A0A096N1S7_PAPAN Loading...

Putative nuclease HARBI1

Transposase-derived protein that may have nuclease activity. Does not have transposase activity.

AlphaFold DB (A0A2K5NV74), UniProt , Accession A0A096N1S7, Species PAPAN (Papio anubis, Olive baboon), Gene HARBI1, Length 349 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	34.5	Very low	250 Å²	250	140.6 Å²	140.6	100%	1.232	80%	0.801	S	S	*	*				0	98.6	0	-79.6	-176.7	-81.6	0	0	106.9
2	A	30.3	Very low	35.4	Very low	102 Å²	102	141.2 Å²	141.2	84%	0.843	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-100.6	128.3	-178.2	0	0	0	0	0	108.3
3	I	31.4	Very low	35.9	Very low	158 Å²	158	141.6 Å²	141.6	81%	0.81	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.8	129.3	174.1	-59.6	167.3	0	0	0	106.7	I5	I3-I5 PolarHBondContact O-N 2.7Å
4	P	32.7	Very low	36	Very low	107 Å²	107	141.2 Å²	141.2	70%	0.695	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-76.1	124.7	178.8	29.9	-29.5	0	0	0	109.6	T6	P4-T6 PolarHBondContact O-N 3.22Å; P4-T6 VanDerWaalsContact O-N 3.15Å
5	I	34.6	Very low	36.3	Very low	164 Å²	164	145.5 Å²	145.5	84%	0.841	79%	0.791	S	S	*	*			trans	-66	106.1	164.8	-66.2	166.4	0	0	0	106.2	I3 V7	I3-I5 PolarHBondContact O-N 2.7Å; I5-V7 PolarHBondContact O-N 3.19Å
6	T	35.9	Very low	36.2	Very low	122 Å²	122	140.4 Å²	140.4	75%	0.748	78%	0.783	S	S	*	*			trans	-68.1	116.8	172.9	41.9	0	0	0	0	109.2	P4 L8	P4-T6 PolarHBondContact O-N 3.22Å; P4-T6 VanDerWaalsContact O-N 3.15Å; T6-L8 PolarHBondContact O-N 2.63Å; T6-L8 VanDerWaalsContact O-N 3.12Å
7	V	39.9	Very low	36.5	Very low	132 Å²	132	148.1 Å²	148.1	80%	0.8	80%	0.797	S	S	*	*			trans	-50.8	103.1	171.4	176.8	0	0	0	0	110.3	I5	I5-V7 PolarHBondContact O-N 3.19Å
8	L	37.1	Very low	36.3	Very low	161 Å²	161	143.1 Å²	143.1	84%	0.843	79%	0.785	S	S	*	*			trans	-155.9	50.6	165.7	-130	131.9	0	0	0	110.1	T6	T6-L8 PolarHBondContact O-N 2.63Å; T6-L8 VanDerWaalsContact O-N 3.12Å
9	D	37.2	Very low	36.7	Very low	141 Å²	141	146.3 Å²	146.3	75%	0.754	79%	0.794	S	S	*	*	S	Bend	trans	-154	25.3	-178.3	-123.7	-8.4	0	0	0	115.4
10	C	33.8	Very low	36.9	Very low	84 Å²	84	150.3 Å²	150.3	57%	0.568	80%	0.797	S	S	*	*	S	Bend	trans	-128.6	-17.7	177.7	-75.9	0	0	0	0	115.3	L12 L13	C10-L12 VanDerWaalsContact C-N 3.34Å; C10-L12 PolarHBondContact O-N 3.42Å; C10-L13 PolarHBondContact O-N 2.95Å
11	D	33.4	Very low	37.1	Very low	126 Å²	126	149 Å²	149	67%	0.674	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-16.2	-177.6	-75.9	-21.7	0	0	0	114	Y15	D11-Y15 WeakPolarHBondContact O-CD2 3.49Å
12	L	45.4	Very low	37.8	Very low	147 Å²	147	142.1 Å²	142.1	77%	0.77	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-17	173.5	-96.7	151.2	0	0	0	113.6	C10	C10-L12 VanDerWaalsContact C-N 3.34Å; C10-L12 PolarHBondContact O-N 3.42Å
13	L	41.6	Very low	38.7	Very low	147 Å²	147	144.9 Å²	144.9	77%	0.77	76%	0.763	S	S	*	*	S	Bend	trans	-100.5	-8.6	-173.8	-70.9	172.4	0	0	0	114.3	C10	C10-L13 PolarHBondContact O-N 2.95Å
14	L	37	Very low	40.3	Very low	136 Å²	136	143 Å²	143	71%	0.712	75%	0.746	S	S	*	*			trans	-101.9	-3.2	-172.7	-73.9	171.6	0	0	0	115.6	G16	L14-G16 PolarHBondContact O-N 3.34Å
15	Y	41.4	Very low	42.2	Very low	206 Å²	206	139.4 Å²	139.4	81%	0.808	72%	0.719	S	S	*	*			trans	-90	91.2	179.2	-72.8	-78	0	0	0	112	D11	D11-Y15 WeakPolarHBondContact O-CD2 3.49Å
16	G	34.6	Very low	44.3	Very low	64 Å²	64	137.4 Å²	137.4	66%	0.66	71%	0.705	S	S	*	*			trans	-57.7	165.7	174.1	0	0	0	0	0	114.5	L14 G18	L14-G16 PolarHBondContact O-N 3.34Å; G16-G18 VanDerWaalsContact C-N 3.35Å; G16-G18 PolarHBondContact O-N 2.86Å
