3.99Å; M95-V282 PolarHBondContact N-O 2.72Å; M95-I283 WeakPolarHBondContact O-CA 3.46Å; M95-I283 HydrophobicContact SD-CG1 4.43Å; M95-L284 WeakPolarHBondContact O-CD2 3.45Å; M95-L284 PolarHBondContact O-N 2.97Å
96	I	98.9	Very high	96.5	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.7	175.5	-55.6	165.1	0	0	0	107.6	L144 W188 I234 L235 H236 Y237 L284 D286	I96-L144 HydrophobicContact CD1-CD1 4.18Å; I96-W188 HydrophobicContact CD1-CH2 4.17Å; I96-W188 HydrophobicContact CD1-CZ2 3.49Å; I96-W188 VanDerWaalsContact CD1-CZ2 3.49Å; I96-I234 HydrophobicContact CD1-CG2 4.11Å; I96-L235 PolarHBondContact N-O 2.86Å; I96-H236 HydrophobicContact CB-CB 4.31Å; I96-H236 WeakPolarHBondContact O-CA 3.47Å; I96-Y237 PolarHBondContact O-N 3.34Å; I96-L284 CarbonylContact C-O 3.51Å; I96-L284 VanDerWaalsContact CA-O 3.31Å; I96-L284 WeakPolarHBondContact CA-O 3.46Å; I96-L284 HydrophobicContact CB-CD2 4.36Å; I96-L284 HydrophobicContact CG1-CD2 3.61Å; I96-L284 HydrophobicContact CG1-CG 4.1Å; I96-D286 HydrophobicContact CG2-CB 3.76Å
97	I	98.8	Very high	97	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.3	173.7	-59.5	166.4	0	0	0	106.2	M95 A99 L100 L240 M261 I283 L284 G285	M95-I97 HydrophobicContact CE-CD1 3.93Å; M95-I97 HydrophobicContact CE-CG1 4.03Å; M95-I97 HydrophobicContact CG-CG1 4.26Å; I97-A99 PolarHBondContact O-N 3.5Å; I97-L100 HydrophobicContact CB-CB 3.96Å; I97-L100 HydrophobicContact CB-CD2 4Å; I97-L100 HydrophobicContact CD1-CD2 3.8Å; I97-L100 HydrophobicContact CG1-CD2 4.43Å; I97-L100 HydrophobicContact CG2-CB 4.03Å; I97-L100 HydrophobicContact CG2-CD2 4.42Å; I97-L100 VanDerWaalsContact O-CB 3.24Å; I97-L100 WeakPolarHBondContact O-CB 3.37Å; I97-L100 PolarHBondContact O-N 3.5Å; I97-L100 VanDerWaalsContact O-N 3.16Å; I97-L240 HydrophobicContact CG2-CB 4Å; I97-L240 HydrophobicContact CG2-CD2 3.72Å; I97-M261 HydrophobicContact CD1-CB 3.72Å; I97-M261 HydrophobicContact CD1-CG 3.93Å; I97-M261 HydrophobicContact CD1-SD 4.31Å; I97-M261 HydrophobicContact CG1-CG 4.26Å; I97-M261 HydrophobicContact CG1-SD 4.13Å; I97-M261 HydrophobicContact CG2-CG 4.14Å; I97-M261 HydrophobicContact CG2-SD 4.49Å; I97-I283 HydrophobicContact CD1-CG2 3.61Å; I97-I283 HydrophobicContact CG1-CG2 4.4Å; I97-L284 PolarHBondContact N-O 3.44Å; I97-G285 WeakPolarHBondContact O-CA 3.18Å
98	D	98.2	Very high	97.3	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	137.1	-177.1	-158.6	-28.7	0	0	0	110.6	L100 T137 H236 Y237 L240 D241 D286 H287	D98-L100 VanDerWaalsContact C-N 3.27Å; D98-L100 PolarHBondContact O-N 3.19Å; D98-T137 PolarHBondContact OD2-OG1 3.18Å; D98-H236 IonicContact OD2-NE2 2.7Å; D98-Y237 WeakPolarHBondContact CB-O 3.28Å; D98-Y237 PolarHBondContact N-O 3.29Å; D98-L240 WeakPolarHBondContact O-CB 3.45Å; D98-D241 HydrophobicContact CB-CB 3.74Å; D98-D241 WeakPolarHBondContact OD1-CB 3.22Å; D98-D286 WeakPolarHBondContact CA-OD1 3.37Å; D98-H287 IonicContact OD1-CD2 3.67Å; D98-H287 IonicContact OD1-CE1 3.4Å; D98-H287 PolarHBondContact OD1-CE1 2.92Å; D98-H287 VanDerWaalsContact OD1-CE1 3.24Å; D98-H287 IonicContact OD1-ND1 2.93Å; D98-H287 IonicContact OD1-NE2 3.78Å; D98-H287 PolarHBondContact OD1-NE2 3.23Å
99	A	97.9	Very high	97.4	Very high	8 Å²	8	28.5 Å²	28.5	7%	0.066	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	17.4	-175.6	0	0	0	0	0	117	I97 R101 D241 D286 H287 M289	I97-A99 PolarHBondContact O-N 3.5Å; A99-R101 PolarHBondContact O-N 3.44Å; A99-D241 HydrophobicContact CB-CB 3.72Å; A99-D241 WeakPolarHBondContact CB-OD1 3.46Å; A99-D286 PolarHBondContact N-OD1 2.96Å; A99-H287 CarbonylContact C-O 3.54Å; A99-H287 VanDerWaalsContact C-O 3.22Å; A99-H287 WeakPolarHBondContact CA-O 3.34Å; A99-M289 HydrophobicContact CB-CB 4.19Å; A99-M289 HydrophobicContact CB-CE 4.19Å
100	L	98.5	Very high	97.4	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	17%	0.166	C	C	.	.			trans	-74.2	93	179.5	-172.3	65.7	0	0	0	113.4	I97 D98 V104 M112 L240 L258 I283 H287 V305 L306	I97-L100 HydrophobicContact CB-CB 3.96Å; I97-L100 HydrophobicContact CB-CD2 4Å; I97-L100 HydrophobicContact CD1-CD2 3.8Å; I97-L100 HydrophobicContact CG1-CD2 4.43Å; I97-L100 HydrophobicContact CG2-CB 4.03Å; I97-L100 HydrophobicContact CG2-CD2 4.42Å; I97-L100 VanDerWaalsContact O-CB 3.24Å; I97-L100 WeakPolarHBondContact O-CB 3.37Å; I97-L100 PolarHBondContact O-N 3.5Å; I97-L100 VanDerWaalsContact O-N 3.16Å; D98-L100 VanDerWaalsContact C-N 3.27Å; D98-L100 PolarHBondContact O-N 3.19Å; L100-V104 HydrophobicContact CD1-CB 4.16Å; L100-V104 HydrophobicContact CD1-CG1 4.14Å; L100-V104 HydrophobicContact CD1-CG2 4.15Å; L100-M112 HydrophobicContact CD1-CE 4.44Å; L100-L240 HydrophobicContact CB-CD2 4.08Å; L100-L240 HydrophobicContact CD1-CD2 3.79Å; L100-L258 HydrophobicContact CD1-CD2 3.92Å; L100-I283 HydrophobicContact CD2-CG2 4.33Å; L100-H287 PolarHBondContact N-O 2.93Å; L100-V305 WeakPolarHBondContact O-CA 3.49Å; L100-L306 HydrophobicContact CD2-CB 4.17Å; L100-L306 HydrophobicContact CD2-CD2 3.82Å; L100-L306 HydrophobicContact CG-CB 4.18Å; L100-L306 HydrophobicContact CG-CD2 4.46Å; L100-L306 PolarHBondContact O-N 2.97Å; L100-L306 VanDerWaalsContact O-N 3.11Å
101	R	98	Very high	97.5	Very high	23 Å²	23	31 Å²	31	9%	0.087	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-67.1	151.4	177.9	-52.4	179.5	-154.3	170	-2	112.6	A99 E103 V104 D249 M289 S290 L301 N304	A99-R101 PolarHBondContact O-N 3.44Å; R101-E103 HydrophobicContact CB-CB 4.1Å; R101-E103 IonicContact NH1-OE2 3.43Å; R101-E103 PolarHBondContact NH1-OE2 3.14Å; R101-E103 PolarHBondContact O-N 2.9Å; R101-V104 WeakPolarHBondContact O-CB 3.33Å; R101-V104 WeakPolarHBondContact O-CG1 3.39Å; R101-V104 PolarHBondContact O-N 3.04Å; R101-D249 IonicContact CZ-OD2 3.93Å; R101-D249 IonicContact NH1-OD2 3Å; R101-D249 PolarHBondContact NH1-OD2 2.79Å; R101-M289 PolarHBondContact NE-O 3.49Å; R101-M289 PolarHBondContact NH2-O 3.29Å; R101-M289 VanDerWaalsContact NH2-O 3.09Å; R101-S290 PolarHBondContact NH2-O 2.76Å; R101-L301 WeakPolarHBondContact CD-O 3.37Å; R101-L301 WeakPolarHBondContact CG-O 3.47Å; R101-N304 WeakPolarHBondContact CA-O 3.27Å
102	A	97.9	Very high	97.6	Very high	6 Å²	6	29.4 Å²	29.4	5%	0.05	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.6	169.6	0	0	0	0	0	113	V104 L105 K128 N304	A102-V104 PolarHBondContact O-N 3.27Å; A102-V104 VanDerWaalsContact O-N 3.1Å; A102-L105 WeakPolarHBondContact O-CB 3.21Å; A102-L105 WeakPolarHBondContact O-CG 3.28Å; A102-L105 PolarHBondContact O-N 2.87Å; A102-K128 HydrophobicContact CB-CB 4.19Å; A102-K128 HydrophobicContact CB-CD 4.13Å; A102-K128 HydrophobicContact CB-CG 3.67Å; A102-N304 HydrophobicContact CB-CB 4.15Å; A102-N304 PolarHBondContact N-O 2.89Å
103	E	96.6	Very high	97.5	Very high	59 Å²	59	32 Å²	32	28%	0.276	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-25.5	174.1	-172.2	-172.2	-172.4	0	0	112.5	R101 L105 E106 S107 L301	R101-E103 HydrophobicContact CB-CB 4.1Å; R101-E103 IonicContact NH1-OE2 3.43Å; R101-E103 PolarHBondContact NH1-OE2 3.14Å; R101-E103 PolarHBondContact O-N 2.9Å; E103-L105 PolarHBondContact O-N 2.78Å; E103-L105 VanDerWaalsContact O-N 3.07Å; E103-E106 PolarHBondContact O-N 3.4Å; E103-S107 PolarHBondContact O-N 3.07Å; E103-S107 VanDerWaalsContact O-N 3.1Å; E103-S107 PolarHBondContact O-OG 2.81Å; E103-L301 WeakPolarHBondContact OE2-CD2 3.43Å
104	V	96.9	Very high	97.5	Very high	9 Å²	9	32.8 Å²	32.8	6%	0.055	17%	0.167	C	C	.	.	I	π-helix	trans	-53.8	-30.5	174.4	76.5	0	0	0	0	111.8	L100 R101 A102 E106 G108 I109 M112 L258 L306	L100-V104 HydrophobicContact CD1-CB 4.16Å; L100-V104 HydrophobicContact CD1-CG1 4.14Å; L100-V104 HydrophobicContact CD1-CG2 4.15Å; R101-V104 WeakPolarHBondContact O-CB 3.33Å; R101-V104 WeakPolarHBondContact O-CG1 3.39Å; R101-V104 PolarHBondContact O-N 3.04Å; A102-V104 PolarHBondContact O-N 3.27Å; A102-V104 VanDerWaalsContact O-N 3.1Å; V104-E106 PolarHBondContact O-N 3.42Å; V104-G108 CarbonylContact O-C 3.52Å; V104-G108 VanDerWaalsContact O-C 3.28Å; V104-G108 VanDerWaalsContact O-CA 3.27Å; V104-G108 WeakPolarHBondContact O-CA 3.28Å; V104-G108 PolarHBondContact O-N 3.43Å; V104-I109 WeakPolarHBondContact O-CA 3.1Å; V104-I109 WeakPolarHBondContact O-CB 3.09Å; V104-I109 PolarHBondContact O-N 3.38Å; V104-M112 HydrophobicContact CG2-SD 3.77Å; V104-L258 HydrophobicContact CG2-CD1 4.08Å; V104-L258 HydrophobicContact CG2-CD2 3.97Å; V104-L306 HydrophobicContact CG1-CB 4.25Å; V104-L306 HydrophobicContact CG1-CD2 3.88Å; V104-L306 HydrophobicContact CG1-CG 4.46Å
105	L	95.3	Very high	97.4	Very high	34 Å²	34	32.3 Å²	32.3	18%	0.178	17%	0.165	C	C	.	.	I	π-helix	trans	-64.1	-25.8	177.1	-64.3	172.7	0	0	0	113.4	A102 E103 I109 I119 V126 L306 V320	A102-L105 WeakPolarHBondContact O-CB 3.21Å; A102-L105 WeakPolarHBondContact O-CG 3.28Å; A102-L105 PolarHBondContact O-N 2.87Å; E103-L105 PolarHBondContact O-N 2.78Å; E103-L105 VanDerWaalsContact O-N 3.07Å; L105-I109 WeakPolarHBondContact O-CG2 3.41Å; L105-I119 HydrophobicContact CD2-CD1 4.46Å; L105-V126 HydrophobicContact CD1-CG1 3.47Å; L105-V126 VanDerWaalsContact CD1-CG1 3.47Å; L105-V126 HydrophobicContact CD2-CG1 3.55Å; L105-V126 HydrophobicContact CG-CG1 4.15Å; L105-L306 HydrophobicContact CD1-CD1 3.91Å; L105-L306 HydrophobicContact CD2-CD1 3.7Å; L105-L306 HydrophobicContact CG-CD1 3.86Å; L105-V320 HydrophobicContact CD1-CG1 4.08Å; L105-V320 HydrophobicContact CD1-CG2 4.39Å
106	E	94.4	Very high	97.3	Very high	165 Å²	165	37.6 Å²	37.6	77%	0.771	19%	0.185	S	C	*	.	I	π-helix	trans	-97.4	-48.1	-177.4	-63.6	176.5	-160.6	0	0	111.5	E103 V104	E103-E106 PolarHBondContact O-N 3.4Å; V104-E106 PolarHBondContact O-N 3.42Å
107	S	94.2	Very high	97.1	Very high	64 Å²	64	41 Å²	41	45%	0.448	20%	0.203	S	C	.	.	I	π-helix	trans	-112.6	-21.3	-170.9	63.8	0	0	0	0	114.4	E103	E103-S107 PolarHBondContact O-N 3.07Å; E103-S107 VanDerWaalsContact O-N 3.1Å; E103-S107 PolarHBondContact O-OG 2.81Å
108	G	96.5	Very high	96.9	Very high	4 Å²	4	42.1 Å²	42.1	4%	0.041	21%	0.208	C	C	.	.	I	π-helix	trans	-103.3	-20.1	-174	0	0	0	0	0	115.2	V104 Q110 Y111	V104-G108 CarbonylContact O-C 3.52Å; V104-G108 VanDerWaalsContact O-C 3.28Å; V104-G108 VanDerWaalsContact O-CA 3.27Å; V104-G108 WeakPolarHBondContact O-CA 3.28Å; V104-G108 PolarHBondContact O-N 3.43Å; G108-Q110 PolarHBondContact O-N 3.04Å; G108-Q110 VanDerWaalsContact O-N 3.11Å; G108-Y111 WeakPolarHBondContact O-CB 3.44Å; G108-Y111 WeakPolarHBondContact O-CD2 3.36Å; G108-Y111 PolarHBondContact O-N 2.97Å
109	I	96.7	Very high	96.7	Very high	30 Å²	30	44 Å²	44	15%	0.154	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-65	-23.8	-169.1	-165.6	60.5	0	0	0	112.5	V104 L105 Y111 M112 L115 R116 I119	V104-I109 WeakPolarHBondContact O-CA 3.1Å; V104-I109 WeakPolarHBondContact O-CB 3.09Å; V104-I109 PolarHBondContact O-N 3.38Å; L105-I109 WeakPolarHBondContact O-CG2 3.41Å; I109-Y111 PolarHBondContact O-N 3.23Å; I109-M112 HydrophobicContact CD1-CB 4.33Å; I109-M112 CarbonylContact O-C 3.41Å; I109-M112 PolarHBondContact O-N 3.01Å; I109-L115 HydrophobicContact CD1-CB 4.33Å; I109-R116 HydrophobicContact CD1-CB 4.29Å; I109-R116 HydrophobicContact CG1-CB 3.96Å; I109-R116 HydrophobicContact CG1-CG 4.13Å; I109-I119 HydrophobicContact CD1-CD1 4.27Å
110	Q	97.5	Very high	96.4	Very high	115 Å²	115	47.4 Å²	47.4	54%	0.537	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-65	-23.7	173	66.1	-176.6	2.1	0	0	113.4	G108 M112	G108-Q110 PolarHBondContact O-N 3.04Å; G108-Q110 VanDerWaalsContact O-N 3.11Å; Q110-M112 VanDerWaalsContact C-N 3.32Å
111	Y	98.4	Very high	96	Very high	77 Å²	77	53 Å²	53	30%	0.302	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-89	-2.9	174.1	-52	-60.8	0	0	0	112.4	G108 I109 P113 L258 Q259	G108-Y111 WeakPolarHBondContact O-CB 3.44Å; G108-Y111 WeakPolarHBondContact O-CD2 3.36Å; G108-Y111 PolarHBondContact O-N 2.97Å; I109-Y111 PolarHBondContact O-N 3.23Å; Y111-P113 WeakPolarHBondContact O-CD 3.46Å; Y111-L258 HydrophobicContact CD2-CD1 4.12Å; Y111-Q259 WeakPolarHBondContact O-CA 3.26Å; Y111-Q259 WeakPolarHBondContact O-CG 3.42Å
112	M	98.6	Very high	95.4	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.271	C	S	.	.			trans	-122.4	62.6	179.7	-60.1	-178.3	142.9	0	0	110.7	L100 V104 I109 Q110 F114 L115 R116 L258 M261 D262	L100-M112 HydrophobicContact CD1-CE 4.44Å; V104-M112 HydrophobicContact CG2-SD 3.77Å; I109-M112 HydrophobicContact CD1-CB 4.33Å; I109-M112 CarbonylContact O-C 3.41Å; I109-M112 PolarHBondContact O-N 3.01Å; Q110-M112 VanDerWaalsContact C-N 3.32Å; M112-F114 VanDerWaalsContact C-N 3.3Å; M112-F114 PolarHBondContact O-N 3.06Å; M112-L115 HydrophobicContact CB-CB 4.33Å; M112-L115 PolarHBondContact O-N 3.33Å; M112-L115 HydrophobicContact SD-CD1 4.11Å; M112-R116 WeakPolarHBondContact O-CB 3.24Å; M112-R116 PolarHBondContact O-N 2.77Å; M112-L258 HydrophobicContact CE-CB 3.88Å; M112-L258 HydrophobicContact CE-CD2 3.36Å; M112-L258 HydrophobicContact CE-CG 4.18Å; M112-L258 HydrophobicContact CG-CB 4.08Å; M112-L258 HydrophobicContact SD-CD2 4.24Å; M112-M261 HydrophobicContact CE-CB 4.26Å; M112-D262 VanDerWaalsContact C-OD1 3.28Å; M112-D262 VanDerWaalsContact C-OD2 3.31Å; M112-D262 WeakPolarHBondContact CA-OD1 3.44Å; M112-D262 HydrophobicContact CB-CB 3.9Å; M112-D262 WeakPolarHBondContact CB-OD1 3.25Å; M112-D262 HydrophobicContact CG-CB 4.01Å
113	P	98.2	Very high	95	Very high	55 Å²	55	54 Å²	54	36%	0.357	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-34.5	-173.1	24.5	-35.6	0	0	0	113.8	Y111 R116 D117 D262	Y111-P113 WeakPolarHBondContact O-CD 3.46Å; P113-R116 PolarHBondContact O-N 2.89Å; P113-D117 WeakPolarHBondContact O-CB 3.38Å; P113-D117 PolarHBondContact O-N 2.92Å; P113-D262 WeakPolarHBondContact CD-OD2 3.49Å; P113-D262 WeakPolarHBondContact CG-OD2 3.41Å; P113-D262 VanDerWaalsContact N-OD2 3.15Å
114	F	98.4	Very high	94.8	Very high	18 Å²	18	51.3 Å²	51.3	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-49.8	177.4	163.7	-95.8	0	0	0	111.5	M112 R116 D117 M118 D262 S266 Y269 L310	M112-F114 VanDerWaalsContact C-N 3.3Å; M112-F114 PolarHBondContact O-N 3.06Å; F114-R116 VanDerWaalsContact C-N 3.31Å; F114-R116 PolarHBondContact O-N 3.49Å; F114-D117 PolarHBondContact O-N 3.45Å; F114-M118 HydrophobicContact CD2-CE 4.1Å; F114-M118 HydrophobicContact CE1-CG 4.27Å; F114-M118 HydrophobicContact CE2-CE 3.18Å; F114-M118 HydrophobicContact CE2-CG 4.15Å; F114-M118 HydrophobicContact CZ-CE 3.48Å; F114-M118 VanDerWaalsContact CZ-CE 3.48Å; F114-M118 HydrophobicContact CZ-CG 3.94Å; F114-M118 WeakPolarHBondContact O-CG 3.49Å; F114-M118 PolarHBondContact O-N 2.7Å; F114-D262 WeakPolarHBondContact CB-OD1 3.45Å; F114-D262 WeakPolarHBondContact CB-OD2 3.49Å; F114-D262 PolarHBondContact N-OD1 3.39Å; F114-D262 PolarHBondContact N-OD2 2.84Å; F114-S266 WeakPolarHBondContact CD2-OG 3.17Å; F114-Y269 HydrophobicContact CE2-CD1 4.03Å; F114-Y269 HydrophobicContact CE2-CG 4.36Å; F114-Y269 VanDerWaalsContact CZ-CB 3.49Å; F114-Y269 AromaticContact CZ-CD1 3.82Å; F114-Y269 HydrophobicContact CZ-CD1 3.82Å; F114-Y269 AromaticContact CZ-CG 3.69Å; F114-Y269 HydrophobicContact CZ-CG 3.69Å; F114-L310 HydrophobicContact CE1-CD1 3.92Å; F114-L310 HydrophobicContact CZ-CD1 4.17Å
115	L	97.3	Very high	94.7	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-40.4	176.5	-67.6	-175.6	0	0	0	111.5	I109 M112 D117 M118 I119 D262 I283 F308 L310	I109-L115 HydrophobicContact CD1-CB 4.33Å; M112-L115 HydrophobicContact CB-CB 4.33Å; M112-L115 PolarHBondContact O-N 3.33Å; M112-L115 HydrophobicContact SD-CD1 4.11Å; L115-D117 VanDerWaalsContact C-N 3.31Å; L115-D117 PolarHBondContact O-N 3.13Å; L115-M118 WeakPolarHBondContact O-CB 3.41Å; L115-M118 PolarHBondContact O-N 3.46Å; L115-I119 WeakPolarHBondContact O-CG1 3.5Å; L115-I119 PolarHBondContact O-N 3.07Å; L115-I119 VanDerWaalsContact O-N 3.08Å; L115-D262 WeakPolarHBondContact CG-OD1 3.33Å; L115-D262 PolarHBondContact N-OD1 3.49Å; L115-I283 HydrophobicContact CD2-CD1 3.91Å; L115-F308 HydrophobicContact CB-CD2 4.44Å; L115-F308 HydrophobicContact CB-CE2 3.88Å; L115-F308 HydrophobicContact CB-CZ 4.25Å; L115-F308 HydrophobicContact CD1-CD2 4.42Å; L115-F308 HydrophobicContact CD2-CD1 4.34Å; L115-F308 HydrophobicContact CD2-CD2 4.43Å; L115-F308 HydrophobicContact CD2-CE1 4.27Å; L115-F308 HydrophobicContact CD2-CE2 4.31Å; L115-F308 HydrophobicContact CD2-CG 4.45Å; L115-F308 HydrophobicContact CD2-CZ 4.25Å; L115-F308 WeakPolarHBondContact O-CZ 3.09Å; L115-L310 HydrophobicContact CD2-CD1 4.09Å
116	R	95.9	Very high	94.7	Very high	112 Å²	112	50.3 Å²	50.3	42%	0.423	26%	0.263	S	S	.	.	H	α-helix	trans	-56.7	-46.1	174.2	-168.9	-176.4	67.8	176.2	-2.1	111.6	I109 M112 P113 F114 M118 I119 T120	I109-R116 HydrophobicContact CD1-CB 4.29Å; I109-R116 HydrophobicContact CG1-CB 3.96Å; I109-R116 HydrophobicContact CG1-CG 4.13Å; M112-R116 WeakPolarHBondContact O-CB 3.24Å; M112-R116 PolarHBondContact O-N 2.77Å; P113-R116 PolarHBondContact O-N 2.89Å; F114-R116 VanDerWaalsContact C-N 3.31Å; F114-R116 PolarHBondContact O-N 3.49Å; R116-M118 VanDerWaalsContact C-N 3.3Å; R116-M118 PolarHBondContact O-N 3.23Å; R116-I119 WeakPolarHBondContact O-CB 3.28Å; R116-I119 PolarHBondContact O-N 3.19Å; R116-T120 WeakPolarHBondContact O-CG2 3.03Å; R116-T120 PolarHBondContact O-N 3.37Å; R116-T120 PolarHBondContact O-OG1 3.23Å
117	D	95.5	Very high	94.8	Very high	74 Å²	74	42.4 Å²	42.4	40%	0.396	23%	0.226	S	C	.	.	H	α-helix	trans	-66.8	-32.7	179.7	-69.9	-6.9	0	0	0	111.8	P113 F114 L115 I119 T120 N121	P113-D117 WeakPolarHBondContact O-CB 3.38Å; P113-D117 PolarHBondContact O-N 2.92Å; F114-D117 PolarHBondContact O-N 3.45Å; L115-D117 VanDerWaalsContact C-N 3.31Å; L115-D117 PolarHBondContact O-N 3.13Å; D117-I119 VanDerWaalsContact C-N 3.35Å; D117-T120 WeakPolarHBondContact CA-OG1 3.22Å; D117-T120 PolarHBondContact O-N 3.36Å; D117-T120 PolarHBondContact O-OG1 3.22Å; D117-N121 VanDerWaalsContact O-CB 3.24Å; D117-N121 WeakPolarHBondContact O-CB 3.47Å; D117-N121 PolarHBondContact O-N 3.38Å; D117-N121 PolarHBondContact O-ND2 3.42Å; D117-N121 VanDerWaalsContact O-ND2 3.16Å
118	M	94.9	Very high	94.9	Very high	24 Å²	24	42.4 Å²	42.4	12%	0.118	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-34.6	173.2	-70.5	-64.1	174.3	0	0	112.8	F114 L115 R116 G122 S123 G124 Y269 F308 L310	F114-M118 HydrophobicContact CD2-CE 4.1Å; F114-M118 HydrophobicContact CE1-CG 4.27Å; F114-M118 HydrophobicContact CE2-CE 3.18Å; F114-M118 HydrophobicContact CE2-CG 4.15Å; F114-M118 HydrophobicContact CZ-CE 3.48Å; F114-M118 VanDerWaalsContact CZ-CE 3.48Å; F114-M118 HydrophobicContact CZ-CG 3.94Å; F114-M118 WeakPolarHBondContact O-CG 3.49Å; F114-M118 PolarHBondContact O-N 2.7Å; L115-M118 WeakPolarHBondContact O-CB 3.41Å; L115-M118 PolarHBondContact O-N 3.46Å; R116-M118 VanDerWaalsContact C-N 3.3Å; R116-M118 PolarHBondContact O-N 3.23Å; M118-G122 PolarHBondContact O-N 3.34Å; M118-S123 PolarHBondContact O-N 2.77Å; M118-G124 PolarHBondContact O-N 3.24Å; M118-Y269 HydrophobicContact CE-CD1 3.57Å; M118-Y269 HydrophobicContact CE-CE1 3.31Å; M118-Y269 HydrophobicContact CE-CG 4.29Å; M118-Y269 HydrophobicContact SD-CE1 4.41Å; M118-F308 HydrophobicContact CB-CE1 4.29Å; M118-F308 HydrophobicContact CB-CZ 4.09Å; M118-L310 HydrophobicContact CB-CD2 3.59Å; M118-L310 HydrophobicContact CG-CD2 3.6Å; M118-L310 HydrophobicContact SD-CD2 4.03Å
119	I	92.5	Very high	95	Very high	42 Å²	42	42.2 Å²	42.2	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-65.4	-50.2	171.7	-59.2	173.3	0	0	0	109.9	L105 I109 L115 R116 D117 N121 G122 V126 F308	L105-I119 HydrophobicContact CD2-CD1 4.46Å; I109-I119 HydrophobicContact CD1-CD1 4.27Å; L115-I119 WeakPolarHBondContact O-CG1 3.5Å; L115-I119 PolarHBondContact O-N 3.07Å; L115-I119 VanDerWaalsContact O-N 3.08Å; R116-I119 WeakPolarHBondContact O-CB 3.28Å; R116-I119 PolarHBondContact O-N 3.19Å; D117-I119 VanDerWaalsContact C-N 3.35Å; I119-N121 PolarHBondContact O-N 2.85Å; I119-G122 PolarHBondContact O-N 3.32Å; I119-G122 VanDerWaalsContact O-N 3.11Å; I119-V126 HydrophobicContact CD1-CG2 3.79Å; I119-V126 HydrophobicContact CG1-CG2 3.66Å; I119-F308 HydrophobicContact CD1-CE2 3.75Å; I119-F308 HydrophobicContact CD1-CZ 4.3Å; I119-F308 HydrophobicContact CG1-CE2 3.53Å; I119-F308 HydrophobicContact CG1-CZ 3.56Å
120	T	91.6	Very high	95.1	Very high	80 Å²	80	45.5 Å²	45.5	49%	0.491	23%	0.229	S	C	.	.	H	α-helix	trans	-67.3	-37.3	-173.7	57.1	0	0	0	0	112.6	R116 D117 G122	R116-T120 WeakPolarHBondContact O-CG2 3.03Å; R116-T120 PolarHBondContact O-N 3.37Å; R116-T120 PolarHBondContact O-OG1 3.23Å; D117-T120 WeakPolarHBondContact CA-OG1 3.22Å; D117-T120 PolarHBondContact O-N 3.36Å; D117-T120 PolarHBondContact O-OG1 3.22Å; T120-G122 PolarHBondContact O-N 2.86Å
121	N	90.1	Very high	94.9	Very high	121 Å²	121	40.1 Å²	40.1	65%	0.647	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-6.9	175.7	-67.5	-26	0	0	0	113.3	D117 I119	D117-N121 VanDerWaalsContact O-CB 3.24Å; D117-N121 WeakPolarHBondContact O-CB 3.47Å; D117-N121 PolarHBondContact O-N 3.38Å; D117-N121 PolarHBondContact O-ND2 3.42Å; D117-N121 VanDerWaalsContact O-ND2 3.16Å; I119-N121 PolarHBondContact O-N 2.85Å
122	G	86.8	Confident	94.6	Very high	14 Å²	14	38.6 Å²	38.6	14%	0.144	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	30.4	-179	0	0	0	0	0	113.2	M118 I119 T120 T315 A316	M118-G122 PolarHBondContact O-N 3.34Å; I119-G122 PolarHBondContact O-N 3.32Å; I119-G122 VanDerWaalsContact O-N 3.11Å; T120-G122 PolarHBondContact O-N 2.86Å; G122-T315 CarbonylContact O-C 3.58Å; G122-T315 VanDerWaalsContact O-CA 3.29Å; G122-T315 WeakPolarHBondContact O-CA 3.25Å; G122-A316 PolarHBondContact O-N 3.2Å
123	S	89.4	Confident	94.1	Very high	35 Å²	35	40.5 Å²	40.5	25%	0.245	22%	0.216	C	C	.	.			trans	-106.1	-6	173.9	-56.2	0	0	0	0	112.9	M118	M118-S123 PolarHBondContact O-N 2.77Å
124	G	91.9	Very high	93.8	Very high	2 Å²	2	38 Å²	38	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.9	179.8	0	0	0	0	0	113.4	M118 F308 A309 A316	M118-G124 PolarHBondContact O-N 3.24Å; G124-F308 VanDerWaalsContact CA-CE1 3.47Å; G124-A309 WeakPolarHBondContact CA-O 3.41Å; G124-A316 WeakPolarHBondContact O-CB 3.49Å
125	H	94.3	Very high	93.5	Very high	13 Å²	13	37.1 Å²	37.1	6%	0.06	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	126.9	169.9	-79.3	-137.3	0	0	0	109.4	F127 A309 L314 T315 A316	H125-F127 HydrophobicContact CB-CE2 3.72Å; H125-F127 HydrophobicContact CB-CZ 3.98Å; H125-A309 HydrophobicContact CB-CB 4.3Å; H125-A309 PolarHBondContact N-O 3.09Å; H125-A309 PolarHBondContact O-N 3.09Å; H125-L314 HydrophobicContact CB-CD1 4.37Å; H125-T315 PolarHBondContact NE2-O 3.41Å; H125-T315 VanDerWaalsContact NE2-O 3.07Å; H125-A316 VanDerWaalsContact CD2-CB 3.5Å; H125-A316 WeakPolarHBondContact CD2-CB 3.47Å; H125-A316 WeakPolarHBondContact NE2-CA 3.2Å
126	V	95.6	Very high	93.3	Very high	9 Å²	9	38.7 Å²	38.7	6%	0.055	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.4	-172.9	-176	0	0	0	0	110.9	L105 I119 L306 F308 V320 Q321	L105-V126 HydrophobicContact CD1-CG1 3.47Å; L105-V126 VanDerWaalsContact CD1-CG1 3.47Å; L105-V126 HydrophobicContact CD2-CG1 3.55Å; L105-V126 HydrophobicContact CG-CG1 4.15Å; I119-V126 HydrophobicContact CD1-CG2 3.79Å; I119-V126 HydrophobicContact CG1-CG2 3.66Å; V126-L306 HydrophobicContact CG1-CD1 3.96Å; V126-F308 HydrophobicContact CG2-CD2 3.78Å; V126-F308 HydrophobicContact CG2-CE2 3.62Å; V126-F308 HydrophobicContact CG2-CG 4.34Å; V126-F308 HydrophobicContact CG2-CZ 4.02Å; V126-V320 HydrophobicContact CB-CG2 4.32Å; V126-V320 HydrophobicContact CG1-CG1 4.28Å; V126-V320 HydrophobicContact CG1-CG2 4.09Å; V126-V320 WeakPolarHBondContact O-CA 3.31Å; V126-Q321 PolarHBondContact O-N 3.08Å; V126-Q321 VanDerWaalsContact O-N 3.12Å
127	F	96.2	Very high	93.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.7	178.9	-48.7	-94.4	0	0	0	110.4	H125 A129 V307 A309 Q321 V323 M349 L352	H125-F127 HydrophobicContact CB-CE2 3.72Å; H125-F127 HydrophobicContact CB-CZ 3.98Å; F127-A129 PolarHBondContact O-N 3.39Å; F127-V307 HydrophobicContact CB-CB 4.17Å; F127-V307 HydrophobicContact CD2-CG1 4.19Å; F127-V307 PolarHBondContact N-O 3.42Å; F127-V307 PolarHBondContact O-N 3.41Å; F127-A309 HydrophobicContact CE2-CB 4.39Å; F127-Q321 CarbonylContact C-O 3.55Å; F127-Q321 VanDerWaalsContact CA-O 3.23Å; F127-Q321 WeakPolarHBondContact CA-O 3.42Å; F127-Q321 HydrophobicContact CD1-CB 3.69Å; F127-Q321 HydrophobicContact CE1-CB 4.08Å; F127-V323 HydrophobicContact CB-CG2 3.87Å; F127-V323 HydrophobicContact CD1-CG1 3.7Å; F127-V323 HydrophobicContact CD1-CG2 4.47Å; F127-V323 HydrophobicContact CE1-CG1 4.4Å; F127-V323 HydrophobicContact CG-CG1 4.46Å; F127-V323 HydrophobicContact CG-CG2 4.44Å; F127-M349 HydrophobicContact CB-CE 4.19Å; F127-M349 HydrophobicContact CD1-CE 3.54Å; F127-M349 HydrophobicContact CD2-CE 3.34Å; F127-M349 HydrophobicContact CE1-CE 3.64Å; F127-M349 HydrophobicContact CE2-CE 3.44Å; F127-M349 VanDerWaalsContact CE2-CE 3.44Å; F127-M349 HydrophobicContact CG-CE 3.4Å; F127-M349 VanDerWaalsContact CG-CE 3.4Å; F127-M349 HydrophobicContact CZ-CE 3.6Å; F127-L352 HydrophobicContact CZ-CB 4.42Å
128	K	97.5	Very high	93	Very high	63 Å²	63	31.7 Å²	31.7	27%	0.274	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	99.2	160.4	177.2	168.1	-178.7	178.1	0	106.7	A102 N304 V320 Q321 T322 V323	A102-K128 HydrophobicContact CB-CB 4.19Å; A102-K128 HydrophobicContact CB-CD 4.13Å; A102-K128 HydrophobicContact CB-CG 3.67Å; K128-N304 HydrophobicContact CD-CB 4.46Å; K128-N304 VanDerWaalsContact CE-CB 3.46Å; K128-N304 WeakPolarHBondContact CE-OD1 3.45Å; K128-N304 HydrophobicContact CG-CB 4.22Å; K128-V320 HydrophobicContact CB-CG1 4.32Å; K128-Q321 PolarHBondContact N-O 3.48Å; K128-T322 WeakPolarHBondContact O-CA 3.5Å; K128-V323 PolarHBondContact O-N 3.07Å
129	A	98	Very high	92.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.1	-179.5	0	0	0	0	0	110.1	F127 N304 V305 V307 V323 Q325	F127-A129 PolarHBondContact O-N 3.39Å; A129-N304 WeakPolarHBondContact O-CA 3.34Å; A129-V305 HydrophobicContact CB-CG2 3.91Å; A129-V305 PolarHBondContact N-O 3.34Å; A129-V305 PolarHBondContact O-N 2.71Å; A129-V307 HydrophobicContact CB-CB 4.31Å; A129-V307 HydrophobicContact CB-CG2 3.53Å; A129-V323 CarbonylContact C-O 3.58Å; A129-V323 WeakPolarHBondContact CA-O 3.34Å; A129-V323 HydrophobicContact CB-CG2 3.81Å; A129-Q325 HydrophobicContact CB-CB 4.35Å
130	K	97.9	Very high	93	Very high	99 Å²	99	28.6 Å²	28.6	43%	0.43	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135.9	174.6	-172.3	172.5	-176	172.6	0	110.4	S303 V323 Q325	K130-S303 CarbonylContact C-O 3.22Å; K130-S303 VanDerWaalsContact CA-O 3.31Å; K130-S303 WeakPolarHBondContact CA-O 2.88Å; K130-V323 PolarHBondContact N-O 2.9Å; K130-Q325 PolarHBondContact O-N 2.82Å