17	R	41.7	Very low	46.5	Very low	271 Å²	271	131.7 Å²	131.7	100%	1.023	67%	0.669	S	S	*	*	S	Bend	trans	-47.1	88.1	175.7	-70.2	178	174.5	164.2	-1.7	112.4
18	G	31.9	Very low	48.7	Very low	57 Å²	57	130.5 Å²	130.5	59%	0.588	66%	0.658	S	S	*	*			trans	-156.6	115.9	175.3	0	0	0	0	0	109.1	G16 R20	G16-G18 VanDerWaalsContact C-N 3.35Å; G16-G18 PolarHBondContact O-N 2.86Å; G18-R20 PolarHBondContact O-N 2.97Å
19	H	44.9	Very low	51	Low	204 Å²	204	128.5 Å²	128.5	94%	0.944	65%	0.649	S	S	*	*			trans	-50.4	100	172.5	-82	16.1	0	0	0	111.4
20	R	39.7	Very low	53.3	Low	227 Å²	227	123.3 Å²	123.3	86%	0.857	62%	0.622	S	S	*	*			trans	-141.3	133.3	161	-70.9	-170.2	173.4	173.7	-2.5	108.4	G18 L22	G18-R20 PolarHBondContact O-N 2.97Å; R20-L22 PolarHBondContact O-N 3.22Å
21	T	41.4	Very low	55.9	Low	122 Å²	122	122.3 Å²	122.3	75%	0.748	62%	0.616	S	S	*	*			trans	-14.5	105.5	171.9	21.7	0	0	0	0	114.2	D23	T21-D23 PolarHBondContact O-N 3.42Å; T21-D23 VanDerWaalsContact O-N 3.08Å
22	L	47.6	Very low	58.6	Low	106 Å²	106	119.8 Å²	119.8	56%	0.555	60%	0.603	S	S	*	*			trans	-62.4	108.8	166.8	-64.8	157.3	0	0	0	106.9	R20 R24 G94	R20-L22 PolarHBondContact O-N 3.22Å; L22-R24 PolarHBondContact O-N 2.65Å; L22-G94 WeakPolarHBondContact CD1-O 3.34Å
23	D	49.9	Very low	60.6	Low	161 Å²	161	120.6 Å²	120.6	86%	0.861	60%	0.602	S	S	*	*			trans	-55.4	105.7	149.9	-80.6	-34.3	0	0	0	105	T21 F25	T21-D23 PolarHBondContact O-N 3.42Å; T21-D23 VanDerWaalsContact O-N 3.08Å; D23-F25 PolarHBondContact O-N 3.01Å
24	R	64.9	Low	62.8	Low	119 Å²	119	117.1 Å²	117.1	45%	0.449	58%	0.579	S	S	.	*			trans	-60	124.8	-176.9	-69.6	175	173.8	-167.7	-12	106.3	L22 K26 A66	L22-R24 PolarHBondContact O-N 2.65Å; R24-K26 WeakPolarHBondContact O-CG 3.48Å; R24-K26 PolarHBondContact O-N 2.82Å; R24-K26 VanDerWaalsContact O-N 3.11Å; R24-A66 PolarHBondContact NH1-O 2.7Å; R24-A66 PolarHBondContact NH2-O 2.96Å
25	F	72.1	Confident	65.2	Low	30 Å²	30	110.6 Å²	110.6	13%	0.132	55%	0.545	C	S	.	.			trans	-40.4	119.5	171.3	178	-86.4	0	0	0	109.6	D23 L27 V30 Y34 L35 Y39 L74	D23-F25 PolarHBondContact O-N 3.01Å; F25-L27 HydrophobicContact CE1-CD2 4.26Å; F25-V30 HydrophobicContact CE1-CG2 4.32Å; F25-V30 HydrophobicContact CE2-CG1 3.66Å; F25-V30 HydrophobicContact CE2-CG2 4.23Å; F25-V30 HydrophobicContact CZ-CB 4.4Å; F25-V30 HydrophobicContact CZ-CG1 3.95Å; F25-V30 HydrophobicContact CZ-CG2 3.62Å; F25-Y34 AromaticContact CE2-CE1 3.75Å; F25-Y34 HydrophobicContact CE2-CE1 3.75Å; F25-Y34 HydrophobicContact CZ-CD1 4.48Å; F25-Y34 AromaticContact CZ-CE1 3.9Å; F25-Y34 HydrophobicContact CZ-CE1 3.9Å; F25-L35 HydrophobicContact CE1-CD2 4.36Å; F25-L35 HydrophobicContact CZ-CD2 4.07Å; F25-Y39 HydrophobicContact CE1-CE2 4.29Å; F25-Y39 AromaticContact CZ-CE2 3.91Å; F25-Y39 HydrophobicContact CZ-CE2 3.91Å; F25-L74 HydrophobicContact CD1-CD1 3.44Å; F25-L74 VanDerWaalsContact CD1-CD1 3.44Å; F25-L74 HydrophobicContact CE1-CD1 3.51Å; F25-L74 HydrophobicContact CE1-CD2 4.46Å
26	K	78.8	Confident	67.5	Low	123 Å²	123	105.2 Å²	105.2	54%	0.535	53%	0.529	S	S	.	.			trans	-105.3	134.3	174.1	-56.6	-178.1	-175.4	165.4	0	108.7	R24 D28 D29	R24-K26 WeakPolarHBondContact O-CG 3.48Å; R24-K26 PolarHBondContact O-N 2.82Å; R24-K26 VanDerWaalsContact O-N 3.11Å; K26-D28 PolarHBondContact O-N 3.3Å; K26-D29 HydrophobicContact CB-CB 4.41Å; K26-D29 WeakPolarHBondContact CB-OD2 3.45Å; K26-D29 PolarHBondContact O-N 2.71Å; K26-D29 VanDerWaalsContact O-N 3.08Å