131	I	95	Very high	93.2	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.015	14%	0.137	C	C	.	.			trans	-108.8	154.5	171	71.6	155.4	0	0	0	110.3	H287 E302 S303 V305 Q325	I131-H287 HydrophobicContact CD1-CB 3.69Å; I131-E302 WeakPolarHBondContact CD1-O 3.29Å; I131-S303 PolarHBondContact N-O 3.43Å; I131-V305 HydrophobicContact CG2-CG1 4.21Å; I131-V305 HydrophobicContact CG2-CG2 3.91Å; I131-Q325 HydrophobicContact CG2-CB 3.76Å; I131-Q325 HydrophobicContact CG2-CG 4.16Å
132	Q	90.7	Very high	93.4	Very high	44 Å²	44	19.6 Å²	19.6	21%	0.206	11%	0.109	C	C	.	.	P	Polyproline II helix	trans	-95.2	146.7	166.7	-64.8	71.6	40.2	0	0	109.2	R140 I149 E324	Q132-R140 PolarHBondContact O-NH1 3.36Å; Q132-R140 PolarHBondContact O-NH2 3.37Å; Q132-I149 HydrophobicContact CB-CG2 3.76Å; Q132-I149 HydrophobicContact CG-CD1 4.21Å; Q132-I149 HydrophobicContact CG-CG1 4.25Å; Q132-I149 HydrophobicContact CG-CG2 3.93Å; Q132-E324 PolarHBondContact NE2-OE2 2.73Å
133	A	89	Confident	93.8	Very high	42 Å²	42	18.9 Å²	18.9	35%	0.347	10%	0.102	S	C	.	.	S	Bend	trans	-57	153.3	170.3	0	0	0	0	0	111.5	G297	A133-G297 WeakPolarHBondContact CB-O 3.37Å
134	P	91.4	Very high	94.2	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	9%	0.093	C	C	.	.	P	Polyproline II helix	cis	-78.5	137.4	-1.6	31.7	-35.5	0	0	0	112.2	V136 P139 R140 F152	P134-V136 HydrophobicContact CB-CG2 4.12Å; P134-V136 PolarHBondContact O-N 3.12Å; P134-P139 HydrophobicContact CG-CB 3.77Å; P134-P139 HydrophobicContact CG-CG 3.66Å; P134-R140 PolarHBondContact O-NE 2.83Å; P134-R140 VanDerWaalsContact O-NE 3.07Å; P134-R140 PolarHBondContact O-NH2 3.45Å; P134-F152 HydrophobicContact CB-CD2 4.32Å
135	S	92.3	Very high	94.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.			trans	-79.3	70.9	170.1	60.5	0	0	0	0	108.9	H295 G296 G297 E302	S135-H295 PolarHBondContact O-ND1 2.88Å; S135-G296 WeakPolarHBondContact O-CA 3.28Å; S135-G296 PolarHBondContact O-N 3.22Å; S135-G296 VanDerWaalsContact OG-C 3.29Å; S135-G296 WeakPolarHBondContact OG-CA 3.39Å; S135-G296 PolarHBondContact OG-N 3.02Å; S135-G297 PolarHBondContact OG-N 2.94Å; S135-G297 PolarHBondContact OG-O 3.29Å; S135-E302 PolarHBondContact OG-OE1 2.8Å
136	V	92.2	Very high	94.5	Very high	34 Å²	34	17.2 Å²	17.2	21%	0.206	9%	0.09	C	C	.	.			trans	-136.6	138.6	-180	176	0	0	0	0	107.9	P134 M138 P139 R140 L155	P134-V136 HydrophobicContact CB-CG2 4.12Å; P134-V136 PolarHBondContact O-N 3.12Å; V136-M138 PolarHBondContact O-N 3.16Å; V136-P139 HydrophobicContact CB-CG 4.21Å; V136-P139 VanDerWaalsContact O-CD 3.22Å; V136-P139 WeakPolarHBondContact O-CD 3.28Å; V136-R140 WeakPolarHBondContact O-CG 3.37Å; V136-R140 PolarHBondContact O-N 3Å; V136-L155 HydrophobicContact CG1-CD1 4.17Å
137	T	92.6	Very high	94.5	Very high	19 Å²	19	16.8 Å²	16.8	12%	0.117	9%	0.088	C	C	.	.	H	α-helix	trans	-44.9	-55.8	-173.7	-38.8	0	0	0	0	113.4	D98 R140 I141 D286 H287	D98-T137 PolarHBondContact OD2-OG1 3.18Å; T137-R140 CarbonylContact O-C 3.42Å; T137-R140 WeakPolarHBondContact O-CA 3.45Å; T137-R140 WeakPolarHBondContact O-CB 3.48Å; T137-R140 PolarHBondContact O-N 3.37Å; T137-I141 HydrophobicContact CG2-CD1 3.95Å; T137-I141 HydrophobicContact CG2-CG1 4.48Å; T137-I141 WeakPolarHBondContact O-CG1 3.2Å; T137-I141 PolarHBondContact O-N 3.31Å; T137-D286 WeakPolarHBondContact CA-OD2 3.47Å; T137-H287 PolarHBondContact N-CD2 3.46Å; T137-H287 PolarHBondContact N-NE2 3.32Å; T137-H287 PolarHBondContact OG1-NE2 2.89Å
138	M	92.9	Very high	94.3	Very high	20 Å²	20	18 Å²	18	10%	0.099	10%	0.095	C	C	.	.	H	α-helix	trans	-60.6	-51.1	-175.3	-176.5	-93.9	-155	0	0	114	V136 R140 I141 K142 N158 T187 M191	V136-M138 PolarHBondContact O-N 3.16Å; M138-R140 VanDerWaalsContact C-N 3.29Å; M138-R140 PolarHBondContact O-N 2.85Å; M138-I141 PolarHBondContact O-N 3.1Å; M138-K142 PolarHBondContact O-N 2.87Å; M138-K142 HydrophobicContact SD-CD 4.45Å; M138-N158 HydrophobicContact CE-CB 3.33Å; M138-N158 HydrophobicContact SD-CB 4.46Å; M138-T187 HydrophobicContact CB-CG2 3.81Å; M138-T187 HydrophobicContact CG-CG2 3.81Å; M138-M191 HydrophobicContact CG-SD 3.74Å
139	P	92.4	Very high	93.9	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.013	10%	0.096	C	C	.	.	H	α-helix	trans	-54.7	-39.1	168.1	-30.4	35.7	0	0	0	114.5	P134 V136 K142 A143 P150 L155	P134-P139 HydrophobicContact CG-CB 3.77Å; P134-P139 HydrophobicContact CG-CG 3.66Å; V136-P139 HydrophobicContact CB-CG 4.21Å; V136-P139 VanDerWaalsContact O-CD 3.22Å; V136-P139 WeakPolarHBondContact O-CD 3.28Å; P139-K142 WeakPolarHBondContact O-CB 3.24Å; P139-K142 PolarHBondContact O-N 3.11Å; P139-A143 PolarHBondContact O-N 3.04Å; P139-P150 HydrophobicContact CB-CB 3.85Å; P139-P150 HydrophobicContact CB-CG 4.03Å; P139-P150 WeakPolarHBondContact O-CG 3.06Å; P139-L155 HydrophobicContact CG-CD1 3.9Å
140	R	95.1	Very high	93.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-68.5	-38.8	179.2	-66.2	-56.5	97	-162.5	5.7	112.4	Q132 P134 V136 T137 M138 K142 A143 L144 P150 D286 H287	Q132-R140 PolarHBondContact O-NH1 3.36Å; Q132-R140 PolarHBondContact O-NH2 3.37Å; P134-R140 PolarHBondContact O-NE 2.83Å; P134-R140 VanDerWaalsContact O-NE 3.07Å; P134-R140 PolarHBondContact O-NH2 3.45Å; V136-R140 WeakPolarHBondContact O-CG 3.37Å; V136-R140 PolarHBondContact O-N 3Å; T137-R140 CarbonylContact O-C 3.42Å; T137-R140 WeakPolarHBondContact O-CA 3.45Å; T137-R140 WeakPolarHBondContact O-CB 3.48Å; T137-R140 PolarHBondContact O-N 3.37Å; M138-R140 VanDerWaalsContact C-N 3.29Å; M138-R140 PolarHBondContact O-N 2.85Å; R140-K142 VanDerWaalsContact C-N 3.27Å; R140-K142 PolarHBondContact O-N 3Å; R140-A143 CarbonylContact O-C 3.52Å; R140-A143 WeakPolarHBondContact O-CB 3.42Å; R140-A143 PolarHBondContact O-N 2.8Å; R140-A143 VanDerWaalsContact O-N 3.1Å; R140-L144 WeakPolarHBondContact O-CB 3.29Å; R140-L144 WeakPolarHBondContact O-CG 3.35Å; R140-L144 PolarHBondContact O-N 3.22Å; R140-P150 VanDerWaalsContact NH2-CD 3.35Å; R140-D286 HydrophobicContact CB-CB 3.92Å; R140-D286 WeakPolarHBondContact CD-O 3.07Å; R140-D286 HydrophobicContact CG-CB 4.48Å; R140-D286 WeakPolarHBondContact CG-O 3.45Å; R140-H287 HydrophobicContact CG-CB 4Å
141	I	95.7	Very high	92	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-57.9	-41.6	171.7	-67.2	168.1	0	0	0	110.7	T137 M138 L144 T145 T187 W188 M191 F192	T137-I141 HydrophobicContact CG2-CD1 3.95Å; T137-I141 HydrophobicContact CG2-CG1 4.48Å; T137-I141 WeakPolarHBondContact O-CG1 3.2Å; T137-I141 PolarHBondContact O-N 3.31Å; M138-I141 PolarHBondContact O-N 3.1Å; I141-L144 PolarHBondContact O-N 2.78Å; I141-T145 WeakPolarHBondContact O-CG2 3.39Å; I141-T145 PolarHBondContact O-N 3.23Å; I141-T145 PolarHBondContact O-OG1 2.95Å; I141-T187 HydrophobicContact CD1-CG2 3.77Å; I141-W188 HydrophobicContact CB-CZ2 4.25Å; I141-W188 HydrophobicContact CD1-CD2 4.3Å; I141-W188 HydrophobicContact CD1-CG 4.15Å; I141-W188 HydrophobicContact CD1-CZ2 4.46Å; I141-W188 VanDerWaalsContact CD1-NE1 3.28Å; I141-W188 HydrophobicContact CG1-CD2 4.4Å; I141-W188 HydrophobicContact CG1-CZ2 3.78Å; I141-W188 HydrophobicContact CG2-CD2 3.83Å; I141-W188 HydrophobicContact CG2-CE3 3.9Å; I141-W188 HydrophobicContact CG2-CG 4.49Å; I141-W188 HydrophobicContact CG2-CH2 3.92Å; I141-W188 HydrophobicContact CG2-CZ2 3.8Å; I141-W188 HydrophobicContact CG2-CZ3 3.97Å; I141-M191 HydrophobicContact CB-CE 4.26Å; I141-M191 HydrophobicContact CB-SD 4.19Å; I141-M191 HydrophobicContact CG2-CE 3.76Å; I141-M191 HydrophobicContact CG2-SD 3.84Å; I141-F192 HydrophobicContact CG2-CE2 3.6Å; I141-F192 HydrophobicContact CG2-CZ 4.22Å
142	K	94.1	Very high	91.1	Very high	11 Å²	11	18.9 Å²	18.9	5%	0.048	10%	0.103	C	C	.	.	H	α-helix	trans	-59.3	-51.4	172.6	-64.8	-179	177.6	177.7	0	110.7	M138 P139 R140 L144 T145 S146 N158 F164 M191	M138-K142 PolarHBondContact O-N 2.87Å; M138-K142 HydrophobicContact SD-CD 4.45Å; P139-K142 WeakPolarHBondContact O-CB 3.24Å; P139-K142 PolarHBondContact O-N 3.11Å; R140-K142 VanDerWaalsContact C-N 3.27Å; R140-K142 PolarHBondContact O-N 3Å; K142-L144 VanDerWaalsContact C-N 3.32Å; K142-L144 PolarHBondContact O-N 3.36Å; K142-T145 PolarHBondContact O-N 2.83Å; K142-T145 VanDerWaalsContact O-N 3.16Å; K142-T145 PolarHBondContact O-OG1 2.97Å; K142-T145 VanDerWaalsContact O-OG1 3.11Å; K142-S146 PolarHBondContact O-N 2.71Å; K142-S146 PolarHBondContact O-OG 3.17Å; K142-N158 PolarHBondContact NZ-ND2 2.81Å; K142-F164 HydrophobicContact CB-CE1 4.44Å; K142-F164 HydrophobicContact CB-CE2 4.35Å; K142-F164 HydrophobicContact CB-CZ 4.1Å; K142-F164 HydrophobicContact CD-CD2 4.03Å; K142-F164 HydrophobicContact CD-CE2 3.86Å; K142-F164 HydrophobicContact CD-CZ 4.45Å; K142-F164 HydrophobicContact CG-CD2 4.05Å; K142-F164 HydrophobicContact CG-CE1 4.41Å; K142-F164 HydrophobicContact CG-CE2 3.93Å; K142-F164 HydrophobicContact CG-CG 4.35Å; K142-F164 HydrophobicContact CG-CZ 4.11Å; K142-M191 HydrophobicContact CB-CE 4.41Å; K142-M191 HydrophobicContact CD-CE 4.33Å; K142-M191 HydrophobicContact CG-CE 3.33Å
143	A	95	Very high	90	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.6	-40.5	179.2	0	0	0	0	0	112.7	P139 R140 T145 G147 P150 V326 V329	P139-A143 PolarHBondContact O-N 3.04Å; R140-A143 CarbonylContact O-C 3.52Å; R140-A143 WeakPolarHBondContact O-CB 3.42Å; R140-A143 PolarHBondContact O-N 2.8Å; R140-A143 VanDerWaalsContact O-N 3.1Å; A143-T145 PolarHBondContact O-N 2.7Å; A143-G147 WeakPolarHBondContact O-CA 3.43Å; A143-G147 PolarHBondContact O-N 3.45Å; A143-P150 HydrophobicContact CB-CG 4.01Å; A143-V326 HydrophobicContact CB-CG1 4.34Å; A143-V329 WeakPolarHBondContact O-CG2 3.47Å
144	L	98	Very high	88.9	Confident	10 Å²	10	17.9 Å²	17.9	5%	0.052	9%	0.094	C	C	.	.	H	α-helix	trans	-72.7	-12.7	-179.9	-73.8	172.2	0	0	0	114	I96 R140 I141 K142 L284 D286 Q325 L328 V329	I96-L144 HydrophobicContact CD1-CD1 4.18Å; R140-L144 WeakPolarHBondContact O-CB 3.29Å; R140-L144 WeakPolarHBondContact O-CG 3.35Å; R140-L144 PolarHBondContact O-N 3.22Å; I141-L144 PolarHBondContact O-N 2.78Å; K142-L144 VanDerWaalsContact C-N 3.32Å; K142-L144 PolarHBondContact O-N 3.36Å; L144-L284 HydrophobicContact CD1-CD1 4.37Å; L144-L284 HydrophobicContact CD2-CD1 3.61Å; L144-D286 HydrophobicContact CD1-CB 4.03Å; L144-Q325 HydrophobicContact CD2-CG 3.6Å; L144-Q325 HydrophobicContact CG-CG 4.42Å; L144-L328 HydrophobicContact CD2-CD2 4.19Å; L144-V329 VanDerWaalsContact C-CG2 3.5Å; L144-V329 VanDerWaalsContact O-CG2 3.22Å; L144-V329 WeakPolarHBondContact O-CG2 3.31Å
145	T	97.9	Very high	88	Confident	4 Å²	4	19.9 Å²	19.9	3%	0.025	10%	0.104	C	C	.	.	H	α-helix	trans	-112.4	-34.9	-179	55	0	0	0	0	112.9	I141 K142 A143 N168 L169 L170 W188 F192	I141-T145 WeakPolarHBondContact O-CG2 3.39Å; I141-T145 PolarHBondContact O-N 3.23Å; I141-T145 PolarHBondContact O-OG1 2.95Å; K142-T145 PolarHBondContact O-N 2.83Å; K142-T145 VanDerWaalsContact O-N 3.16Å; K142-T145 PolarHBondContact O-OG1 2.97Å; K142-T145 VanDerWaalsContact O-OG1 3.11Å; A143-T145 PolarHBondContact O-N 2.7Å; T145-N168 CarbonylContact O-C 3.59Å; T145-N168 WeakPolarHBondContact O-CA 3.35Å; T145-L169 WeakPolarHBondContact O-CB 3.07Å; T145-L169 PolarHBondContact O-N 2.79Å; T145-L170 HydrophobicContact CG2-CD1 4.45Å; T145-W188 HydrophobicContact CG2-CH2 3.79Å; T145-W188 HydrophobicContact CG2-CZ3 3.57Å; T145-F192 HydrophobicContact CG2-CE2 4.21Å; T145-F192 HydrophobicContact CG2-CZ 3.78Å; T145-F192 WeakPolarHBondContact OG1-CZ 3.24Å
146	S	96.2	Very high	87	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-101.3	-24.1	176.8	68.1	0	0	0	0	113.1	K142 T148 D167 N344	K142-S146 PolarHBondContact O-N 2.71Å; K142-S146 PolarHBondContact O-OG 3.17Å; S146-T148 PolarHBondContact O-N 2.86Å; S146-T148 WeakPolarHBondContact OG-CB 3.48Å; S146-T148 PolarHBondContact OG-N 2.98Å; S146-T148 VanDerWaalsContact OG-N 3.12Å; S146-T148 PolarHBondContact OG-OG1 3.21Å; S146-D167 WeakPolarHBondContact CB-O 3.07Å; S146-N344 WeakPolarHBondContact O-CA 3.29Å; S146-N344 VanDerWaalsContact O-CB 3.24Å; S146-N344 WeakPolarHBondContact O-CB 3.36Å; S146-N344 PolarHBondContact O-ND2 3.48Å; S146-N344 VanDerWaalsContact O-ND2 3.09Å
147	G	95.2	Very high	85.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.			trans	56.3	31.8	-167.2	0	0	0	0	0	113.6	A143 N344 V345	A143-G147 WeakPolarHBondContact O-CA 3.43Å; A143-G147 PolarHBondContact O-N 3.45Å; G147-N344 WeakPolarHBondContact CA-ND2 3.47Å; G147-V345 WeakPolarHBondContact O-CG2 3.37Å; G147-V345 PolarHBondContact O-N 3.1Å
148	T	91.7	Very high	84.4	Confident	24 Å²	24	29.8 Å²	29.8	15%	0.147	15%	0.154	C	C	.	.			trans	-85.9	153.7	162.1	59.2	0	0	0	0	110.1	S146 P150 R343	S146-T148 PolarHBondContact O-N 2.86Å; S146-T148 WeakPolarHBondContact OG-CB 3.48Å; S146-T148 PolarHBondContact OG-N 2.98Å; S146-T148 VanDerWaalsContact OG-N 3.12Å; S146-T148 PolarHBondContact OG-OG1 3.21Å; T148-P150 VanDerWaalsContact O-CD 3.28Å; T148-P150 WeakPolarHBondContact O-CD 3.39Å; T148-R343 HydrophobicContact CG2-CB 3.67Å; T148-R343 WeakPolarHBondContact CG2-O 3.42Å
149	I	88.9	Confident	82.9	Confident	59 Å²	59	37.8 Å²	37.8	30%	0.303	19%	0.189	S	C	.	.			trans	-81.3	113.7	167.2	-62	168.4	0	0	0	108.1	Q132 V345	Q132-I149 HydrophobicContact CB-CG2 3.76Å; Q132-I149 HydrophobicContact CG-CD1 4.21Å; Q132-I149 HydrophobicContact CG-CG1 4.25Å; Q132-I149 HydrophobicContact CG-CG2 3.93Å; I149-V345 HydrophobicContact CD1-CG2 4.18Å; I149-V345 HydrophobicContact CG1-CG2 3.97Å
150	P	81.3	Confident	81.5	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.019	22%	0.221	C	C	.	.			trans	-64.7	142.1	178.3	-17.1	30.9	0	0	0	111.4	P139 R140 A143 T148	P139-P150 HydrophobicContact CB-CB 3.85Å; P139-P150 HydrophobicContact CB-CG 4.03Å; P139-P150 WeakPolarHBondContact O-CG 3.06Å; R140-P150 VanDerWaalsContact NH2-CD 3.35Å; A143-P150 HydrophobicContact CB-CG 4.01Å; T148-P150 VanDerWaalsContact O-CD 3.28Å; T148-P150 WeakPolarHBondContact O-CD 3.39Å
151	A	75.1	Confident	79.9	Confident	8 Å²	8	42.9 Å²	42.9	7%	0.066	24%	0.235	C	C	.	.			trans	-88.9	149.7	173.5	0	0	0	0	0	110.9	V153 D154	A151-V153 HydrophobicContact CB-CG1 3.67Å; A151-V153 PolarHBondContact O-N 2.69Å; A151-D154 PolarHBondContact N-OD2 3.21Å; A151-D154 VanDerWaalsContact O-CB 3.26Å; A151-D154 WeakPolarHBondContact O-CB 3.49Å; A151-D154 PolarHBondContact O-N 3.16Å
152	F	74.6	Confident	78.9	Confident	114 Å²	114	45.2 Å²	45.2	50%	0.5	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-32.3	176.2	-165.7	-91.2	0	0	0	112.2	P134 D154 L155	P134-F152 HydrophobicContact CB-CD2 4.32Å; F152-D154 PolarHBondContact O-N 3.28Å; F152-L155 HydrophobicContact CE2-CD2 4.5Å; F152-L155 VanDerWaalsContact O-CB 3.29Å; F152-L155 WeakPolarHBondContact O-CB 3.35Å; F152-L155 PolarHBondContact O-N 2.66Å; F152-L155 VanDerWaalsContact O-N 3.16Å
153	V	68.8	Low	78.7	Confident	14 Å²	14	48.7 Å²	48.7	9%	0.085	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-28.6	173.9	68	0	0	0	0	112.6	L51 V55 A151 L155 L156 L157	L51-V153 HydrophobicContact CB-CB 4.41Å; L51-V153 HydrophobicContact CB-CG2 3.99Å; L51-V153 HydrophobicContact CD1-CG2 4.32Å; L51-V153 HydrophobicContact CD2-CB 4.3Å; L51-V153 HydrophobicContact CD2-CG2 4.48Å; V55-V153 HydrophobicContact CG2-CB 4.19Å; V55-V153 HydrophobicContact CG2-CG1 3.37Å; V55-V153 HydrophobicContact CG2-CG2 4.17Å; A151-V153 HydrophobicContact CB-CG1 3.67Å; A151-V153 PolarHBondContact O-N 2.69Å; V153-L155 PolarHBondContact O-N 3.02Å; V153-L156 PolarHBondContact O-N 3.07Å; V153-L156 VanDerWaalsContact O-N 3.14Å; V153-L157 HydrophobicContact CG2-CD1 3.83Å; V153-L157 HydrophobicContact CG2-CG 4.03Å; V153-L157 WeakPolarHBondContact O-CB 3.4Å; V153-L157 WeakPolarHBondContact O-CG 3.26Å; V153-L157 PolarHBondContact O-N 3.05Å
154	D	66.5	Low	78.5	Confident	52 Å²	52	49.4 Å²	49.4	28%	0.278	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-30.1	177.6	-61.1	-31.6	0	0	0	110.9	A151 F152 N158	A151-D154 PolarHBondContact N-OD2 3.21Å; A151-D154 VanDerWaalsContact O-CB 3.26Å; A151-D154 WeakPolarHBondContact O-CB 3.49Å; A151-D154 PolarHBondContact O-N 3.16Å; F152-D154 PolarHBondContact O-N 3.28Å; D154-N158 VanDerWaalsContact O-CB 3.23Å; D154-N158 WeakPolarHBondContact O-CB 3.38Å; D154-N158 PolarHBondContact O-N 3.19Å; D154-N158 PolarHBondContact O-ND2 2.93Å
155	L	70.8	Confident	78	Confident	42 Å²	42	54.6 Å²	54.6	22%	0.22	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-41.8	174.1	-173.1	68.8	0	0	0	111	V136 P139 F152 V153 F159	V136-L155 HydrophobicContact CG1-CD1 4.17Å; P139-L155 HydrophobicContact CG-CD1 3.9Å; F152-L155 HydrophobicContact CE2-CD2 4.5Å; F152-L155 VanDerWaalsContact O-CB 3.29Å; F152-L155 WeakPolarHBondContact O-CB 3.35Å; F152-L155 PolarHBondContact O-N 2.66Å; F152-L155 VanDerWaalsContact O-N 3.16Å; V153-L155 PolarHBondContact O-N 3.02Å; L155-F159 PolarHBondContact O-N 3.39Å
156	L	71.3	Confident	77.6	Confident	94 Å²	94	57.2 Å²	57.2	49%	0.492	31%	0.308	S	S	.	.	H	α-helix	trans	-71.7	-42.6	179.3	-66.4	174.1	0	0	0	112.4	L51 V153	L51-L156 HydrophobicContact CD1-CD1 3.81Å; L51-L156 HydrophobicContact CD2-CD1 4.18Å; V153-L156 PolarHBondContact O-N 3.07Å; V153-L156 VanDerWaalsContact O-N 3.14Å
157	L	67.4	Low	77.5	Confident	128 Å²	128	58.1 Å²	58.1	67%	0.67	31%	0.313	S	S	*	.	H	α-helix	trans	-74.3	-26.8	-177.7	-68.3	177.1	0	0	0	113	V153	V153-L157 HydrophobicContact CG2-CD1 3.83Å; V153-L157 HydrophobicContact CG2-CG 4.03Å; V153-L157 WeakPolarHBondContact O-CB 3.4Å; V153-L157 WeakPolarHBondContact O-CG 3.26Å; V153-L157 PolarHBondContact O-N 3.05Å
158	N	63.1	Low	77.6	Confident	40 Å²	40	58.1 Å²	58.1	21%	0.214	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	21.9	179.7	-54.8	-66.2	0	0	0	112.8	M138 K142 D154 G160 S161 S162	M138-N158 HydrophobicContact CE-CB 3.33Å; M138-N158 HydrophobicContact SD-CB 4.46Å; K142-N158 PolarHBondContact NZ-ND2 2.81Å; D154-N158 VanDerWaalsContact O-CB 3.23Å; D154-N158 WeakPolarHBondContact O-CB 3.38Å; D154-N158 PolarHBondContact O-N 3.19Å; D154-N158 PolarHBondContact O-ND2 2.93Å; N158-G160 PolarHBondContact O-N 3.14Å; N158-G160 VanDerWaalsContact O-N 3.08Å; N158-S161 PolarHBondContact O-N 2.7Å; N158-S161 VanDerWaalsContact O-N 3.16Å; N158-S162 WeakPolarHBondContact CB-OG 3.17Å; N158-S162 PolarHBondContact OD1-OG 2.77Å
159	F	62.6	Low	77.9	Confident	188 Å²	188	57.2 Å²	57.2	83%	0.825	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	111.6	172.7	-164.9	-93.6	0	0	0	108.7	L155	L155-F159 PolarHBondContact O-N 3.39Å
160	G	62.2	Low	78.3	Confident	66 Å²	66	54.5 Å²	54.5	68%	0.68	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.6	19.7	-171.9	0	0	0	0	0	115.8	N158	N158-G160 PolarHBondContact O-N 3.14Å; N158-G160 VanDerWaalsContact O-N 3.08Å
161	S	60.7	Low	79.1	Confident	43 Å²	43	57.3 Å²	57.3	30%	0.301	30%	0.303	S	S	.	.			trans	54.4	64.3	167.9	59.4	0	0	0	0	114	N158	N158-S161 PolarHBondContact O-N 2.7Å; N158-S161 VanDerWaalsContact O-N 3.16Å
162	S	76.5	Confident	80.1	Confident	48 Å²	48	58.5 Å²	58.5	34%	0.336	31%	0.306	S	S	.	.			trans	-68.2	151.9	167.3	44.5	0	0	0	0	111.6	N158 F164	N158-S162 WeakPolarHBondContact CB-OG 3.17Å; N158-S162 PolarHBondContact OD1-OG 2.77Å; S162-F164 PolarHBondContact O-N 2.82Å
163	E	89.4	Confident	81.2	Confident	84 Å²	84	53.1 Å²	53.1	39%	0.393	28%	0.283	S	S	.	.			trans	-53.9	134.5	170.4	179.5	176.9	163.9	0	0	110.6	H165 P193	E163-H165 PolarHBondContact O-CD2 3.28Å; E163-H165 PolarHBondContact O-N 2.93Å; E163-H165 IonicContact OE1-CE1 3.34Å; E163-H165 PolarHBondContact OE1-CE1 3.01Å; E163-H165 IonicContact OE1-ND1 3.73Å; E163-H165 PolarHBondContact OE1-ND1 2.76Å; E163-H165 IonicContact OE2-CE1 3.07Å; E163-H165 PolarHBondContact OE2-CE1 3.1Å; E163-P193 HydrophobicContact CB-CG 4.37Å; E163-P193 HydrophobicContact CG-CG 3.85Å
164	F	89.7	Confident	82.5	Confident	15 Å²	15	59.2 Å²	59.2	7%	0.066	30%	0.304	C	S	.	.			trans	-87.6	102.4	177.8	-174.8	-129.1	0	0	0	110.3	K142 S162 D166 N168 M191 F192	K142-F164 HydrophobicContact CB-CE1 4.44Å; K142-F164 HydrophobicContact CB-CE2 4.35Å; K142-F164 HydrophobicContact CB-CZ 4.1Å; K142-F164 HydrophobicContact CD-CD2 4.03Å; K142-F164 HydrophobicContact CD-CE2 3.86Å; K142-F164 HydrophobicContact CD-CZ 4.45Å; K142-F164 HydrophobicContact CG-CD2 4.05Å; K142-F164 HydrophobicContact CG-CE1 4.41Å; K142-F164 HydrophobicContact CG-CE2 3.93Å; K142-F164 HydrophobicContact CG-CG 4.35Å; K142-F164 HydrophobicContact CG-CZ 4.11Å; S162-F164 PolarHBondContact O-N 2.82Å; F164-D166 HydrophobicContact CD2-CB 4.38Å; F164-D166 HydrophobicContact CE1-CB 4.26Å; F164-D166 HydrophobicContact CE2-CB 3.65Å; F164-D166 HydrophobicContact CZ-CB 3.59Å; F164-N168 HydrophobicContact CE1-CB 4.11Å; F164-M191 HydrophobicContact CB-CB 4.21Å; F164-M191 HydrophobicContact CB-CE 3.95Å; F164-M191 HydrophobicContact CD1-CE 4.4Å; F164-M191 HydrophobicContact CG-CE 4.15Å; F164-M191 PolarHBondContact N-O 2.82Å; F164-F192 HydrophobicContact CB-CE1 4.27Å; F164-F192 AromaticContact CD1-CE1 3.69Å; F164-F192 HydrophobicContact CD1-CE1 3.69Å; F164-F192 AromaticContact CD1-CZ 3.89Å; F164-F192 HydrophobicContact CD1-CZ 3.89Å; F164-F192 HydrophobicContact CG-CE1 4.48Å
165	H	89.1	Confident	83.9	Confident	119 Å²	119	62.1 Å²	62.1	55%	0.551	32%	0.316	S	S	*	.			trans	-88.4	-11.6	-174	-64	-66.7	0	0	0	115.1	E163 R171	E163-H165 PolarHBondContact O-CD2 3.28Å; E163-H165 PolarHBondContact O-N 2.93Å; E163-H165 IonicContact OE1-CE1 3.34Å; E163-H165 PolarHBondContact OE1-CE1 3.01Å; E163-H165 IonicContact OE1-ND1 3.73Å; E163-H165 PolarHBondContact OE1-ND1 2.76Å; E163-H165 IonicContact OE2-CE1 3.07Å; E163-H165 PolarHBondContact OE2-CE1 3.1Å; H165-R171 VanDerWaalsContact C-NH2 3.31Å; H165-R171 PolarHBondContact O-NH1 2.77Å; H165-R171 PolarHBondContact O-NH2 3.04Å
166	D	89.5	Confident	85.1	Confident	59 Å²	59	62.8 Å²	62.8	32%	0.316	32%	0.324	S	S	.	.	S	Bend	trans	-67.6	156.2	177.2	-82.7	5	0	0	0	111	F164 N168 R343	F164-D166 HydrophobicContact CD2-CB 4.38Å; F164-D166 HydrophobicContact CE1-CB 4.26Å; F164-D166 HydrophobicContact CE2-CB 3.65Å; F164-D166 HydrophobicContact CZ-CB 3.59Å; D166-N168 PolarHBondContact O-ND2 2.78Å; D166-R343 IonicContact OD1-NH1 2.87Å; D166-R343 PolarHBondContact OD1-NH1 3.25Å; D166-R343 IonicContact OD2-NH1 2.92Å; D166-R343 PolarHBondContact OD2-NH1 2.92Å
167	D	94.1	Very high	86.3	Confident	21 Å²	21	65.5 Å²	65.5	11%	0.112	34%	0.339	C	S	.	.			trans	-62.2	136.8	175.7	-176	33.4	0	0	0	111.6	S146 R172 P341 E342	S146-D167 WeakPolarHBondContact CB-O 3.07Å; D167-R172 VanDerWaalsContact CG-NH2 3.26Å; D167-R172 IonicContact OD1-CZ 2.82Å; D167-R172 IonicContact OD1-NE 3.12Å; D167-R172 PolarHBondContact OD1-NE 2.72Å; D167-R172 IonicContact OD1-NH2 3.36Å; D167-R172 IonicContact OD2-CZ 3.98Å; D167-R172 IonicContact OD2-NE 3.57Å; D167-R172 PolarHBondContact OD2-NE 3.43Å; D167-R172 IonicContact OD2-NH2 3.15Å; D167-R172 PolarHBondContact OD2-NH2 2.96Å; D167-P341 WeakPolarHBondContact OD2-CA 3.31Å; D167-E342 HydrophobicContact CB-CB 4.44Å; D167-E342 PolarHBondContact OD2-N 2.88Å
168	N	96.6	Very high	87.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.32	C	S	.	.			trans	-158.6	164.8	-170.9	68.1	75.1	0	0	0	111.4	T145 F164 D166 L170 R171 R172	T145-N168 CarbonylContact O-C 3.59Å; T145-N168 WeakPolarHBondContact O-CA 3.35Å; F164-N168 HydrophobicContact CE1-CB 4.11Å; D166-N168 PolarHBondContact O-ND2 2.78Å; N168-L170 VanDerWaalsContact C-N 3.33Å; N168-L170 PolarHBondContact O-N 3.41Å; N168-L170 WeakPolarHBondContact OD1-CB 3.26Å; N168-L170 PolarHBondContact OD1-N 2.82Å; N168-R171 WeakPolarHBondContact O-CB 3.42Å; N168-R171 PolarHBondContact O-N 3.36Å; N168-R171 PolarHBondContact OD1-N 2.88Å; N168-R172 WeakPolarHBondContact O-CG 3.24Å; N168-R172 PolarHBondContact O-N 3.37Å
169	L	97.9	Very high	89.4	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-58.6	-39.8	-175.5	-172.1	60.2	0	0	0	113	T145 R171 R172 M173 M232 L332 A333 L338	T145-L169 WeakPolarHBondContact O-CB 3.07Å; T145-L169 PolarHBondContact O-N 2.79Å; L169-R171 PolarHBondContact O-N 3.28Å; L169-R172 PolarHBondContact O-N 3.45Å; L169-M173 WeakPolarHBondContact O-CB 3.39Å; L169-M173 VanDerWaalsContact O-CG 3.28Å; L169-M173 WeakPolarHBondContact O-CG 3.36Å; L169-M173 PolarHBondContact O-N 2.9Å; L169-M232 HydrophobicContact CD2-CE 3.77Å; L169-M232 HydrophobicContact CG-CE 4.4Å; L169-L332 HydrophobicContact CD2-CB 3.88Å; L169-L332 HydrophobicContact CD2-CD1 4.05Å; L169-A333 HydrophobicContact CD1-CB 4.07Å; L169-L338 HydrophobicContact CD1-CD1 3.76Å
170	L	98.3	Very high	91.1	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-66	-39.1	179.1	-63.2	176	0	0	0	111.7	T145 N168 M173 R174 W188 F192 H195 F196 I234	T145-L170 HydrophobicContact CG2-CD1 4.45Å; N168-L170 VanDerWaalsContact C-N 3.33Å; N168-L170 PolarHBondContact O-N 3.41Å; N168-L170 WeakPolarHBondContact OD1-CB 3.26Å; N168-L170 PolarHBondContact OD1-N 2.82Å; L170-M173 PolarHBondContact O-N 3.25Å; L170-R174 PolarHBondContact O-N 2.78Å; L170-W188 HydrophobicContact CD1-CE3 4.35Å; L170-W188 HydrophobicContact CD1-CZ3 4.13Å; L170-F192 HydrophobicContact CD1-CB 4.11Å; L170-F192 HydrophobicContact CD1-CD1 3.77Å; L170-F192 HydrophobicContact CD1-CD2 3.81Å; L170-F192 HydrophobicContact CD1-CE1 4.06Å; L170-F192 HydrophobicContact CD1-CE2 4.13Å; L170-F192 HydrophobicContact CD1-CG 3.63Å; L170-F192 HydrophobicContact CD1-CZ 4.26Å; L170-H195 HydrophobicContact CB-CB 4.42Å; L170-F196 HydrophobicContact CD1-CE1 3.86Å; L170-F196 HydrophobicContact CD1-CZ 3.58Å; L170-F196 HydrophobicContact CD2-CE1 3.94Å; L170-I234 HydrophobicContact CD2-CD1 3.94Å
171	R	97.3	Very high	92.8	Very high	61 Å²	61	49.5 Å²	49.5	23%	0.23	25%	0.25	C	C	.	.	H	α-helix	trans	-62.5	-49.5	172.2	180	176.9	-64	169.1	3.9	111	H165 N168 L169 M173 R174 E175	H165-R171 VanDerWaalsContact C-NH2 3.31Å; H165-R171 PolarHBondContact O-NH1 2.77Å; H165-R171 PolarHBondContact O-NH2 3.04Å; N168-R171 WeakPolarHBondContact O-CB 3.42Å; N168-R171 PolarHBondContact O-N 3.36Å; N168-R171 PolarHBondContact OD1-N 2.88Å; L169-R171 PolarHBondContact O-N 3.28Å; R171-M173 VanDerWaalsContact C-N 3.28Å; R171-M173 PolarHBondContact O-N 3.18Å; R171-R174 PolarHBondContact O-N 2.81Å; R171-R174 VanDerWaalsContact O-N 3.14Å; R171-E175 HydrophobicContact CG-CG 4.31Å; R171-E175 WeakPolarHBondContact CG-OE1 3.48Å; R171-E175 WeakPolarHBondContact O-CG 3.11Å; R171-E175 PolarHBondContact O-N 2.83Å