27	L	83.2	Confident	69.9	Low	1 Å²	1	107 Å²	107	1%	0.005	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-55.7	-32.4	175.2	-78.1	169.3	0	0	0	113.9	F25 D29 L35 R43 I46 Y47 E70 L74	F25-L27 HydrophobicContact CE1-CD2 4.26Å; L27-D29 VanDerWaalsContact C-N 3.27Å; L27-D29 PolarHBondContact O-N 3.07Å; L27-L35 HydrophobicContact CD2-CD1 3.96Å; L27-L35 HydrophobicContact CD2-CD2 3.73Å; L27-R43 HydrophobicContact CB-CG 4.16Å; L27-R43 PolarHBondContact O-NE 2.97Å; L27-R43 PolarHBondContact O-NH2 3.37Å; L27-I46 HydrophobicContact CD1-CB 4.33Å; L27-I46 HydrophobicContact CD1-CG2 3.73Å; L27-I46 HydrophobicContact CD2-CB 4.45Å; L27-I46 HydrophobicContact CD2-CD1 3.96Å; L27-I46 HydrophobicContact CD2-CG2 4.11Å; L27-Y47 HydrophobicContact CB-CE1 4.28Å; L27-Y47 HydrophobicContact CD1-CD1 3.87Å; L27-Y47 HydrophobicContact CD1-CE1 3.52Å; L27-E70 HydrophobicContact CD1-CG 3.78Å; L27-E70 WeakPolarHBondContact CD1-OE1 3.42Å; L27-E70 HydrophobicContact CG-CG 4.25Å; L27-E70 WeakPolarHBondContact CG-OE1 3.28Å; L27-E70 PolarHBondContact N-OE1 3.31Å; L27-L74 HydrophobicContact CD2-CD1 4.39Å; L27-L74 HydrophobicContact CD2-CD2 4.05Å
28	D	85.1	Confident	71.9	Confident	107 Å²	107	96.2 Å²	96.2	57%	0.572	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-72.5	-19.1	-179.6	-66.7	-42.5	0	0	0	113.5	K26 Y47	K26-D28 PolarHBondContact O-N 3.3Å; D28-Y47 PolarHBondContact OD1-OH 3.06Å; D28-Y47 PolarHBondContact OD2-OH 2.88Å
29	D	85.6	Confident	74.6	Confident	120 Å²	120	93.5 Å²	93.5	64%	0.642	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-86.4	-6.5	-175.6	-63.5	-20.1	0	0	0	112.7	K26 L27	K26-D29 HydrophobicContact CB-CB 4.41Å; K26-D29 WeakPolarHBondContact CB-OD2 3.45Å; K26-D29 PolarHBondContact O-N 2.71Å; K26-D29 VanDerWaalsContact O-N 3.08Å; L27-D29 VanDerWaalsContact C-N 3.27Å; L27-D29 PolarHBondContact O-N 3.07Å
30	V	86.1	Confident	76.7	Confident	31 Å²	31	84.8 Å²	84.8	19%	0.188	43%	0.43	C	S	.	.	S	Bend	trans	-125.2	153.6	-177.2	-64.3	0	0	0	0	112.7	F25 Y34 L35 R43	F25-V30 HydrophobicContact CE1-CG2 4.32Å; F25-V30 HydrophobicContact CE2-CG1 3.66Å; F25-V30 HydrophobicContact CE2-CG2 4.23Å; F25-V30 HydrophobicContact CZ-CB 4.4Å; F25-V30 HydrophobicContact CZ-CG1 3.95Å; F25-V30 HydrophobicContact CZ-CG2 3.62Å; V30-Y34 HydrophobicContact CB-CD1 3.78Å; V30-Y34 HydrophobicContact CB-CE1 4.4Å; V30-Y34 HydrophobicContact CB-CG 4.3Å; V30-Y34 HydrophobicContact CG1-CD1 3.97Å; V30-Y34 HydrophobicContact CG1-CE1 4.13Å; V30-Y34 HydrophobicContact CG2-CD1 4Å; V30-L35 HydrophobicContact CG2-CD1 4.22Å; V30-L35 HydrophobicContact CG2-CD2 3.62Å; V30-L35 HydrophobicContact CG2-CG 3.81Å; V30-R43 PolarHBondContact O-NH2 3.41Å
31	S	88.7	Confident	79.2	Confident	63 Å²	63	74 Å²	74	44%	0.441	39%	0.389	S	S	.	.			trans	-73.6	157	177.8	66.4	0	0	0	0	113.1	E33 Y34 L35	S31-E33 PolarHBondContact O-N 2.79Å; S31-Y34 WeakPolarHBondContact O-CB 3.33Å; S31-Y34 PolarHBondContact O-N 2.92Å; S31-Y34 VanDerWaalsContact O-N 3.17Å; S31-Y34 PolarHBondContact OG-N 3.38Å; S31-L35 WeakPolarHBondContact O-CG 3.34Å; S31-L35 PolarHBondContact O-N 3.46Å; S31-L35 VanDerWaalsContact O-N 3.08Å
32	D	88.4	Confident	81.7	Confident	74 Å²	74	69.9 Å²	69.9	40%	0.396	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-32	171	-84.1	-31.7	0	0	0	112.1	Y34 L35 M36 R43	D32-Y34 VanDerWaalsContact C-N 3.34Å; D32-Y34 PolarHBondContact O-N 2.92Å; D32-L35 PolarHBondContact O-N 3.47Å; D32-M36 WeakPolarHBondContact O-CB 3.23Å; D32-M36 VanDerWaalsContact O-CG 3.23Å; D32-M36 WeakPolarHBondContact O-CG 3.29Å; D32-M36 PolarHBondContact O-N 3.36Å; D32-R43 WeakPolarHBondContact OD1-CB 3.31Å; D32-R43 PolarHBondContact OD1-N 3.45Å
33	E	88.1	Confident	83.8	Confident	164 Å²	164	67.6 Å²	67.6	77%	0.766	35%	0.349	S	S	*	.	H	α-helix	trans	-61.3	-42.8	174.3	-174.2	178.1	-173.5	0	0	111.6	S31 M36 S37	S31-E33 PolarHBondContact O-N 2.79Å; E33-M36 PolarHBondContact O-N 2.95Å; E33-S37 WeakPolarHBondContact O-CB 3.37Å; E33-S37 PolarHBondContact O-N 2.71Å
34	Y	87.3	Confident	85.9	Confident	73 Å²	73	67.6 Å²	67.6	29%	0.286	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-44.2	173.7	176.8	-89.4	0	0	0	111.3	F25 V30 S31 D32 S37 M38 Y39	F25-Y34 AromaticContact CE2-CE1 3.75Å; F25-Y34 HydrophobicContact CE2-CE1 3.75Å; F25-Y34 HydrophobicContact CZ-CD1 4.48Å; F25-Y34 AromaticContact CZ-CE1 3.9Å; F25-Y34 HydrophobicContact CZ-CE1 3.9Å; V30-Y34 HydrophobicContact CB-CD1 3.78Å; V30-Y34 HydrophobicContact CB-CE1 4.4Å; V30-Y34 HydrophobicContact CB-CG 4.3Å; V30-Y34 HydrophobicContact CG1-CD1 3.97Å; V30-Y34 HydrophobicContact CG1-CE1 4.13Å; V30-Y34 HydrophobicContact CG2-CD1 4Å; S31-Y34 WeakPolarHBondContact O-CB 3.33Å; S31-Y34 PolarHBondContact O-N 2.92Å; S31-Y34 VanDerWaalsContact O-N 3.17Å; S31-Y34 PolarHBondContact OG-N 3.38Å; D32-Y34 VanDerWaalsContact C-N 3.34Å; D32-Y34 PolarHBondContact O-N 2.92Å; Y34-S37 PolarHBondContact O-N 2.89Å; Y34-M38 HydrophobicContact CD1-CG 4.31Å; Y34-M38 HydrophobicContact CD2-CG 4.15Å; Y34-M38 HydrophobicContact CE1-CB 4.32Å; Y34-M38 HydrophobicContact CE1-CG 3.93Å; Y34-M38 HydrophobicContact CE2-CG 3.77Å; Y34-M38 HydrophobicContact CG-CG 4.42Å; Y34-M38 WeakPolarHBondContact O-CB 3.36Å; Y34-M38 WeakPolarHBondContact O-CG 3.46Å; Y34-M38 PolarHBondContact O-N 3.48Å; Y34-Y39 HydrophobicContact CE1-CE2 4.23Å
35	L	88.7	Confident	87.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-41.7	179.6	-66	174.1	0	0	0	112.2	F25 L27 V30 S31 D32 M38 Y39 G40 F41 R43 I46	F25-L35 HydrophobicContact CE1-CD2 4.36Å; F25-L35 HydrophobicContact CZ-CD2 4.07Å; L27-L35 HydrophobicContact CD2-CD1 3.96Å; L27-L35 HydrophobicContact CD2-CD2 3.73Å; V30-L35 HydrophobicContact CG2-CD1 4.22Å; V30-L35 HydrophobicContact CG2-CD2 3.62Å; V30-L35 HydrophobicContact CG2-CG 3.81Å; S31-L35 WeakPolarHBondContact O-CG 3.34Å; S31-L35 PolarHBondContact O-N 3.46Å; S31-L35 VanDerWaalsContact O-N 3.08Å; D32-L35 PolarHBondContact O-N 3.47Å; L35-M38 PolarHBondContact O-N 3.1Å; L35-Y39 HydrophobicContact CD2-CD2 3.63Å; L35-Y39 HydrophobicContact CD2-CE2 3.79Å; L35-Y39 CarbonylContact O-C 3.56Å; L35-Y39 WeakPolarHBondContact O-CA 3.41Å; L35-Y39 WeakPolarHBondContact O-CB 3.11Å; L35-Y39 PolarHBondContact O-N 3.36Å; L35-G40 PolarHBondContact O-N 3.29Å; L35-G40 VanDerWaalsContact O-N 3.15Å; L35-F41 CarbonylContact C-O 3.58Å; L35-F41 WeakPolarHBondContact CB-O 3.36Å; L35-R43 HydrophobicContact CD1-CB 3.64Å; L35-R43 HydrophobicContact CD1-CG 4.16Å; L35-I46 HydrophobicContact CB-CD1 4.43Å; L35-I46 HydrophobicContact CD1-CD1 4.35Å; L35-I46 HydrophobicContact CD2-CD1 4.19Å
36	M	89	Confident	88.5	Confident	92 Å²	92	60.7 Å²	60.7	45%	0.453	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-44	173.3	-72.4	-63.1	-64.3	0	0	111.2	D32 E33 G40 P42	D32-M36 WeakPolarHBondContact O-CB 3.23Å; D32-M36 VanDerWaalsContact O-CG 3.23Å; D32-M36 WeakPolarHBondContact O-CG 3.29Å; D32-M36 PolarHBondContact O-N 3.36Å; E33-M36 PolarHBondContact O-N 2.95Å; M36-G40 WeakPolarHBondContact O-CA 3.36Å; M36-G40 PolarHBondContact O-N 3.37Å; M36-P42 HydrophobicContact SD-CB 4.29Å; M36-P42 HydrophobicContact SD-CG 4.48Å; M36-P42 VanDerWaalsContact SD-N 3.42Å
37	S	85.4	Confident	89.3	Confident	101 Å²	101	58.8 Å²	58.8	71%	0.706	31%	0.307	S	S	*	.	H	α-helix	trans	-68.4	-36.1	179.5	-179.7	0	0	0	0	113.5	E33 Y34	E33-S37 WeakPolarHBondContact O-CB 3.37Å; E33-S37 PolarHBondContact O-N 2.71Å; Y34-S37 PolarHBondContact O-N 2.89Å