172	R	96.5	Very high	94.6	Very high	34 Å²	34	47.4 Å²	47.4	13%	0.128	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-37.8	178.7	-64.4	-54.4	-174.1	-176.7	2.3	112.6	D167 N168 L169 E175 S176 E342	D167-R172 VanDerWaalsContact CG-NH2 3.26Å; D167-R172 IonicContact OD1-CZ 2.82Å; D167-R172 IonicContact OD1-NE 3.12Å; D167-R172 PolarHBondContact OD1-NE 2.72Å; D167-R172 IonicContact OD1-NH2 3.36Å; D167-R172 IonicContact OD2-CZ 3.98Å; D167-R172 IonicContact OD2-NE 3.57Å; D167-R172 PolarHBondContact OD2-NE 3.43Å; D167-R172 IonicContact OD2-NH2 3.15Å; D167-R172 PolarHBondContact OD2-NH2 2.96Å; N168-R172 WeakPolarHBondContact O-CG 3.24Å; N168-R172 PolarHBondContact O-N 3.37Å; L169-R172 PolarHBondContact O-N 3.45Å; R172-E175 IonicContact NH1-OE2 2.66Å; R172-E175 PolarHBondContact NH1-OE2 3.25Å; R172-E175 VanDerWaalsContact NH1-OE2 3.12Å; R172-S176 WeakPolarHBondContact O-CB 3.18Å; R172-S176 PolarHBondContact O-N 3.28Å; R172-S176 VanDerWaalsContact O-N 3.15Å; R172-S176 PolarHBondContact O-OG 3.05Å; R172-E342 IonicContact CZ-OE1 3.61Å; R172-E342 IonicContact NH2-OE1 2.71Å; R172-E342 PolarHBondContact NH2-OE1 2.87Å
173	M	97.4	Very high	95.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-52.2	172.4	-77.4	-177.2	72.5	0	0	111.6	L169 L170 R171 E175 S176 N177 L178 T231 M232 L338	L169-M173 WeakPolarHBondContact O-CB 3.39Å; L169-M173 VanDerWaalsContact O-CG 3.28Å; L169-M173 WeakPolarHBondContact O-CG 3.36Å; L169-M173 PolarHBondContact O-N 2.9Å; L170-M173 PolarHBondContact O-N 3.25Å; R171-M173 VanDerWaalsContact C-N 3.28Å; R171-M173 PolarHBondContact O-N 3.18Å; M173-E175 PolarHBondContact O-N 3.37Å; M173-S176 CarbonylContact O-C 3.58Å; M173-S176 WeakPolarHBondContact O-CA 3.17Å; M173-S176 PolarHBondContact O-N 2.77Å; M173-N177 PolarHBondContact O-N 3.33Å; M173-L178 CarbonylContact C-O 3.52Å; M173-L178 HydrophobicContact CB-CB 4.05Å; M173-L178 HydrophobicContact CE-CB 3.97Å; M173-L178 HydrophobicContact CG-CB 4.33Å; M173-L178 PolarHBondContact O-N 2.92Å; M173-T231 HydrophobicContact CE-CG2 4.27Å; M173-M232 HydrophobicContact CE-CB 3.53Å; M173-M232 HydrophobicContact SD-CB 3.94Å; M173-M232 HydrophobicContact SD-CE 3.82Å; M173-M232 HydrophobicContact SD-SD 4Å; M173-L338 HydrophobicContact CB-CD1 4.49Å; M173-L338 HydrophobicContact CG-CD1 3.52Å
174	R	96.1	Very high	96.1	Very high	142 Å²	142	41.6 Å²	41.6	54%	0.536	20%	0.203	S	C	.	.	H	α-helix	trans	-60.3	-44.2	-179.7	-176.5	178.3	177.3	176.4	1.4	112.3	L170 R171 S176 N177 G194	L170-R174 PolarHBondContact O-N 2.78Å; R171-R174 PolarHBondContact O-N 2.81Å; R171-R174 VanDerWaalsContact O-N 3.14Å; R174-S176 PolarHBondContact O-N 3.18Å; R174-N177 PolarHBondContact O-N 3.33Å; R174-N177 VanDerWaalsContact O-N 3.07Å; R174-G194 PolarHBondContact NH1-O 2.91Å; R174-G194 VanDerWaalsContact NH1-O 3.07Å
175	E	95.4	Very high	96.4	Very high	114 Å²	114	41 Å²	41	53%	0.533	20%	0.2	S	C	.	.	H	α-helix	trans	-60.7	-27.5	175.2	-72.1	174	176.7	0	0	112.5	R171 R172 M173	R171-E175 HydrophobicContact CG-CG 4.31Å; R171-E175 WeakPolarHBondContact CG-OE1 3.48Å; R171-E175 WeakPolarHBondContact O-CG 3.11Å; R171-E175 PolarHBondContact O-N 2.83Å; R172-E175 IonicContact NH1-OE2 2.66Å; R172-E175 PolarHBondContact NH1-OE2 3.25Å; R172-E175 VanDerWaalsContact NH1-OE2 3.12Å; M173-E175 PolarHBondContact O-N 3.37Å
176	S	95.3	Very high	96.7	Very high	55 Å²	55	37.7 Å²	37.7	39%	0.385	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	12.1	177.9	-52.9	0	0	0	0	113.3	R172 M173 R174 L178 L338	R172-S176 WeakPolarHBondContact O-CB 3.18Å; R172-S176 PolarHBondContact O-N 3.28Å; R172-S176 VanDerWaalsContact O-N 3.15Å; R172-S176 PolarHBondContact O-OG 3.05Å; M173-S176 CarbonylContact O-C 3.58Å; M173-S176 WeakPolarHBondContact O-CA 3.17Å; M173-S176 PolarHBondContact O-N 2.77Å; R174-S176 PolarHBondContact O-N 3.18Å; S176-L178 PolarHBondContact O-N 3.07Å; S176-L338 WeakPolarHBondContact OG-CD2 3.48Å
177	N	96.4	Very high	96.9	Very high	152 Å²	152	35.9 Å²	35.9	81%	0.813	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	23.5	-175.5	-58.4	-60.4	0	0	0	114.7	M173 R174	M173-N177 PolarHBondContact O-N 3.33Å; R174-N177 PolarHBondContact O-N 3.33Å; R174-N177 VanDerWaalsContact O-N 3.07Å
178	L	97.5	Very high	97	Very high	49 Å²	49	35 Å²	35	26%	0.257	17%	0.171	S	C	.	.			trans	-86	143	170.2	-57.8	179.6	0	0	0	109.4	M173 S176 T231 L338	M173-L178 CarbonylContact C-O 3.52Å; M173-L178 HydrophobicContact CB-CB 4.05Å; M173-L178 HydrophobicContact CE-CB 3.97Å; M173-L178 HydrophobicContact CG-CB 4.33Å; M173-L178 PolarHBondContact O-N 2.92Å; S176-L178 PolarHBondContact O-N 3.07Å; L178-T231 HydrophobicContact CB-CG2 4.41Å; L178-T231 HydrophobicContact CD1-CG2 4.23Å; L178-T231 HydrophobicContact CD2-CG2 4.32Å; L178-L338 HydrophobicContact CD1-CD1 4.15Å; L178-L338 HydrophobicContact CD1-CD2 3.8Å; L178-L338 HydrophobicContact CD1-CG 4.15Å
179	S	98.3	Very high	97	Very high	33 Å²	33	37.5 Å²	37.5	23%	0.231	18%	0.184	C	C	.	.			trans	-105	138.6	-175.9	-68.7	0	0	0	0	111.1	D229 T231 M232	S179-D229 VanDerWaalsContact CB-O 3.24Å; S179-D229 WeakPolarHBondContact CB-O 3.38Å; S179-T231 PolarHBondContact O-N 3.16Å; S179-M232 PolarHBondContact O-N 2.96Å
180	S	98.6	Very high	96.8	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.021	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.3	170	48.5	0	0	0	0	111.7	H195 F196 R197 M232	S180-H195 PolarHBondContact OG-O 3.46Å; S180-F196 CarbonylContact O-C 3.52Å; S180-F196 WeakPolarHBondContact O-CA 3.3Å; S180-R197 PolarHBondContact O-N 2.85Å; S180-M232 CarbonylContact C-O 3.44Å; S180-M232 WeakPolarHBondContact CA-O 3.22Å
181	V	98.8	Very high	96.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	150.7	169.9	-63.6	0	0	0	0	109.9	Y183 R197 R198 W230 M232 M233 I234	V181-Y183 HydrophobicContact CB-CE2 4.36Å; V181-R197 HydrophobicContact CG1-CB 4.43Å; V181-R198 VanDerWaalsContact CA-O 3.29Å; V181-R198 WeakPolarHBondContact CA-O 3.41Å; V181-R198 HydrophobicContact CG1-CB 4.04Å; V181-W230 HydrophobicContact CG1-CB 4Å; V181-W230 HydrophobicContact CG1-CG 4.49Å; V181-W230 HydrophobicContact CG2-CB 4.1Å; V181-W230 HydrophobicContact CG2-CD2 4.46Å; V181-W230 HydrophobicContact CG2-CG 3.98Å; V181-M232 PolarHBondContact N-O 3.39Å; V181-M233 HydrophobicContact CG2-CB 3.85Å; V181-M233 HydrophobicContact CG2-CE 4.5Å; V181-M233 HydrophobicContact CG2-CG 3.89Å; V181-I234 PolarHBondContact O-N 3.44Å
182	F	98.8	Very high	96.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	135.9	-172.1	169.1	-95.7	0	0	0	114.2	G184 D185 W188 L189 F196 R198 S199 E200 I234 H236	F182-G184 VanDerWaalsContact CZ-C 3.49Å; F182-D185 VanDerWaalsContact CZ-O 3.24Å; F182-D185 WeakPolarHBondContact CZ-O 3.26Å; F182-W188 HydrophobicContact CD1-CB 4.08Å; F182-W188 HydrophobicContact CD2-CB 4.08Å; F182-W188 HydrophobicContact CD2-CD2 4.12Å; F182-W188 AromaticContact CD2-CG 3.94Å; F182-W188 HydrophobicContact CD2-CG 3.94Å; F182-W188 HydrophobicContact CE1-CB 3.62Å; F182-W188 HydrophobicContact CE1-CG 4.16Å; F182-W188 HydrophobicContact CE2-CB 3.63Å; F182-W188 AromaticContact CE2-CD1 3.32Å; F182-W188 AromaticContact CE2-CD2 3.74Å; F182-W188 HydrophobicContact CE2-CD2 3.74Å; F182-W188 AromaticContact CE2-CG 3.27Å; F182-W188 HydrophobicContact CE2-CG 3.27Å; F182-W188 AromaticContact CE2-NE1 3.78Å; F182-W188 HydrophobicContact CG-CB 4.3Å; F182-W188 HydrophobicContact CZ-CB 3.37Å; F182-W188 AromaticContact CZ-CD1 3.34Å; F182-W188 HydrophobicContact CZ-CD2 4.34Å; F182-W188 AromaticContact CZ-CG 3.41Å; F182-W188 HydrophobicContact CZ-CG 3.41Å; F182-W188 VanDerWaalsContact CZ-CG 3.41Å; F182-L189 HydrophobicContact CD1-CD2 3.63Å; F182-L189 HydrophobicContact CD1-CG 4.26Å; F182-L189 HydrophobicContact CE1-CD2 4.05Å; F182-L189 HydrophobicContact CE1-CG 4.16Å; F182-F196 HydrophobicContact CB-CB 4.35Å; F182-F196 HydrophobicContact CB-CD1 3.43Å; F182-F196 VanDerWaalsContact CB-CD1 3.43Å; F182-F196 HydrophobicContact CB-CD2 3.79Å; F182-F196 HydrophobicContact CB-CE1 3.53Å; F182-F196 HydrophobicContact CB-CE2 3.86Å; F182-F196 HydrophobicContact CB-CG 3.57Å; F182-F196 HydrophobicContact CB-CZ 3.74Å; F182-F196 HydrophobicContact CD1-CE2 4.36Å; F182-F196 HydrophobicContact CD2-CZ 4.35Å; F182-F196 HydrophobicContact CG-CD2 4.31Å; F182-F196 HydrophobicContact CG-CE1 4.28Å; F182-F196 HydrophobicContact CG-CE2 4.03Å; F182-F196 HydrophobicContact CG-CZ 4.01Å; F182-R198 PolarHBondContact N-O 3.47Å; F182-R198 VanDerWaalsContact N-O 3.1Å; F182-S199 CarbonylContact O-C 3.57Å; F182-S199 WeakPolarHBondContact O-CA 3.38Å; F182-S199 VanDerWaalsContact O-CB 3.29Å; F182-S199 WeakPolarHBondContact O-CB 3.49Å; F182-E200 PolarHBondContact O-N 3.45Å; F182-E200 VanDerWaalsContact O-N 3.09Å; F182-I234 WeakPolarHBondContact CA-O 3.33Å; F182-I234 HydrophobicContact CD2-CB 3.92Å; F182-I234 HydrophobicContact CD2-CG2 3.79Å; F182-I234 HydrophobicContact CE2-CG2 4.16Å; F182-H236 HydrophobicContact CE2-CB 4.18Å
183	Y	98.8	Very high	96.5	Very high	9 Å²	9	39.6 Å²	39.6	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	127.8	172	-57.7	-79.3	0	0	0	110.7	V181 E200 H220 E224 I234 L235 H236	V181-Y183 HydrophobicContact CB-CE2 4.36Å; Y183-E200 WeakPolarHBondContact CA-O 3.23Å; Y183-E200 HydrophobicContact CD1-CB 3.8Å; Y183-E200 HydrophobicContact CE1-CB 3.95Å; Y183-H220 HydrophobicContact CD1-CB 3.96Å; Y183-H220 AromaticContact CD1-CD2 2.97Å; Y183-H220 WeakPolarHBondContact CD1-CD2 3.34Å; Y183-H220 AromaticContact CD1-CE1 3.96Å; Y183-H220 AromaticContact CD1-CG 3.48Å; Y183-H220 VanDerWaalsContact CD1-CG 3.48Å; Y183-H220 AromaticContact CD1-NE2 3.25Å; Y183-H220 VanDerWaalsContact CD1-NE2 3.25Å; Y183-H220 WeakPolarHBondContact CD1-NE2 3.28Å; Y183-H220 HydrophobicContact CD2-CB 4.14Å; Y183-H220 HydrophobicContact CE1-CB 3.9Å; Y183-H220 AromaticContact CE1-CD2 3.25Å; Y183-H220 WeakPolarHBondContact CE1-CD2 3.39Å; Y183-H220 AromaticContact CE1-CE1 3.46Å; Y183-H220 VanDerWaalsContact CE1-CE1 3.46Å; Y183-H220 WeakPolarHBondContact CE1-CE1 3.29Å; Y183-H220 AromaticContact CE1-CG 3.34Å; Y183-H220 AromaticContact CE1-ND1 3.54Å; Y183-H220 AromaticContact CE1-NE2 3.25Å; Y183-H220 WeakPolarHBondContact CE1-NE2 3.45Å; Y183-H220 HydrophobicContact CE2-CB 4.15Å; Y183-H220 HydrophobicContact CG-CB 4.03Å; Y183-H220 AromaticContact CG-CD2 3.68Å; Y183-H220 AromaticContact CZ-CG 3.87Å; Y183-E224 HydrophobicContact CE2-CG 3.57Å; Y183-E224 PolarHBondContact OH-OE1 2.91Å; Y183-I234 PolarHBondContact N-O 3.05Å; Y183-L235 HydrophobicContact CD2-CD2 4.22Å; Y183-L235 CarbonylContact O-C 3.28Å; Y183-L235 VanDerWaalsContact O-CA 3.23Å; Y183-L235 WeakPolarHBondContact O-CA 3.49Å; Y183-H236 PolarHBondContact O-N 3.09Å
184	G	98.4	Very high	96.3	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.7	-152.6	-176.1	0	0	0	0	0	113.9	F182 E186 E200 G201 T202 H236	F182-G184 VanDerWaalsContact CZ-C 3.49Å; G184-E186 PolarHBondContact O-N 2.78Å; G184-E200 PolarHBondContact N-O 2.81Å; G184-G201 CarbonylContact O-C 3.48Å; G184-G201 VanDerWaalsContact O-CA 3.22Å; G184-G201 WeakPolarHBondContact O-CA 3.47Å; G184-T202 PolarHBondContact O-N 2.82Å; G184-H236 WeakPolarHBondContact CA-O 3.23Å
185	D	95.6	Very high	96.4	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.011	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.1	124.7	-179.8	-171	-54.1	0	0	0	112.7	F182 T187 W188 L238	F182-D185 VanDerWaalsContact CZ-O 3.24Å; F182-D185 WeakPolarHBondContact CZ-O 3.26Å; D185-T187 PolarHBondContact O-N 2.89Å; D185-T187 WeakPolarHBondContact OD1-CA 3.49Å; D185-T187 WeakPolarHBondContact OD1-CB 3.02Å; D185-T187 PolarHBondContact OD1-N 3.35Å; D185-T187 PolarHBondContact OD1-OG1 2.9Å; D185-W188 PolarHBondContact O-N 3.42Å; D185-W188 VanDerWaalsContact O-N 3.16Å; D185-L238 HydrophobicContact CB-CD1 4.23Å; D185-L238 HydrophobicContact CB-CD2 4.03Å; D185-L238 HydrophobicContact CB-CG 4.32Å; D185-L238 WeakPolarHBondContact OD2-CD2 3.27Å
186	E	95.1	Very high	96.5	Very high	50 Å²	50	32.4 Å²	32.4	23%	0.234	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.8	-177.9	67.7	-172.4	162	0	0	114.8	G184 W188 L189 H190 T202 T203	G184-E186 PolarHBondContact O-N 2.78Å; E186-W188 PolarHBondContact O-N 3.1Å; E186-W188 VanDerWaalsContact O-N 3.15Å; E186-L189 WeakPolarHBondContact O-CB 3.39Å; E186-L189 PolarHBondContact O-N 2.71Å; E186-H190 PolarHBondContact O-CD2 3.09Å; E186-H190 VanDerWaalsContact O-CD2 3.28Å; E186-H190 PolarHBondContact O-N 2.83Å; E186-T202 PolarHBondContact N-O 2.78Å; E186-T203 WeakPolarHBondContact OE1-CA 3.34Å; E186-T203 VanDerWaalsContact OE1-CB 3.28Å; E186-T203 WeakPolarHBondContact OE1-CB 3.49Å; E186-T203 PolarHBondContact OE1-OG1 3.14Å
187	T	93.9	Very high	96.7	Very high	21 Å²	21	36.3 Å²	36.3	13%	0.129	20%	0.198	C	C	.	.	H	α-helix	trans	-50.1	-37.6	171.1	-60.5	0	0	0	0	111.8	M138 I141 D185 L189 H190 M191	M138-T187 HydrophobicContact CB-CG2 3.81Å; M138-T187 HydrophobicContact CG-CG2 3.81Å; I141-T187 HydrophobicContact CD1-CG2 3.77Å; D185-T187 PolarHBondContact O-N 2.89Å; D185-T187 WeakPolarHBondContact OD1-CA 3.49Å; D185-T187 WeakPolarHBondContact OD1-CB 3.02Å; D185-T187 PolarHBondContact OD1-N 3.35Å; D185-T187 PolarHBondContact OD1-OG1 2.9Å; T187-L189 VanDerWaalsContact C-N 3.33Å; T187-L189 PolarHBondContact O-N 2.77Å; T187-H190 PolarHBondContact O-N 2.91Å; T187-M191 HydrophobicContact CG2-CG 4.24Å; T187-M191 HydrophobicContact CG2-SD 3.67Å; T187-M191 WeakPolarHBondContact O-CB 3.41Å; T187-M191 VanDerWaalsContact O-CG 3.28Å; T187-M191 WeakPolarHBondContact O-CG 3.36Å; T187-M191 PolarHBondContact O-N 3.06Å
188	W	96.8	Very high	96.8	Very high	3 Å²	3	31.6 Å²	31.6	1%	0.011	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-40	175.8	-74.9	85.6	0	0	0	112.7	I96 I141 T145 L170 F182 D185 E186 M191 F192 F196 I234 H236	I96-W188 HydrophobicContact CD1-CH2 4.17Å; I96-W188 HydrophobicContact CD1-CZ2 3.49Å; I96-W188 VanDerWaalsContact CD1-CZ2 3.49Å; I141-W188 HydrophobicContact CB-CZ2 4.25Å; I141-W188 HydrophobicContact CD1-CD2 4.3Å; I141-W188 HydrophobicContact CD1-CG 4.15Å; I141-W188 HydrophobicContact CD1-CZ2 4.46Å; I141-W188 VanDerWaalsContact CD1-NE1 3.28Å; I141-W188 HydrophobicContact CG1-CD2 4.4Å; I141-W188 HydrophobicContact CG1-CZ2 3.78Å; I141-W188 HydrophobicContact CG2-CD2 3.83Å; I141-W188 HydrophobicContact CG2-CE3 3.9Å; I141-W188 HydrophobicContact CG2-CG 4.49Å; I141-W188 HydrophobicContact CG2-CH2 3.92Å; I141-W188 HydrophobicContact CG2-CZ2 3.8Å; I141-W188 HydrophobicContact CG2-CZ3 3.97Å; T145-W188 HydrophobicContact CG2-CH2 3.79Å; T145-W188 HydrophobicContact CG2-CZ3 3.57Å; L170-W188 HydrophobicContact CD1-CE3 4.35Å; L170-W188 HydrophobicContact CD1-CZ3 4.13Å; F182-W188 HydrophobicContact CD1-CB 4.08Å; F182-W188 HydrophobicContact CD2-CB 4.08Å; F182-W188 HydrophobicContact CD2-CD2 4.12Å; F182-W188 AromaticContact CD2-CG 3.94Å; F182-W188 HydrophobicContact CD2-CG 3.94Å; F182-W188 HydrophobicContact CE1-CB 3.62Å; F182-W188 HydrophobicContact CE1-CG 4.16Å; F182-W188 HydrophobicContact CE2-CB 3.63Å; F182-W188 AromaticContact CE2-CD1 3.32Å; F182-W188 AromaticContact CE2-CD2 3.74Å; F182-W188 HydrophobicContact CE2-CD2 3.74Å; F182-W188 AromaticContact CE2-CG 3.27Å; F182-W188 HydrophobicContact CE2-CG 3.27Å; F182-W188 AromaticContact CE2-NE1 3.78Å; F182-W188 HydrophobicContact CG-CB 4.3Å; F182-W188 HydrophobicContact CZ-CB 3.37Å; F182-W188 AromaticContact CZ-CD1 3.34Å; F182-W188 HydrophobicContact CZ-CD2 4.34Å; F182-W188 AromaticContact CZ-CG 3.41Å; F182-W188 HydrophobicContact CZ-CG 3.41Å; F182-W188 VanDerWaalsContact CZ-CG 3.41Å; D185-W188 PolarHBondContact O-N 3.42Å; D185-W188 VanDerWaalsContact O-N 3.16Å; E186-W188 PolarHBondContact O-N 3.1Å; E186-W188 VanDerWaalsContact O-N 3.15Å; W188-M191 PolarHBondContact O-N 2.79Å; W188-F192 AromaticContact CE3-CD2 3.79Å; W188-F192 HydrophobicContact CE3-CD2 3.79Å; W188-F192 AromaticContact CE3-CE2 3.68Å; W188-F192 HydrophobicContact CE3-CE2 3.68Å; W188-F192 HydrophobicContact CZ3-CD2 4.41Å; W188-F192 AromaticContact CZ3-CE2 3.98Å; W188-F192 HydrophobicContact CZ3-CE2 3.98Å; W188-F192 WeakPolarHBondContact O-CB 3.23Å; W188-F192 WeakPolarHBondContact O-CD2 3.45Å; W188-F192 PolarHBondContact O-N 3.42Å; W188-F196 HydrophobicContact CB-CE2 4.39Å; W188-F196 AromaticContact CE3-CZ 3.98Å; W188-F196 HydrophobicContact CE3-CZ 3.98Å; W188-I234 HydrophobicContact CH2-CD1 4.15Å; W188-I234 HydrophobicContact CH2-CG2 4.08Å; W188-I234 HydrophobicContact CZ2-CG2 4.08Å; W188-I234 HydrophobicContact CZ3-CD1 3.83Å; W188-I234 HydrophobicContact CZ3-CG2 4.38Å; W188-H236 AromaticContact CE2-ND1 3.87Å; W188-H236 AromaticContact NE1-CE1 3.97Å; W188-H236 AromaticContact NE1-CG 3.73Å; W188-H236 AromaticContact NE1-ND1 3.04Å; W188-H236 PolarHBondContact NE1-ND1 2.97Å
189	L	96.2	Very high	96.8	Very high	52 Å²	52	31.8 Å²	31.8	27%	0.272	17%	0.174	S	C	.	.	H	α-helix	trans	-70.2	-36.6	-178.5	-59.1	-172.2	0	0	0	111.7	F182 E186 T187 F196 S199	F182-L189 HydrophobicContact CD1-CD2 3.63Å; F182-L189 HydrophobicContact CD1-CG 4.26Å; F182-L189 HydrophobicContact CE1-CD2 4.05Å; F182-L189 HydrophobicContact CE1-CG 4.16Å; E186-L189 WeakPolarHBondContact O-CB 3.39Å; E186-L189 PolarHBondContact O-N 2.71Å; T187-L189 VanDerWaalsContact C-N 3.33Å; T187-L189 PolarHBondContact O-N 2.77Å; L189-F196 HydrophobicContact CD2-CD2 4Å; L189-F196 HydrophobicContact CD2-CE2 4.34Å; L189-S199 WeakPolarHBondContact CD2-OG 3.5Å
190	H	94.1	Very high	96.8	Very high	89 Å²	89	34 Å²	34	41%	0.412	18%	0.181	S	C	.	.	H	α-helix	trans	-69.4	-39.9	174.4	-65.4	-55.1	0	0	0	112.4	E186 T187	E186-H190 PolarHBondContact O-CD2 3.09Å; E186-H190 VanDerWaalsContact O-CD2 3.28Å; E186-H190 PolarHBondContact O-N 2.83Å; T187-H190 PolarHBondContact O-N 2.91Å
191	M	93.5	Very high	96.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-75.1	-33.6	-179.9	-73.3	178.4	61.5	0	0	113.4	M138 I141 K142 F164 T187 W188 P193	M138-M191 HydrophobicContact CG-SD 3.74Å; I141-M191 HydrophobicContact CB-CE 4.26Å; I141-M191 HydrophobicContact CB-SD 4.19Å; I141-M191 HydrophobicContact CG2-CE 3.76Å; I141-M191 HydrophobicContact CG2-SD 3.84Å; K142-M191 HydrophobicContact CB-CE 4.41Å; K142-M191 HydrophobicContact CD-CE 4.33Å; K142-M191 HydrophobicContact CG-CE 3.33Å; F164-M191 HydrophobicContact CB-CB 4.21Å; F164-M191 HydrophobicContact CB-CE 3.95Å; F164-M191 HydrophobicContact CD1-CE 4.4Å; F164-M191 HydrophobicContact CG-CE 4.15Å; F164-M191 PolarHBondContact N-O 2.82Å; T187-M191 HydrophobicContact CG2-CG 4.24Å; T187-M191 HydrophobicContact CG2-SD 3.67Å; T187-M191 WeakPolarHBondContact O-CB 3.41Å; T187-M191 VanDerWaalsContact O-CG 3.28Å; T187-M191 WeakPolarHBondContact O-CG 3.36Å; T187-M191 PolarHBondContact O-N 3.06Å; W188-M191 PolarHBondContact O-N 2.79Å; M191-P193 WeakPolarHBondContact O-CD 3.31Å
192	F	96.1	Very high	96.5	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	20%	0.196	C	C	.	.	S	Bend	trans	-125.9	55.8	-173	-54.1	-77.5	0	0	0	112.8	I141 T145 F164 L170 W188 G194 H195 F196	I141-F192 HydrophobicContact CG2-CE2 3.6Å; I141-F192 HydrophobicContact CG2-CZ 4.22Å; T145-F192 HydrophobicContact CG2-CE2 4.21Å; T145-F192 HydrophobicContact CG2-CZ 3.78Å; T145-F192 WeakPolarHBondContact OG1-CZ 3.24Å; F164-F192 HydrophobicContact CB-CE1 4.27Å; F164-F192 AromaticContact CD1-CE1 3.69Å; F164-F192 HydrophobicContact CD1-CE1 3.69Å; F164-F192 AromaticContact CD1-CZ 3.89Å; F164-F192 HydrophobicContact CD1-CZ 3.89Å; F164-F192 HydrophobicContact CG-CE1 4.48Å; L170-F192 HydrophobicContact CD1-CB 4.11Å; L170-F192 HydrophobicContact CD1-CD1 3.77Å; L170-F192 HydrophobicContact CD1-CD2 3.81Å; L170-F192 HydrophobicContact CD1-CE1 4.06Å; L170-F192 HydrophobicContact CD1-CE2 4.13Å; L170-F192 HydrophobicContact CD1-CG 3.63Å; L170-F192 HydrophobicContact CD1-CZ 4.26Å; W188-F192 AromaticContact CE3-CD2 3.79Å; W188-F192 HydrophobicContact CE3-CD2 3.79Å; W188-F192 AromaticContact CE3-CE2 3.68Å; W188-F192 HydrophobicContact CE3-CE2 3.68Å; W188-F192 HydrophobicContact CZ3-CD2 4.41Å; W188-F192 AromaticContact CZ3-CE2 3.98Å; W188-F192 HydrophobicContact CZ3-CE2 3.98Å; W188-F192 WeakPolarHBondContact O-CB 3.23Å; W188-F192 WeakPolarHBondContact O-CD2 3.45Å; W188-F192 PolarHBondContact O-N 3.42Å; F192-G194 PolarHBondContact O-N 2.77Å; F192-H195 VanDerWaalsContact C-ND1 3.32Å; F192-H195 HydrophobicContact CB-CB 3.94Å; F192-H195 WeakPolarHBondContact O-CB 3.48Å; F192-H195 PolarHBondContact O-N 3.21Å; F192-H195 VanDerWaalsContact O-N 3.16Å; F192-H195 PolarHBondContact O-ND1 2.76Å; F192-F196 HydrophobicContact CB-CE2 4.04Å; F192-F196 HydrophobicContact CB-CZ 4.41Å
193	P	95	Very high	96.2	Very high	56 Å²	56	38.1 Å²	38.1	36%	0.364	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	131.6	-179.6	26	-34.6	0	0	0	110.8	E163 M191 H195	E163-P193 HydrophobicContact CB-CG 4.37Å; E163-P193 HydrophobicContact CG-CG 3.85Å; M191-P193 WeakPolarHBondContact O-CD 3.31Å; P193-H195 PolarHBondContact O-N 2.9Å; P193-H195 PolarHBondContact O-ND1 3.36Å
194	G	94.5	Very high	95.5	Very high	63 Å²	63	39.4 Å²	39.4	65%	0.649	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	14.6	177.7	0	0	0	0	0	116.1	R174 F192	R174-G194 PolarHBondContact NH1-O 2.91Å; R174-G194 VanDerWaalsContact NH1-O 3.07Å; F192-G194 PolarHBondContact O-N 2.77Å
195	H	97.1	Very high	94.9	Very high	20 Å²	20	47.6 Å²	47.6	9%	0.093	26%	0.257	C	S	.	.			trans	-86.2	-27.1	174.4	-69.8	68.8	0	0	0	112.8	L170 S180 F192 P193	L170-H195 HydrophobicContact CB-CB 4.42Å; S180-H195 PolarHBondContact OG-O 3.46Å; F192-H195 VanDerWaalsContact C-ND1 3.32Å; F192-H195 HydrophobicContact CB-CB 3.94Å; F192-H195 WeakPolarHBondContact O-CB 3.48Å; F192-H195 PolarHBondContact O-N 3.21Å; F192-H195 VanDerWaalsContact O-N 3.16Å; F192-H195 PolarHBondContact O-ND1 2.76Å; P193-H195 PolarHBondContact O-N 2.9Å; P193-H195 PolarHBondContact O-ND1 3.36Å
196	F	98.3	Very high	94.5	Very high	22 Å²	22	52.1 Å²	52.1	10%	0.096	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134	-178.7	-54.7	-66.9	0	0	0	111.7	L170 S180 F182 W188 L189 F192 I234	L170-F196 HydrophobicContact CD1-CE1 3.86Å; L170-F196 HydrophobicContact CD1-CZ 3.58Å; L170-F196 HydrophobicContact CD2-CE1 3.94Å; S180-F196 CarbonylContact O-C 3.52Å; S180-F196 WeakPolarHBondContact O-CA 3.3Å; F182-F196 HydrophobicContact CB-CB 4.35Å; F182-F196 HydrophobicContact CB-CD1 3.43Å; F182-F196 VanDerWaalsContact CB-CD1 3.43Å; F182-F196 HydrophobicContact CB-CD2 3.79Å; F182-F196 HydrophobicContact CB-CE1 3.53Å; F182-F196 HydrophobicContact CB-CE2 3.86Å; F182-F196 HydrophobicContact CB-CG 3.57Å; F182-F196 HydrophobicContact CB-CZ 3.74Å; F182-F196 HydrophobicContact CD1-CE2 4.36Å; F182-F196 HydrophobicContact CD2-CZ 4.35Å; F182-F196 HydrophobicContact CG-CD2 4.31Å; F182-F196 HydrophobicContact CG-CE1 4.28Å; F182-F196 HydrophobicContact CG-CE2 4.03Å; F182-F196 HydrophobicContact CG-CZ 4.01Å; W188-F196 HydrophobicContact CB-CE2 4.39Å; W188-F196 AromaticContact CE3-CZ 3.98Å; W188-F196 HydrophobicContact CE3-CZ 3.98Å; L189-F196 HydrophobicContact CD2-CD2 4Å; L189-F196 HydrophobicContact CD2-CE2 4.34Å; F192-F196 HydrophobicContact CB-CE2 4.04Å; F192-F196 HydrophobicContact CB-CZ 4.41Å; F196-I234 HydrophobicContact CE1-CD1 4.27Å
197	R	98	Very high	94.1	Very high	136 Å²	136	52.3 Å²	52.3	51%	0.513	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-40.1	176	179.4	177	-178.3	149.3	-6.8	111.7	S180 V181 D229	S180-R197 PolarHBondContact O-N 2.85Å; V181-R197 HydrophobicContact CG1-CB 4.43Å; R197-D229 IonicContact CZ-OD2 3.56Å; R197-D229 IonicContact NE-OD2 3.9Å; R197-D229 PolarHBondContact NE-OD2 3.24Å; R197-D229 PolarHBondContact NH1-O 3.11Å; R197-D229 IonicContact NH1-OD2 2.69Å; R197-D229 IonicContact NH2-OD2 3.33Å; R197-D229 PolarHBondContact NH2-OD2 2.86Å
198	R	98.5	Very high	93.9	Very high	53 Å²	53	55.9 Å²	55.9	20%	0.2	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.1	171.1	-68.1	-179.7	-63.2	-81.8	-1.7	107.5	V181 F182 E224 D229	V181-R198 VanDerWaalsContact CA-O 3.29Å; V181-R198 WeakPolarHBondContact CA-O 3.41Å; V181-R198 HydrophobicContact CG1-CB 4.04Å; F182-R198 PolarHBondContact N-O 3.47Å; F182-R198 VanDerWaalsContact N-O 3.1Å; R198-E224 WeakPolarHBondContact CD-OE1 3.49Å; R198-E224 IonicContact CZ-OE1 3.64Å; R198-E224 IonicContact CZ-OE2 3.62Å; R198-E224 IonicContact NE-OE1 2.93Å; R198-E224 PolarHBondContact NE-OE1 2.95Å; R198-E224 IonicContact NE-OE2 2.97Å; R198-E224 PolarHBondContact NE-OE2 2.95Å; R198-E224 IonicContact NH2-OE1 3.44Å; R198-E224 IonicContact NH2-OE2 2.72Å; R198-E224 PolarHBondContact NH2-OE2 3.35Å; R198-D229 IonicContact CZ-OD1 3.81Å; R198-D229 IonicContact CZ-OD2 3.24Å; R198-D229 VanDerWaalsContact NH1-CG 3.32Å; R198-D229 IonicContact NH1-OD1 2.65Å; R198-D229 PolarHBondContact NH1-OD1 3.48Å; R198-D229 IonicContact NH1-OD2 3.97Å; R198-D229 PolarHBondContact NH1-OD2 3.25Å; R198-D229 IonicContact NH2-OD1 3.55Å; R198-D229 PolarHBondContact NH2-OD1 3.45Å; R198-D229 IonicContact NH2-OD2 3.98Å
199	S	98.5	Very high	93.8	Very high	54 Å²	54	57.9 Å²	57.9	38%	0.378	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	152.6	177.3	58.5	0	0	0	0	113.6	F182 L189	F182-S199 CarbonylContact O-C 3.57Å; F182-S199 WeakPolarHBondContact O-CA 3.38Å; F182-S199 VanDerWaalsContact O-CB 3.29Å; F182-S199 WeakPolarHBondContact O-CB 3.49Å; L189-S199 WeakPolarHBondContact CD2-OG 3.5Å
200	E	98.2	Very high	93.8	Very high	80 Å²	80	58 Å²	58	37%	0.374	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	129.1	167.5	-162	-175.5	147.2	0	0	110.4	F182 Y183 G184 R219 H220	F182-E200 PolarHBondContact O-N 3.45Å; F182-E200 VanDerWaalsContact O-N 3.09Å; Y183-E200 WeakPolarHBondContact CA-O 3.23Å; Y183-E200 HydrophobicContact CD1-CB 3.8Å; Y183-E200 HydrophobicContact CE1-CB 3.95Å; G184-E200 PolarHBondContact N-O 2.81Å; E200-R219 VanDerWaalsContact CD-NH2 3.31Å; E200-R219 IonicContact OE1-CZ 3.41Å; E200-R219 IonicContact OE1-NH1 3.06Å; E200-R219 IonicContact OE1-NH2 3.2Å; E200-R219 PolarHBondContact OE1-NH2 3.35Å; E200-R219 IonicContact OE2-CZ 3.37Å; E200-R219 IonicContact OE2-NH1 3.17Å; E200-R219 PolarHBondContact OE2-NH1 3.03Å; E200-R219 IonicContact OE2-NH2 2.71Å; E200-R219 PolarHBondContact OE2-NH2 3.07Å; E200-H220 IonicContact OE2-CE1 2.95Å; E200-H220 PolarHBondContact OE2-CE1 2.98Å; E200-H220 IonicContact OE2-NE2 2.79Å; E200-H220 PolarHBondContact OE2-NE2 2.94Å
201	G	96.6	Very high	93.9	Very high	26 Å²	26	57.2 Å²	57.2	27%	0.268	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	152.6	178.3	0	0	0	0	0	111.7	G184	G184-G201 CarbonylContact O-C 3.48Å; G184-G201 VanDerWaalsContact O-CA 3.22Å; G184-G201 WeakPolarHBondContact O-CA 3.47Å
202	T	95.4	Very high	94.1	Very high	10 Å²	10	61.1 Å²	61.1	6%	0.061	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	147.5	163.2	-172.3	0	0	0	0	109.1	G184 E186 V213 L238	G184-T202 PolarHBondContact O-N 2.82Å; E186-T202 PolarHBondContact N-O 2.78Å; T202-V213 HydrophobicContact CG2-CB 4.22Å; T202-L238 HydrophobicContact CG2-CD1 3.45Å; T202-L238 VanDerWaalsContact CG2-CD1 3.45Å