38	M	83.4	Confident	89.9	Confident	45 Å²	45	61.5 Å²	61.5	22%	0.222	32%	0.318	C	S	.	.	H	α-helix	trans	-95.6	-37.6	-172.2	-70.9	-61.8	-59.6	0	0	113.2	Y34 L35 M89	Y34-M38 HydrophobicContact CD1-CG 4.31Å; Y34-M38 HydrophobicContact CD2-CG 4.15Å; Y34-M38 HydrophobicContact CE1-CB 4.32Å; Y34-M38 HydrophobicContact CE1-CG 3.93Å; Y34-M38 HydrophobicContact CE2-CG 3.77Å; Y34-M38 HydrophobicContact CG-CG 4.42Å; Y34-M38 WeakPolarHBondContact O-CB 3.36Å; Y34-M38 WeakPolarHBondContact O-CG 3.46Å; Y34-M38 PolarHBondContact O-N 3.48Å; L35-M38 PolarHBondContact O-N 3.1Å; M38-M89 HydrophobicContact CE-CG 3.37Å; M38-M89 HydrophobicContact CE-SD 4.22Å; M38-M89 VanDerWaalsContact O-SD 3.4Å
39	Y	88.2	Confident	90.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-117.6	-11.8	-173.4	-53.7	-69.5	0	0	0	113.1	F25 Y34 L35 F41 L74 T81 M89 I93	F25-Y39 HydrophobicContact CE1-CE2 4.29Å; F25-Y39 AromaticContact CZ-CE2 3.91Å; F25-Y39 HydrophobicContact CZ-CE2 3.91Å; Y34-Y39 HydrophobicContact CE1-CE2 4.23Å; L35-Y39 HydrophobicContact CD2-CD2 3.63Å; L35-Y39 HydrophobicContact CD2-CE2 3.79Å; L35-Y39 CarbonylContact O-C 3.56Å; L35-Y39 WeakPolarHBondContact O-CA 3.41Å; L35-Y39 WeakPolarHBondContact O-CB 3.11Å; L35-Y39 PolarHBondContact O-N 3.36Å; Y39-F41 VanDerWaalsContact C-N 3.29Å; Y39-F41 WeakPolarHBondContact O-CD2 3.49Å; Y39-F41 PolarHBondContact O-N 3.48Å; Y39-L74 HydrophobicContact CD1-CB 4.46Å; Y39-L74 HydrophobicContact CD1-CD2 4.02Å; Y39-L74 WeakPolarHBondContact CD1-O 3.39Å; Y39-L74 HydrophobicContact CD2-CD2 3.82Å; Y39-L74 HydrophobicContact CE1-CB 4.02Å; Y39-L74 HydrophobicContact CE1-CD2 4.01Å; Y39-L74 WeakPolarHBondContact CE1-O 3.27Å; Y39-L74 HydrophobicContact CE2-CD2 3.8Å; Y39-L74 HydrophobicContact CG-CD2 3.92Å; Y39-T81 WeakPolarHBondContact O-CG2 3.45Å; Y39-M89 HydrophobicContact CD1-SD 4.15Å; Y39-M89 HydrophobicContact CE1-CG 4.42Å; Y39-M89 HydrophobicContact CE1-SD 3.95Å; Y39-I93 HydrophobicContact CE1-CD1 4.08Å
40	G	89.3	Confident	91	Very high	21 Å²	21	52.5 Å²	52.5	22%	0.216	27%	0.27	C	S	.	.	S	Bend	trans	80.2	2.9	178	0	0	0	0	0	115.3	L35 M36	L35-G40 PolarHBondContact O-N 3.29Å; L35-G40 VanDerWaalsContact O-N 3.15Å; M36-G40 WeakPolarHBondContact O-CA 3.36Å; M36-G40 PolarHBondContact O-N 3.37Å
41	F	92.4	Very high	91.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.298	C	S	.	.	S	Bend	trans	-139.4	146.3	-173.2	-63.2	-76.9	0	0	0	112.4	L35 Y39 F45 I46 L77 T81 R270 F271 M307	L35-F41 CarbonylContact C-O 3.58Å; L35-F41 WeakPolarHBondContact CB-O 3.36Å; Y39-F41 VanDerWaalsContact C-N 3.29Å; Y39-F41 WeakPolarHBondContact O-CD2 3.49Å; Y39-F41 PolarHBondContact O-N 3.48Å; F41-F45 HydrophobicContact CB-CB 4.42Å; F41-F45 HydrophobicContact CB-CD1 3.66Å; F41-F45 HydrophobicContact CB-CE1 4.36Å; F41-F45 HydrophobicContact CB-CG 4.39Å; F41-F45 AromaticContact CD1-CD1 3.38Å; F41-F45 HydrophobicContact CD1-CD1 3.38Å; F41-F45 AromaticContact CD1-CE1 3.34Å; F41-F45 HydrophobicContact CD1-CE1 3.34Å; F41-F45 HydrophobicContact CD1-CG 4.14Å; F41-F45 HydrophobicContact CD1-CZ 4.09Å; F41-F45 HydrophobicContact CD2-CD1 4.45Å; F41-F45 HydrophobicContact CD2-CE1 4.36Å; F41-F45 HydrophobicContact CE1-CD1 4.13Å; F41-F45 AromaticContact CE1-CE1 3.6Å; F41-F45 HydrophobicContact CE1-CE1 3.6Å; F41-F45 HydrophobicContact CE1-CZ 4.05Å; F41-F45 AromaticContact CG-CD1 3.57Å; F41-F45 HydrophobicContact CG-CD1 3.57Å; F41-F45 AromaticContact CG-CE1 3.77Å; F41-F45 HydrophobicContact CG-CE1 3.77Å; F41-F45 HydrophobicContact CZ-CE1 4.23Å; F41-I46 