203	T	91	Very high	94.1	Very high	52 Å²	52	61.1 Å²	61.1	32%	0.319	34%	0.335	S	S	.	.			trans	-82	138.3	-179.1	-170	0	0	0	0	111.6	E186 F205	E186-T203 WeakPolarHBondContact OE1-CA 3.34Å; E186-T203 VanDerWaalsContact OE1-CB 3.28Å; E186-T203 WeakPolarHBondContact OE1-CB 3.49Å; E186-T203 PolarHBondContact OE1-OG1 3.14Å; T203-F205 WeakPolarHBondContact OG1-CD2 3.39Å
204	S	85.6	Confident	94.3	Very high	36 Å²	36	58.5 Å²	58.5	25%	0.252	32%	0.317	S	S	.	.	S	Bend	trans	-92.4	-1.6	176.5	51.9	0	0	0	0	113.5	I206 L238	S204-I206 VanDerWaalsContact C-N 3.32Å; S204-I206 PolarHBondContact O-N 3.12Å; S204-L238 VanDerWaalsContact CB-CD2 3.49Å
205	F	85.2	Confident	94.5	Very high	173 Å²	173	62.6 Å²	62.6	76%	0.759	31%	0.313	S	S	*	.	S	Bend	trans	-66.9	-26.8	-174.5	-70.1	-59.4	0	0	0	114.6	T203 V207	T203-F205 WeakPolarHBondContact OG1-CD2 3.39Å; F205-V207 PolarHBondContact O-N 2.8Å
206	I	87.4	Confident	94.5	Very high	97 Å²	97	64 Å²	64	50%	0.497	32%	0.322	S	S	.	.			trans	-97.6	81.9	-179.2	-52.6	177.7	0	0	0	109.1	S204 T208 D209	S204-I206 VanDerWaalsContact C-N 3.32Å; S204-I206 PolarHBondContact O-N 3.12Å; I206-T208 WeakPolarHBondContact CG2-OG1 3.42Å; I206-T208 PolarHBondContact O-N 2.92Å; I206-T208 VanDerWaalsContact O-N 3.08Å; I206-D209 HydrophobicContact CB-CB 4.36Å; I206-D209 HydrophobicContact CG2-CB 3.98Å; I206-D209 PolarHBondContact O-N 2.88Å
207	V	85.7	Confident	94.5	Very high	54 Å²	54	63 Å²	63	33%	0.327	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-22.1	-177.7	-178.2	0	0	0	0	113.3	F205 D209 H242 H245 S246	F205-V207 PolarHBondContact O-N 2.8Å; V207-D209 VanDerWaalsContact C-N 3.29Å; V207-D209 PolarHBondContact O-N 2.85Å; V207-H242 VanDerWaalsContact O-CB 3.32Å; V207-H242 WeakPolarHBondContact O-CB 3.2Å; V207-H245 HydrophobicContact CG1-CB 3.37Å; V207-S246 PolarHBondContact O-OG 2.9Å
208	T	90.3	Very high	94.5	Very high	97 Å²	97	58.5 Å²	58.5	60%	0.595	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.7	175.4	55.5	0	0	0	0	113.6	I206 Y210	I206-T208 WeakPolarHBondContact CG2-OG1 3.42Å; I206-T208 PolarHBondContact O-N 2.92Å; I206-T208 VanDerWaalsContact O-N 3.08Å; T208-Y210 VanDerWaalsContact O-CD1 3.28Å; T208-Y210 WeakPolarHBondContact O-CD1 3.33Å; T208-Y210 WeakPolarHBondContact O-CE1 3.42Å
209	D	94.6	Very high	94.5	Very high	45 Å²	45	60.9 Å²	60.9	24%	0.241	31%	0.314	C	S	.	.			trans	-92.5	102.3	177.8	176	20.2	0	0	0	110.4	I206 V207 V211 E212 V213 H242	I206-D209 HydrophobicContact CB-CB 4.36Å; I206-D209 HydrophobicContact CG2-CB 3.98Å; I206-D209 PolarHBondContact O-N 2.88Å; V207-D209 VanDerWaalsContact C-N 3.29Å; V207-D209 PolarHBondContact O-N 2.85Å; D209-V211 PolarHBondContact OD1-N 2.93Å; D209-V211 VanDerWaalsContact OD1-N 3.07Å; D209-E212 PolarHBondContact OD1-N 3.47Å; D209-E212 WeakPolarHBondContact OD2-CB 3.15Å; D209-V213 WeakPolarHBondContact O-CG2 3.42Å; D209-V213 PolarHBondContact OD2-N 2.84Å; D209-H242 PolarHBondContact O-ND1 3.47Å
210	Y	95.6	Very high	94.5	Very high	54 Å²	54	59.8 Å²	59.8	21%	0.212	30%	0.303	C	S	.	.	S	Bend	trans	-111.2	13	176.1	51	-94.6	0	0	0	112.4	T208 G239 I243 Y247 L253 K257	T208-Y210 VanDerWaalsContact O-CD1 3.28Å; T208-Y210 WeakPolarHBondContact O-CD1 3.33Å; T208-Y210 WeakPolarHBondContact O-CE1 3.42Å; Y210-G239 WeakPolarHBondContact CB-O 3.32Å; Y210-I243 HydrophobicContact CD1-CG1 3.9Å; Y210-I243 HydrophobicContact CD2-CD1 3.82Å; Y210-I243 HydrophobicContact CD2-CG1 3.76Å; Y210-I243 HydrophobicContact CE2-CD1 4.5Å; Y210-I243 HydrophobicContact CE2-CG1 4.41Å; Y210-I243 HydrophobicContact CG-CD1 4Å; Y210-I243 HydrophobicContact CG-CG1 3.46Å; Y210-I243 VanDerWaalsContact CG-CG1 3.46Å; Y210-Y247 HydrophobicContact CD1-CE2 4.44Å; Y210-Y247 AromaticContact CE1-CE2 3.8Å; Y210-Y247 HydrophobicContact CE1-CE2 3.8Å; Y210-L253 HydrophobicContact CE1-CD1 4.46Å; Y210-L253 HydrophobicContact CE2-CD1 4.41Å; Y210-K257 WeakPolarHBondContact O-CE 3.25Å; Y210-K257 PolarHBondContact O-NZ 2.9Å
211	V	96.6	Very high	94.6	Very high	72 Å²	72	56 Å²	56	44%	0.436	29%	0.285	S	S	.	.	S	Bend	trans	-118.2	-55.5	-177.3	178.3	0	0	0	0	110.6	D209 V213 D214 R215	D209-V211 PolarHBondContact OD1-N 2.93Å; D209-V211 VanDerWaalsContact OD1-N 3.07Å; V211-V213 VanDerWaalsContact C-N 3.35Å; V211-D214 PolarHBondContact O-N 2.84Å; V211-R215 WeakPolarHBondContact O-CB 3.49Å; V211-R215 PolarHBondContact O-N 2.78Å
212	E	97	Very high	94.6	Very high	82 Å²	82	59.9 Å²	59.9	38%	0.383	30%	0.3	S	S	.	.	H	α-helix	trans	-71.9	-33	-175.8	-65.4	-64.9	153.7	0	0	111	D209 D214 R215 N216	D209-E212 PolarHBondContact OD1-N 3.47Å; D209-E212 WeakPolarHBondContact OD2-CB 3.15Å; E212-D214 VanDerWaalsContact C-N 3.32Å; E212-D214 PolarHBondContact O-N 2.8Å; E212-R215 PolarHBondContact O-N 2.93Å; E212-R215 IonicContact OE1-NH1 3.2Å; E212-R215 PolarHBondContact OE1-NH1 2.78Å; E212-R215 WeakPolarHBondContact OE2-CD 3.33Å; E212-R215 IonicContact OE2-NH1 3.75Å; E212-N216 VanDerWaalsContact O-CB 3.28Å; E212-N216 WeakPolarHBondContact O-CB 3.2Å; E212-N216 PolarHBondContact O-N 2.96Å; E212-N216 PolarHBondContact O-ND2 2.75Å; E212-N216 VanDerWaalsContact O-ND2 3.16Å
213	V	97.4	Very high	94.8	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.012	32%	0.319	C	S	.	.	H	α-helix	trans	-54.4	-45	171.5	-64.7	0	0	0	0	112.6	T202 D209 V211 L238	T202-V213 HydrophobicContact CG2-CB 4.22Å; D209-V213 WeakPolarHBondContact O-CG2 3.42Å; D209-V213 PolarHBondContact OD2-N 2.84Å; V211-V213 VanDerWaalsContact C-N 3.35Å; V213-L238 HydrophobicContact CB-CB 4.45Å; V213-L238 HydrophobicContact CB-CD1 4.41Å; V213-L238 HydrophobicContact CG2-CB 4.2Å
214	D	98.4	Very high	95.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-81.8	-32.6	-178.8	-72.7	-7.5	0	0	0	112.1	V211 E212 N216 V217 T218 Y237 L238 G239 K257 M261	V211-D214 PolarHBondContact O-N 2.84Å; E212-D214 VanDerWaalsContact C-N 3.32Å; E212-D214 PolarHBondContact O-N 2.8Å; D214-N216 VanDerWaalsContact C-N 3.28Å; D214-N216 PolarHBondContact O-N 2.83Å; D214-V217 PolarHBondContact O-N 3.4Å; D214-T218 WeakPolarHBondContact O-CB 3.12Å; D214-T218 PolarHBondContact O-N 3.03Å; D214-T218 PolarHBondContact O-OG1 3.27Å; D214-Y237 HydrophobicContact CB-CD1 3.77Å; D214-Y237 HydrophobicContact CB-CE1 4.23Å; D214-L238 PolarHBondContact OD1-N 2.83Å; D214-G239 PolarHBondContact OD1-N 3.39Å; D214-G239 VanDerWaalsContact OD2-CA 3.31Å; D214-G239 WeakPolarHBondContact OD2-CA 3.26Å; D214-G239 PolarHBondContact OD2-N 2.89Å; D214-K257 WeakPolarHBondContact OD2-CD 2.97Å; D214-K257 WeakPolarHBondContact OD2-CE 3.2Å; D214-K257 IonicContact OD2-NZ 2.73Å; D214-K257 PolarHBondContact OD2-NZ 3.08Å; D214-M261 HydrophobicContact CB-CE 4.45Å
215	R	98.1	Very high	95.7	Very high	149 Å²	149	60.5 Å²	60.5	56%	0.562	29%	0.293	S	S	*	.	H	α-helix	trans	-62.8	-37.9	172.7	-171.4	-176.3	-177.1	-179	0.1	111.3	V211 E212 V217 T218 R219	V211-R215 WeakPolarHBondContact O-CB 3.49Å; V211-R215 PolarHBondContact O-N 2.78Å; E212-R215 PolarHBondContact O-N 2.93Å; E212-R215 IonicContact OE1-NH1 3.2Å; E212-R215 PolarHBondContact OE1-NH1 2.78Å; E212-R215 WeakPolarHBondContact OE2-CD 3.33Å; E212-R215 IonicContact OE2-NH1 3.75Å; R215-V217 PolarHBondContact O-N 2.84Å; R215-T218 PolarHBondContact O-N 3.42Å; R215-R219 WeakPolarHBondContact O-CB 3.34Å; R215-R219 WeakPolarHBondContact O-CG 3.45Å; R215-R219 PolarHBondContact O-N 2.72Å
216	N	97.9	Very high	96.3	Very high	50 Å²	50	58.3 Å²	58.3	27%	0.267	29%	0.285	S	S	.	.	H	α-helix	trans	-64.7	-27.6	177.7	-79.1	-31.4	0	0	0	113.3	E212 D214 R219 H220	E212-N216 VanDerWaalsContact O-CB 3.28Å; E212-N216 WeakPolarHBondContact O-CB 3.2Å; E212-N216 PolarHBondContact O-N 2.96Å; E212-N216 PolarHBondContact O-ND2 2.75Å; E212-N216 VanDerWaalsContact O-ND2 3.16Å; D214-N216 VanDerWaalsContact C-N 3.28Å; D214-N216 PolarHBondContact O-N 2.83Å; N216-R219 PolarHBondContact OD1-NE 2.83Å; N216-R219 VanDerWaalsContact OD1-NE 3.07Å; N216-R219 PolarHBondContact OD1-NH2 3.28Å; N216-H220 PolarHBondContact O-CD2 2.82Å; N216-H220 VanDerWaalsContact O-CD2 3.25Å
217	V	98.6	Very high	96.8	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-77.8	-52.5	169.4	-175.3	0	0	0	0	110.5	D214 R215 R219 H220 L235 Y237	D214-V217 PolarHBondContact O-N 3.4Å; R215-V217 PolarHBondContact O-N 2.84Å; V217-R219 PolarHBondContact O-N 3.5Å; V217-H220 PolarHBondContact O-N 2.75Å; V217-L235 HydrophobicContact CG1-CB 3.99Å; V217-L235 HydrophobicContact CG1-CD2 3.91Å; V217-Y237 HydrophobicContact CB-CD1 4.26Å; V217-Y237 HydrophobicContact CB-CE1 3.82Å; V217-Y237 HydrophobicContact CB-CE2 4.49Å; V217-Y237 HydrophobicContact CG1-CD1 4.43Å; V217-Y237 HydrophobicContact CG1-CD2 4.26Å; V217-Y237 HydrophobicContact CG1-CE1 3.92Å; V217-Y237 HydrophobicContact CG1-CE2 3.7Å; V217-Y237 VanDerWaalsContact CG1-CZ 3.5Å
218	T	98.7	Very high	97.3	Very high	42 Å²	42	59.7 Å²	59.7	26%	0.258	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-37.4	-170.2	-56.1	0	0	0	0	113.5	D214 R215 H220 L221 Y237 V264	D214-T218 WeakPolarHBondContact O-CB 3.12Å; D214-T218 PolarHBondContact O-N 3.03Å; D214-T218 PolarHBondContact O-OG1 3.27Å; R215-T218 PolarHBondContact O-N 3.42Å; T218-H220 PolarHBondContact O-N 3.06Å; T218-L221 HydrophobicContact CG2-CD1 4.06Å; T218-L221 WeakPolarHBondContact O-CB 3.13Å; T218-L221 WeakPolarHBondContact O-CG 3.48Å; T218-L221 PolarHBondContact O-N 3.37Å; T218-Y237 VanDerWaalsContact OG1-CE1 3.27Å; T218-Y237 WeakPolarHBondContact OG1-CE1 3.24Å; T218-Y237 PolarHBondContact OG1-OH 3.16Å; T218-V264 HydrophobicContact CG2-CG2 4.16Å
219	R	98.2	Very high	97.6	Very high	102 Å²	102	56.7 Å²	56.7	39%	0.385	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.3	-175.9	67.3	179.4	159	60.3	1.2	114.8	E200 R215 N216 V217	E200-R219 VanDerWaalsContact CD-NH2 3.31Å; E200-R219 IonicContact OE1-CZ 3.41Å; E200-R219 IonicContact OE1-NH1 3.06Å; E200-R219 IonicContact OE1-NH2 3.2Å; E200-R219 PolarHBondContact OE1-NH2 3.35Å; E200-R219 IonicContact OE2-CZ 3.37Å; E200-R219 IonicContact OE2-NH1 3.17Å; E200-R219 PolarHBondContact OE2-NH1 3.03Å; E200-R219 IonicContact OE2-NH2 2.71Å; E200-R219 PolarHBondContact OE2-NH2 3.07Å; R215-R219 WeakPolarHBondContact O-CB 3.34Å; R215-R219 WeakPolarHBondContact O-CG 3.45Å; R215-R219 PolarHBondContact O-N 2.72Å; N216-R219 PolarHBondContact OD1-NE 2.83Å; N216-R219 VanDerWaalsContact OD1-NE 3.07Å; N216-R219 PolarHBondContact OD1-NH2 3.28Å; V217-R219 PolarHBondContact O-N 3.5Å
220	H	98.6	Very high	97.8	Very high	31 Å²	31	54.8 Å²	54.8	14%	0.144	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-17.4	176.2	-71.6	-67.2	0	0	0	113.7	Y183 E200 N216 V217 T218 D222 F223 E224	Y183-H220 HydrophobicContact CD1-CB 3.96Å; Y183-H220 AromaticContact CD1-CD2 2.97Å; Y183-H220 WeakPolarHBondContact CD1-CD2 3.34Å; Y183-H220 AromaticContact CD1-CE1 3.96Å; Y183-H220 AromaticContact CD1-CG 3.48Å; Y183-H220 VanDerWaalsContact CD1-CG 3.48Å; Y183-H220 AromaticContact CD1-NE2 3.25Å; Y183-H220 VanDerWaalsContact CD1-NE2 3.25Å; Y183-H220 WeakPolarHBondContact CD1-NE2 3.28Å; Y183-H220 HydrophobicContact CD2-CB 4.14Å; Y183-H220 HydrophobicContact CE1-CB 3.9Å; Y183-H220 AromaticContact CE1-CD2 3.25Å; Y183-H220 WeakPolarHBondContact CE1-CD2 3.39Å; Y183-H220 AromaticContact CE1-CE1 3.46Å; Y183-H220 VanDerWaalsContact CE1-CE1 3.46Å; Y183-H220 WeakPolarHBondContact CE1-CE1 3.29Å; Y183-H220 AromaticContact CE1-CG 3.34Å; Y183-H220 AromaticContact CE1-ND1 3.54Å; Y183-H220 AromaticContact CE1-NE2 3.25Å; Y183-H220 WeakPolarHBondContact CE1-NE2 3.45Å; Y183-H220 HydrophobicContact CE2-CB 4.15Å; Y183-H220 HydrophobicContact CG-CB 4.03Å; Y183-H220 AromaticContact CG-CD2 3.68Å; Y183-H220 AromaticContact CZ-CG 3.87Å; E200-H220 IonicContact OE2-CE1 2.95Å; E200-H220 PolarHBondContact OE2-CE1 2.98Å; E200-H220 IonicContact OE2-NE2 2.79Å; E200-H220 PolarHBondContact OE2-NE2 2.94Å; N216-H220 PolarHBondContact O-CD2 2.82Å; N216-H220 VanDerWaalsContact O-CD2 3.25Å; V217-H220 PolarHBondContact O-N 2.75Å; T218-H220 PolarHBondContact O-N 3.06Å; H220-D222 VanDerWaalsContact C-N 3.34Å; H220-D222 PolarHBondContact O-N 3.02Å; H220-F223 PolarHBondContact O-N 3.06Å; H220-F223 VanDerWaalsContact O-N 3.16Å; H220-E224 PolarHBondContact O-N 3.26Å
221	L	98.7	Very high	98	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-41.3	-172.9	-69.2	175.6	0	0	0	112.8	T218 F223 E224 L225 M233 L235 V264 F267 I268	T218-L221 HydrophobicContact CG2-CD1 4.06Å; T218-L221 WeakPolarHBondContact O-CB 3.13Å; T218-L221 WeakPolarHBondContact O-CG 3.48Å; T218-L221 PolarHBondContact O-N 3.37Å; L221-F223 PolarHBondContact O-N 3.16Å; L221-E224 PolarHBondContact O-N 3.34Å; L221-L225 HydrophobicContact CB-CD1 4.07Å; L221-L225 HydrophobicContact CD2-CD1 4.42Å; L221-L225 HydrophobicContact CD2-CG 4.5Å; L221-L225 VanDerWaalsContact O-CB 3.27Å; L221-L225 WeakPolarHBondContact O-CB 3.31Å; L221-L225 VanDerWaalsContact O-CG 3.24Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 3.27Å; L221-M233 HydrophobicContact CD2-SD 4.14Å; L221-L235 HydrophobicContact CD2-CD1 3.6Å; L221-L235 HydrophobicContact CD2-CD2 4.05Å; L221-L235 HydrophobicContact CD2-CG 4.47Å; L221-V264 HydrophobicContact CD1-CG1 3.88Å; L221-F267 HydrophobicContact CB-CD1 4.33Å; L221-F267 HydrophobicContact CB-CE1 3.8Å; L221-F267 HydrophobicContact CD1-CD1 4.15Å; L221-F267 HydrophobicContact CD1-CE1 4.44Å; L221-I268 HydrophobicContact CD1-CD1 4.16Å; L221-I268 HydrophobicContact CD1-CG1 4.04Å; L221-I268 HydrophobicContact CD2-CD1 4.05Å; L221-I268 HydrophobicContact CD2-CG1 4.01Å
222	D	97.7	Very high	98.1	Very high	106 Å²	106	50 Å²	50	57%	0.567	24%	0.236	S	C	*	.	H	α-helix	trans	-56.8	-39.5	178.7	-74.8	-24.7	0	0	0	111.6	H220 H226 F267	H220-D222 VanDerWaalsContact C-N 3.34Å; H220-D222 PolarHBondContact O-N 3.02Å; D222-H226 PolarHBondContact O-ND1 3.31Å; D222-F267 WeakPolarHBondContact OD1-CZ 3.39Å
223	F	98.5	Very high	98.1	Very high	104 Å²	104	46 Å²	46	46%	0.456	22%	0.218	S	C	.	.	H	α-helix	trans	-77	-51.3	177.6	172.7	-101.7	0	0	0	111.6	H220 L221 H226 Q227	H220-F223 PolarHBondContact O-N 3.06Å; H220-F223 VanDerWaalsContact O-N 3.16Å; L221-F223 PolarHBondContact O-N 3.16Å; F223-H226 PolarHBondContact O-N 2.72Å; F223-Q227 HydrophobicContact CD1-CG 4.25Å; F223-Q227 HydrophobicContact CE1-CG 3.79Å; F223-Q227 HydrophobicContact CE2-CG 4.37Å; F223-Q227 VanDerWaalsContact CE2-NE2 3.28Å; F223-Q227 HydrophobicContact CZ-CG 3.85Å; F223-Q227 WeakPolarHBondContact O-CG 3.3Å; F223-Q227 PolarHBondContact O-NE2 2.8Å; F223-Q227 VanDerWaalsContact O-NE2 3.09Å
224	E	98.5	Very high	98.2	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-70.9	-35.6	-169.3	-71.8	-64.4	154	0	0	113.8	Y183 R198 H220 L221 H226 Q227 W230 M233	Y183-E224 HydrophobicContact CE2-CG 3.57Å; Y183-E224 PolarHBondContact OH-OE1 2.91Å; R198-E224 WeakPolarHBondContact CD-OE1 3.49Å; R198-E224 IonicContact CZ-OE1 3.64Å; R198-E224 IonicContact CZ-OE2 3.62Å; R198-E224 IonicContact NE-OE1 2.93Å; R198-E224 PolarHBondContact NE-OE1 2.95Å; R198-E224 IonicContact NE-OE2 2.97Å; R198-E224 PolarHBondContact NE-OE2 2.95Å; R198-E224 IonicContact NH2-OE1 3.44Å; R198-E224 IonicContact NH2-OE2 2.72Å; R198-E224 PolarHBondContact NH2-OE2 3.35Å; H220-E224 PolarHBondContact O-N 3.26Å; L221-E224 PolarHBondContact O-N 3.34Å; E224-H226 PolarHBondContact O-N 2.84Å; E224-Q227 PolarHBondContact O-N 3.04Å; E224-W230 PolarHBondContact O-NE1 3.15Å; E224-M233 HydrophobicContact CB-CE 3.51Å; E224-M233 HydrophobicContact CB-SD 4.43Å
225	L	98.4	Very high	98.2	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.8	178.7	-67.3	172.3	0	0	0	112.9	L221 M233 F267 I268 T271 L272	L221-L225 HydrophobicContact CB-CD1 4.07Å; L221-L225 HydrophobicContact CD2-CD1 4.42Å; L221-L225 HydrophobicContact CD2-CG 4.5Å; L221-L225 VanDerWaalsContact O-CB 3.27Å; L221-L225 WeakPolarHBondContact O-CB 3.31Å; L221-L225 VanDerWaalsContact O-CG 3.24Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 3.27Å; L225-M233 HydrophobicContact CD2-CE 3.99Å; L225-M233 HydrophobicContact CD2-SD 4.34Å; L225-M233 HydrophobicContact CG-CE 4.5Å; L225-F267 HydrophobicContact CD1-CD1 4.14Å; L225-F267 HydrophobicContact CD1-CE1 3.71Å; L225-F267 HydrophobicContact CD1-CZ 4.27Å; L225-I268 HydrophobicContact CD1-CG1 4.31Å; L225-I268 HydrophobicContact CD2-CG2 4.28Å; L225-T271 HydrophobicContact CB-CG2 3.75Å; L225-T271 HydrophobicContact CD1-CG2 4.08Å; L225-L272 HydrophobicContact CD2-CD2 4.07Å; L225-L272 HydrophobicContact CD2-CG 4.2Å
226	H	97.5	Very high	98.3	Very high	127 Å²	127	39 Å²	39	59%	0.588	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-6	175.2	-64.5	93.3	0	0	0	113.6	D222 F223 E224	D222-H226 PolarHBondContact O-ND1 3.31Å; F223-H226 PolarHBondContact O-N 2.72Å; E224-H226 PolarHBondContact O-N 2.84Å
227	Q	97.8	Very high	98.3	Very high	50 Å²	50	36.7 Å²	36.7	23%	0.234	18%	0.179	C	C	.	.			trans	-79.8	150.8	174.1	-56.8	-46.7	-62.4	0	0	110.8	R91 F223 E224	R91-Q227 PolarHBondContact NH1-O 3.35Å; F223-Q227 HydrophobicContact CD1-CG 4.25Å; F223-Q227 HydrophobicContact CE1-CG 3.79Å; F223-Q227 HydrophobicContact CE2-CG 4.37Å; F223-Q227 VanDerWaalsContact CE2-NE2 3.28Å; F223-Q227 HydrophobicContact CZ-CG 3.85Å; F223-Q227 WeakPolarHBondContact O-CG 3.3Å; F223-Q227 PolarHBondContact O-NE2 2.8Å; F223-Q227 VanDerWaalsContact O-NE2 3.09Å; E224-Q227 PolarHBondContact O-N 3.04Å
228	D	96.3	Very high	98.3	Very high	129 Å²	129	36.6 Å²	36.6	69%	0.69	18%	0.178	S	C	*	.	S	Bend	trans	-112	3.4	178.5	67.8	-10	0	0	0	115.4	R91	R91-D228 VanDerWaalsContact NH2-CB 3.32Å
229	D	97.4	Very high	98.3	Very high	35 Å²	35	34.6 Å²	34.6	19%	0.187	17%	0.166	C	C	.	.	S	Bend	trans	-103	9.1	-165.6	73.1	-14.7	0	0	0	114.2	S179 R197 R198	S179-D229 VanDerWaalsContact CB-O 3.24Å; S179-D229 WeakPolarHBondContact CB-O 3.38Å; R197-D229 IonicContact CZ-OD2 3.56Å; R197-D229 IonicContact NE-OD2 3.9Å; R197-D229 PolarHBondContact NE-OD2 3.24Å; R197-D229 PolarHBondContact NH1-O 3.11Å; R197-D229 IonicContact NH1-OD2 2.69Å; R197-D229 IonicContact NH2-OD2 3.33Å; R197-D229 PolarHBondContact NH2-OD2 2.86Å; R198-D229 IonicContact CZ-OD1 3.81Å; R198-D229 IonicContact CZ-OD2 3.24Å; R198-D229 VanDerWaalsContact NH1-CG 3.32Å; R198-D229 IonicContact NH1-OD1 2.65Å; R198-D229 PolarHBondContact NH1-OD1 3.48Å; R198-D229 IonicContact NH1-OD2 3.97Å; R198-D229 PolarHBondContact NH1-OD2 3.25Å; R198-D229 IonicContact NH2-OD1 3.55Å; R198-D229 PolarHBondContact NH2-OD1 3.45Å; R198-D229 IonicContact NH2-OD2 3.98Å
230	W	98.2	Very high	98.3	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.015	15%	0.151	C	C	.	.			trans	-119.1	145.8	173.7	60	-99.2	0	0	0	111.6	R91 V93 V181 E224 M233 L272	R91-W230 HydrophobicContact CB-CH2 4.25Å; R91-W230 HydrophobicContact CB-CZ3 3.83Å; R91-W230 HydrophobicContact CG-CZ3 4.17Å; V93-W230 HydrophobicContact CG2-CH2 3.81Å; V93-W230 HydrophobicContact CG2-CZ3 4.1Å; V181-W230 HydrophobicContact CG1-CB 4Å; V181-W230 HydrophobicContact CG1-CG 4.49Å; V181-W230 HydrophobicContact CG2-CB 4.1Å; V181-W230 HydrophobicContact CG2-CD2 4.46Å; V181-W230 HydrophobicContact CG2-CG 3.98Å; E224-W230 PolarHBondContact O-NE1 3.15Å; W230-M233 HydrophobicContact CD2-CB 4.36Å; W230-M233 HydrophobicContact CD2-CE 4.32Å; W230-M233 HydrophobicContact CE3-CB 4.03Å; W230-M233 HydrophobicContact CH2-CB 4.32Å; W230-M233 HydrophobicContact CH2-CE 3.97Å; W230-M233 HydrophobicContact CZ2-CE 3.43Å; W230-M233 VanDerWaalsContact CZ2-CE 3.43Å; W230-M233 HydrophobicContact CZ3-CB 3.99Å; W230-L272 HydrophobicContact CH2-CD2 4.17Å
231	T	98.5	Very high	98.2	Very high	24 Å²	24	29.3 Å²	29.3	15%	0.147	15%	0.146	C	C	.	.	S	Bend	trans	-99	-35.7	173.5	-51.1	0	0	0	0	110.7	K90 R91 V92 M173 L178 S179 L336	K90-T231 WeakPolarHBondContact O-CG2 3.29Å; R91-T231 CarbonylContact C-O 3.28Å; R91-T231 WeakPolarHBondContact CA-O 3.36Å; V92-T231 PolarHBondContact N-O 2.62Å; M173-T231 HydrophobicContact CE-CG2 4.27Å; L178-T231 HydrophobicContact CB-CG2 4.41Å; L178-T231 HydrophobicContact CD1-CG2 4.23Å; L178-T231 HydrophobicContact CD2-CG2 4.32Å; S179-T231 PolarHBondContact O-N 3.16Å; T231-L336 HydrophobicContact CG2-CD2 3.85Å
232	M	98.8	Very high	98.2	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.1	176	-170.5	177.7	-72.2	0	0	111.6	V92 L94 L169 M173 S179 S180 V181 I234 L336	V92-M232 HydrophobicContact CB-CE 4.33Å; V92-M232 HydrophobicContact CB-CG 4.31Å; V92-M232 HydrophobicContact CG1-CE 4.32Å; V92-M232 HydrophobicContact CG1-CG 4.47Å; V92-M232 CarbonylContact O-C 3.57Å; V92-M232 VanDerWaalsContact O-CA 3.26Å; V92-M232 WeakPolarHBondContact O-CA 3.18Å; L94-M232 HydrophobicContact CD1-CE 4.43Å; L94-M232 HydrophobicContact CD1-SD 3.86Å; L94-M232 HydrophobicContact CG-SD 4.42Å; L169-M232 HydrophobicContact CD2-CE 3.77Å; L169-M232 HydrophobicContact CG-CE 4.4Å; M173-M232 HydrophobicContact CE-CB 3.53Å; M173-M232 HydrophobicContact SD-CB 3.94Å; M173-M232 HydrophobicContact SD-CE 3.82Å; M173-M232 HydrophobicContact SD-SD 4Å; S179-M232 PolarHBondContact O-N 2.96Å; S180-M232 CarbonylContact C-O 3.44Å; S180-M232 WeakPolarHBondContact CA-O 3.22Å; V181-M232 PolarHBondContact N-O 3.39Å; M232-I234 HydrophobicContact CG-CD1 4.47Å; M232-I234 HydrophobicContact CG-CG1 3.93Å; M232-I234 HydrophobicContact SD-CD1 3.89Å; M232-I234 HydrophobicContact SD-CG1 3.95Å; M232-L336 HydrophobicContact CE-CD1 3.73Å
233	M	98.9	Very high	98.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.3	167.3	178.5	-174.5	-53.1	0	0	108.4	V92 V93 L94 V181 L221 E224 L225 W230 L235	V92-M233 PolarHBondContact O-N 3.32Å; V93-M233 CarbonylContact C-O 3.56Å; V93-M233 WeakPolarHBondContact CA-O 3.42Å; V93-M233 HydrophobicContact CG1-CB 4.43Å; V93-M233 HydrophobicContact CG1-SD 4.35Å; V93-M233 HydrophobicContact CG2-CB 4.18Å; L94-M233 PolarHBondContact N-O 3.17Å; V181-M233 HydrophobicContact CG2-CB 3.85Å; V181-M233 HydrophobicContact CG2-CE 4.5Å; V181-M233 HydrophobicContact CG2-CG 3.89Å; L221-M233 HydrophobicContact CD2-SD 4.14Å; E224-M233 HydrophobicContact CB-CE 3.51Å; E224-M233 HydrophobicContact CB-SD 4.43Å; L225-M233 HydrophobicContact CD2-CE 3.99Å; L225-M233 HydrophobicContact CD2-SD 4.34Å; L225-M233 HydrophobicContact CG-CE 4.5Å; W230-M233 HydrophobicContact CD2-CB 4.36Å; W230-M233 HydrophobicContact CD2-CE 4.32Å; W230-M233 HydrophobicContact CE3-CB 4.03Å; W230-M233 HydrophobicContact CH2-CB 4.32Å; W230-M233 HydrophobicContact CH2-CE 3.97Å; W230-M233 HydrophobicContact CZ2-CE 3.43Å; W230-M233 VanDerWaalsContact CZ2-CE 3.43Å; W230-M233 HydrophobicContact CZ3-CB 3.99Å; M233-L235 HydrophobicContact CG-CD2 4.03Å; M233-L235 HydrophobicContact CG-CG 4.12Å; M233-L235 HydrophobicContact SD-CD1 4.15Å; M233-L235 HydrophobicContact SD-CD2 4.03Å; M233-L235 HydrophobicContact SD-CG 4.21Å
234	I	98.9	Very high	98.2	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.015	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.3	176.5	-56.6	-179.5	0	0	0	108.3	L94 I96 L170 V181 F182 Y183 W188 F196 M232	L94-I234 HydrophobicContact CB-CG1 4.42Å; L94-I234 HydrophobicContact CD1-CG1 4.36Å; L94-I234 WeakPolarHBondContact O-CA 3.2Å; I96-I234 HydrophobicContact CD1-CG2 4.11Å; L170-I234 HydrophobicContact CD2-CD1 3.94Å; V181-I234 PolarHBondContact O-N 3.44Å; F182-I234 WeakPolarHBondContact CA-O 3.33Å; F182-I234 HydrophobicContact CD2-CB 3.92Å; F182-I234 HydrophobicContact CD2-CG2 3.79Å; F182-I234 HydrophobicContact CE2-CG2 4.16Å; Y183-I234 PolarHBondContact N-O 3.05Å; W188-I234 HydrophobicContact CH2-CD1 4.15Å; W188-I234 HydrophobicContact CH2-CG2 4.08Å; W188-I234 HydrophobicContact CZ2-CG2 4.08Å; W188-I234 HydrophobicContact CZ3-CD1 3.83Å; W188-I234 HydrophobicContact CZ3-CG2 4.38Å; F196-I234 HydrophobicContact CE1-CD1 4.27Å; M232-I234 HydrophobicContact CG-CD1 4.47Å; M232-I234 HydrophobicContact CG-CG1 3.93Å; M232-I234 HydrophobicContact SD-CD1 3.89Å; M232-I234 HydrophobicContact SD-CG1 3.95Å
235	L	98.9	Very high	98.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.5	177.4	-53.2	167.2	0	0	0	107.3	V93 L94 I96 Y183 V217 L221 M233 Y237 I268	V93-L235 HydrophobicContact CG1-CD1 4.13Å; L94-L235 PolarHBondContact O-N 3.01Å; I96-L235 PolarHBondContact N-O 2.86Å; Y183-L235 HydrophobicContact CD2-CD2 4.22Å; Y183-L235 CarbonylContact O-C 3.28Å; Y183-L235 VanDerWaalsContact O-CA 3.23Å; Y183-L235 WeakPolarHBondContact O-CA 3.49Å; V217-L235 HydrophobicContact CG1-CB 3.99Å; V217-L235 HydrophobicContact CG1-CD2 3.91Å; L221-L235 HydrophobicContact CD2-CD1 3.6Å; L221-L235 HydrophobicContact CD2-CD2 4.05Å; L221-L235 HydrophobicContact CD2-CG 4.47Å; M233-L235 HydrophobicContact CG-CD2 4.03Å; M233-L235 HydrophobicContact CG-CG 4.12Å; M233-L235 HydrophobicContact SD-CD1 4.15Å; M233-L235 HydrophobicContact SD-CD2 4.03Å; M233-L235 HydrophobicContact SD-CG 4.21Å; L235-Y237 HydrophobicContact CB-CD2 4.26Å; L235-Y237 HydrophobicContact CB-CE2 3.75Å; L235-Y237 HydrophobicContact CD1-CE2 4.37Å; L235-I268 HydrophobicContact CD1-CD1 3.56Å
236	H	98.8	Very high	97.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	100.8	179.1	-162.8	135.5	0	0	0	109.9	I96 D98 F182 Y183 G184 W188 L238 D286	I96-H236 HydrophobicContact CB-CB 4.31Å; I96-H236 WeakPolarHBondContact O-CA 3.47Å; D98-H236 IonicContact OD2-NE2 2.7Å; F182-H236 HydrophobicContact CE2-CB 4.18Å; Y183-H236 PolarHBondContact O-N 3.09Å; G184-H236 WeakPolarHBondContact CA-O 3.23Å; W188-H236 AromaticContact CE2-ND1 3.87Å; W188-H236 AromaticContact NE1-CE1 3.97Å; W188-H236 AromaticContact NE1-CG 3.73Å; W188-H236 AromaticContact NE1-ND1 3.04Å; W188-H236 PolarHBondContact NE1-ND1 2.97Å; H236-L238 WeakPolarHBondContact O-CD1 3.33Å; H236-D286 IonicContact CE1-OD2 3.43Å; H236-D286 IonicContact NE2-OD2 3.73Å
237	Y	98.7	Very high	97.9	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	136.6	-179.2	-72.4	-90.6	0	0	0	110.7	M95 I96 D98 D214 V217 T218 L235 M261 V264	M95-Y237 HydrophobicContact CE-CD2 3.82Å; M95-Y237 HydrophobicContact CE-CE2 3.67Å; M95-Y237 HydrophobicContact CE-CG 4.49Å; M95-Y237 HydrophobicContact CG-CD2 3.97Å; M95-Y237 HydrophobicContact CG-CE2 3.94Å; M95-Y237 HydrophobicContact SD-CE2 4.37Å; I96-Y237 PolarHBondContact O-N 3.34Å; D98-Y237 WeakPolarHBondContact CB-O 3.28Å; D98-Y237 PolarHBondContact N-O 3.29Å; D214-Y237 HydrophobicContact CB-CD1 3.77Å; D214-Y237 HydrophobicContact CB-CE1 4.23Å; V217-Y237 HydrophobicContact CB-CD1 4.26Å; V217-Y237 HydrophobicContact CB-CE1 3.82Å; V217-Y237 HydrophobicContact CB-CE2 4.49Å; V217-Y237 HydrophobicContact CG1-CD1 4.43Å; V217-Y237 HydrophobicContact CG1-CD2 4.26Å; V217-Y237 HydrophobicContact CG1-CE1 3.92Å; V217-Y237 HydrophobicContact CG1-CE2 3.7Å; V217-Y237 VanDerWaalsContact CG1-CZ 3.5Å; T218-Y237 VanDerWaalsContact OG1-CE1 3.27Å; T218-Y237 WeakPolarHBondContact OG1-CE1 3.24Å; T218-Y237 PolarHBondContact OG1-OH 3.16Å; L235-Y237 HydrophobicContact CB-CD2 4.26Å; L235-Y237 HydrophobicContact CB-CE2 3.75Å; L235-Y237 HydrophobicContact CD1-CE2 4.37Å; Y237-M261 HydrophobicContact CD1-CE 3.75Å; Y237-M261 HydrophobicContact CD1-SD 3.7Å; Y237-M261 HydrophobicContact CD2-SD 4.32Å; Y237-M261 HydrophobicContact CE1-CE 4.06Å; Y237-M261 HydrophobicContact CE1-SD 4.3Å; Y237-M261 HydrophobicContact CG-CE 4.38Å; Y237-M261 HydrophobicContact CG-SD 3.71Å; Y237-V264 HydrophobicContact CE2-CG1 4.34Å; Y237-V264 WeakPolarHBondContact OH-CG1 3.45Å
238	L	98.4	Very high	97.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.			trans	-111.5	-19.9	-173.2	-60.6	91.5	0	0	0	113.1	D185 T202 S204 V213 D214 H236 L240 D241 H242	D185-L238 HydrophobicContact CB-CD1 4.23Å; D185-L238 HydrophobicContact CB-CD2 4.03Å; D185-L238 HydrophobicContact CB-CG 4.32Å; D185-L238 WeakPolarHBondContact OD2-CD2 3.27Å; T202-L238 HydrophobicContact CG2-CD1 3.45Å; T202-L238 VanDerWaalsContact CG2-CD1 3.45Å; S204-L238 VanDerWaalsContact CB-CD2 3.49Å; V213-L238 HydrophobicContact CB-CB 4.45Å; V213-L238 HydrophobicContact CB-CD1 4.41Å; V213-L238 HydrophobicContact CG2-CB 4.2Å; D214-L238 PolarHBondContact OD1-N 2.83Å; H236-L238 WeakPolarHBondContact O-CD1 3.33Å; L238-L240 PolarHBondContact O-N 3.46Å; L238-D241 PolarHBondContact O-N 3.08Å; L238-D241 VanDerWaalsContact O-N 3.11Å; L238-H242 PolarHBondContact O-CD2 2.8Å; L238-H242 PolarHBondContact O-N 3.39Å; L238-H242 VanDerWaalsContact O-N 3.08Å
239	G	98.2	Very high	97.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.3	-26.7	-166.4	0	0	0	0	0	114.5	Y210 D214 I243	Y210-G239 WeakPolarHBondContact CB-O 3.32Å; D214-G239 PolarHBondContact OD1-N 3.39Å; D214-G239 VanDerWaalsContact OD2-CA 3.31Å; D214-G239 WeakPolarHBondContact OD2-CA 3.26Å; D214-G239 PolarHBondContact OD2-N 2.89Å; G239-I243 WeakPolarHBondContact O-CD1 3.24Å; G239-I243 VanDerWaalsContact O-CG1 3.24Å; G239-I243 WeakPolarHBondContact O-CG1 3.45Å; G239-I243 PolarHBondContact O-N 2.92Å
240	L	98.3	Very high	97.3	Very high	14 Å²	14	23.9 Å²	23.9	7%	0.073	12%	0.117	C	C	.	.	H	α-helix	trans	-68.7	-47.3	176.2	-178.8	65.4	0	0	0	112	I97 D98 L100 L238 I243 G244 I254 K257 L258	I97-L240 HydrophobicContact CG2-CB 4Å; I97-L240 HydrophobicContact CG2-CD2 3.72Å; D98-L240 WeakPolarHBondContact O-CB 3.45Å; L100-L240 HydrophobicContact CB-CD2 4.08Å; L100-L240 HydrophobicContact CD1-CD2 3.79Å; L238-L240 PolarHBondContact O-N 3.46Å; L240-I243 PolarHBondContact O-N 2.81Å; L240-G244 PolarHBondContact O-N 3.39Å; L240-I254 HydrophobicContact CD1-CD1 3.73Å; L240-I254 HydrophobicContact CD1-CG2 4.24Å; L240-K257 HydrophobicContact CB-CG 4.03Å; L240-K257 HydrophobicContact CD1-CG 4.16Å; L240-L258 HydrophobicContact CD1-CD2 4.38Å; L240-L258 HydrophobicContact CD2-CD2 4.32Å
241	D	97.7	Very high	97.2	Very high	7 Å²	7	24.8 Å²	24.8	4%	0.037	12%	0.124	C	C	.	.	H	α-helix	trans	-61	-45.8	175	-178.9	80.7	0	0	0	111.3	D98 A99 L238 I243 G244 H245 H287 M289 H295	D98-D241 HydrophobicContact CB-CB 3.74Å; D98-D241 WeakPolarHBondContact OD1-CB 3.22Å; A99-D241 HydrophobicContact CB-CB 3.72Å; A99-D241 WeakPolarHBondContact CB-OD1 3.46Å; L238-D241 PolarHBondContact O-N 3.08Å; L238-D241 VanDerWaalsContact O-N 3.11Å; D241-I243 PolarHBondContact O-N 3.06Å; D241-G244 CarbonylContact O-C 3.54Å; D241-G244 WeakPolarHBondContact O-CA 3.39Å; D241-G244 PolarHBondContact O-N 3.41Å; D241-H245 PolarHBondContact O-N 3.2Å; D241-H245 IonicContact OD2-CD2 3.59Å; D241-H245 PolarHBondContact OD2-CD2 3.45Å; D241-H245 IonicContact OD2-CG 3.98Å; D241-H245 IonicContact OD2-NE2 3.42Å; D241-H245 PolarHBondContact OD2-NE2 3Å; D241-H287 IonicContact OD1-CE1 3.38Å; D241-M289 HydrophobicContact CB-CE 4.37Å; D241-M289 WeakPolarHBondContact O-CE 3.42Å; D241-M289 WeakPolarHBondContact OD1-CE 3.22Å; D241-H295 IonicContact OD1-CD2 2.79Å; D241-H295 PolarHBondContact OD1-CD2 3.1Å; D241-H295 IonicContact OD1-NE2 3.53Å
242	H	98	Very high	97.1	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.019	15%	0.146	C	C	.	.	H	α-helix	trans	-58.1	-41.5	177.1	-77.3	-155.3	0	0	0	113.3	V207 D209 L238 S246	V207-H242 VanDerWaalsContact O-CB 3.32Å; V207-H242 WeakPolarHBondContact O-CB 3.2Å; D209-H242 PolarHBondContact O-ND1 3.47Å; L238-H242 PolarHBondContact O-CD2 2.8Å; L238-H242 PolarHBondContact O-N 3.39Å; L238-H242 VanDerWaalsContact O-N 3.08Å; H242-S246 WeakPolarHBondContact O-CB 2.99Å; H242-S246 PolarHBondContact O-N 3.16Å; H242-S246 PolarHBondContact O-OG 3.28Å
243	I	98.1	Very high	97	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-64.5	-43.8	172.6	-70.8	163.1	0	0	0	110.3	Y210 G239 L240 D241 S246 Y247 L253 I254 K257	Y210-I243 HydrophobicContact CD1-CG1 3.9Å; Y210-I243 HydrophobicContact CD2-CD1 3.82Å; Y210-I243 HydrophobicContact CD2-CG1 3.76Å; Y210-I243 HydrophobicContact CE2-CD1 4.5Å; Y210-I243 HydrophobicContact CE2-CG1 4.41Å; Y210-I243 HydrophobicContact CG-CD1 4Å; Y210-I243 HydrophobicContact CG-CG1 3.46Å; Y210-I243 VanDerWaalsContact CG-CG1 3.46Å; G239-I243 WeakPolarHBondContact O-CD1 3.24Å; G239-I243 VanDerWaalsContact O-CG1 3.24Å; G239-I243 WeakPolarHBondContact O-CG1 3.45Å; G239-I243 PolarHBondContact O-N 2.92Å; L240-I243 PolarHBondContact O-N 2.81Å; D241-I243 PolarHBondContact O-N 3.06Å; I243-S246 PolarHBondContact O-N 3.16Å; I243-Y247 HydrophobicContact CG2-CD2 4.3Å; I243-Y247 PolarHBondContact O-N 3.5Å; I243-L253 HydrophobicContact CD1-CB 4.07Å; I243-L253 HydrophobicContact CG1-CB 4.31Å; I243-L253 HydrophobicContact CG2-CB 3.72Å; I243-I254 HydrophobicContact CB-CD1 4.13Å; I243-I254 HydrophobicContact CG2-CD1 3.5Å; I243-I254 HydrophobicContact CG2-CG1 3.95Å; I243-K257 HydrophobicContact CD1-CB 3.59Å; I243-K257 HydrophobicContact CD1-CG 3.93Å
244	G	97.3	Very high	97	Very high	4 Å²	4	31.2 Å²	31.2	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-54.9	-53.7	176.8	0	0	0	0	0	111.4	L240 D241 S246 G248 G293	L240-G244 PolarHBondContact O-N 3.39Å; D241-G244 CarbonylContact O-C 3.54Å; D241-G244 WeakPolarHBondContact O-CA 3.39Å; D241-G244 PolarHBondContact O-N 3.41Å; G244-S246 VanDerWaalsContact C-N 3.33Å; G244-S246 PolarHBondContact O-N 3.08Å; G244-G248 VanDerWaalsContact O-CA 3.23Å; G244-G248 WeakPolarHBondContact O-CA 3.29Å; G244-G248 PolarHBondContact O-N 3.18Å; G244-G293 VanDerWaalsContact O-CA 3.26Å; G244-G293 WeakPolarHBondContact O-CA 3.3Å
245	H	96.2	Very high	96.9	Very high	72 Å²	72	32.1 Å²	32.1	33%	0.333	17%	0.17	S	C	.	.	H	α-helix	trans	-56.6	-42.9	176	-78.2	-33.3	0	0	0	113.9	V207 D241 G293 H295	V207-H245 HydrophobicContact CG1-CB 3.37Å; D241-H245 PolarHBondContact O-N 3.2Å; D241-H245 IonicContact OD2-CD2 3.59Å; D241-H245 PolarHBondContact OD2-CD2 3.45Å; D241-H245 IonicContact OD2-CG 3.98Å; D241-H245 IonicContact OD2-NE2 3.42Å; D241-H245 PolarHBondContact OD2-NE2 3Å; H245-G293 WeakPolarHBondContact CA-O 3.24Å; H245-G293 PolarHBondContact ND1-O 3.23Å; H245-H295 AromaticContact CE1-CD2 3.25Å; H245-H295 PolarHBondContact CE1-CD2 3.19Å; H245-H295 AromaticContact CE1-NE2 3.3Å; H245-H295 PolarHBondContact CE1-NE2 3.41Å; H245-H295 VanDerWaalsContact CE1-NE2 3.3Å; H245-H295 AromaticContact NE2-CD2 3.66Å; H245-H295 AromaticContact NE2-NE2 3.27Å; H245-H295 PolarHBondContact NE2-NE2 3.07Å
246	S	96.2	Very high	96.9	Very high	44 Å²	44	36.8 Å²	36.8	31%	0.308	19%	0.194	S	C	.	.	H	α-helix	trans	-80.3	-32.1	-172.9	-63.2	0	0	0	0	113.4	V207 H242 I243 G244	V207-S246 PolarHBondContact O-OG 2.9Å; H242-S246 WeakPolarHBondContact O-CB 2.99Å; H242-S246 PolarHBondContact O-N 3.16Å; H242-S246 PolarHBondContact O-OG 3.28Å; I243-S246 PolarHBondContact O-N 3.16Å; G244-S246 VanDerWaalsContact C-N 3.33Å; G244-S246 PolarHBondContact O-N 3.08Å
247	Y	95.8	Very high	96.9	Very high	127 Å²	127	37 Å²	37	50%	0.498	20%	0.195	S	C	.	.	H	α-helix	trans	-136.9	-4.1	-166.5	-54.9	-73.5	0	0	0	115.1	Y210 I243 L253	Y210-Y247 HydrophobicContact CD1-CE2 4.44Å; Y210-Y247 AromaticContact CE1-CE2 3.8Å; Y210-Y247 HydrophobicContact CE1-CE2 3.8Å; I243-Y247 HydrophobicContact CG2-CD2 4.3Å; I243-Y247 PolarHBondContact O-N 3.5Å; Y247-L253 HydrophobicContact CD2-CD1 3.69Å; Y247-L253 HydrophobicContact CE2-CD1 3.67Å; Y247-L253 HydrophobicContact CG-CD1 4.3Å
248	G	94.6	Very high	96.9	Very high	12 Å²	12	37.3 Å²	37.3	12%	0.124	20%	0.197	C	C	.	.			trans	74.6	172.1	-175.6	0	0	0	0	0	113.8	G244 K250 S251	G244-G248 VanDerWaalsContact O-CA 3.23Å; G244-G248 WeakPolarHBondContact O-CA 3.29Å; G244-G248 PolarHBondContact O-N 3.18Å; G248-K250 VanDerWaalsContact C-N 3.3Å; G248-K250 PolarHBondContact O-N 3.3Å; G248-S251 WeakPolarHBondContact O-CB 3.03Å; G248-S251 PolarHBondContact O-N 2.85Å
249	D	91.8	Very high	96.9	Very high	24 Å²	24	41.3 Å²	41.3	13%	0.128	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.8	-170.6	82.1	-14.5	0	0	0	114.7	R101 D291	R101-D249 IonicContact CZ-OD2 3.93Å; R101-D249 IonicContact NH1-OD2 3Å; R101-D249 PolarHBondContact NH1-OD2 2.79Å; D249-D291 PolarHBondContact N-O 3.27Å; D249-D291 VanDerWaalsContact N-O 3.08Å
250	K	92.5	Very high	96.9	Very high	159 Å²	159	44.4 Å²	44.4	69%	0.691	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	2.4	177.6	-55.3	-45.7	175.9	-135.5	0	113.4	G248	G248-K250 VanDerWaalsContact C-N 3.3Å; G248-K250 PolarHBondContact O-N 3.3Å
251	S	95.9	Very high	97	Very high	23 Å²	23	43.8 Å²	43.8	16%	0.161	23%	0.227	C	C	.	.			trans	-61.5	136.7	176.4	-179	0	0	0	0	111.2	G248 L253 I254	G248-S251 WeakPolarHBondContact O-CB 3.03Å; G248-S251 PolarHBondContact O-N 2.85Å; S251-L253 PolarHBondContact O-N 3.11Å; S251-L253 VanDerWaalsContact O-N 3.14Å; S251-L253 WeakPolarHBondContact OG-CB 3.25Å; S251-L253 PolarHBondContact OG-N 3.13Å; S251-I254 WeakPolarHBondContact O-CB 3.25Å; S251-I254 PolarHBondContact O-N 3.2Å
252	S	96.7	Very high	97	Very high	88 Å²	88	43.6 Å²	43.6	62%	0.615	23%	0.226	S	C	*	.	H	α-helix	trans	-60.8	-23	173.5	55.9	0	0	0	0	112.3	I254 S255 L256	S252-I254 PolarHBondContact O-N 2.8Å; S252-S255 PolarHBondContact O-N 3.46Å; S252-S255 PolarHBondContact O-OG 3.4Å; S252-L256 PolarHBondContact O-N 2.84Å
253	L	97.8	Very high	97.1	Very high	40 Å²	40	48.5 Å²	48.5	21%	0.209	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-28.6	174.1	-62.5	176.5	0	0	0	112.6	Y210 I243 Y247 S251 S255 L256 K257	Y210-L253 HydrophobicContact CE1-CD1 4.46Å; Y210-L253 HydrophobicContact CE2-CD1 4.41Å; I243-L253 HydrophobicContact CD1-CB 4.07Å; I243-L253 HydrophobicContact CG1-CB 4.31Å; I243-L253 HydrophobicContact CG2-CB 3.72Å; Y247-L253 HydrophobicContact CD2-CD1 3.69Å; Y247-L253 HydrophobicContact CE2-CD1 3.67Å; Y247-L253 HydrophobicContact CG-CD1 4.3Å; S251-L253 PolarHBondContact O-N 3.11Å; S251-L253 VanDerWaalsContact O-N 3.14Å; S251-L253 WeakPolarHBondContact OG-CB 3.25Å; S251-L253 PolarHBondContact OG-N 3.13Å; L253-S255 VanDerWaalsContact C-N 3.34Å; L253-S255 PolarHBondContact O-N 2.83Å; L253-L256 HydrophobicContact CD2-CD1 4.3Å; L253-L256 PolarHBondContact O-N 3.39Å; L253-K257 WeakPolarHBondContact O-CB 3.46Å; L253-K257 PolarHBondContact O-N 3.48Å
254	I	98	Very high	97.1	Very high	31 Å²	31	49 Å²	49	16%	0.159	26%	0.256	C	S	.	.	H	α-helix	trans	-59.3	-47.7	175	-63.6	-68.1	0	0	0	109.8	L240 I243 S251 S252 L256 K257 L258	L240-I254 HydrophobicContact CD1-CD1 3.73Å; L240-I254 HydrophobicContact CD1-CG2 4.24Å; I243-I254 HydrophobicContact CB-CD1 4.13Å; I243-I254 HydrophobicContact CG2-CD1 3.5Å; I243-I254 HydrophobicContact CG2-CG1 3.95Å; S251-I254 WeakPolarHBondContact O-CB 3.25Å; S251-I254 PolarHBondContact O-N 3.2Å; S252-I254 PolarHBondContact O-N 2.8Å; I254-L256 VanDerWaalsContact C-N 3.32Å; I254-L256 PolarHBondContact O-N 3.17Å; I254-K257 PolarHBondContact O-N 2.98Å; I254-L258 HydrophobicContact CG2-CD1 4.02Å; I254-L258 HydrophobicContact CG2-CG 4.27Å; I254-L258 VanDerWaalsContact O-CG 3.28Å; I254-L258 WeakPolarHBondContact O-CG 3.43Å; I254-L258 PolarHBondContact O-N 2.75Å
255	S	98	Very high	97.2	Very high	23 Å²	23	48.9 Å²	48.9	16%	0.161	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-38.3	179.9	68.6	0	0	0	0	113.1	S252 L253 Q259	S252-S255 PolarHBondContact O-N 3.46Å; S252-S255 PolarHBondContact O-OG 3.4Å; L253-S255 VanDerWaalsContact C-N 3.34Å; L253-S255 PolarHBondContact O-N 2.83Å; S255-Q259 WeakPolarHBondContact O-CG 3.24Å; S255-Q259 PolarHBondContact O-N 2.98Å; S255-Q259 VanDerWaalsContact O-N 3.13Å
256	L	98.3	Very high	97.3	Very high	97 Å²	97	46 Å²	46	51%	0.508	24%	0.242	S	C	.	.	H	α-helix	trans	-68.1	-41	176.3	-63.7	178.1	0	0	0	111.4	S252 L253 I254 Q259 E260	S252-L256 PolarHBondContact O-N 2.84Å; L253-L256 HydrophobicContact CD2-CD1 4.3Å; L253-L256 PolarHBondContact O-N 3.39Å; I254-L256 VanDerWaalsContact C-N 3.32Å; I254-L256 PolarHBondContact O-N 3.17Å; L256-Q259 WeakPolarHBondContact O-CB 3.46Å; L256-Q259 PolarHBondContact O-N 3.42Å; L256-E260 PolarHBondContact O-N 2.77Å
257	K	98.5	Very high	97.4	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.017	24%	0.244	C	C	.	.	H	α-helix	trans	-67.1	-38.6	176.9	-177.9	56.4	60.7	174.6	0	112.1	Y210 D214 L240 I243 L253 I254 Q259 E260 M261	Y210-K257 WeakPolarHBondContact O-CE 3.25Å; Y210-K257 PolarHBondContact O-NZ 2.9Å; D214-K257 WeakPolarHBondContact OD2-CD 2.97Å; D214-K257 WeakPolarHBondContact OD2-CE 3.2Å; D214-K257 IonicContact OD2-NZ 2.73Å; D214-K257 PolarHBondContact OD2-NZ 3.08Å; L240-K257 HydrophobicContact CB-CG 4.03Å; L240-K257 HydrophobicContact CD1-CG 4.16Å; I243-K257 HydrophobicContact CD1-CB 3.59Å; I243-K257 HydrophobicContact CD1-CG 3.93Å; L253-K257 WeakPolarHBondContact O-CB 3.46Å; L253-K257 PolarHBondContact O-N 3.48Å; I254-K257 PolarHBondContact O-N 2.98Å; K257-Q259 VanDerWaalsContact C-N 3.33Å; K257-Q259 PolarHBondContact O-N 2.94Å; K257-E260 VanDerWaalsContact CE-OE2 3.27Å; K257-E260 WeakPolarHBondContact CE-OE2 3.3Å; K257-E260 IonicContact NZ-OE1 3Å; K257-E260 PolarHBondContact NZ-OE1 3.45Å; K257-E260 IonicContact NZ-OE2 2.73Å; K257-E260 PolarHBondContact NZ-OE2 2.77Å; K257-E260 WeakPolarHBondContact O-CB 3.49Å; K257-E260 PolarHBondContact O-N 3.27Å; K257-M261 HydrophobicContact CD-CE 4.09Å; K257-M261 HydrophobicContact CD-CG 4.32Å; K257-M261 WeakPolarHBondContact O-CG 3.24Å; K257-M261 PolarHBondContact O-N 3.29Å
258	L	98.7	Very high	97.6	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-40.2	173.6	-67.2	175.5	0	0	0	111.6	L100 V104 Y111 M112 L240 I254 M261 D262	L100-L258 HydrophobicContact CD1-CD2 3.92Å; V104-L258 HydrophobicContact CG2-CD1 4.08Å; V104-L258 HydrophobicContact CG2-CD2 3.97Å; Y111-L258 HydrophobicContact CD2-CD1 4.12Å; M112-L258 HydrophobicContact CE-CB 3.88Å; M112-L258 HydrophobicContact CE-CD2 3.36Å; M112-L258 HydrophobicContact CE-CG 4.18Å; M112-L258 HydrophobicContact CG-CB 4.08Å; M112-L258 HydrophobicContact SD-CD2 4.24Å; L240-L258 HydrophobicContact CD1-CD2 4.38Å; L240-L258 HydrophobicContact CD2-CD2 4.32Å; I254-L258 HydrophobicContact CG2-CD1 4.02Å; I254-L258 HydrophobicContact CG2-CG 4.27Å; I254-L258 VanDerWaalsContact O-CG 3.28Å; I254-L258 WeakPolarHBondContact O-CG 3.43Å; I254-L258 PolarHBondContact O-N 2.75Å; L258-M261 PolarHBondContact O-N 2.98Å; L258-D262 WeakPolarHBondContact O-CB 3.1Å; L258-D262 PolarHBondContact O-N 2.72Å
259	Q	98.7	Very high	97.7	Very high	83 Å²	83	41.8 Å²	41.8	39%	0.388	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-41	173.3	-72	171.9	5.5	0	0	112.3	Y111 S255 L256 K257 D262 N263	Y111-Q259 WeakPolarHBondContact O-CA 3.26Å; Y111-Q259 WeakPolarHBondContact O-CG 3.42Å; S255-Q259 WeakPolarHBondContact O-CG 3.24Å; S255-Q259 PolarHBondContact O-N 2.98Å; S255-Q259 VanDerWaalsContact O-N 3.13Å; L256-Q259 WeakPolarHBondContact O-CB 3.46Å; L256-Q259 PolarHBondContact O-N 3.42Å; K257-Q259 VanDerWaalsContact C-N 3.33Å; K257-Q259 PolarHBondContact O-N 2.94Å; Q259-D262 PolarHBondContact O-N 3.24Å; Q259-N263 WeakPolarHBondContact O-CB 3.37Å; Q259-N263 VanDerWaalsContact O-CG 3.24Å; Q259-N263 PolarHBondContact O-N 2.84Å; Q259-N263 PolarHBondContact O-ND2 3.2Å
260	E	98.8	Very high	98	Very high	65 Å²	65	47.9 Å²	47.9	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-59.9	-49.1	175.1	-172.8	-171.3	143.3	0	0	111.2	L256 K257 D262 N263 V264	L256-E260 PolarHBondContact O-N 2.77Å; K257-E260 VanDerWaalsContact CE-OE2 3.27Å; K257-E260 WeakPolarHBondContact CE-OE2 3.3Å; K257-E260 IonicContact NZ-OE1 3Å; K257-E260 PolarHBondContact NZ-OE1 3.45Å; K257-E260 IonicContact NZ-OE2 2.73Å; K257-E260 PolarHBondContact NZ-OE2 2.77Å; K257-E260 WeakPolarHBondContact O-CB 3.49Å; K257-E260 PolarHBondContact O-N 3.27Å; E260-D262 VanDerWaalsContact C-N 3.34Å; E260-D262 PolarHBondContact O-N 3.5Å; E260-N263 WeakPolarHBondContact O-CB 3.44Å; E260-N263 PolarHBondContact O-N 3.16Å; E260-V264 WeakPolarHBondContact O-CG2 3.41Å; E260-V264 PolarHBondContact O-N 2.84Å
261	M	98.8	Very high	98.3	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-33.8	179.4	-65.8	-57.9	98.5	0	0	112.9	M95 I97 M112 D214 Y237 K257 L258 V264 S265	M95-M261 HydrophobicContact CE-CB 4.23Å; M95-M261 HydrophobicContact CE-SD 3.71Å; I97-M261 HydrophobicContact CD1-CB 3.72Å; I97-M261 HydrophobicContact CD1-CG 3.93Å; I97-M261 HydrophobicContact CD1-SD 4.31Å; I97-M261 HydrophobicContact CG1-CG 4.26Å; I97-M261 HydrophobicContact CG1-SD 4.13Å; I97-M261 HydrophobicContact CG2-CG 4.14Å; I97-M261 HydrophobicContact CG2-SD 4.49Å; M112-M261 HydrophobicContact CE-CB 4.26Å; D214-M261 HydrophobicContact CB-CE 4.45Å; Y237-M261 HydrophobicContact CD1-CE 3.75Å; Y237-M261 HydrophobicContact CD1-SD 3.7Å; Y237-M261 HydrophobicContact CD2-SD 4.32Å; Y237-M261 HydrophobicContact CE1-CE 4.06Å; Y237-M261 HydrophobicContact CE1-SD 4.3Å; Y237-M261 HydrophobicContact CG-CE 4.38Å; Y237-M261 HydrophobicContact CG-SD 3.71Å; K257-M261 HydrophobicContact CD-CE 4.09Å; K257-M261 HydrophobicContact CD-CG 4.32Å; K257-M261 WeakPolarHBondContact O-CG 3.24Å; K257-M261 PolarHBondContact O-N 3.29Å; L258-M261 PolarHBondContact O-N 2.98Å; M261-V264 HydrophobicContact CE-CG2 4.49Å; M261-V264 PolarHBondContact O-N 3.03Å; M261-S265 WeakPolarHBondContact O-CB 3.49Å; M261-S265 PolarHBondContact O-N 3.48Å; M261-S265 PolarHBondContact O-OG 3.33Å
262	D	98.9	Very high	98.4	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-67.2	-40	173.2	-170.4	67	0	0	0	112	M112 P113 F114 L115 L258 Q259 E260 S265 S266	M112-D262 VanDerWaalsContact C-OD1 3.28Å; M112-D262 VanDerWaalsContact C-OD2 3.31Å; M112-D262 WeakPolarHBondContact CA-OD1 3.44Å; M112-D262 HydrophobicContact CB-CB 3.9Å; M112-D262 WeakPolarHBondContact CB-OD1 3.25Å; M112-D262 HydrophobicContact CG-CB 4.01Å; P113-D262 WeakPolarHBondContact CD-OD2 3.49Å; P113-D262 WeakPolarHBondContact CG-OD2 3.41Å; P113-D262 VanDerWaalsContact N-OD2 3.15Å; F114-D262 WeakPolarHBondContact CB-OD1 3.45Å; F114-D262 WeakPolarHBondContact CB-OD2 3.49Å; F114-D262 PolarHBondContact N-OD1 3.39Å; F114-D262 PolarHBondContact N-OD2 2.84Å; L115-D262 WeakPolarHBondContact CG-OD1 3.33Å; L115-D262 PolarHBondContact N-OD1 3.49Å; L258-D262 WeakPolarHBondContact O-CB 3.1Å; L258-D262 PolarHBondContact O-N 2.72Å; Q259-D262 PolarHBondContact O-N 3.24Å; E260-D262 VanDerWaalsContact C-N 3.34Å; E260-D262 PolarHBondContact O-N 3.5Å; D262-S265 WeakPolarHBondContact O-CB 3.29Å; D262-S265 PolarHBondContact O-N 3.41Å; D262-S266 VanDerWaalsContact O-CB 3.31Å; D262-S266 WeakPolarHBondContact O-CB 3.42Å; D262-S266 PolarHBondContact O-N 3.49Å
263	N	98.9	Very high	98.4	Very high	107 Å²	107	40.4 Å²	40.4	57%	0.572	19%	0.194	S	C	*	.	H	α-helix	trans	-63.3	-43.3	174.6	-73.8	-32.2	0	0	0	111.7	Q259 E260 S266 F267	Q259-N263 WeakPolarHBondContact O-CB 3.37Å; Q259-N263 VanDerWaalsContact O-CG 3.24Å; Q259-N263 PolarHBondContact O-N 2.84Å; Q259-N263 PolarHBondContact O-ND2 3.2Å; E260-N263 WeakPolarHBondContact O-CB 3.44Å; E260-N263 PolarHBondContact O-N 3.16Å; N263-S266 WeakPolarHBondContact O-CB 3.22Å; N263-S266 PolarHBondContact O-N 3.15Å; N263-F267 WeakPolarHBondContact O-CB 3.44Å; N263-F267 PolarHBondContact O-N 3.03Å
264	V	98.9	Very high	98.4	Very high	14 Å²	14	45.6 Å²	45.6	9%	0.085	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-46.1	173.6	171.6	0	0	0	0	110.7	M95 T218 L221 Y237 E260 M261 S266 F267 I268	M95-V264 HydrophobicContact CE-CB 3.92Å; M95-V264 HydrophobicContact CE-CG1 3.57Å; M95-V264 HydrophobicContact SD-CG1 4.07Å; T218-V264 HydrophobicContact CG2-CG2 4.16Å; L221-V264 HydrophobicContact CD1-CG1 3.88Å; Y237-V264 HydrophobicContact CE2-CG1 4.34Å; Y237-V264 WeakPolarHBondContact OH-CG1 3.45Å; E260-V264 WeakPolarHBondContact O-CG2 3.41Å; E260-V264 PolarHBondContact O-N 2.84Å; M261-V264 HydrophobicContact CE-CG2 4.49Å; M261-V264 PolarHBondContact O-N 3.03Å; V264-S266 VanDerWaalsContact C-N 3.32Å; V264-S266 PolarHBondContact O-N 3.03Å; V264-F267 PolarHBondContact O-N 3.36Å; V264-I268 HydrophobicContact CG1-CD1 3.79Å; V264-I268 HydrophobicContact CG1-CG1 4.43Å; V264-I268 WeakPolarHBondContact O-CG1 3.5Å; V264-I268 PolarHBondContact O-N 2.94Å
265	S	98.8	Very high	98.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-44.1	177.4	-60.2	0	0	0	0	111.9	M95 M261 D262 I268 Y269 F281	M95-S265 PolarHBondContact SD-OG 3.41Å; M261-S265 WeakPolarHBondContact O-CB 3.49Å; M261-S265 PolarHBondContact O-N 3.48Å; M261-S265 PolarHBondContact O-OG 3.33Å; D262-S265 WeakPolarHBondContact O-CB 3.29Å; D262-S265 PolarHBondContact O-N 3.41Å; S265-I268 PolarHBondContact O-N 2.8Å; S265-Y269 WeakPolarHBondContact O-CB 3.45Å; S265-Y269 PolarHBondContact O-N 3.5Å; S265-F281 WeakPolarHBondContact O-CE1 3.36Å
266	S	98.7	Very high	98.2	Very high	13 Å²	13	49.7 Å²	49.7	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-44.4	176	-175.7	0	0	0	0	111.8	F114 D262 N263 V264 R270	F114-S266 WeakPolarHBondContact CD2-OG 3.17Å; D262-S266 VanDerWaalsContact O-CB 3.31Å; D262-S266 WeakPolarHBondContact O-CB 3.42Å; D262-S266 PolarHBondContact O-N 3.49Å; N263-S266 WeakPolarHBondContact O-CB 3.22Å; N263-S266 PolarHBondContact O-N 3.15Å; V264-S266 VanDerWaalsContact C-N 3.32Å; V264-S266 PolarHBondContact O-N 3.03Å; S266-R270 VanDerWaalsContact O-CB 3.29Å; S266-R270 WeakPolarHBondContact O-CB 3.45Å; S266-R270 WeakPolarHBondContact O-CG 3.38Å; S266-R270 PolarHBondContact O-N 3.37Å; S266-R270 PolarHBondContact OG-NE 3.25Å
267	F	98.8	Very high	98	Very high	77 Å²	77	48.6 Å²	48.6	34%	0.338	24%	0.238	S	C	.	.	H	α-helix	trans	-62.6	-48	177.7	175.5	-114.2	0	0	0	112.3	L221 D222 L225 N263 V264 T271	L221-F267 HydrophobicContact CB-CD1 4.33Å; L221-F267 HydrophobicContact CB-CE1 3.8Å; L221-F267 HydrophobicContact CD1-CD1 4.15Å; L221-F267 HydrophobicContact CD1-CE1 4.44Å; D222-F267 WeakPolarHBondContact OD1-CZ 3.39Å; L225-F267 HydrophobicContact CD1-CD1 4.14Å; L225-F267 HydrophobicContact CD1-CE1 3.71Å; L225-F267 HydrophobicContact CD1-CZ 4.27Å; N263-F267 WeakPolarHBondContact O-CB 3.44Å; N263-F267 PolarHBondContact O-N 3.03Å; V264-F267 PolarHBondContact O-N 3.36Å; F267-T271 WeakPolarHBondContact O-CB 3.49Å; F267-T271 PolarHBondContact O-N 3.34Å; F267-T271 PolarHBondContact O-OG1 2.76Å
268	I	98.8	Very high	97.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.7	-54.4	177.3	-68.7	168	0	0	0	110.1	V93 M95 L221 L225 L235 V264 S265 R270 T271 L272 F281	V93-I268 HydrophobicContact CB-CG2 4.49Å; V93-I268 HydrophobicContact CG1-CG2 4.09Å; M95-I268 HydrophobicContact SD-CD1 4.12Å; L221-I268 HydrophobicContact CD1-CD1 4.16Å; L221-I268 HydrophobicContact CD1-CG1 4.04Å; L221-I268 HydrophobicContact CD2-CD1 4.05Å; L221-I268 HydrophobicContact CD2-CG1 4.01Å; L225-I268 HydrophobicContact CD1-CG1 4.31Å; L225-I268 HydrophobicContact CD2-CG2 4.28Å; L235-I268 HydrophobicContact CD1-CD1 3.56Å; V264-I268 HydrophobicContact CG1-CD1 3.79Å; V264-I268 HydrophobicContact CG1-CG1 4.43Å; V264-I268 WeakPolarHBondContact O-CG1 3.5Å; V264-I268 PolarHBondContact O-N 2.94Å; S265-I268 PolarHBondContact O-N 2.8Å; I268-R270 PolarHBondContact O-N 3.36Å; I268-T271 PolarHBondContact O-N 3.28Å; I268-L272 HydrophobicContact CG2-CD1 3.75Å; I268-L272 HydrophobicContact CG2-CG 4.43Å; I268-L272 VanDerWaalsContact O-CG 3.3Å; I268-L272 WeakPolarHBondContact O-CG 3.36Å; I268-L272 PolarHBondContact O-N 2.93Å; I268-F281 HydrophobicContact CB-CE1 4.17Å; I268-F281 HydrophobicContact CB-CZ 4.09Å; I268-F281 HydrophobicContact CD1-CE2 4.36Å; I268-F281 HydrophobicContact CD1-CZ 4.11Å; I268-F281 HydrophobicContact CG2-CD1 4.18Å; I268-F281 HydrophobicContact CG2-CD2 4.14Å; I268-F281 HydrophobicContact CG2-CE1 4Å; I268-F281 HydrophobicContact CG2-CE2 3.96Å; I268-F281 HydrophobicContact CG2-CG 4.26Å; I268-F281 HydrophobicContact CG2-CZ 3.9Å
269	Y	98.4	Very high	97.9	Very high	16 Å²	16	49.4 Å²	49.4	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-46	-176.6	-179.5	-91.4	0	0	0	112.2	F114 M118 S265 T271 L272 H273 F279 F281 L310	F114-Y269 HydrophobicContact CE2-CD1 4.03Å; F114-Y269 HydrophobicContact CE2-CG 4.36Å; F114-Y269 VanDerWaalsContact CZ-CB 3.49Å; F114-Y269 AromaticContact CZ-CD1 3.82Å; F114-Y269 HydrophobicContact CZ-CD1 3.82Å; F114-Y269 AromaticContact CZ-CG 3.69Å; F114-Y269 HydrophobicContact CZ-CG 3.69Å; M118-Y269 HydrophobicContact CE-CD1 3.57Å; M118-Y269 HydrophobicContact CE-CE1 3.31Å; M118-Y269 HydrophobicContact CE-CG 4.29Å; M118-Y269 HydrophobicContact SD-CE1 4.41Å; S265-Y269 WeakPolarHBondContact O-CB 3.45Å; S265-Y269 PolarHBondContact O-N 3.5Å; Y269-T271 PolarHBondContact O-N 2.78Å; Y269-L272 PolarHBondContact O-N 3.29Å; Y269-H273 HydrophobicContact CD1-CB 4.43Å; Y269-H273 HydrophobicContact CE1-CB 4.13Å; Y269-H273 WeakPolarHBondContact O-CB 3.24Å; Y269-H273 PolarHBondContact O-N 3.26Å; Y269-F279 AromaticContact CD2-CE2 3.92Å; Y269-F279 HydrophobicContact CD2-CE2 3.92Å; Y269-F279 AromaticContact CD2-CZ 3.92Å; Y269-F279 HydrophobicContact CD2-CZ 3.92Å; Y269-F279 HydrophobicContact CE2-CE2 4.04Å; Y269-F279 AromaticContact CE2-CZ 3.79Å; Y269-F279 HydrophobicContact CE2-CZ 3.79Å; Y269-F281 HydrophobicContact CD2-CD1 4.41Å; Y269-L310 HydrophobicContact CD2-CB 3.84Å; Y269-L310 HydrophobicContact CD2-CD1 3.97Å; Y269-L310 HydrophobicContact CD2-CG 4.4Å; Y269-L310 HydrophobicContact CE2-CB 3.91Å; Y269-L310 HydrophobicContact CG-CD1 4.49Å
270	R	98.1	Very high	97.8	Very high	152 Å²	152	45.5 Å²	45.5	57%	0.574	22%	0.224	S	C	*	.	H	α-helix	trans	-64.1	-42.7	-178.7	-72.6	173.5	179.8	-175.9	2.2	111.7	S266 I268 H273 Q274	S266-R270 VanDerWaalsContact O-CB 3.29Å; S266-R270 WeakPolarHBondContact O-CB 3.45Å; S266-R270 WeakPolarHBondContact O-CG 3.38Å; S266-R270 PolarHBondContact O-N 3.37Å; S266-R270 PolarHBondContact OG-NE 3.25Å; I268-R270 PolarHBondContact O-N 3.36Å; R270-H273 PolarHBondContact O-N 3.28Å; R270-Q274 WeakPolarHBondContact O-CB 3.19Å; R270-Q274 WeakPolarHBondContact O-CG 3.29Å; R270-Q274 PolarHBondContact O-N 2.86Å