HydrophobicContact CB-CG1 4.2Å; F41-L77 HydrophobicContact CD2-CD1 4.14Å; F41-L77 HydrophobicContact CD2-CD2 3.74Å; F41-L77 HydrophobicContact CD2-CG 4.35Å; F41-L77 HydrophobicContact CE2-CD2 3.68Å; F41-T81 HydrophobicContact CE2-CG2 4.04Å; F41-R270 HydrophobicContact CZ-CG 4.09Å; F41-F271 HydrophobicContact CE2-CE1 4.04Å; F41-F271 AromaticContact CZ-CE1 3.72Å; F41-F271 HydrophobicContact CZ-CE1 3.72Å; F41-F271 AromaticContact CZ-CZ 3.9Å; F41-F271 HydrophobicContact CZ-CZ 3.9Å; F41-M307 HydrophobicContact CD1-CE 3.74Å; F41-M307 HydrophobicContact CD1-SD 3.78Å; F41-M307 HydrophobicContact CE1-CE 4.12Å; F41-M307 HydrophobicContact CE1-SD 4.25Å
42	P	92.8	Very high	91.8	Very high	36 Å²	36	57.1 Å²	57.1	23%	0.234	28%	0.284	C	S	.	.			trans	-75	160.7	178.6	32	-35.2	0	0	0	111.3	M36 Q44 F45 I46	M36-P42 HydrophobicContact SD-CB 4.29Å; M36-P42 HydrophobicContact SD-CG 4.48Å; M36-P42 VanDerWaalsContact SD-N 3.42Å; P42-Q44 VanDerWaalsContact C-N 3.3Å; P42-Q44 PolarHBondContact O-N 3.26Å; P42-F45 HydrophobicContact CG-CB 3.93Å; P42-F45 WeakPolarHBondContact O-CB 3.4Å; P42-F45 PolarHBondContact O-N 3.34Å; P42-F45 VanDerWaalsContact O-N 3.08Å; P42-I46 PolarHBondContact O-N 3.45Å
43	R	93.6	Very high	92.2	Very high	59 Å²	59	53.7 Å²	53.7	22%	0.223	27%	0.265	C	S	.	.	H	α-helix	trans	-53.4	-44.9	-177.1	-170.4	-177.3	-59.5	131.1	-11.3	113.1	L27 V30 D32 L35 F45 I46 Y47	L27-R43 HydrophobicContact CB-CG 4.16Å; L27-R43 PolarHBondContact O-NE 2.97Å; L27-R43 PolarHBondContact O-NH2 3.37Å; V30-R43 PolarHBondContact O-NH2 3.41Å; D32-R43 WeakPolarHBondContact OD1-CB 3.31Å; D32-R43 PolarHBondContact OD1-N 3.45Å; L35-R43 HydrophobicContact CD1-CB 3.64Å; L35-R43 HydrophobicContact CD1-CG 4.16Å; R43-F45 VanDerWaalsContact C-N 3.28Å; R43-F45 PolarHBondContact O-N 2.91Å; R43-I46 PolarHBondContact O-N 2.96Å; R43-I46 VanDerWaalsContact O-N 3.13Å; R43-Y47 VanDerWaalsContact CD-CE2 3.48Å; R43-Y47 HydrophobicContact CG-CD2 3.78Å; R43-Y47 HydrophobicContact CG-CE2 3.43Å; R43-Y47 VanDerWaalsContact CG-CE2 3.43Å; R43-Y47 PolarHBondContact O-N 3.4Å
44	Q	93.6	Very high	92.4	Very high	161 Å²	161	46.4 Å²	46.4	75%	0.752	23%	0.234	S	C	*	.	H	α-helix	trans	-59.4	-40.1	-178.5	-173	-179.9	10.4	0	0	112	P42 Y47 Y48	P42-Q44 VanDerWaalsContact C-N 3.3Å; P42-Q44 PolarHBondContact O-N 3.26Å; Q44-Y47 PolarHBondContact O-N 3.45Å; Q44-Y48 PolarHBondContact O-N 3.1Å
45	F	95.1	Very high	92.6	Very high	4 Å²	4	47 Å²	47	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-40.6	176.9	-174.2	-99.1	0	0	0	111.7	F41 P42 R43 Y47 Y48 L49 L298 I301 H305 M307	F41-F45 HydrophobicContact CB-CB 4.42Å; F41-F45 HydrophobicContact CB-CD1 3.66Å; F41-F45 HydrophobicContact CB-CE1 4.36Å; F41-F45 HydrophobicContact CB-CG 4.39Å; F41-F45 AromaticContact CD1-CD1 3.38Å; F41-F45 HydrophobicContact CD1-CD1 3.38Å; F41-F45 AromaticContact CD1-CE1 3.34Å; F41-F45 HydrophobicContact CD1-CE1 3.34Å; F41-F45 HydrophobicContact CD1-CG 4.14Å; F41-F45 HydrophobicContact CD1-CZ 4.09Å; F41-F45 HydrophobicContact CD2-CD1 4.45Å; F41-F45 HydrophobicContact CD2-CE1 4.36Å; F41-F45 HydrophobicContact CE1-CD1 4.13Å; F41-F45 AromaticContact CE1-CE1 3.6Å; F41-F45 HydrophobicContact CE1-CE1 3.6Å; F41-F45 HydrophobicContact CE1-CZ 4.05Å; F41-F45 AromaticContact CG-CD1 3.57Å; F41-F45 HydrophobicContact CG-CD1 3.57Å; F41-F45 AromaticContact CG-CE1 3.77Å; F41-F45 HydrophobicContact CG-CE1 3.77Å; F41-F45 HydrophobicContact CZ-CE1 4.23Å; P42-F45 HydrophobicContact CG-CB 3.93Å; P42-F45 WeakPolarHBondContact O-CB 3.4Å; P42-F45 PolarHBondContact O-N 3.34Å; P42-F45 VanDerWaalsContact