271	T	98.4	Very high	97.8	Very high	10 Å²	10	42.4 Å²	42.4	6%	0.061	21%	0.21	C	C	.	.	H	α-helix	trans	-65.9	-41.7	178.6	-54.8	0	0	0	0	111.5	L225 F267 I268 Y269 N275	L225-T271 HydrophobicContact CB-CG2 3.75Å; L225-T271 HydrophobicContact CD1-CG2 4.08Å; F267-T271 WeakPolarHBondContact O-CB 3.49Å; F267-T271 PolarHBondContact O-N 3.34Å; F267-T271 PolarHBondContact O-OG1 2.76Å; I268-T271 PolarHBondContact O-N 3.28Å; Y269-T271 PolarHBondContact O-N 2.78Å; T271-N275 PolarHBondContact O-ND2 3.22Å
272	L	98.1	Very high	97.8	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-48.8	174	-68.5	171.3	0	0	0	111.2	V93 L225 W230 I268 Y269 Q274 N275 L276 F279	V93-L272 HydrophobicContact CB-CD1 4.49Å; V93-L272 HydrophobicContact CG2-CD1 3.74Å; V93-L272 HydrophobicContact CG2-CD2 4.49Å; L225-L272 HydrophobicContact CD2-CD2 4.07Å; L225-L272 HydrophobicContact CD2-CG 4.2Å; W230-L272 HydrophobicContact CH2-CD2 4.17Å; I268-L272 HydrophobicContact CG2-CD1 3.75Å; I268-L272 HydrophobicContact CG2-CG 4.43Å; I268-L272 VanDerWaalsContact O-CG 3.3Å; I268-L272 WeakPolarHBondContact O-CG 3.36Å; I268-L272 PolarHBondContact O-N 2.93Å; Y269-L272 PolarHBondContact O-N 3.29Å; L272-Q274 VanDerWaalsContact C-N 3.26Å; L272-Q274 PolarHBondContact O-N 3.31Å; L272-N275 PolarHBondContact O-N 3.45Å; L272-L276 HydrophobicContact CD2-CD1 3.94Å; L272-L276 WeakPolarHBondContact O-CA 3.33Å; L272-L276 WeakPolarHBondContact O-CB 3.16Å; L272-L276 PolarHBondContact O-N 3.34Å; L272-F279 HydrophobicContact CB-CD1 4Å; L272-F279 HydrophobicContact CB-CD2 4.11Å; L272-F279 HydrophobicContact CB-CE1 3.83Å; L272-F279 HydrophobicContact CB-CE2 3.96Å; L272-F279 HydrophobicContact CB-CG 4.13Å; L272-F279 HydrophobicContact CB-CZ 3.81Å; L272-F279 HydrophobicContact CD1-CD2 3.75Å; L272-F279 HydrophobicContact CD1-CE2 3.95Å; L272-F279 HydrophobicContact CD1-CG 4.28Å
273	H	96.5	Very high	97.8	Very high	102 Å²	102	42.2 Å²	42.2	47%	0.472	21%	0.209	S	C	.	.	H	α-helix	trans	-65.6	-26.7	-175.9	-169.8	56	0	0	0	113.9	Y269 R270 N275 F279	Y269-H273 HydrophobicContact CD1-CB 4.43Å; Y269-H273 HydrophobicContact CE1-CB 4.13Å; Y269-H273 WeakPolarHBondContact O-CB 3.24Å; Y269-H273 PolarHBondContact O-N 3.26Å; R270-H273 PolarHBondContact O-N 3.28Å; H273-N275 VanDerWaalsContact C-N 3.31Å; H273-F279 HydrophobicContact CB-CE1 4.21Å; H273-F279 HydrophobicContact CB-CZ 4.2Å
274	Q	96.9	Very high	97.8	Very high	149 Å²	149	37.1 Å²	37.1	70%	0.696	18%	0.182	S	C	*	.	H	α-helix	trans	-67.7	-30.8	172.8	-77.4	169.4	3.1	0	0	113	R270 L272	R270-Q274 WeakPolarHBondContact O-CB 3.19Å; R270-Q274 WeakPolarHBondContact O-CG 3.29Å; R270-Q274 PolarHBondContact O-N 2.86Å; L272-Q274 VanDerWaalsContact C-N 3.26Å; L272-Q274 PolarHBondContact O-N 3.31Å
275	N	95.2	Very high	97.8	Very high	105 Å²	105	36.5 Å²	36.5	56%	0.561	18%	0.178	S	C	*	.	H	α-helix	trans	-113.9	-22.4	-168.7	-64.5	-56	0	0	0	113.7	T271 L272 H273	T271-N275 PolarHBondContact O-ND2 3.22Å; L272-N275 PolarHBondContact O-N 3.45Å; H273-N275 VanDerWaalsContact C-N 3.31Å
276	L	96.2	Very high	97.8	Very high	35 Å²	35	36.5 Å²	36.5	18%	0.183	18%	0.178	C	C	.	.			trans	-136.3	145.3	-169.8	-57	173.7	0	0	0	110.9	R91 L272 F279	R91-L276 HydrophobicContact CG-CD1 4.44Å; L272-L276 HydrophobicContact CD2-CD1 3.94Å; L272-L276 WeakPolarHBondContact O-CA 3.33Å; L272-L276 WeakPolarHBondContact O-CB 3.16Å; L272-L276 PolarHBondContact O-N 3.34Å; L276-F279 HydrophobicContact CB-CD1 4.03Å
277	S	95.3	Very high	97.7	Very high	73 Å²	73	35.9 Å²	35.9	51%	0.51	17%	0.173	S	C	.	.	S	Bend	trans	-108.6	-22	172.1	50.2	0	0	0	0	112.7	P312 H313	S277-P312 WeakPolarHBondContact O-CG 3.49Å; S277-H313 PolarHBondContact O-CD2 3.27Å; S277-H313 PolarHBondContact O-NE2 3.3Å
278	D	96.1	Very high	97.6	Very high	30 Å²	30	32.2 Å²	32.2	16%	0.16	16%	0.157	C	C	.	.	S	Bend	trans	-108.6	52.6	-169.8	51.5	-1.3	0	0	0	112.2	Y88 K90 R91	Y88-D278 CarbonylContact O-C 3.54Å; Y88-D278 VanDerWaalsContact O-C 3.28Å; Y88-D278 WeakPolarHBondContact O-CA 3.44Å; K90-D278 HydrophobicContact CB-CB 4.41Å; K90-D278 WeakPolarHBondContact CD-OD2 3.38Å; K90-D278 WeakPolarHBondContact CE-OD2 3.42Å; K90-D278 HydrophobicContact CG-CB 4.17Å; K90-D278 WeakPolarHBondContact CG-OD2 3.11Å; K90-D278 PolarHBondContact N-O 3.07Å; K90-D278 IonicContact NZ-OD2 3.8Å; K90-D278 PolarHBondContact NZ-OD2 2.82Å; R91-D278 PolarHBondContact N-O 2.88Å
279	F	97.8	Very high	97.5	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	156.3	176	74.6	-89.1	0	0	0	112.3	R91 Y269 L272 H273 L276 F281 S311 P312	R91-F279 HydrophobicContact CB-CB 4.26Å; R91-F279 CarbonylContact O-C 3.59Å; R91-F279 VanDerWaalsContact O-CA 3.24Å; R91-F279 WeakPolarHBondContact O-CA 3.44Å; Y269-F279 AromaticContact CD2-CE2 3.92Å; Y269-F279 HydrophobicContact CD2-CE2 3.92Å; Y269-F279 AromaticContact CD2-CZ 3.92Å; Y269-F279 HydrophobicContact CD2-CZ 3.92Å; Y269-F279 HydrophobicContact CE2-CE2 4.04Å; Y269-F279 AromaticContact CE2-CZ 3.79Å; Y269-F279 HydrophobicContact CE2-CZ 3.79Å; L272-F279 HydrophobicContact CB-CD1 4Å; L272-F279 HydrophobicContact CB-CD2 4.11Å; L272-F279 HydrophobicContact CB-CE1 3.83Å; L272-F279 HydrophobicContact CB-CE2 3.96Å; L272-F279 HydrophobicContact CB-CG 4.13Å; L272-F279 HydrophobicContact CB-CZ 3.81Å; L272-F279 HydrophobicContact CD1-CD2 3.75Å; L272-F279 HydrophobicContact CD1-CE2 3.95Å; L272-F279 HydrophobicContact CD1-CG 4.28Å; H273-F279 HydrophobicContact CB-CE1 4.21Å; H273-F279 HydrophobicContact CB-CZ 4.2Å; L276-F279 HydrophobicContact CB-CD1 4.03Å; F279-F281 HydrophobicContact CD2-CB 4.17Å; F279-F281 HydrophobicContact CE2-CB 4.07Å; F279-S311 WeakPolarHBondContact O-CB 3.39Å; F279-S311 PolarHBondContact O-OG 3.24Å; F279-P312 HydrophobicContact CD1-CG 4.02Å; F279-P312 VanDerWaalsContact CE1-CD 3.5Å; F279-P312 HydrophobicContact CE1-CG 3.39Å; F279-P312 HydrophobicContact CZ-CG 3.89Å
280	L	98.1	Very high	97.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.4	166	173.7	63.7	0	0	0	108.6	V89 R91 V92 V93 V282 A309 L332 L335 L352 L356	V89-L280 HydrophobicContact CB-CB 4.5Å; V89-L280 HydrophobicContact CG1-CB 3.72Å; V89-L280 HydrophobicContact CG2-CB 3.91Å; R91-L280 PolarHBondContact O-N 3.34Å; V92-L280 CarbonylContact C-O 3.56Å; V92-L280 VanDerWaalsContact CA-O 3.24Å; V92-L280 WeakPolarHBondContact CA-O 3.37Å; V92-L280 HydrophobicContact CG2-CB 4.42Å; V93-L280 PolarHBondContact N-O 3.01Å; L280-V282 HydrophobicContact CD1-CG2 4.1Å; L280-V282 HydrophobicContact CD2-CG2 3.95Å; L280-V282 HydrophobicContact CG-CG2 3.75Å; L280-A309 HydrophobicContact CD1-CB 4.08Å; L280-L332 HydrophobicContact CD2-CD2 3.86Å; L280-L335 HydrophobicContact CD2-CD1 3.81Å; L280-L352 HydrophobicContact CD1-CD1 4.21Å; L280-L352 HydrophobicContact CD2-CD2 4.39Å; L280-L356 HydrophobicContact CD1-CD1 4.14Å; L280-L356 HydrophobicContact CD2-CD1 4.39Å
281	F	98.6	Very high	97.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.9	172.8	175.2	-147.9	0	0	0	108.8	V93 M95 S265 I268 Y269 F279 I283 L310	V93-F281 HydrophobicContact CB-CD2 3.76Å; V93-F281 HydrophobicContact CB-CE2 4.38Å; V93-F281 HydrophobicContact CG1-CD2 3.84Å; V93-F281 HydrophobicContact CG1-CE2 3.94Å; M95-F281 HydrophobicContact CB-CE2 3.59Å; M95-F281 HydrophobicContact CB-CZ 4.11Å; M95-F281 HydrophobicContact SD-CE2 4.41Å; M95-F281 HydrophobicContact SD-CZ 3.99Å; S265-F281 WeakPolarHBondContact O-CE1 3.36Å; I268-F281 HydrophobicContact CB-CE1 4.17Å; I268-F281 HydrophobicContact CB-CZ 4.09Å; I268-F281 HydrophobicContact CD1-CE2 4.36Å; I268-F281 HydrophobicContact CD1-CZ 4.11Å; I268-F281 HydrophobicContact CG2-CD1 4.18Å; I268-F281 HydrophobicContact CG2-CD2 4.14Å; I268-F281 HydrophobicContact CG2-CE1 4Å; I268-F281 HydrophobicContact CG2-CE2 3.96Å; I268-F281 HydrophobicContact CG2-CG 4.26Å; I268-F281 HydrophobicContact CG2-CZ 3.9Å; Y269-F281 HydrophobicContact CD2-CD1 4.41Å; F279-F281 HydrophobicContact CD2-CB 4.17Å; F279-F281 HydrophobicContact CE2-CB 4.07Å; F281-I283 HydrophobicContact CD1-CD1 3.89Å; F281-I283 HydrophobicContact CD2-CD1 4.39Å; F281-I283 HydrophobicContact CE1-CD1 3.52Å; F281-I283 HydrophobicContact CE1-CG1 3.97Å; F281-I283 HydrophobicContact CE2-CD1 4.07Å; F281-I283 HydrophobicContact CE2-CG1 3.94Å; F281-I283 HydrophobicContact CG-CD1 4.32Å; F281-I283 HydrophobicContact CZ-CD1 3.61Å; F281-I283 HydrophobicContact CZ-CG1 3.54Å; F281-L310 HydrophobicContact CB-CB 4.18Å; F281-L310 HydrophobicContact CD1-CB 4.33Å; F281-L310 HydrophobicContact CD1-CD1 3.7Å; F281-L310 HydrophobicContact CE1-CD1 4.09Å; F281-L310 PolarHBondContact N-O 3.45Å; F281-L310 PolarHBondContact O-N 3.43Å
282	V	98.8	Very high	96.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	120.1	179.8	-170	0	0	0	0	109	V93 L94 M95 L280 L284 V307 F308 L328	V93-V282 PolarHBondContact O-N 2.65Å; L94-V282 HydrophobicContact CD2-CB 3.79Å; L94-V282 HydrophobicContact CD2-CG2 3.97Å; M95-V282 PolarHBondContact N-O 2.72Å; L280-V282 HydrophobicContact CD1-CG2 4.1Å; L280-V282 HydrophobicContact CD2-CG2 3.95Å; L280-V282 HydrophobicContact CG-CG2 3.75Å; V282-L284 HydrophobicContact CG1-CD2 4.32Å; V282-V307 HydrophobicContact CG1-CG1 3.91Å; V282-F308 CarbonylContact C-O 3.55Å; V282-F308 VanDerWaalsContact CA-O 3.3Å; V282-F308 WeakPolarHBondContact CA-O 3.45Å; V282-L328 HydrophobicContact CG1-CD1 4.49Å
283	I	98.8	Very high	96.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.8	167.5	-53.6	87.4	0	0	0	107.5	M95 I97 L100 L115 F281 V307 F308 L310	M95-I283 WeakPolarHBondContact O-CA 3.46Å; M95-I283 HydrophobicContact SD-CG1 4.43Å; I97-I283 HydrophobicContact CD1-CG2 3.61Å; I97-I283 HydrophobicContact CG1-CG2 4.4Å; L100-I283 HydrophobicContact CD2-CG2 4.33Å; L115-I283 HydrophobicContact CD2-CD1 3.91Å; F281-I283 HydrophobicContact CD1-CD1 3.89Å; F281-I283 HydrophobicContact CD2-CD1 4.39Å; F281-I283 HydrophobicContact CE1-CD1 3.52Å; F281-I283 HydrophobicContact CE1-CG1 3.97Å; F281-I283 HydrophobicContact CE2-CD1 4.07Å; F281-I283 HydrophobicContact CE2-CG1 3.94Å; F281-I283 HydrophobicContact CG-CD1 4.32Å; F281-I283 HydrophobicContact CZ-CD1 3.61Å; F281-I283 HydrophobicContact CZ-CG1 3.54Å; I283-V307 CarbonylContact O-C 3.55Å; I283-F308 HydrophobicContact CB-CB 4.27Å; I283-F308 PolarHBondContact N-O 3.31Å; I283-F308 PolarHBondContact O-N 3.29Å; I283-L310 HydrophobicContact CD1-CD1 3.74Å; I283-L310 HydrophobicContact CD1-CG 4.39Å
284	L	98.8	Very high	96.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	156.3	-178.9	69.1	172.6	0	0	0	113.7	M95 I96 I97 L144 V282 L306 V307 L328	M95-L284 WeakPolarHBondContact O-CD2 3.45Å; M95-L284 PolarHBondContact O-N 2.97Å; I96-L284 CarbonylContact C-O 3.51Å; I96-L284 VanDerWaalsContact CA-O 3.31Å; I96-L284 WeakPolarHBondContact CA-O 3.46Å; I96-L284 HydrophobicContact CB-CD2 4.36Å; I96-L284 HydrophobicContact CG1-CD2 3.61Å; I96-L284 HydrophobicContact CG1-CG 4.1Å; I97-L284 PolarHBondContact N-O 3.44Å; L144-L284 HydrophobicContact CD1-CD1 4.37Å; L144-L284 HydrophobicContact CD2-CD1 3.61Å; V282-L284 HydrophobicContact CG1-CD2 4.32Å; L284-L306 CarbonylContact C-O 3.57Å; L284-L306 WeakPolarHBondContact CA-O 3.11Å; L284-L306 WeakPolarHBondContact CB-O 3.49Å; L284-V307 HydrophobicContact CB-CB 4.46Å; L284-V307 HydrophobicContact CB-CG2 3.88Å; L284-L328 HydrophobicContact CD1-CD2 3.53Å
285	G	98.7	Very high	96.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.16	C	C	.	.			trans	-87.3	142.7	160.8	0	0	0	0	0	111.1	I97 V305 L306 Q325	I97-G285 WeakPolarHBondContact O-CA 3.18Å; G285-V305 WeakPolarHBondContact O-CG2 3.33Å; G285-L306 PolarHBondContact N-O 3.22Å; G285-Q325 PolarHBondContact O-NE2 3.29Å; G285-Q325 VanDerWaalsContact O-NE2 3.08Å
286	D	98.1	Very high	96.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	-81.3	-41.9	170.2	69.8	-35.4	0	0	0	111	I96 D98 A99 T137 R140 L144 H236 Q325	I96-D286 HydrophobicContact CG2-CB 3.76Å; D98-D286 WeakPolarHBondContact CA-OD1 3.37Å; A99-D286 PolarHBondContact N-OD1 2.96Å; T137-D286 WeakPolarHBondContact CA-OD2 3.47Å; R140-D286 HydrophobicContact CB-CB 3.92Å; R140-D286 WeakPolarHBondContact CD-O 3.07Å; R140-D286 HydrophobicContact CG-CB 4.48Å; R140-D286 WeakPolarHBondContact CG-O 3.45Å; L144-D286 HydrophobicContact CD1-CB 4.03Å; H236-D286 IonicContact CE1-OD2 3.43Å; H236-D286 IonicContact NE2-OD2 3.73Å; D286-Q325 PolarHBondContact O-NE2 3.46Å
287	H	97.6	Very high	95.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.151	C	C	.	.			trans	-142.3	175.8	167.1	57.3	82.7	0	0	0	112.6	D98 A99 L100 I131 T137 R140 D241 H295 V305	D98-H287 IonicContact OD1-CD2 3.67Å; D98-H287 IonicContact OD1-CE1 3.4Å; D98-H287 PolarHBondContact OD1-CE1 2.92Å; D98-H287 VanDerWaalsContact OD1-CE1 3.24Å; D98-H287 IonicContact OD1-ND1 2.93Å; D98-H287 IonicContact OD1-NE2 3.78Å; D98-H287 PolarHBondContact OD1-NE2 3.23Å; A99-H287 CarbonylContact C-O 3.54Å; A99-H287 VanDerWaalsContact C-O 3.22Å; A99-H287 WeakPolarHBondContact CA-O 3.34Å; L100-H287 PolarHBondContact N-O 2.93Å; I131-H287 HydrophobicContact CD1-CB 3.69Å; T137-H287 PolarHBondContact N-CD2 3.46Å; T137-H287 PolarHBondContact N-NE2 3.32Å; T137-H287 PolarHBondContact OG1-NE2 2.89Å; R140-H287 HydrophobicContact CG-CB 4Å; D241-H287 IonicContact OD1-CE1 3.38Å; H287-H295 AromaticContact CE1-CD2 3.58Å; H287-H295 AromaticContact CE1-CE1 3.71Å; H287-H295 AromaticContact CE1-CG 3.57Å; H287-H295 AromaticContact CE1-ND1 3.63Å; H287-H295 AromaticContact CE1-NE2 3.76Å; H287-H295 AromaticContact ND1-CG 3.92Å; H287-H295 AromaticContact NE2-CE1 3.8Å; H287-H295 AromaticContact NE2-ND1 3.91Å; H287-V305 WeakPolarHBondContact O-CG1 3.44Å
288	G	97.2	Very high	95.6	Very high	0 Å²	0	24 Å²	24	0%	0	16%	0.157	C	C	.	.			trans	-103	-166.7	165.7	0	0	0	0	0	111.7	L301 E302	G288-L301 WeakPolarHBondContact CA-O 3.18Å; G288-E302 WeakPolarHBondContact CA-O 3.43Å; G288-E302 PolarHBondContact N-O 2.98Å
289	M	96.3	Very high	95.5	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	17%	0.165	C	C	.	.			trans	-150.1	155.6	-174.4	-179.2	96.1	89.9	0	0	109.4	A99 R101 D241 G293 S294 H295 L301	A99-M289 HydrophobicContact CB-CB 4.19Å; A99-M289 HydrophobicContact CB-CE 4.19Å; R101-M289 PolarHBondContact NE-O 3.49Å; R101-M289 PolarHBondContact NH2-O 3.29Å; R101-M289 VanDerWaalsContact NH2-O 3.09Å; D241-M289 HydrophobicContact CB-CE 4.37Å; D241-M289 WeakPolarHBondContact O-CE 3.42Å; D241-M289 WeakPolarHBondContact OD1-CE 3.22Å; M289-G293 VanDerWaalsContact CG-C 3.46Å; M289-G293 VanDerWaalsContact CG-CA 3.41Å; M289-S294 PolarHBondContact SD-N 2.88Å; M289-H295 HydrophobicContact SD-CB 3.76Å; M289-H295 PolarHBondContact SD-CD2 3.48Å; M289-L301 PolarHBondContact N-O 2.96Å; M289-L301 CarbonylContact O-C 3.54Å; M289-L301 WeakPolarHBondContact O-CB 3.34Å
290	S	95.4	Very high	95.4	Very high	18 Å²	18	31.5 Å²	31.5	13%	0.126	20%	0.196	C	C	.	.			trans	-67.5	165.3	168.3	74.9	0	0	0	0	111.7	R101 T292 G293 S294	R101-S290 PolarHBondContact NH2-O 2.76Å; S290-T292 PolarHBondContact O-N 3.47Å; S290-T292 PolarHBondContact OG-N 3.45Å; S290-T292 PolarHBondContact OG-OG1 3.45Å; S290-G293 PolarHBondContact O-N 3Å; S290-G293 PolarHBondContact OG-N 2.89Å; S290-S294 WeakPolarHBondContact CB-O 3.35Å; S290-S294 PolarHBondContact N-O 2.93Å; S290-S294 PolarHBondContact OG-N 2.89Å; S290-S294 PolarHBondContact OG-O 3.3Å; S290-S294 VanDerWaalsContact OG-O 3.09Å
291	D	92.5	Very high	95.4	Very high	96 Å²	96	34.1 Å²	34.1	51%	0.513	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-36.7	172.1	56.8	-12.6	0	0	0	113.3	D249 G293 L301	D249-D291 PolarHBondContact N-O 3.27Å; D249-D291 VanDerWaalsContact N-O 3.08Å; D291-G293 PolarHBondContact O-N 2.94Å; D291-L301 HydrophobicContact CB-CD1 4.46Å
292	T	93	Very high	95.3	Very high	94 Å²	94	35.1 Å²	35.1	58%	0.577	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	2.3	176.7	62.1	0	0	0	0	114.8	S290	S290-T292 PolarHBondContact O-N 3.47Å; S290-T292 PolarHBondContact OG-N 3.45Å; S290-T292 PolarHBondContact OG-OG1 3.45Å
293	G	93.2	Very high	95.2	Very high	2 Å²	2	35.5 Å²	35.5	2%	0.021	22%	0.217	C	C	.	.	S	Bend	trans	78.2	25.7	-178.3	0	0	0	0	0	114	G244 H245 M289 S290 D291	G244-G293 VanDerWaalsContact O-CA 3.26Å; G244-G293 WeakPolarHBondContact O-CA 3.3Å; H245-G293 WeakPolarHBondContact CA-O 3.24Å; H245-G293 PolarHBondContact ND1-O 3.23Å; M289-G293 VanDerWaalsContact CG-C 3.46Å; M289-G293 VanDerWaalsContact CG-CA 3.41Å; S290-G293 PolarHBondContact O-N 3Å; S290-G293 PolarHBondContact OG-N 2.89Å; D291-G293 PolarHBondContact O-N 2.94Å
294	S	94.1	Very high	95.2	Very high	66 Å²	66	36.3 Å²	36.3	46%	0.462	22%	0.221	S	C	.	.			trans	-107.6	148.7	171.8	-58.3	0	0	0	0	110.5	M289 S290	M289-S294 PolarHBondContact SD-N 2.88Å; S290-S294 WeakPolarHBondContact CB-O 3.35Å; S290-S294 PolarHBondContact N-O 2.93Å; S290-S294 PolarHBondContact OG-N 2.89Å; S290-S294 PolarHBondContact OG-O 3.3Å; S290-S294 VanDerWaalsContact OG-O 3.09Å
295	H	93.1	Very high	95.1	Very high	49 Å²	49	36.2 Å²	36.2	23%	0.227	22%	0.221	C	C	.	.			trans	-140.5	164	175.2	66.8	79	0	0	0	110.6	S135 D241 H245 H287 M289 E302	S135-H295 PolarHBondContact O-ND1 2.88Å; D241-H295 IonicContact OD1-CD2 2.79Å; D241-H295 PolarHBondContact OD1-CD2 3.1Å; D241-H295 IonicContact OD1-NE2 3.53Å; H245-H295 AromaticContact CE1-CD2 3.25Å; H245-H295 PolarHBondContact CE1-CD2 3.19Å; H245-H295 AromaticContact CE1-NE2 3.3Å; H245-H295 PolarHBondContact CE1-NE2 3.41Å; H245-H295 VanDerWaalsContact CE1-NE2 3.3Å; H245-H295 AromaticContact NE2-CD2 3.66Å; H245-H295 AromaticContact NE2-NE2 3.27Å; H245-H295 PolarHBondContact NE2-NE2 3.07Å; H287-H295 AromaticContact CE1-CD2 3.58Å; H287-H295 AromaticContact CE1-CE1 3.71Å; H287-H295 AromaticContact CE1-CG 3.57Å; H287-H295 AromaticContact CE1-ND1 3.63Å; H287-H295 AromaticContact CE1-NE2 3.76Å; H287-H295 AromaticContact ND1-CG 3.92Å; H287-H295 AromaticContact NE2-CE1 3.8Å; H287-H295 AromaticContact NE2-ND1 3.91Å; M289-H295 HydrophobicContact SD-CB 3.76Å; M289-H295 PolarHBondContact SD-CD2 3.48Å; H295-E302 WeakPolarHBondContact CA-OE1 3.48Å
296	G	89.8	Confident	95.1	Very high	24 Å²	24	36.3 Å²	36.3	25%	0.247	22%	0.222	C	C	.	.	S	Bend	trans	136.4	-10.3	174.6	0	0	0	0	0	112.7	S135 E302	S135-G296 WeakPolarHBondContact O-CA 3.28Å; S135-G296 PolarHBondContact O-N 3.22Å; S135-G296 VanDerWaalsContact OG-C 3.29Å; S135-G296 WeakPolarHBondContact OG-CA 3.39Å; S135-G296 PolarHBondContact OG-N 3.02Å; G296-E302 PolarHBondContact N-OE1 2.68Å
297	G	89.5	Confident	95.1	Very high	29 Å²	29	36.5 Å²	36.5	30%	0.299	22%	0.222	S	C	.	.	S	Bend	trans	-92.8	-148.2	-178.1	0	0	0	0	0	114.2	A133 S135 E302	A133-G297 WeakPolarHBondContact CB-O 3.37Å; S135-G297 PolarHBondContact OG-N 2.94Å; S135-G297 PolarHBondContact OG-O 3.29Å; G297-E302 WeakPolarHBondContact CA-OE1 3.32Å; G297-E302 PolarHBondContact N-OE1 3.3Å
298	S	91.8	Very high	95.1	Very high	91 Å²	91	36.5 Å²	36.5	64%	0.636	22%	0.223	S	C	*	.			trans	-142.7	22.6	-174.6	55.8	0	0	0	0	112.4	S303	S298-S303 VanDerWaalsContact CA-OG 3.29Å; S298-S303 WeakPolarHBondContact CA-OG 3.46Å; S298-S303 PolarHBondContact O-OG 2.86Å; S298-S303 VanDerWaalsContact O-OG 3.13Å
299	S	95.4	Very high	95.1	Very high	47 Å²	47	36.5 Å²	36.5	33%	0.329	22%	0.223	S	C	.	.			trans	-61.9	161.9	173.9	69.4	0	0	0	0	111	L301 E302 S303	S299-L301 PolarHBondContact O-N 3.42Å; S299-E302 WeakPolarHBondContact CB-OE2 3.19Å; S299-E302 PolarHBondContact N-OE2 2.97Å; S299-E302 PolarHBondContact O-N 3.36Å; S299-E302 VanDerWaalsContact O-N 3.17Å; S299-E302 WeakPolarHBondContact OG-CB 3.35Å; S299-E302 VanDerWaalsContact OG-CG 3.25Å; S299-E302 WeakPolarHBondContact OG-CG 3.37Å; S299-E302 PolarHBondContact OG-N 3.09Å; S299-E302 PolarHBondContact OG-OE2 2.94Å; S299-S303 WeakPolarHBondContact O-CB 3.42Å; S299-S303 PolarHBondContact O-N 3.43Å; S299-S303 PolarHBondContact O-OG 3.49Å
300	E	95.6	Very high	95.2	Very high	142 Å²	142	36.4 Å²	36.4	66%	0.664	22%	0.222	S	C	*	.	H	α-helix	trans	-54.1	-41	175.6	-79.3	-93.7	135.2	0	0	112.1	S303 N304	E300-S303 PolarHBondContact O-N 2.61Å; E300-N304 WeakPolarHBondContact O-CB 3.48Å; E300-N304 PolarHBondContact O-N 3.25Å; E300-N304 PolarHBondContact O-ND2 2.73Å
301	L	96.3	Very high	95.2	Very high	56 Å²	56	35.6 Å²	35.6	29%	0.293	22%	0.216	S	C	.	.	H	α-helix	trans	-71.6	-34.4	179.8	-64.1	178.2	0	0	0	112.4	R101 E103 G288 M289 D291 S299	R101-L301 WeakPolarHBondContact CD-O 3.37Å; R101-L301 WeakPolarHBondContact CG-O 3.47Å; E103-L301 WeakPolarHBondContact OE2-CD2 3.43Å; G288-L301 WeakPolarHBondContact CA-O 3.18Å; M289-L301 PolarHBondContact N-O 2.96Å; M289-L301 CarbonylContact O-C 3.54Å; M289-L301 WeakPolarHBondContact O-CB 3.34Å; D291-L301 HydrophobicContact CB-CD1 4.46Å; S299-L301 PolarHBondContact O-N 3.42Å
302	E	97	Very high	95.3	Very high	20 Å²	20	33.1 Å²	33.1	9%	0.093	21%	0.206	C	C	.	.	H	α-helix	trans	-76.6	-29.8	176.3	-69.8	168.3	100.9	0	0	112.9	I131 S135 G288 H295 G296 G297 S299	I131-E302 WeakPolarHBondContact CD1-O 3.29Å; S135-E302 PolarHBondContact OG-OE1 2.8Å; G288-E302 WeakPolarHBondContact CA-O 3.43Å; G288-E302 PolarHBondContact N-O 2.98Å; H295-E302 WeakPolarHBondContact CA-OE1 3.48Å; G296-E302 PolarHBondContact N-OE1 2.68Å; G297-E302 WeakPolarHBondContact CA-OE1 3.32Å; G297-E302 PolarHBondContact N-OE1 3.3Å; S299-E302 WeakPolarHBondContact CB-OE2 3.19Å; S299-E302 PolarHBondContact N-OE2 2.97Å; S299-E302 PolarHBondContact O-N 3.36Å; S299-E302 VanDerWaalsContact O-N 3.17Å; S299-E302 WeakPolarHBondContact OG-CB 3.35Å; S299-E302 VanDerWaalsContact OG-CG 3.25Å; S299-E302 WeakPolarHBondContact OG-CG 3.37Å; S299-E302 PolarHBondContact OG-N 3.09Å; S299-E302 PolarHBondContact OG-OE2 2.94Å
303	S	96.8	Very high	95.3	Very high	8 Å²	8	31.6 Å²	31.6	6%	0.056	19%	0.192	C	C	.	.	H	α-helix	trans	-98.8	-9.3	-167.1	-53	0	0	0	0	114.8	K130 I131 S298 S299 E300	K130-S303 CarbonylContact C-O 3.22Å; K130-S303 VanDerWaalsContact CA-O 3.31Å; K130-S303 WeakPolarHBondContact CA-O 2.88Å; I131-S303 PolarHBondContact N-O 3.43Å; S298-S303 VanDerWaalsContact CA-OG 3.29Å; S298-S303 WeakPolarHBondContact CA-OG 3.46Å; S298-S303 PolarHBondContact O-OG 2.86Å; S298-S303 VanDerWaalsContact O-OG 3.13Å; S299-S303 WeakPolarHBondContact O-CB 3.42Å; S299-S303 PolarHBondContact O-N 3.43Å; S299-S303 PolarHBondContact O-OG 3.49Å; E300-S303 PolarHBondContact O-N 2.61Å
304	N	98.1	Very high	95.2	Very high	17 Å²	17	31.7 Å²	31.7	9%	0.091	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	111	-178.1	-66.2	-77.3	0	0	0	110.3	R101 A102 K128 A129 E300	R101-N304 WeakPolarHBondContact CA-O 3.27Å; A102-N304 HydrophobicContact CB-CB 4.15Å; A102-N304 PolarHBondContact N-O 2.89Å; K128-N304 HydrophobicContact CD-CB 4.46Å; K128-N304 VanDerWaalsContact CE-CB 3.46Å; K128-N304 WeakPolarHBondContact CE-OD1 3.45Å; K128-N304 HydrophobicContact CG-CB 4.22Å; A129-N304 WeakPolarHBondContact O-CA 3.34Å; E300-N304 WeakPolarHBondContact O-CB 3.48Å; E300-N304 PolarHBondContact O-N 3.25Å; E300-N304 PolarHBondContact O-ND2 2.73Å
305	V	98.6	Very high	94.8	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	156.9	-177.2	-58.6	0	0	0	0	111.6	L100 A129 I131 G285 H287	L100-V305 WeakPolarHBondContact O-CA 3.49Å; A129-V305 HydrophobicContact CB-CG2 3.91Å; A129-V305 PolarHBondContact N-O 3.34Å; A129-V305 PolarHBondContact O-N 2.71Å; I131-V305 HydrophobicContact CG2-CG1 4.21Å; I131-V305 HydrophobicContact CG2-CG2 3.91Å; G285-V305 WeakPolarHBondContact O-CG2 3.33Å; H287-V305 WeakPolarHBondContact O-CG1 3.44Å
306	L	98.3	Very high	93.7	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	139	171.7	-179.1	65.5	0	0	0	109.8	L100 V104 L105 V126 L284 G285 F308	L100-L306 HydrophobicContact CD2-CB 4.17Å; L100-L306 HydrophobicContact CD2-CD2 3.82Å; L100-L306 HydrophobicContact CG-CB 4.18Å; L100-L306 HydrophobicContact CG-CD2 4.46Å; L100-L306 PolarHBondContact O-N 2.97Å; L100-L306 VanDerWaalsContact O-N 3.11Å; V104-L306 HydrophobicContact CG1-CB 4.25Å; V104-L306 HydrophobicContact CG1-CD2 3.88Å; V104-L306 HydrophobicContact CG1-CG 4.46Å; L105-L306 HydrophobicContact CD1-CD1 3.91Å; L105-L306 HydrophobicContact CD2-CD1 3.7Å; L105-L306 HydrophobicContact CG-CD1 3.86Å; V126-L306 HydrophobicContact CG1-CD1 3.96Å; L284-L306 CarbonylContact C-O 3.57Å; L284-L306 WeakPolarHBondContact CA-O 3.11Å; L284-L306 WeakPolarHBondContact CB-O 3.49Å; G285-L306 PolarHBondContact N-O 3.22Å; L306-F308 HydrophobicContact CD1-CB 4.38Å; L306-F308 HydrophobicContact CD2-CB 4.19Å; L306-F308 HydrophobicContact CD2-CD2 4.46Å; L306-F308 HydrophobicContact CG-CB 4.21Å
307	V	98.2	Very high	92.7	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	121.7	154.9	172.2	0	0	0	0	107.3	F127 A129 V282 I283 L284 M349	F127-V307 HydrophobicContact CB-CB 4.17Å; F127-V307 HydrophobicContact CD2-CG1 4.19Å; F127-V307 PolarHBondContact N-O 3.42Å; F127-V307 PolarHBondContact O-N 3.41Å; A129-V307 HydrophobicContact CB-CB 4.31Å; A129-V307 HydrophobicContact CB-CG2 3.53Å; V282-V307 HydrophobicContact CG1-CG1 3.91Å; I283-V307 CarbonylContact O-C 3.55Å; L284-V307 HydrophobicContact CB-CB 4.46Å; L284-V307 HydrophobicContact CB-CG2 3.88Å; V307-M349 HydrophobicContact CG1-CE 4.19Å
308	F	97.4	Very high	91.7	Very high	1 Å²	1	48 Å²	48	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	115.6	-175.4	-162.6	-54.9	0	0	0	108.7	L115 M118 I119 G124 V126 V282 I283 L306 L310	L115-F308 HydrophobicContact CB-CD2 4.44Å; L115-F308 HydrophobicContact CB-CE2 3.88Å; L115-F308 HydrophobicContact CB-CZ 4.25Å; L115-F308 HydrophobicContact CD1-CD2 4.42Å; L115-F308 HydrophobicContact CD2-CD1 4.34Å; L115-F308 HydrophobicContact CD2-CD2 4.43Å; L115-F308 HydrophobicContact CD2-CE1 4.27Å; L115-F308 HydrophobicContact CD2-CE2 4.31Å; L115-F308 HydrophobicContact CD2-CG 4.45Å; L115-F308 HydrophobicContact CD2-CZ 4.25Å; L115-F308 WeakPolarHBondContact O-CZ 3.09Å; M118-F308 HydrophobicContact CB-CE1 4.29Å; M118-F308 HydrophobicContact CB-CZ 4.09Å; I119-F308 HydrophobicContact CD1-CE2 3.75Å; I119-F308 HydrophobicContact CD1-CZ 4.3Å; I119-F308 HydrophobicContact CG1-CE2 3.53Å; I119-F308 HydrophobicContact CG1-CZ 3.56Å; G124-F308 VanDerWaalsContact CA-CE1 3.47Å; V126-F308 HydrophobicContact CG2-CD2 3.78Å; V126-F308 HydrophobicContact CG2-CE2 3.62Å; V126-F308 HydrophobicContact CG2-CG 4.34Å; V126-F308 HydrophobicContact CG2-CZ 4.02Å; V282-F308 CarbonylContact C-O 3.55Å; V282-F308 VanDerWaalsContact CA-O 3.3Å; V282-F308 WeakPolarHBondContact CA-O 3.45Å; I283-F308 HydrophobicContact CB-CB 4.27Å; I283-F308 PolarHBondContact N-O 3.31Å; I283-F308 PolarHBondContact O-N 3.29Å; L306-F308 HydrophobicContact CD1-CB 4.38Å; L306-F308 HydrophobicContact CD2-CB 4.19Å; L306-F308 HydrophobicContact CD2-CD2 4.46Å; L306-F308 HydrophobicContact CG-CB 4.21Å; F308-L310 HydrophobicContact CD1-CD2 4.19Å; F308-L310 HydrophobicContact CD1-CG 3.95Å; F308-L310 HydrophobicContact CE1-CD1 4.45Å; F308-L310 HydrophobicContact CE1-CD2 3.54Å; F308-L310 HydrophobicContact CE1-CG 3.81Å; F308-L310 HydrophobicContact CZ-CD2 4.49Å
309	A	97.5	Very high	91.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.2	179.8	0	0	0	0	0	111.7	G124 H125 F127 L280 L314 L352	G124-A309 WeakPolarHBondContact CA-O 3.41Å; H125-A309 HydrophobicContact CB-CB 4.3Å; H125-A309 PolarHBondContact N-O 3.09Å; H125-A309 PolarHBondContact O-N 3.09Å; F127-A309 HydrophobicContact CE2-CB 4.39Å; L280-A309 HydrophobicContact CD1-CB 4.08Å; A309-L314 HydrophobicContact CB-CD1 4.12Å; A309-L314 WeakPolarHBondContact O-CD1 3.2Å; A309-L352 HydrophobicContact CB-CD1 3.79Å; A309-L352 HydrophobicContact CB-CD2 4.32Å
310	L	96.9	Very high	90.9	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.4	178.7	-69.7	172.4	0	0	0	109.6	F114 L115 M118 Y269 F281 I283 F308	F114-L310 HydrophobicContact CE1-CD1 3.92Å; F114-L310 HydrophobicContact CZ-CD1 4.17Å; L115-L310 HydrophobicContact CD2-CD1 4.09Å; M118-L310 HydrophobicContact CB-CD2 3.59Å; M118-L310 HydrophobicContact CG-CD2 3.6Å; M118-L310 HydrophobicContact SD-CD2 4.03Å; Y269-L310 HydrophobicContact CD2-CB 3.84Å; Y269-L310 HydrophobicContact CD2-CD1 3.97Å; Y269-L310 HydrophobicContact CD2-CG 4.4Å; Y269-L310 HydrophobicContact CE2-CB 3.91Å; Y269-L310 HydrophobicContact CG-CD1 4.49Å; F281-L310 HydrophobicContact CB-CB 4.18Å; F281-L310 HydrophobicContact CD1-CB 4.33Å; F281-L310 HydrophobicContact CD1-CD1 3.7Å; F281-L310 HydrophobicContact CE1-CD1 4.09Å; F281-L310 PolarHBondContact N-O 3.45Å; F281-L310 PolarHBondContact O-N 3.43Å; I283-L310 HydrophobicContact CD1-CD1 3.74Å; I283-L310 HydrophobicContact CD1-CG 4.39Å; F308-L310 HydrophobicContact CD1-CD2 4.19Å; F308-L310 HydrophobicContact CD1-CG 3.95Å; F308-L310 HydrophobicContact CE1-CD1 4.45Å; F308-L310 HydrophobicContact CE1-CD2 3.54Å; F308-L310 HydrophobicContact CE1-CG 3.81Å; F308-L310 HydrophobicContact CZ-CD2 4.49Å
311	S	95.8	Very high	90.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.			trans	-162.5	151.4	170.6	165.7	0	0	0	0	109.3	F279 H313 L314	F279-S311 WeakPolarHBondContact O-CB 3.39Å; F279-S311 PolarHBondContact O-OG 3.24Å; S311-H313 PolarHBondContact O-N 2.95Å; S311-H313 PolarHBondContact OG-N 2.99Å; S311-L314 PolarHBondContact O-N 3.25Å
312	P	94.5	Very high	90.7	Very high	45 Å²	45	48.8 Å²	48.8	29%	0.292	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.6	176.2	-25	37.1	0	0	0	113.8	S277 F279	S277-P312 WeakPolarHBondContact O-CG 3.49Å; F279-P312 HydrophobicContact CD1-CG 4.02Å; F279-P312 VanDerWaalsContact CE1-CD 3.5Å; F279-P312 HydrophobicContact CE1-CG 3.39Å; F279-P312 HydrophobicContact CZ-CG 3.89Å
313	H	93	Very high	90.7	Very high	61 Å²	61	48.7 Å²	48.7	28%	0.282	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-2.1	-179.8	-66.2	-80.2	0	0	0	113.7	Y88 S277 S311 L356	Y88-H313 AromaticContact CD1-CE1 3.58Å; Y88-H313 AromaticContact CD1-ND1 3.79Å; Y88-H313 AromaticContact CD1-NE2 3.78Å; Y88-H313 HydrophobicContact CD2-CB 4.02Å; Y88-H313 AromaticContact CD2-CG 3.89Å; Y88-H313 AromaticContact CD2-ND1 3.88Å; Y88-H313 AromaticContact CE1-CE1 3.86Å; Y88-H313 HydrophobicContact CG-CB 4.18Å; Y88-H313 AromaticContact CG-CD2 3.85Å; Y88-H313 AromaticContact CG-CE1 3.94Å; Y88-H313 AromaticContact CG-CG 3.65Å; Y88-H313 AromaticContact CG-ND1 3.73Å; S277-H313 PolarHBondContact O-CD2 3.27Å; S277-H313 PolarHBondContact O-NE2 3.3Å; S311-H313 PolarHBondContact O-N 2.95Å; S311-H313 PolarHBondContact OG-N 2.99Å; H313-L356 HydrophobicContact CB-CD2 4Å
314	L	92.2	Very high	90.7	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.021	27%	0.265	C	S	.	.			trans	-82.3	125.7	175.9	-65.7	178.1	0	0	0	110.8	H125 A309 S311 L352 A355 L356	H125-L314 HydrophobicContact CB-CD1 4.37Å; A309-L314 HydrophobicContact CB-CD1 4.12Å; A309-L314 WeakPolarHBondContact O-CD1 3.2Å; S311-L314 PolarHBondContact O-N 3.25Å; L314-L352 HydrophobicContact CD1-CD1 4.17Å; L314-L352 HydrophobicContact CD2-CD1 3.85Å; L314-A355 HydrophobicContact CD2-CB 3.63Å; L314-L356 HydrophobicContact CD2-CD1 4.4Å; L314-L356 HydrophobicContact CD2-CD2 3.94Å; L314-L356 HydrophobicContact CD2-CG 4.02Å; L314-L356 HydrophobicContact CG-CD2 4.42Å
315	T	85.1	Confident	90.6	Very high	116 Å²	116	50.8 Å²	50.8	71%	0.712	26%	0.261	S	S	*	.			trans	-113	105.2	160.4	52	0	0	0	0	106.5	G122 H125	G122-T315 CarbonylContact O-C 3.58Å; G122-T315 VanDerWaalsContact O-CA 3.29Å; G122-T315 WeakPolarHBondContact O-CA 3.25Å; H125-T315 PolarHBondContact NE2-O 3.41Å; H125-T315 VanDerWaalsContact NE2-O 3.07Å
316	A	70.2	Confident	90.5	Very high	20 Å²	20	51 Å²	51	17%	0.165	26%	0.262	C	S	.	.			trans	-80.4	136.5	-178.3	0	0	0	0	0	110.2	G122 G124 H125	G122-A316 PolarHBondContact O-N 3.2Å; G124-A316 WeakPolarHBondContact O-CB 3.49Å; H125-A316 VanDerWaalsContact CD2-CB 3.5Å; H125-A316 WeakPolarHBondContact CD2-CB 3.47Å; H125-A316 WeakPolarHBondContact NE2-CA 3.2Å
317	R	69.5	Low	90.5	Very high	213 Å²	213	51.8 Å²	51.8	80%	0.804	27%	0.266	S	S	*	.			trans	-78.7	144.3	151.4	-70.4	179.3	165.5	-179	-4.7	106.9	L319	R317-L319 PolarHBondContact O-N 3.06Å
318	Q	67.3	Low	90.5	Very high	163 Å²	163	51.8 Å²	51.8	76%	0.762	27%	0.266	S	S	*	.	S	Bend	trans	-65.9	22.2	178.6	-69.1	-179.1	-16.4	0	0	114.2
319	L	82.9	Confident	90.6	Very high	121 Å²	121	51.8 Å²	51.8	63%	0.634	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-99	116.9	-176.2	-158.9	96.4	0	0	0	110.2	R317 Q321	R317-L319 PolarHBondContact O-N 3.06Å; L319-Q321 HydrophobicContact CD2-CG 4.24Å; L319-Q321 PolarHBondContact O-N 3.11Å
320	V	88.6	Confident	90.6	Very high	78 Å²	78	51.8 Å²	51.8	47%	0.473	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-70.4	124.3	166.8	179.7	0	0	0	0	108.6	L105 V126 K128	L105-V320 HydrophobicContact CD1-CG1 4.08Å; L105-V320 HydrophobicContact CD1-CG2 4.39Å; V126-V320 HydrophobicContact CB-CG2 4.32Å; V126-V320 HydrophobicContact CG1-CG1 4.28Å; V126-V320 HydrophobicContact CG1-CG2 4.09Å; V126-V320 WeakPolarHBondContact O-CA 3.31Å; K128-V320 HydrophobicContact CB-CG1 4.32Å
321	Q	91.5	Very high	90.6	Very high	44 Å²	44	51.8 Å²	51.8	21%	0.206	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	154	178.7	-78.1	167.2	66.6	0	0	111.8	V126 F127 K128 L319 D351	V126-Q321 PolarHBondContact O-N 3.08Å; V126-Q321 VanDerWaalsContact O-N 3.12Å; F127-Q321 CarbonylContact C-O 3.55Å; F127-Q321 VanDerWaalsContact CA-O 3.23Å; F127-Q321 WeakPolarHBondContact CA-O 3.42Å; F127-Q321 HydrophobicContact CD1-CB 3.69Å; F127-Q321 HydrophobicContact CE1-CB 4.08Å; K128-Q321 PolarHBondContact N-O 3.48Å; L319-Q321 HydrophobicContact CD2-CG 4.24Å; L319-Q321 PolarHBondContact O-N 3.11Å; Q321-D351 VanDerWaalsContact NE2-CG 3.33Å; Q321-D351 PolarHBondContact NE2-OD2 3.36Å
322	T	95	Very high	90.7	Very high	108 Å²	108	51.8 Å²	51.8	66%	0.663	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	131	171.1	-55	0	0	0	0	109.5	K128	K128-T322 WeakPolarHBondContact O-CA 3.5Å
323	V	96.6	Very high	90.8	Very high	18 Å²	18	49.6 Å²	49.6	11%	0.109	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	168.8	178.8	-60.5	0	0	0	0	109.5	F127 K128 A129 K130 M349	F127-V323 HydrophobicContact CB-CG2 3.87Å; F127-V323 HydrophobicContact CD1-CG1 3.7Å; F127-V323 HydrophobicContact CD1-CG2 4.47Å; F127-V323 HydrophobicContact CE1-CG1 4.4Å; F127-V323 HydrophobicContact CG-CG1 4.46Å; F127-V323 HydrophobicContact CG-CG2 4.44Å; K128-V323 PolarHBondContact O-N 3.07Å; A129-V323 CarbonylContact C-O 3.58Å; A129-V323 WeakPolarHBondContact CA-O 3.34Å; A129-V323 HydrophobicContact CB-CG2 3.81Å; K130-V323 PolarHBondContact N-O 2.9Å; V323-M349 HydrophobicContact CG1-CE 4.36Å; V323-M349 HydrophobicContact CG1-CG 4.45Å; V323-M349 HydrophobicContact CG2-CE 4.21Å
324	E	96.5	Very high	90.9	Very high	67 Å²	67	46.8 Å²	46.8	31%	0.313	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	142	165	-60.9	-67	161.9	0	0	108.9	Q132 V326 D327	Q132-E324 PolarHBondContact NE2-OE2 2.73Å; E324-V326 HydrophobicContact CB-CG2 3.86Å; E324-V326 PolarHBondContact O-N 3.31Å; E324-V326 VanDerWaalsContact O-N 3.14Å; E324-D327 PolarHBondContact N-OD2 3.34Å; E324-D327 WeakPolarHBondContact O-CB 2.91Å; E324-D327 VanDerWaalsContact O-CG 3.24Å; E324-D327 PolarHBondContact O-N 2.91Å
325	Q	97.7	Very high	91.1	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-59.1	-31.7	-179	-179.1	-173.4	63.4	0	0	112.2	A129 K130 I131 L144 G285 D286 D327 L328	A129-Q325 HydrophobicContact CB-CB 4.35Å; K130-Q325 PolarHBondContact O-N 2.82Å; I131-Q325 HydrophobicContact CG2-CB 3.76Å; I131-Q325 HydrophobicContact CG2-CG 4.16Å; L144-Q325 HydrophobicContact CD2-CG 3.6Å; L144-Q325 HydrophobicContact CG-CG 4.42Å; G285-Q325 PolarHBondContact O-NE2 3.29Å; G285-Q325 VanDerWaalsContact O-NE2 3.08Å; D286-Q325 PolarHBondContact O-NE2 3.46Å; Q325-D327 PolarHBondContact O-N 2.85Å; Q325-L328 WeakPolarHBondContact O-CB 3.43Å; Q325-L328 PolarHBondContact O-N 3.48Å
326	V	96.7	Very high	91.5	Very high	4 Å²	4	42 Å²	42	2%	0.024	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-65.1	-17.2	176.4	-64.6	0	0	0	0	113.5	A143 E324 L328 V329 P330 V345	A143-V326 HydrophobicContact CB-CG1 4.34Å; E324-V326 HydrophobicContact CB-CG2 3.86Å; E324-V326 PolarHBondContact O-N 3.31Å; E324-V326 VanDerWaalsContact O-N 3.14Å; V326-L328 PolarHBondContact O-N 3.16Å; V326-V329 PolarHBondContact O-N 2.99Å; V326-P330 WeakPolarHBondContact O-CD 3.27Å; V326-V345 HydrophobicContact CG2-CG2 4.44Å
327	D	97.8	Very high	92.6	Very high	19 Å²	19	44.4 Å²	44.4	10%	0.102	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-67.7	-21.4	176.4	-63.4	-15.2	0	0	0	112.4	E324 Q325 V329 P330 T331 G346 L347 M349	E324-D327 PolarHBondContact N-OD2 3.34Å; E324-D327 WeakPolarHBondContact O-CB 2.91Å; E324-D327 VanDerWaalsContact O-CG 3.24Å; E324-D327 PolarHBondContact O-N 2.91Å; Q325-D327 PolarHBondContact O-N 2.85Å; D327-V329 VanDerWaalsContact C-N 3.32Å; D327-V329 PolarHBondContact O-N 3.34Å; D327-P330 VanDerWaalsContact O-CD 3.28Å; D327-P330 WeakPolarHBondContact O-CD 3.46Å; D327-P330 WeakPolarHBondContact O-CG 3.39Å; D327-T331 WeakPolarHBondContact O-CB 3.43Å; D327-T331 PolarHBondContact O-N 2.92Å; D327-T331 PolarHBondContact O-OG1 3.36Å; D327-G346 VanDerWaalsContact OD1-CA 3.28Å; D327-G346 WeakPolarHBondContact OD1-CA 3.37Å; D327-L347 CarbonylContact C-O 3.37Å; D327-L347 WeakPolarHBondContact CA-O 3.34Å; D327-L347 WeakPolarHBondContact CB-O 3.28Å; D327-L347 PolarHBondContact OD1-N 2.88Å; D327-M349 HydrophobicContact CB-CG 3.94Å
328	L	98.4	Very high	93.8	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-63.8	-39.1	176.5	-177.3	61.4	0	0	0	111.5	L144 V282 L284 Q325 V326 T331 L332 M349	L144-L328 HydrophobicContact CD2-CD2 4.19Å; V282-L328 HydrophobicContact CG1-CD1 4.49Å; L284-L328 HydrophobicContact CD1-CD2 3.53Å; Q325-L328 WeakPolarHBondContact O-CB 3.43Å; Q325-L328 PolarHBondContact O-N 3.48Å; V326-L328 PolarHBondContact O-N 3.16Å; L328-T331 WeakPolarHBondContact O-CB 3.45Å; L328-T331 PolarHBondContact O-N 3.07Å; L328-L332 HydrophobicContact CD1-CD1 4.04Å; L328-L332 HydrophobicContact CD1-CD2 4.3Å; L328-L332 HydrophobicContact CD1-CG 3.91Å; L328-L332 HydrophobicContact CD2-CD1 4.32Å; L328-L332 HydrophobicContact CG-CD1 3.81Å; L328-L332 HydrophobicContact CG-CG 4.09Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 2.94Å; L328-M349 HydrophobicContact CB-SD 4.48Å; L328-M349 HydrophobicContact CD1-SD 4.17Å
329	V	98.4	Very high	95.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.1	-52.4	-174.4	179.1	0	0	0	0	113.8	A143 L144 V326 D327 T331 L332 A333 P341 N344	A143-V329 WeakPolarHBondContact O-CG2 3.47Å; L144-V329 VanDerWaalsContact C-CG2 3.5Å; L144-V329 VanDerWaalsContact O-CG2 3.22Å; L144-V329 WeakPolarHBondContact O-CG2 3.31Å; V326-V329 PolarHBondContact O-N 2.99Å; D327-V329 VanDerWaalsContact C-N 3.32Å; D327-V329 PolarHBondContact O-N 3.34Å; V329-T331 PolarHBondContact O-N 3.45Å; V329-L332 PolarHBondContact O-N 3.17Å; V329-A333 WeakPolarHBondContact O-CB 3.32Å; V329-A333 PolarHBondContact O-N 3.28Å; V329-P341 HydrophobicContact CG1-CG 3.81Å; V329-N344 WeakPolarHBondContact CB-ND2 3.42Å
330	P	97	Very high	95.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.1	-29.5	177.1	29.6	-35.3	0	0	0	111.1	V326 D327 M334 I340 N344 L348	V326-P330 WeakPolarHBondContact O-CD 3.27Å; D327-P330 VanDerWaalsContact O-CD 3.28Å; D327-P330 WeakPolarHBondContact O-CD 3.46Å; D327-P330 WeakPolarHBondContact O-CG 3.39Å; P330-M334 WeakPolarHBondContact O-CB 3.41Å; P330-M334 VanDerWaalsContact O-CG 3.27Å; P330-M334 WeakPolarHBondContact O-CG 3.08Å; P330-M334 PolarHBondContact O-N 3.33Å; P330-I340 HydrophobicContact CB-CD1 3.82Å; P330-I340 HydrophobicContact CB-CG1 3.97Å; P330-I340 HydrophobicContact CB-CG2 3.92Å; P330-N344 WeakPolarHBondContact CD-ND2 3.35Å; P330-L348 HydrophobicContact CB-CD2 4.09Å; P330-L348 WeakPolarHBondContact O-CD2 3.22Å
331	T	97.7	Very high	95.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.8	-51.8	175.3	-58.7	0	0	0	0	111.5	D327 L328 V329 M334 L335 M349 L352 V353	D327-T331 WeakPolarHBondContact O-CB 3.43Å; D327-T331 PolarHBondContact O-N 2.92Å; D327-T331 PolarHBondContact O-OG1 3.36Å; L328-T331 WeakPolarHBondContact O-CB 3.45Å; L328-T331 PolarHBondContact O-N 3.07Å; V329-T331 PolarHBondContact O-N 3.45Å; T331-M334 PolarHBondContact O-N 3.41Å; T331-L335 HydrophobicContact CG2-CD1 3.91Å; T331-L335 HydrophobicContact CG2-CG 4.49Å; T331-L335 WeakPolarHBondContact O-CB 3.45Å; T331-L335 VanDerWaalsContact O-CG 3.25Å; T331-L335 WeakPolarHBondContact O-CG 3.46Å; T331-L335 PolarHBondContact O-N 2.87Å; T331-M349 HydrophobicContact CG2-CB 4.21Å; T331-M349 PolarHBondContact OG1-N 3.33Å; T331-L352 HydrophobicContact CG2-CD2 3.9Å; T331-L352 HydrophobicContact CG2-CG 4.42Å; T331-V353 HydrophobicContact CG2-CG1 3.89Å
332	L	98.1	Very high	95.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.1	-42	176.6	-68.7	177.6	0	0	0	112	V92 L94 L169 L280 L328 V329 M334 L335 L336	V92-L332 HydrophobicContact CG1-CD2 4.03Å; V92-L332 HydrophobicContact CG2-CD2 4.4Å; L94-L332 HydrophobicContact CD1-CD1 3.98Å; L94-L332 HydrophobicContact CD2-CD1 3.95Å; L169-L332 HydrophobicContact CD2-CB 3.88Å; L169-L332 HydrophobicContact CD2-CD1 4.05Å; L280-L332 HydrophobicContact CD2-CD2 3.86Å; L328-L332 HydrophobicContact CD1-CD1 4.04Å; L328-L332 HydrophobicContact CD1-CD2 4.3Å; L328-L332 HydrophobicContact CD1-CG 3.91Å; L328-L332 HydrophobicContact CD2-CD1 4.32Å; L328-L332 HydrophobicContact CG-CD1 3.81Å; L328-L332 HydrophobicContact CG-CG 4.09Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 2.94Å; V329-L332 PolarHBondContact O-N 3.17Å; L332-M334 PolarHBondContact O-N 3.02Å; L332-L335 PolarHBondContact O-N 3.05Å; L332-L336 WeakPolarHBondContact O-CB 3.21Å; L332-L336 WeakPolarHBondContact O-CG 3.28Å; L332-L336 PolarHBondContact O-N 3.06Å
333	A	96.5	Very high	95.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.5	-49.7	176.5	0	0	0	0	0	111.1	L169 V329 L336 N337 L338 I340	L169-A333 HydrophobicContact CD1-CB 4.07Å; V329-A333 WeakPolarHBondContact O-CB 3.32Å; V329-A333 PolarHBondContact O-N 3.28Å; A333-L336 CarbonylContact O-C 3.54Å; A333-L336 PolarHBondContact O-N 3Å; A333-N337 PolarHBondContact O-N 3.24Å; A333-N337 VanDerWaalsContact O-N 3.1Å; A333-L338 HydrophobicContact CB-CB 4.35Å; A333-L338 PolarHBondContact O-N 3.43Å; A333-I340 HydrophobicContact CB-CG1 4.16Å
334	M	94.7	Very high	95.4	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-64.4	-42.2	178.4	-72.3	-65	109.3	0	0	112.7	F84 P330 T331 L332 L336 N337 L338 I340 L348 M366 V369	F84-M334 HydrophobicContact CD2-SD 4.43Å; F84-M334 HydrophobicContact CE2-CE 4.09Å; F84-M334 HydrophobicContact CE2-SD 3.42Å; F84-M334 WeakPolarHBondContact CE2-SD 2.89Å; F84-M334 HydrophobicContact CZ-SD 3.68Å; P330-M334 WeakPolarHBondContact O-CB 3.41Å; P330-M334 VanDerWaalsContact O-CG 3.27Å; P330-M334 WeakPolarHBondContact O-CG 3.08Å; P330-M334 PolarHBondContact O-N 3.33Å; T331-M334 PolarHBondContact O-N 3.41Å; L332-M334 PolarHBondContact O-N 3.02Å; M334-L336 VanDerWaalsContact C-N 3.28Å; M334-L336 PolarHBondContact O-N 3.14Å; M334-N337 PolarHBondContact O-N 3.17Å; M334-N337 VanDerWaalsContact O-N 3.08Å; M334-L338 WeakPolarHBondContact CE-O 3.08Å; M334-I340 HydrophobicContact CE-CD1 3.75Å; M334-I340 HydrophobicContact CE-CG1 3.5Å; M334-I340 HydrophobicContact CG-CD1 4.34Å; M334-I340 HydrophobicContact CG-CG1 4.49Å; M334-L348 HydrophobicContact CB-CD2 4.24Å; M334-L348 HydrophobicContact CG-CD1 4.48Å; M334-L348 HydrophobicContact CG-CD2 3.74Å; M334-M366 HydrophobicContact CB-CE 4.14Å; M334-M366 HydrophobicContact CB-CG 4.35Å; M334-M366 HydrophobicContact CB-SD 4.03Å; M334-M366 HydrophobicContact CG-CB 4.4Å; M334-M366 HydrophobicContact CG-CG 4.32Å; M334-M366 WeakPolarHBondContact O-CE 3.27Å; M334-M366 HydrophobicContact SD-CB 4.15Å; M334-M366 HydrophobicContact SD-CG 3.86Å; M334-V369 HydrophobicContact CE-CG1 4Å; M334-V369 HydrophobicContact SD-CG1 4.44Å
335	L	95.9	Very high	95.2	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-33.6	178.2	-71.8	172.5	0	0	0	112.6	S87 V89 L280 T331 L332 N337 L356 I357	S87-L335 WeakPolarHBondContact CB-O 3.24Å; S87-L335 PolarHBondContact OG-O 3.2Å; V89-L335 HydrophobicContact CB-CB 4.35Å; V89-L335 HydrophobicContact CG2-CB 4.49Å; V89-L335 HydrophobicContact CG2-CD1 4.43Å; V89-L335 HydrophobicContact CG2-CD2 4.28Å; L280-L335 HydrophobicContact CD2-CD1 3.81Å; T331-L335 HydrophobicContact CG2-CD1 3.91Å; T331-L335 HydrophobicContact CG2-CG 4.49Å; T331-L335 WeakPolarHBondContact O-CB 3.45Å; T331-L335 VanDerWaalsContact O-CG 3.25Å; T331-L335 WeakPolarHBondContact O-CG 3.46Å; T331-L335 PolarHBondContact O-N 2.87Å; L332-L335 PolarHBondContact O-N 3.05Å; L335-N337 VanDerWaalsContact C-N 3.32Å; L335-L356 HydrophobicContact CD1-CD1 3.94Å; L335-L356 HydrophobicContact CD2-CB 3.64Å; L335-L356 HydrophobicContact CD2-CD1 4.16Å; L335-I357 HydrophobicContact CD2-CD1 3.96Å; L335-I357 HydrophobicContact CD2-CG1 4.37Å
336	L	95.4	Very high	95.1	Very high	17 Å²	17	22.1 Å²	22.1	9%	0.089	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	6.1	175.6	-67	174.3	0	0	0	113.5	V89 V92 T231 M232 L332 A333 M334 L338	V89-L336 HydrophobicContact CG1-CD2 4.47Å; V92-L336 HydrophobicContact CG2-CD1 4.23Å; V92-L336 HydrophobicContact CG2-CD2 3.95Å; V92-L336 HydrophobicContact CG2-CG 4.26Å; T231-L336 HydrophobicContact CG2-CD2 3.85Å; M232-L336 HydrophobicContact CE-CD1 3.73Å; L332-L336 WeakPolarHBondContact O-CB 3.21Å; L332-L336 WeakPolarHBondContact O-CG 3.28Å; L332-L336 PolarHBondContact O-N 3.06Å; A333-L336 CarbonylContact O-C 3.54Å; A333-L336 PolarHBondContact O-N 3Å; M334-L336 VanDerWaalsContact C-N 3.28Å; M334-L336 PolarHBondContact O-N 3.14Å; L336-L338 HydrophobicContact CB-CD1 3.85Å; L336-L338 HydrophobicContact CB-CG 4Å; L336-L338 HydrophobicContact CD1-CD1 4.21Å; L336-L338 PolarHBondContact O-N 3.25Å
337	N	93.5	Very high	95	Very high	70 Å²	70	25.4 Å²	25.4	37%	0.374	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	36.3	-177.7	-166.6	37.9	0	0	0	113.4	N83 F84 A333 M334 L335	N83-N337 PolarHBondContact N-OD1 3.31Å; F84-N337 WeakPolarHBondContact CD2-OD1 3.45Å; F84-N337 PolarHBondContact N-OD1 2.94Å; F84-N337 VanDerWaalsContact N-OD1 3.15Å; A333-N337 PolarHBondContact O-N 3.24Å; A333-N337 VanDerWaalsContact O-N 3.1Å; M334-N337 PolarHBondContact O-N 3.17Å; M334-N337 VanDerWaalsContact O-N 3.08Å; L335-N337 VanDerWaalsContact C-N 3.32Å
338	L	94.5	Very high	94.9	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-100.5	153.6	176.9	-65.5	171.1	0	0	0	111.3	L169 M173 S176 L178 A333 M334 L336	L169-L338 HydrophobicContact CD1-CD1 3.76Å; M173-L338 HydrophobicContact CB-CD1 4.49Å; M173-L338 HydrophobicContact CG-CD1 3.52Å; S176-L338 WeakPolarHBondContact OG-CD2 3.48Å; L178-L338 HydrophobicContact CD1-CD1 4.15Å; L178-L338 HydrophobicContact CD1-CD2 3.8Å; L178-L338 HydrophobicContact CD1-CG 4.15Å; A333-L338 HydrophobicContact CB-CB 4.35Å; A333-L338 PolarHBondContact O-N 3.43Å; M334-L338 WeakPolarHBondContact CE-O 3.08Å; L336-L338 HydrophobicContact CB-CD1 3.85Å; L336-L338 HydrophobicContact CB-CG 4Å; L336-L338 HydrophobicContact CD1-CD1 4.21Å; L336-L338 PolarHBondContact O-N 3.25Å
339	P	93.2	Very high	94.8	Very high	41 Å²	41	25.1 Å²	25.1	27%	0.266	12%	0.122	S	C	.	.	P	Polyproline II helix	trans	-57.9	138.4	163.5	-20.8	33	0	0	0	110.9	V81	V81-P339 HydrophobicContact CG1-CB 3.93Å; V81-P339 HydrophobicContact CG1-CG 4.21Å
340	I	94.3	Very high	94.5	Very high	12 Å²	12	26 Å²	26	6%	0.062	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-67	136	170.4	-63.2	166.7	0	0	0	108	P330 A333 M334 E342 N344 V369 N370 Q373	P330-I340 HydrophobicContact CB-CD1 3.82Å; P330-I340 HydrophobicContact CB-CG1 3.97Å; P330-I340 HydrophobicContact CB-CG2 3.92Å; A333-I340 HydrophobicContact CB-CG1 4.16Å; M334-I340 HydrophobicContact CE-CD1 3.75Å; M334-I340 HydrophobicContact CE-CG1 3.5Å; M334-I340 HydrophobicContact CG-CD1 4.34Å; M334-I340 HydrophobicContact CG-CG1 4.49Å; I340-E342 PolarHBondContact O-N 3.48Å; I340-N344 HydrophobicContact CG2-CB 3.61Å; I340-V369 HydrophobicContact CD1-CG1 4.3Å; I340-N370 HydrophobicContact CD1-CB 3.9Å; I340-Q373 HydrophobicContact CB-CG 4.16Å; I340-Q373 HydrophobicContact CG2-CG 3.9Å
341	P	94.5	Very high	94.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-50.8	136.4	175.3	-29.4	36.4	0	0	0	112.7	D167 V329 R343 N344 Q373	D167-P341 WeakPolarHBondContact OD2-CA 3.31Å; V329-P341 HydrophobicContact CG1-CG 3.81Å; P341-R343 VanDerWaalsContact C-N 3.26Å; P341-R343 PolarHBondContact O-N 3.21Å; P341-R343 VanDerWaalsContact O-N 3.09Å; P341-N344 HydrophobicContact CB-CB 4.39Å; P341-N344 WeakPolarHBondContact O-CB 3.32Å; P341-N344 PolarHBondContact O-N 3.4Å; P341-Q373 PolarHBondContact O-NE2 3.42Å; P341-Q373 VanDerWaalsContact O-NE2 3.12Å
342	E	90.1	Very high	94	Very high	129 Å²	129	28.6 Å²	28.6	60%	0.603	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-39.6	-163.7	-83.4	168.3	-154.7	0	0	113.7	D167 R172 I340 N377	D167-E342 HydrophobicContact CB-CB 4.44Å; D167-E342 PolarHBondContact OD2-N 2.88Å; R172-E342 IonicContact CZ-OE1 3.61Å; R172-E342 IonicContact NH2-OE1 2.71Å; R172-E342 PolarHBondContact NH2-OE1 2.87Å; I340-E342 PolarHBondContact O-N 3.48Å; E342-N377 PolarHBondContact O-ND2 2.78Å
343	R	90	Very high	93.8	Very high	140 Å²	140	28.6 Å²	28.6	53%	0.528	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	5.5	-177.2	-67.1	-174.6	176.3	162.3	-0.4	114.4	T148 D166 P341	T148-R343 HydrophobicContact CG2-CB 3.67Å; T148-R343 WeakPolarHBondContact CG2-O 3.42Å; D166-R343 IonicContact OD1-NH1 2.87Å; D166-R343 PolarHBondContact OD1-NH1 3.25Å; D166-R343 IonicContact OD2-NH1 2.92Å; D166-R343 PolarHBondContact OD2-NH1 2.92Å; P341-R343 VanDerWaalsContact C-N 3.26Å; P341-R343 PolarHBondContact O-N 3.21Å; P341-R343 VanDerWaalsContact O-N 3.09Å
344	N	92.5	Very high	93.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.171	C	C	.	.			trans	-55.5	143.5	179.7	178.8	-81.3	0	0	0	111.2	S146 G147 V329 P330 I340 P341 G346 Q373 N377	S146-N344 WeakPolarHBondContact O-CA 3.29Å; S146-N344 VanDerWaalsContact O-CB 3.24Å; S146-N344 WeakPolarHBondContact O-CB 3.36Å; S146-N344 PolarHBondContact O-ND2 3.48Å; S146-N344 VanDerWaalsContact O-ND2 3.09Å; G147-N344 WeakPolarHBondContact CA-ND2 3.47Å; V329-N344 WeakPolarHBondContact CB-ND2 3.42Å; P330-N344 WeakPolarHBondContact CD-ND2 3.35Å; I340-N344 HydrophobicContact CG2-CB 3.61Å; P341-N344 HydrophobicContact CB-CB 4.39Å; P341-N344 WeakPolarHBondContact O-CB 3.32Å; P341-N344 PolarHBondContact O-N 3.4Å; N344-G346 PolarHBondContact OD1-N 2.94Å; N344-G346 PolarHBondContact OD1-O 3.11Å; N344-Q373 VanDerWaalsContact C-NE2 3.33Å; N344-Q373 PolarHBondContact O-NE2 3Å; N344-Q373 PolarHBondContact O-OE1 3.43Å; N344-N377 PolarHBondContact O-ND2 2.95Å
345	V	93.1	Very high	93.4	Very high	22 Å²	22	36.8 Å²	36.8	13%	0.133	18%	0.181	C	C	.	.			trans	-123.9	11.7	177.6	-62.6	0	0	0	0	112.4	G147 I149 V326 F374 N377	G147-V345 WeakPolarHBondContact O-CG2 3.37Å; G147-V345 PolarHBondContact O-N 3.1Å; I149-V345 HydrophobicContact CD1-CG2 4.18Å; I149-V345 HydrophobicContact CG1-CG2 3.97Å; V326-V345 HydrophobicContact CG2-CG2 4.44Å; V345-F374 VanDerWaalsContact O-CD2 3.25Å; V345-F374 WeakPolarHBondContact O-CD2 3.46Å; V345-F374 VanDerWaalsContact O-CE2 3.23Å; V345-F374 WeakPolarHBondContact O-CE2 3.48Å; V345-N377 HydrophobicContact CG1-CB 3.83Å
346	G	94.6	Very high	93.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.			trans	-83.5	162.3	177.9	0	0	0	0	0	112.4	D327 N344 N370	D327-G346 VanDerWaalsContact OD1-CA 3.28Å; D327-G346 WeakPolarHBondContact OD1-CA 3.37Å; N344-G346 PolarHBondContact OD1-N 2.94Å; N344-G346 PolarHBondContact OD1-O 3.11Å; G346-N370 PolarHBondContact O-ND2 3.43Å
347	L	95.5	Very high	93.3	Very high	74 Å²	74	36.2 Å²	36.2	39%	0.387	18%	0.178	S	C	.	.			trans	-107.9	162.2	172.3	-63.1	175.3	0	0	0	110.8	D327 M349 N370 F374	D327-L347 CarbonylContact C-O 3.37Å; D327-L347 WeakPolarHBondContact CA-O 3.34Å; D327-L347 WeakPolarHBondContact CB-O 3.28Å; D327-L347 PolarHBondContact OD1-N 2.88Å; L347-M349 PolarHBondContact O-N 2.7Å; L347-N370 VanDerWaalsContact CA-OD1 3.23Å; L347-N370 WeakPolarHBondContact CA-OD1 3.37Å; L347-F374 HydrophobicContact CD2-CB 4.03Å; L347-F374 HydrophobicContact CD2-CD1 4.27Å; L347-F374 HydrophobicContact CD2-CD2 3.8Å; L347-F374 HydrophobicContact CD2-CE2 4.32Å; L347-F374 HydrophobicContact CD2-CG 3.77Å; L347-F374 HydrophobicContact CG-CD2 4.3Å; L347-F374 HydrophobicContact CG-CE2 4.46Å
348	L	96.2	Very high	93	Very high	12 Å²	12	35.7 Å²	35.7	6%	0.063	18%	0.178	C	C	.	.			trans	-67.7	133.8	173.6	-61	179.5	0	0	0	111.3	P330 M334 G350 V353 M366 Y367 N370	P330-L348 HydrophobicContact CB-CD2 4.09Å; P330-L348 WeakPolarHBondContact O-CD2 3.22Å; M334-L348 HydrophobicContact CB-CD2 4.24Å; M334-L348 HydrophobicContact CG-CD1 4.48Å; M334-L348 HydrophobicContact CG-CD2 3.74Å; L348-G350 PolarHBondContact O-N 3.04Å; L348-V353 HydrophobicContact CB-CG1 4.29Å; L348-V353 HydrophobicContact CB-CG2 4.3Å; L348-M366 HydrophobicContact CD1-CB 3.8Å; L348-Y367 HydrophobicContact CB-CD1 4.44Å; L348-Y367 HydrophobicContact CB-CE1 4.14Å; L348-Y367 HydrophobicContact CD1-CD1 4.15Å; L348-Y367 HydrophobicContact CD1-CE1 4.46Å; L348-Y367 HydrophobicContact CD1-CG 4.42Å; L348-N370 HydrophobicContact CD1-CB 4.07Å; L348-N370 HydrophobicContact CD2-CB 4.17Å; L348-N370 HydrophobicContact CG-CB 3.74Å; L348-N370 PolarHBondContact N-OD1 2.92Å