O-N 3.08Å; R43-F45 VanDerWaalsContact C-N 3.28Å; R43-F45 PolarHBondContact O-N 2.91Å; F45-Y47 VanDerWaalsContact C-N 3.35Å; F45-Y47 PolarHBondContact O-N 3.16Å; F45-Y48 WeakPolarHBondContact O-CB 3.5Å; F45-Y48 PolarHBondContact O-N 2.84Å; F45-L49 HydrophobicContact CD1-CD1 3.97Å; F45-L49 HydrophobicContact CD1-CG 4.26Å; F45-L49 HydrophobicContact CE1-CD1 3.62Å; F45-L49 HydrophobicContact CE1-CD2 4.4Å; F45-L49 HydrophobicContact CE1-CG 4.03Å; F45-L49 HydrophobicContact CZ-CD1 4.45Å; F45-L49 HydrophobicContact CZ-CD2 4.47Å; F45-L49 WeakPolarHBondContact O-CG 3.45Å; F45-L49 PolarHBondContact O-N 3.02Å; F45-L298 HydrophobicContact CE1-CD2 4.49Å; F45-I301 HydrophobicContact CE2-CB 4.29Å; F45-I301 HydrophobicContact CE2-CG2 3.62Å; F45-I301 HydrophobicContact CZ-CB 4.26Å; F45-I301 HydrophobicContact CZ-CG2 3.89Å; F45-H305 HydrophobicContact CD2-CB 4.11Å; F45-H305 AromaticContact CD2-CG 3.98Å; F45-H305 HydrophobicContact CE2-CB 4.41Å; F45-M307 HydrophobicContact CB-CE 4.09Å; F45-M307 HydrophobicContact CD1-CE 4.02Å; F45-M307 HydrophobicContact CD2-CE 3.12Å; F45-M307 HydrophobicContact CE1-CE 4.17Å; F45-M307 HydrophobicContact CE2-CE 3.29Å; F45-M307 HydrophobicContact CG-CE 3.48Å; F45-M307 VanDerWaalsContact CG-CE 3.48Å; F45-M307 HydrophobicContact CZ-CE 3.83Å
46	I	95.1	Very high	92.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-42.6	177.3	-59.2	169.3	0	0	0	110.3	L27 L35 F41 P42 R43 Y48 L49 V50 I73 L74 L77	L27-I46 HydrophobicContact CD1-CB 4.33Å; L27-I46 HydrophobicContact CD1-CG2 3.73Å; L27-I46 HydrophobicContact CD2-CB 4.45Å; L27-I46 HydrophobicContact CD2-CD1 3.96Å; L27-I46 HydrophobicContact CD2-CG2 4.11Å; L35-I46 HydrophobicContact CB-CD1 4.43Å; L35-I46 HydrophobicContact CD1-CD1 4.35Å; L35-I46 HydrophobicContact CD2-CD1 4.19Å; F41-I46 HydrophobicContact CB-CG1 4.2Å; P42-I46 PolarHBondContact O-N 3.45Å; R43-I46 PolarHBondContact O-N 2.96Å; R43-I46 VanDerWaalsContact O-N 3.13Å; I46-Y48 VanDerWaalsContact C-N 3.35Å; I46-Y48 PolarHBondContact O-N 2.78Å; I46-L49 PolarHBondContact O-N 3.33Å; I46-V50 WeakPolarHBondContact O-CG2 3.25Å; I46-V50 PolarHBondContact O-N 3.27Å; I46-I73 HydrophobicContact CG2-CG2 4.23Å; I46-L74 HydrophobicContact CD1-CD2 4.01Å; I46-L74 HydrophobicContact CG2-CD2 4.18Å; I46-L77 HydrophobicContact CG1-CD1 3.99Å
47	Y	95.6	Very high	92.9	Very high	83 Å²	83	46.5 Å²	46.5	33%	0.325	25%	0.253	S	S	.	.	H	α-helix	trans	-62.2	-40.9	174.6	-77.8	-45.8	0	0	0	112.9	L27 D28 R43 Q44 F45 L49 V50 E51	L27-Y47 HydrophobicContact CB-CE1 4.28Å; L27-Y47 HydrophobicContact CD1-CD1 3.87Å; L27-Y47 HydrophobicContact CD1-CE1 3.52Å; D28-Y47 PolarHBondContact OD1-OH 3.06Å; D28-Y47 PolarHBondContact OD2-OH 2.88Å; R43-Y47 VanDerWaalsContact CD-CE2 3.48Å; R43-Y47 HydrophobicContact CG-CD2 3.78Å; R43-Y47 HydrophobicContact CG-CE2 3.43Å; R43-Y47 VanDerWaalsContact CG-CE2 3.43Å; R43-Y47 PolarHBondContact O-N 3.4Å; Q44-Y47 PolarHBondContact O-N 3.45Å; F45-Y47 VanDerWaalsContact C-N 3.35Å; F45-Y47 PolarHBondContact O-N 3.16Å; Y47-L49 VanDerWaalsContact C-N 3.31Å; Y47-L49 PolarHBondContact O-N 3.3Å; Y47-V50 WeakPolarHBondContact O-CB 3.2Å; Y47-V50 PolarHBondContact O-N 3.46Å; Y47-V50 VanDerWaalsContact O-N 3.13Å; Y47-E51 PolarHBondContact O-N 3.46Å