349	M	95.7	Very high	92.8	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.025	20%	0.204	C	C	.	.			trans	-71	95	171.1	-61.5	175.7	68.3	0	0	109	F127 V307 V323 D327 L328 T331 L347 D351 L352 V353	F127-M349 HydrophobicContact CB-CE 4.19Å; F127-M349 HydrophobicContact CD1-CE 3.54Å; F127-M349 HydrophobicContact CD2-CE 3.34Å; F127-M349 HydrophobicContact CE1-CE 3.64Å; F127-M349 HydrophobicContact CE2-CE 3.44Å; F127-M349 VanDerWaalsContact CE2-CE 3.44Å; F127-M349 HydrophobicContact CG-CE 3.4Å; F127-M349 VanDerWaalsContact CG-CE 3.4Å; F127-M349 HydrophobicContact CZ-CE 3.6Å; V307-M349 HydrophobicContact CG1-CE 4.19Å; V323-M349 HydrophobicContact CG1-CE 4.36Å; V323-M349 HydrophobicContact CG1-CG 4.45Å; V323-M349 HydrophobicContact CG2-CE 4.21Å; D327-M349 HydrophobicContact CB-CG 3.94Å; L328-M349 HydrophobicContact CB-SD 4.48Å; L328-M349 HydrophobicContact CD1-SD 4.17Å; T331-M349 HydrophobicContact CG2-CB 4.21Å; T331-M349 PolarHBondContact OG1-N 3.33Å; L347-M349 PolarHBondContact O-N 2.7Å; M349-D351 PolarHBondContact O-N 3Å; M349-L352 HydrophobicContact CB-CB 4.11Å; M349-L352 WeakPolarHBondContact O-CB 3.37Å; M349-L352 PolarHBondContact O-N 3.21Å; M349-L352 HydrophobicContact SD-CD2 4.48Å; M349-V353 PolarHBondContact O-N 3.01Å
350	G	91.9	Very high	92.5	Very high	18 Å²	18	46 Å²	46	19%	0.186	23%	0.225	C	C	.	.	H	α-helix	trans	-58.7	-39.7	-160.6	0	0	0	0	0	115.7	L348 V353 R354 Y367	L348-G350 PolarHBondContact O-N 3.04Å; G350-V353 VanDerWaalsContact O-CG2 3.32Å; G350-V353 WeakPolarHBondContact O-CG2 3.26Å; G350-R354 WeakPolarHBondContact O-CB 3.23Å; G350-R354 PolarHBondContact O-N 3.27Å; G350-Y367 WeakPolarHBondContact CA-OH 3.41Å
351	D	90.5	Very high	92.1	Very high	53 Å²	53	47.6 Å²	47.6	28%	0.283	25%	0.245	S	C	.	.	H	α-helix	trans	-72	-33.1	179.2	-82.3	13.6	0	0	0	112.4	Q321 M349 A355	Q321-D351 VanDerWaalsContact NE2-CG 3.33Å; Q321-D351 PolarHBondContact NE2-OD2 3.36Å; M349-D351 PolarHBondContact O-N 3Å; D351-A355 WeakPolarHBondContact O-CB 3.33Å; D351-A355 PolarHBondContact O-N 3.17Å; D351-A355 VanDerWaalsContact O-N 3.13Å
352	L	92.8	Very high	92	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-49	177.2	-168.2	60.1	0	0	0	110.8	F127 L280 A309 L314 T331 M349 R354 A355 L356	F127-L352 HydrophobicContact CZ-CB 4.42Å; L280-L352 HydrophobicContact CD1-CD1 4.21Å; L280-L352 HydrophobicContact CD2-CD2 4.39Å; A309-L352 HydrophobicContact CB-CD1 3.79Å; A309-L352 HydrophobicContact CB-CD2 4.32Å; L314-L352 HydrophobicContact CD1-CD1 4.17Å; L314-L352 HydrophobicContact CD2-CD1 3.85Å; T331-L352 HydrophobicContact CG2-CD2 3.9Å; T331-L352 HydrophobicContact CG2-CG 4.42Å; M349-L352 HydrophobicContact CB-CB 4.11Å; M349-L352 WeakPolarHBondContact O-CB 3.37Å; M349-L352 PolarHBondContact O-N 3.21Å; M349-L352 HydrophobicContact SD-CD2 4.48Å; L352-R354 PolarHBondContact O-N 3.4Å; L352-A355 PolarHBondContact O-N 2.96Å; L352-L356 HydrophobicContact CD1-CD1 3.55Å; L352-L356 HydrophobicContact CD1-CG 4.35Å; L352-L356 HydrophobicContact CG-CD1 3.85Å; L352-L356 WeakPolarHBondContact O-CB 3.46Å; L352-L356 WeakPolarHBondContact O-CG 3.35Å; L352-L356 PolarHBondContact O-N 2.86Å
353	V	93.7	Very high	92	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-36.5	178	-64.9	0	0	0	0	112.2	T331 L348 M349 G350 A355 L356 I357 L363 Y367	T331-V353 HydrophobicContact CG2-CG1 3.89Å; L348-V353 HydrophobicContact CB-CG1 4.29Å; L348-V353 HydrophobicContact CB-CG2 4.3Å; M349-V353 PolarHBondContact O-N 3.01Å; G350-V353 VanDerWaalsContact O-CG2 3.32Å; G350-V353 WeakPolarHBondContact O-CG2 3.26Å; V353-A355 VanDerWaalsContact C-N 3.32Å; V353-A355 PolarHBondContact O-N 3.13Å; V353-L356 PolarHBondContact O-N 3.47Å; V353-I357 HydrophobicContact CB-CG1 4.49Å; V353-I357 WeakPolarHBondContact O-CB 3.46Å; V353-I357 WeakPolarHBondContact O-CG1 3.48Å; V353-I357 PolarHBondContact O-N 3.31Å; V353-L363 HydrophobicContact CB-CD1 4Å; V353-L363 HydrophobicContact CG2-CD1 3.65Å; V353-Y367 HydrophobicContact CG2-CE2 4.47Å
354	R	92.4	Very high	92.1	Very high	148 Å²	148	39.8 Å²	39.8	56%	0.558	22%	0.224	S	C	*	.	H	α-helix	trans	-65.6	-36.3	177.5	-172.5	-173.2	-54.6	-80.3	-2.5	112.1	G350 L352 L363	G350-R354 WeakPolarHBondContact O-CB 3.23Å; G350-R354 PolarHBondContact O-N 3.27Å; L352-R354 PolarHBondContact O-N 3.4Å; R354-L363 HydrophobicContact CB-CD2 4.35Å; R354-L363 HydrophobicContact CG-CD2 4.26Å
355	A	92.1	Very high	92	Very high	27 Å²	27	44.4 Å²	44.4	22%	0.223	24%	0.244	C	C	.	.	H	α-helix	trans	-75.5	-32.6	178.5	0	0	0	0	0	112.7	L314 D351 L352 V353	L314-A355 HydrophobicContact CD2-CB 3.63Å; D351-A355 WeakPolarHBondContact O-CB 3.33Å; D351-A355 PolarHBondContact O-N 3.17Å; D351-A355 VanDerWaalsContact O-N 3.13Å; L352-A355 PolarHBondContact O-N 2.96Å; V353-A355 VanDerWaalsContact C-N 3.32Å; V353-A355 PolarHBondContact O-N 3.13Å
356	L	94.3	Very high	92	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-101.1	-8.7	-170.5	-62.7	176.3	0	0	0	114.7	Y88 V89 L280 H313 L314 L335 L352 V353	Y88-L356 PolarHBondContact N-O 2.91Å; V89-L356 HydrophobicContact CG2-CB 4.29Å; V89-L356 HydrophobicContact CG2-CD1 3.79Å; V89-L356 HydrophobicContact CG2-CD2 4.31Å; V89-L356 HydrophobicContact CG2-CG 4.36Å; L280-L356 HydrophobicContact CD1-CD1 4.14Å; L280-L356 HydrophobicContact CD2-CD1 4.39Å; H313-L356 HydrophobicContact CB-CD2 4Å; L314-L356 HydrophobicContact CD2-CD1 4.4Å; L314-L356 HydrophobicContact CD2-CD2 3.94Å; L314-L356 HydrophobicContact CD2-CG 4.02Å; L314-L356 HydrophobicContact CG-CD2 4.42Å; L335-L356 HydrophobicContact CD1-CD1 3.94Å; L335-L356 HydrophobicContact CD2-CB 3.64Å; L335-L356 HydrophobicContact CD2-CD1 4.16Å; L352-L356 HydrophobicContact CD1-CD1 3.55Å; L352-L356 HydrophobicContact CD1-CG 4.35Å; L352-L356 HydrophobicContact CG-CD1 3.85Å; L352-L356 WeakPolarHBondContact O-CB 3.46Å; L352-L356 WeakPolarHBondContact O-CG 3.35Å; L352-L356 PolarHBondContact O-N 2.86Å; V353-L356 PolarHBondContact O-N 3.47Å
357	I	93.5	Very high	91.9	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.041	25%	0.251	C	S	.	.			trans	-104	113.1	175.8	-59.8	-59.3	0	0	0	109.8	L335 V353 K359 D362 L363 M366	L335-I357 HydrophobicContact CD2-CD1 3.96Å; L335-I357 HydrophobicContact CD2-CG1 4.37Å; V353-I357 HydrophobicContact CB-CG1 4.49Å; V353-I357 WeakPolarHBondContact O-CB 3.46Å; V353-I357 WeakPolarHBondContact O-CG1 3.48Å; V353-I357 PolarHBondContact O-N 3.31Å; I357-K359 VanDerWaalsContact C-N 3.33Å; I357-K359 PolarHBondContact O-N 3.41Å; I357-D362 HydrophobicContact CG2-CB 4.18Å; I357-L363 HydrophobicContact CG2-CB 4.38Å; I357-M366 HydrophobicContact CD1-CE 3.51Å; I357-M366 HydrophobicContact CD1-SD 3.76Å; I357-M366 HydrophobicContact CG1-CE 4.17Å; I357-M366 HydrophobicContact CG1-SD 3.72Å
358	P	88.2	Confident	91.7	Very high	58 Å²	58	47.1 Å²	47.1	38%	0.377	25%	0.251	S	S	.	.	S	Bend	trans	-68.4	-27.4	-175	-16.7	26.6	0	0	0	114.5	Y88	Y88-P358 HydrophobicContact CD1-CG 4.35Å; Y88-P358 HydrophobicContact CD2-CG 4.16Å; Y88-P358 HydrophobicContact CE1-CG 3.92Å; Y88-P358 HydrophobicContact CE2-CB 4.15Å; Y88-P358 HydrophobicContact CE2-CG 3.71Å; Y88-P358 HydrophobicContact CG-CG 4.46Å
359	K	89.7	Confident	91.4	Very high	126 Å²	126	47.2 Å²	47.2	55%	0.548	25%	0.252	S	S	.	.			trans	-109.9	118.5	-172.8	-63.4	-169.9	-171.9	176.9	0	111.7	S85 I357 G361 D362 L363	S85-K359 WeakPolarHBondContact OG-CD 3.39Å; I357-K359 VanDerWaalsContact C-N 3.33Å; I357-K359 PolarHBondContact O-N 3.41Å; K359-G361 PolarHBondContact O-N 3.02Å; K359-G361 VanDerWaalsContact O-N 3.14Å; K359-D362 HydrophobicContact CB-CB 4.43Å; K359-D362 PolarHBondContact O-N 2.96Å; K359-L363 PolarHBondContact O-N 2.89Å; K359-L363 VanDerWaalsContact O-N 3.16Å
360	D	86.1	Confident	91.3	Very high	132 Å²	132	47.1 Å²	47.1	71%	0.706	25%	0.252	S	S	*	.	H	α-helix	trans	-54.8	-34.9	175.3	-69.2	-27.6	0	0	0	113.6	D362 L363 C364	D360-D362 VanDerWaalsContact C-N 3.3Å; D360-D362 PolarHBondContact O-N 3.49Å; D360-L363 WeakPolarHBondContact O-CB 3.4Å; D360-L363 PolarHBondContact O-N 2.81Å; D360-C364 PolarHBondContact O-N 3.38Å
361	G	87.7	Confident	91.3	Very high	47 Å²	47	49.7 Å²	49.7	49%	0.485	26%	0.261	S	S	.	.	H	α-helix	trans	-64.2	-32.6	177.8	0	0	0	0	0	113.5	K359 K365	K359-G361 PolarHBondContact O-N 3.02Å; K359-G361 VanDerWaalsContact O-N 3.14Å; G361-K365 WeakPolarHBondContact O-CG 3.39Å; G361-K365 PolarHBondContact O-N 3.33Å
362	D	91	Very high	91.1	Very high	12 Å²	12	47.7 Å²	47.7	6%	0.064	25%	0.251	C	S	.	.	H	α-helix	trans	-80.5	-36.1	176	-69.6	-21.5	0	0	0	111	F84 S85 I357 K359 D360 C364 K365 M366	F84-D362 HydrophobicContact CB-CB 4.36Å; F84-D362 HydrophobicContact CD1-CB 4.2Å; S85-D362 WeakPolarHBondContact CB-OD2 3.34Å; S85-D362 PolarHBondContact N-OD2 3.23Å; S85-D362 PolarHBondContact OG-OD2 2.98Å; I357-D362 HydrophobicContact CG2-CB 4.18Å; K359-D362 HydrophobicContact CB-CB 4.43Å; K359-D362 PolarHBondContact O-N 2.96Å; D360-D362 VanDerWaalsContact C-N 3.3Å; D360-D362 PolarHBondContact O-N 3.49Å; D362-C364 VanDerWaalsContact C-N 3.32Å; D362-C364 PolarHBondContact O-N 2.84Å; D362-K365 PolarHBondContact O-N 3.05Å; D362-K365 VanDerWaalsContact O-N 3.13Å; D362-K365 IonicContact OD1-NZ 3.2Å; D362-K365 PolarHBondContact OD1-NZ 2.76Å; D362-M366 WeakPolarHBondContact O-CG 3.49Å; D362-M366 PolarHBondContact O-N 3.39Å
363	L	91.5	Very high	90.8	Very high	11 Å²	11	48.5 Å²	48.5	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-55.1	-46.9	172.7	-176.8	64.6	0	0	0	111.6	V353 R354 I357 K359 D360 K365 M366 Y367	V353-L363 HydrophobicContact CB-CD1 4Å; V353-L363 HydrophobicContact CG2-CD1 3.65Å; R354-L363 HydrophobicContact CB-CD2 4.35Å; R354-L363 HydrophobicContact CG-CD2 4.26Å; I357-L363 HydrophobicContact CG2-CB 4.38Å; K359-L363 PolarHBondContact O-N 2.89Å; K359-L363 VanDerWaalsContact O-N 3.16Å; D360-L363 WeakPolarHBondContact O-CB 3.4Å; D360-L363 PolarHBondContact O-N 2.81Å; L363-K365 PolarHBondContact O-N 2.98Å; L363-M366 PolarHBondContact O-N 2.73Å; L363-Y367 HydrophobicContact CD1-CD2 4.07Å; L363-Y367 HydrophobicContact CD1-CE2 3.52Å; L363-Y367 HydrophobicContact CD2-CE2 4.26Å; L363-Y367 HydrophobicContact CG-CD2 4Å; L363-Y367 HydrophobicContact CG-CE2 3.67Å; L363-Y367 WeakPolarHBondContact O-CD2 3.32Å; L363-Y367 PolarHBondContact O-N 2.73Å; L363-Y367 VanDerWaalsContact O-N 3.07Å
364	C	90.6	Very high	90.5	Very high	82 Å²	82	50.5 Å²	50.5	55%	0.554	26%	0.263	S	S	*	.	H	α-helix	trans	-60.1	-43.2	176.7	-177.2	0	0	0	0	112.4	D360 D362 Y367 M368	D360-C364 PolarHBondContact O-N 3.38Å; D362-C364 VanDerWaalsContact C-N 3.32Å; D362-C364 PolarHBondContact O-N 2.84Å; C364-Y367 PolarHBondContact O-N 3Å; C364-M368 WeakPolarHBondContact O-CG 3.24Å; C364-M368 PolarHBondContact O-N 2.94Å; C364-M368 VanDerWaalsContact O-N 3.09Å
365	K	90.5	Very high	90	Very high	97 Å²	97	45.8 Å²	45.8	42%	0.422	25%	0.249	S	C	.	.	H	α-helix	trans	-65	-41.7	176.9	-66.5	171.5	-166.3	160.4	0	111.8	F84 G361 D362 L363 Y367 M368 V369	F84-K365 HydrophobicContact CD1-CB 4.44Å; F84-K365 HydrophobicContact CE1-CB 3.81Å; G361-K365 WeakPolarHBondContact O-CG 3.39Å; G361-K365 PolarHBondContact O-N 3.33Å; D362-K365 PolarHBondContact O-N 3.05Å; D362-K365 VanDerWaalsContact O-N 3.13Å; D362-K365 IonicContact OD1-NZ 3.2Å; D362-K365 PolarHBondContact OD1-NZ 2.76Å; L363-K365 PolarHBondContact O-N 2.98Å; K365-Y367 PolarHBondContact O-N 2.73Å; K365-M368 PolarHBondContact O-N 3.08Å; K365-M368 VanDerWaalsContact O-N 3.14Å; K365-V369 WeakPolarHBondContact O-CG2 3.38Å; K365-V369 PolarHBondContact O-N 3.07Å
366	M	92.5	Very high	89.5	Confident	2 Å²	2	50 Å²	50	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-46.4	177.3	-72.3	-179	167.4	0	0	111.3	F84 M334 L348 I357 D362 L363 M368 V369 N370	F84-M366 HydrophobicContact CB-CE 3.76Å; F84-M366 HydrophobicContact CD1-CE 4.07Å; F84-M366 HydrophobicContact CD1-CG 3.92Å; F84-M366 HydrophobicContact CD2-CE 3.46Å; F84-M366 VanDerWaalsContact CD2-CE 3.46Å; F84-M366 HydrophobicContact CD2-CG 4.27Å; F84-M366 HydrophobicContact CE1-CG 3.66Å; F84-M366 HydrophobicContact CE2-CE 4.05Å; F84-M366 HydrophobicContact CE2-CG 4.04Å; F84-M366 HydrophobicContact CG-CE 3.47Å; F84-M366 VanDerWaalsContact CG-CE 3.47Å; F84-M366 HydrophobicContact CG-CG 4.21Å; F84-M366 HydrophobicContact CZ-CG 3.73Å; M334-M366 HydrophobicContact CB-CE 4.14Å; M334-M366 HydrophobicContact CB-CG 4.35Å; M334-M366 HydrophobicContact CB-SD 4.03Å; M334-M366 HydrophobicContact CG-CB 4.4Å; M334-M366 HydrophobicContact CG-CG 4.32Å; M334-M366 WeakPolarHBondContact O-CE 3.27Å; M334-M366 HydrophobicContact SD-CB 4.15Å; M334-M366 HydrophobicContact SD-CG 3.86Å; L348-M366 HydrophobicContact CD1-CB 3.8Å; I357-M366 HydrophobicContact CD1-CE 3.51Å; I357-M366 HydrophobicContact CD1-SD 3.76Å; I357-M366 HydrophobicContact CG1-CE 4.17Å; I357-M366 HydrophobicContact CG1-SD 3.72Å; D362-M366 WeakPolarHBondContact O-CG 3.49Å; D362-M366 PolarHBondContact O-N 3.39Å; L363-M366 PolarHBondContact O-N 2.73Å; M366-M368 VanDerWaalsContact C-N 3.31Å; M366-M368 PolarHBondContact O-N 3.28Å; M366-V369 PolarHBondContact O-N 2.84Å; M366-N370 WeakPolarHBondContact O-CB 3.44Å; M366-N370 PolarHBondContact O-N 2.84Å
367	Y	93	Very high	88.7	Confident	70 Å²	70	51 Å²	51	28%	0.275	26%	0.264	S	S	.	.	H	α-helix	trans	-60.3	-39.6	174.2	-80.3	-66.9	0	0	0	112.7	L348 G350 V353 L363 C364 K365 L371	L348-Y367 HydrophobicContact CB-CD1 4.44Å; L348-Y367 HydrophobicContact CB-CE1 4.14Å; L348-Y367 HydrophobicContact CD1-CD1 4.15Å; L348-Y367 HydrophobicContact CD1-CE1 4.46Å; L348-Y367 HydrophobicContact CD1-CG 4.42Å; G350-Y367 WeakPolarHBondContact CA-OH 3.41Å; V353-Y367 HydrophobicContact CG2-CE2 4.47Å; L363-Y367 HydrophobicContact CD1-CD2 4.07Å; L363-Y367 HydrophobicContact CD1-CE2 3.52Å; L363-Y367 HydrophobicContact CD2-CE2 4.26Å; L363-Y367 HydrophobicContact CG-CD2 4Å; L363-Y367 HydrophobicContact CG-CE2 3.67Å; L363-Y367 WeakPolarHBondContact O-CD2 3.32Å; L363-Y367 PolarHBondContact O-N 2.73Å; L363-Y367 VanDerWaalsContact O-N 3.07Å; C364-Y367 PolarHBondContact O-N 3Å; K365-Y367 PolarHBondContact O-N 2.73Å; Y367-L371 WeakPolarHBondContact O-CB 3.37Å; Y367-L371 PolarHBondContact O-N 3.48Å
368	M	91.3	Very high	87.5	Confident	81 Å²	81	51.4 Å²	51.4	40%	0.399	27%	0.267	S	S	.	.	H	α-helix	trans	-66.3	-43	176.2	-69.3	-68.7	95.2	0	0	112.5	L79 C364 K365 M366 L371 C372	L79-M368 HydrophobicContact CD1-CB 3.84Å; L79-M368 HydrophobicContact CD2-CB 4.35Å; C364-M368 WeakPolarHBondContact O-CG 3.24Å; C364-M368 PolarHBondContact O-N 2.94Å; C364-M368 VanDerWaalsContact O-N 3.09Å; K365-M368 PolarHBondContact O-N 3.08Å; K365-M368 VanDerWaalsContact O-N 3.14Å; M366-M368 VanDerWaalsContact C-N 3.31Å; M366-M368 PolarHBondContact O-N 3.28Å; M368-L371 HydrophobicContact CE-CD2 3.91Å; M368-L371 PolarHBondContact O-N 3.41Å; M368-C372 VanDerWaalsContact O-CB 3.25Å; M368-C372 WeakPolarHBondContact O-CB 3.46Å; M368-C372 PolarHBondContact O-N 3.07Å; M368-C372 PolarHBondContact O-SG 3.18Å
369	V	91.3	Very high	86	Confident	13 Å²	13	49.8 Å²	49.8	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-48.8	176.6	170.3	0	0	0	0	110.6	L79 F84 M334 I340 K365 M366 C372 Q373	L79-V369 HydrophobicContact CB-CG2 4.22Å; L79-V369 HydrophobicContact CD1-CG2 4.18Å; F84-V369 HydrophobicContact CZ-CG2 4.38Å; M334-V369 HydrophobicContact CE-CG1 4Å; M334-V369 HydrophobicContact SD-CG1 4.44Å; I340-V369 HydrophobicContact CD1-CG1 4.3Å; K365-V369 WeakPolarHBondContact O-CG2 3.38Å; K365-V369 PolarHBondContact O-N 3.07Å; M366-V369 PolarHBondContact O-N 2.84Å; V369-C372 PolarHBondContact O-N 2.89Å; V369-Q373 VanDerWaalsContact O-CB 3.26Å; V369-Q373 WeakPolarHBondContact O-CB 3.37Å; V369-Q373 PolarHBondContact O-N 3.2Å
370	N	93.1	Very high	84.1	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-65.9	-41.8	178.7	172.4	-122	0	0	0	112.4	I340 G346 L347 L348 M366 C372 Q373 F374	I340-N370 HydrophobicContact CD1-CB 3.9Å; G346-N370 PolarHBondContact O-ND2 3.43Å; L347-N370 VanDerWaalsContact CA-OD1 3.23Å; L347-N370 WeakPolarHBondContact CA-OD1 3.37Å; L348-N370 HydrophobicContact CD1-CB 4.07Å; L348-N370 HydrophobicContact CD2-CB 4.17Å; L348-N370 HydrophobicContact CG-CB 3.74Å; L348-N370 PolarHBondContact N-OD1 2.92Å; M366-N370 WeakPolarHBondContact O-CB 3.44Å; M366-N370 PolarHBondContact O-N 2.84Å; N370-C372 PolarHBondContact O-N 2.74Å; N370-Q373 PolarHBondContact O-N 3.13Å; N370-F374 WeakPolarHBondContact O-CB 3.38Å; N370-F374 PolarHBondContact O-N 2.92Å
371	L	90.5	Very high	82.2	Confident	71 Å²	71	44.8 Å²	44.8	37%	0.372	24%	0.241	S	C	.	.	H	α-helix	trans	-61.8	-43.7	176.1	-179.6	62.4	0	0	0	111.8	Y367 M368 Q373 F374 L375	Y367-L371 WeakPolarHBondContact O-CB 3.37Å; Y367-L371 PolarHBondContact O-N 3.48Å; M368-L371 HydrophobicContact CE-CD2 3.91Å; M368-L371 PolarHBondContact O-N 3.41Å; L371-Q373 VanDerWaalsContact C-N 3.31Å; L371-Q373 PolarHBondContact O-N 3.42Å; L371-F374 PolarHBondContact O-N 2.95Å; L371-L375 HydrophobicContact CD1-CD1 4.24Å; L371-L375 HydrophobicContact CD1-CG 4.24Å; L371-L375 HydrophobicContact CG-CD1 3.98Å; L371-L375 HydrophobicContact CG-CG 4.43Å; L371-L375 WeakPolarHBondContact O-CB 3.47Å; L371-L375 WeakPolarHBondContact O-CG 3.28Å; L371-L375 PolarHBondContact O-N 2.74Å
372	C	88.1	Confident	80.2	Confident	11 Å²	11	46.7 Å²	46.7	7%	0.074	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-42.2	175.3	-81.6	0	0	0	0	112.6	C76 L79 M368 V369 N370 R376	C76-C372 WeakPolarHBondContact CA-SG 3.09Å; C76-C372 HydrophobicContact CB-CB 3.51Å; C76-C372 WeakPolarHBondContact CB-SG 3.34Å; C76-C372 WeakPolarHBondContact SG-CA 3.48Å; C76-C372 WeakPolarHBondContact SG-CB 3.44Å; C76-C372 CovalentContact SG-SG 2.02Å; C76-C372 PolarHBondContact SG-SG 3.41Å; L79-C372 HydrophobicContact CD1-CB 4.47Å; M368-C372 VanDerWaalsContact O-CB 3.25Å; M368-C372 WeakPolarHBondContact O-CB 3.46Å; M368-C372 PolarHBondContact O-N 3.07Å; M368-C372 PolarHBondContact O-SG 3.18Å; V369-C372 PolarHBondContact O-N 2.89Å; N370-C372 PolarHBondContact O-N 2.74Å; C372-R376 WeakPolarHBondContact O-CG 3.49Å; C372-R376 PolarHBondContact O-N 2.93Å
373	Q	86	Confident	78	Confident	18 Å²	18	48 Å²	48	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-66.7	-46.2	178.3	-173.5	-78.9	-20.9	0	0	110.7	I340 P341 N344 V369 N370 L371 L375 R376 N377	I340-Q373 HydrophobicContact CB-CG 4.16Å; I340-Q373 HydrophobicContact CG2-CG 3.9Å; P341-Q373 PolarHBondContact O-NE2 3.42Å; P341-Q373 VanDerWaalsContact O-NE2 3.12Å; N344-Q373 VanDerWaalsContact C-NE2 3.33Å; N344-Q373 PolarHBondContact O-NE2 3Å; N344-Q373 PolarHBondContact O-OE1 3.43Å; V369-Q373 VanDerWaalsContact O-CB 3.26Å; V369-Q373 WeakPolarHBondContact O-CB 3.37Å; V369-Q373 PolarHBondContact O-N 3.2Å; N370-Q373 PolarHBondContact O-N 3.13Å; L371-Q373 VanDerWaalsContact C-N 3.31Å; L371-Q373 PolarHBondContact O-N 3.42Å; Q373-L375 PolarHBondContact O-N 3.39Å; Q373-R376 PolarHBondContact O-N 3.45Å; Q373-N377 PolarHBondContact NE2-ND2 3.32Å; Q373-N377 PolarHBondContact O-N 3.43Å; Q373-N377 PolarHBondContact O-ND2 3.08Å
374	F	86.8	Confident	75.6	Confident	42 Å²	42	51.1 Å²	51.1	18%	0.184	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-50.8	175.2	179.4	-98.6	0	0	0	111.6	V345 L347 N370 L371 R376 N377 I378	V345-F374 VanDerWaalsContact O-CD2 3.25Å; V345-F374 WeakPolarHBondContact O-CD2 3.46Å; V345-F374 VanDerWaalsContact O-CE2 3.23Å; V345-F374 WeakPolarHBondContact O-CE2 3.48Å; L347-F374 HydrophobicContact CD2-CB 4.03Å; L347-F374 HydrophobicContact CD2-CD1 4.27Å; L347-F374 HydrophobicContact CD2-CD2 3.8Å; L347-F374 HydrophobicContact CD2-CE2 4.32Å; L347-F374 HydrophobicContact CD2-CG 3.77Å; L347-F374 HydrophobicContact CG-CD2 4.3Å; L347-F374 HydrophobicContact CG-CE2 4.46Å; N370-F374 WeakPolarHBondContact O-CB 3.38Å; N370-F374 PolarHBondContact O-N 2.92Å; L371-F374 PolarHBondContact O-N 2.95Å; F374-R376 PolarHBondContact O-N 2.96Å; F374-N377 CarbonylContact O-C 3.53Å; F374-N377 PolarHBondContact O-N 3.08Å; F374-I378 HydrophobicContact CD1-CD1 3.9Å; F374-I378 HydrophobicContact CD1-CG1 3.83Å; F374-I378 HydrophobicContact CE1-CD1 3.59Å; F374-I378 HydrophobicContact CE1-CG1 3.61Å; F374-I378 HydrophobicContact CZ-CD1 4.47Å; F374-I378 HydrophobicContact CZ-CG1 4.13Å; F374-I378 WeakPolarHBondContact O-CG1 3.38Å; F374-I378 PolarHBondContact O-N 3.36Å
375	L	83	Confident	73	Confident	50 Å²	50	55 Å²	55	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-57.9	-32.5	-179.1	-74.6	168.1	0	0	0	113.6	L72 L371 Q373 N377 I378	L72-L375 HydrophobicContact CD1-CD1 4.03Å; L72-L375 HydrophobicContact CD2-CD1 4.4Å; L371-L375 HydrophobicContact CD1-CD1 4.24Å; L371-L375 HydrophobicContact CD1-CG 4.24Å; L371-L375 HydrophobicContact CG-CD1 3.98Å; L371-L375 HydrophobicContact CG-CG 4.43Å; L371-L375 WeakPolarHBondContact O-CB 3.47Å; L371-L375 WeakPolarHBondContact O-CG 3.28Å; L371-L375 PolarHBondContact O-N 2.74Å; Q373-L375 PolarHBondContact O-N 3.39Å; L375-N377 VanDerWaalsContact C-N 3.32Å; L375-I378 HydrophobicContact CD2-CD1 3.8Å
376	R	79.9	Confident	70.6	Confident	115 Å²	115	53.4 Å²	53.4	43%	0.434	28%	0.284	S	S	.	.	H	α-helix	trans	-69.6	-30.7	175.9	-72.5	172	-179.6	167.9	3.8	112.5	C76 C372 Q373 F374	C76-R376 PolarHBondContact O-NH2 2.69Å; C372-R376 WeakPolarHBondContact O-CG 3.49Å; C372-R376 PolarHBondContact O-N 2.93Å; Q373-R376 PolarHBondContact O-N 3.45Å; F374-R376 PolarHBondContact O-N 2.96Å
377	N	78.4	Confident	68.1	Low	20 Å²	20	55.8 Å²	55.8	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-107.3	2.1	-172.2	-63.4	-38.8	0	0	0	114.3	E342 N344 V345 Q373 F374 L375 P379	E342-N377 PolarHBondContact O-ND2 2.78Å; N344-N377 PolarHBondContact O-ND2 2.95Å; V345-N377 HydrophobicContact CG1-CB 3.83Å; Q373-N377 PolarHBondContact NE2-ND2 3.32Å; Q373-N377 PolarHBondContact O-N 3.43Å; Q373-N377 PolarHBondContact O-ND2 3.08Å; F374-N377 CarbonylContact O-C 3.53Å; F374-N377 PolarHBondContact O-N 3.08Å; L375-N377 VanDerWaalsContact C-N 3.32Å; N377-P379 WeakPolarHBondContact O-CD 3.33Å; N377-P379 VanDerWaalsContact O-N 3.14Å
378	I	68.5	Low	65.4	Low	17 Å²	17	54.4 Å²	54.4	9%	0.087	31%	0.312	C	S	.	.			trans	-50.5	122.9	-179.7	-71.5	-177.4	0	0	0	110.1	F374 L375 V380 I382	F374-I378 HydrophobicContact CD1-CD1 3.9Å; F374-I378 HydrophobicContact CD1-CG1 3.83Å; F374-I378 HydrophobicContact CE1-CD1 3.59Å; F374-I378 HydrophobicContact CE1-CG1 3.61Å; F374-I378 HydrophobicContact CZ-CD1 4.47Å; F374-I378 HydrophobicContact CZ-CG1 4.13Å; F374-I378 WeakPolarHBondContact O-CG1 3.38Å; F374-I378 PolarHBondContact O-N 3.36Å; L375-I378 HydrophobicContact CD2-CD1 3.8Å; I378-V380 PolarHBondContact O-N 3.33Å; I378-I382 HydrophobicContact CG2-CB 3.89Å; I378-I382 HydrophobicContact CG2-CG2 4.18Å
379	P	56.9	Low	62.8	Low	25 Å²	25	60.9 Å²	60.9	16%	0.162	33%	0.332	C	S	.	.			trans	-58.5	135.6	169.2	-22.8	33.1	0	0	0	110.4	N377 T381 I382	N377-P379 WeakPolarHBondContact O-CD 3.33Å; N377-P379 VanDerWaalsContact O-N 3.14Å; P379-T381 PolarHBondContact O-N 3.36Å; P379-I382 PolarHBondContact O-N 2.7Å
380	V	50.4	Low	60.4	Low	72 Å²	72	64.1 Å²	64.1	44%	0.436	36%	0.36	S	S	.	.	H	α-helix	trans	-50.7	-29.8	-176.6	178.7	0	0	0	0	112.7	Q61 I378 I382 S383 S384	Q61-V380 HydrophobicContact CB-CG2 4.17Å; I378-V380 PolarHBondContact O-N 3.33Å; V380-I382 PolarHBondContact O-N 3.01Å; V380-S383 WeakPolarHBondContact O-CB 3.37Å; V380-S383 PolarHBondContact O-N 3.14Å; V380-S384 PolarHBondContact O-N 3.47Å
381	T	45	Very low	57.7	Low	81 Å²	81	71.5 Å²	71.5	50%	0.497	40%	0.398	S	S	.	.	H	α-helix	trans	-60.4	-36.1	176.8	46.8	0	0	0	0	113.9	P379 S384	P379-T381 PolarHBondContact O-N 3.36Å; T381-S384 PolarHBondContact O-OG 3.34Å
382	I	45.6	Very low	55	Low	86 Å²	86	78.9 Å²	78.9	44%	0.441	43%	0.434	S	S	.	.	H	α-helix	trans	-79.6	-36.7	177.3	-63	175.5	0	0	0	110.8	I378 P379 V380 S384 K385 A386	I378-I382 HydrophobicContact CG2-CB 3.89Å; I378-I382 HydrophobicContact CG2-CG2 4.18Å; P379-I382 PolarHBondContact O-N 2.7Å; V380-I382 PolarHBondContact O-N 3.01Å; I382-S384 VanDerWaalsContact C-N 3.26Å; I382-S384 PolarHBondContact O-N 3.22Å; I382-K385 PolarHBondContact O-N 3.47Å; I382-K385 VanDerWaalsContact O-N 3.15Å; I382-A386 PolarHBondContact O-N 3.3Å
383	S	45.7	Very low	53.3	Low	39 Å²	39	82.3 Å²	82.3	27%	0.273	45%	0.452	S	S	.	.	H	α-helix	trans	-56.9	-39.9	176.2	-173.4	0	0	0	0	112	V380 A386 A387	V380-S383 WeakPolarHBondContact O-CB 3.37Å; V380-S383 PolarHBondContact O-N 3.14Å; S383-A386 PolarHBondContact O-N 3.29Å; S383-A387 WeakPolarHBondContact O-CB 3.42Å; S383-A387 PolarHBondContact O-N 3.27Å
384	S	39.6	Very low	51.6	Low	77 Å²	77	85.7 Å²	85.7	54%	0.538	47%	0.471	S	S	.	.	H	α-helix	trans	-66	-38	176.8	73.9	0	0	0	0	114	V380 T381 I382 G388	V380-S384 PolarHBondContact O-N 3.47Å; T381-S384 PolarHBondContact O-OG 3.34Å; I382-S384 VanDerWaalsContact C-N 3.26Å; I382-S384 PolarHBondContact O-N 3.22Å; S384-G388 PolarHBondContact O-N 3.46Å
385	K	37.3	Very low	49.7	Very low	165 Å²	165	88.1 Å²	88.1	72%	0.717	49%	0.487	S	S	*	.	H	α-helix	trans	-73.5	-34.6	177.6	-78.9	-175.5	176.8	177.6	0	112.5	I382 R389	I382-K385 PolarHBondContact O-N 3.47Å; I382-K385 VanDerWaalsContact O-N 3.15Å; K385-R389 PolarHBondContact O-N 3.06Å
386	A	40.3	Very low	47.7	Very low	63 Å²	63	90.4 Å²	90.4	52%	0.521	50%	0.5	S	S	.	.	H	α-helix	trans	-68.8	-42.1	174.2	0	0	0	0	0	111.5	I382 S383 R389 A390	I382-A386 PolarHBondContact O-N 3.3Å; S383-A386 PolarHBondContact O-N 3.29Å; A386-R389 PolarHBondContact O-N 2.86Å; A386-A390 PolarHBondContact O-N 2.92Å
387	A	39.7	Very low	45.7	Very low	52 Å²	52	88.8 Å²	88.8	43%	0.43	50%	0.504	S	S	.	.	H	α-helix	trans	-66.8	-38.7	175.9	0	0	0	0	0	112.7	S383 R389 A390 L391	S383-A387 WeakPolarHBondContact O-CB 3.42Å; S383-A387 PolarHBondContact O-N 3.27Å; A387-R389 VanDerWaalsContact C-N 3.33Å; A387-R389 PolarHBondContact O-N 3.26Å; A387-A390 PolarHBondContact O-N 3.14Å; A387-L391 PolarHBondContact O-N 3.03Å
388	G	35.2	Very low	43.5	Very low	41 Å²	41	93.4 Å²	93.4	42%	0.423	53%	0.531	S	S	.	.	H	α-helix	trans	-67.6	-28.3	177.1	0	0	0	0	0	114.3	S384	S384-G388 PolarHBondContact O-N 3.46Å
389	R	37.7	Very low	41.7	Very low	217 Å²	217	98.9 Å²	98.9	82%	0.819	56%	0.562	S	S	*	*	H	α-helix	trans	-85.3	-15.5	174.9	-82.2	-175	173.1	-173.5	-2	114.4	K385 A386 A387	K385-R389 PolarHBondContact O-N 3.06Å; A386-R389 PolarHBondContact O-N 2.86Å; A387-R389 VanDerWaalsContact C-N 3.33Å; A387-R389 PolarHBondContact O-N 3.26Å
390	A	40.8	Very low	40.6	Very low	81 Å²	81	104.5 Å²	104.5	67%	0.669	59%	0.593	S	S	*	*	H	α-helix	trans	-88.4	-11.4	174.5	0	0	0	0	0	113	A386 A387	A386-A390 PolarHBondContact O-N 2.92Å; A387-A390 PolarHBondContact O-N 3.14Å
391	L	36	Very low	39.7	Very low	158 Å²	158	107.3 Å²	107.3	83%	0.827	61%	0.606	S	S	*	*			trans	-104.7	4.3	177.2	-75.4	165.5	0	0	0	113.5	A387	A387-L391 PolarHBondContact O-N 3.03Å
392	M	33.8	Very low	39.3	Very low	227 Å²	227	109.6 Å²	109.6	100%	1.118	62%	0.616	S	S	*	*			trans	-110.2	0	162.9	-73.1	-169.5	-179.3	0	0	108.6

Retrieved 392 of 392 residues in 98.5 ms (Link to these results)

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