48	Y	96.9	Very high	92.9	Very high	58 Å²	58	44.9 Å²	44.9	23%	0.227	24%	0.242	C	C	.	.	H	α-helix	trans	-57.2	-45.1	173.1	171	-92.1	0	0	0	111.6	Q44 F45 I46 V50 E51 L52 I301 H305	Q44-Y48 PolarHBondContact O-N 3.1Å; F45-Y48 WeakPolarHBondContact O-CB 3.5Å; F45-Y48 PolarHBondContact O-N 2.84Å; I46-Y48 VanDerWaalsContact C-N 3.35Å; I46-Y48 PolarHBondContact O-N 2.78Å; Y48-V50 VanDerWaalsContact C-N 3.31Å; Y48-V50 PolarHBondContact O-N 2.93Å; Y48-E51 PolarHBondContact O-N 2.9Å; Y48-L52 HydrophobicContact CE1-CB 4.36Å; Y48-L52 HydrophobicContact CE1-CD2 3.79Å; Y48-L52 WeakPolarHBondContact O-CB 3.28Å; Y48-L52 PolarHBondContact O-N 2.88Å; Y48-I301 HydrophobicContact CD1-CG2 3.95Å; Y48-I301 HydrophobicContact CE1-CG2 3.42Å; Y48-I301 VanDerWaalsContact CE1-CG2 3.42Å; Y48-H305 AromaticContact CD1-CE1 3.58Å; Y48-H305 AromaticContact CD1-NE2 3.68Å; Y48-H305 AromaticContact CD2-CE1 3.84Å; Y48-H305 AromaticContact CD2-NE2 3.38Å; Y48-H305 WeakPolarHBondContact CD2-NE2 3.41Å; Y48-H305 AromaticContact CE1-CE1 3.49Å; Y48-H305 VanDerWaalsContact CE1-CE1 3.49Å; Y48-H305 WeakPolarHBondContact CE1-CE1 3.45Å; Y48-H305 AromaticContact CE1-NE2 3.99Å; Y48-H305 AromaticContact CE2-CE1 3.72Å; Y48-H305 AromaticContact CE2-NE2 3.67Å; Y48-H305 AromaticContact CG-CE1 3.75Å; Y48-H305 AromaticContact CG-NE2 3.37Å; Y48-H305 AromaticContact CZ-CE1 3.54Å; Y48-H305 AromaticContact CZ-NE2 3.96Å
49	L	97	Very high	92.6	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-37.3	176	-67.6	179.9	0	0	0	112.4	F45 I46 Y47 E51 L52 L53 I73 L77 L298 I301	F45-L49 HydrophobicContact CD1-CD1 3.97Å; F45-L49 HydrophobicContact CD1-CG 4.26Å; F45-L49 HydrophobicContact CE1-CD1 3.62Å; F45-L49 HydrophobicContact CE1-CD2 4.4Å; F45-L49 HydrophobicContact CE1-CG 4.03Å; F45-L49 HydrophobicContact CZ-CD1 4.45Å; F45-L49 HydrophobicContact CZ-CD2 4.47Å; F45-L49 WeakPolarHBondContact O-CG 3.45Å; F45-L49 PolarHBondContact O-N 3.02Å; I46-L49 PolarHBondContact O-N 3.33Å; Y47-L49 VanDerWaalsContact C-N 3.31Å; Y47-L49 PolarHBondContact O-N 3.3Å; L49-E51 VanDerWaalsContact C-N 3.33Å; L49-L52 PolarHBondContact O-N 3.05Å; L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 WeakPolarHBondContact O-CG 3.3Å; L49-L53 PolarHBondContact O-N 3.32Å; L49-I73 HydrophobicContact CB-CD1 4.2Å; L49-I73 HydrophobicContact CB-CG2 4.17Å; L49-I73 HydrophobicContact CD1-CG2 4.18Å; L49-L77 HydrophobicContact CD1-CD1 4.12Å; L49-L77 HydrophobicContact CD1-CD2 4Å; L49-L298 HydrophobicContact CD1-CD2 3.77Å; L49-L298 HydrophobicContact CD2-CD2 3.81Å; L49-L298 HydrophobicContact CG-CD2 4.46Å; L49-I301 HydrophobicContact CD2-CD1 4.26Å
50	V	95.4	Very high	91.4	Very high	34 Å²	34	56.8 Å²	56.8	21%	0.206	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-41.2	175.6	173	0	0	0	0	111	I46 Y47 Y48 G54 E70 I73	I46-V50 WeakPolarHBondContact O-CG2 3.25Å; I46-V50 PolarHBondContact O-N 3.27Å; Y47-V50 WeakPolarHBondContact O-CB 3.2Å; Y47-V50 PolarHBondContact O-N 3.46Å; Y47-V50 VanDerWaalsContact O-N 3.13Å; Y48-V50 VanDerWaalsContact C-N 3.31Å; Y48-V50 PolarHBondContact O-N 2.93Å; V50-G54 WeakPolarHBondContact O-CA 3.5Å; V50-G54 PolarHBondContact O-N 3.47Å; V50-E70 HydrophobicContact CG2-CB 4.01Å; V50-E70 HydrophobicContact CG2-CG 4.38Å; V50-I73 VanDerWaalsContact CA-CD1 3.48Å; V50-I73 HydrophobicContact CB-CD1 4.16Å; V50-I73 HydrophobicContact CG2-CD1 3.62Å
51	E	96.5	Very high	90.3	Very high	166 Å²	166	58.7 Å²	58.7	78%	0.776	31%	0.311	S	S	*	.	H	α-helix	trans	-66.8	-47	175.9	-172.9	176	178.1	0	0	111.4	Y47 Y48 L49 L53	Y47-E51 PolarHBondContact O-N 3.46Å; Y48-E51 PolarHBondContact O-N 2.9Å; L49-E51 VanDerWaalsContact C-N 3.33Å; E51-L53 PolarHBondContact O-N 3.41Å
52	L	96.8	Very high	88.6	Confident	26 Å²	26	68 Å²	68	14%	0.136	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-40.3	-177	-179.7	65.7	0	0	0	113.5	Y48 L49 R114 F118 I301	Y48-L52 HydrophobicContact CE1-CB 4.36Å; Y48-L52 HydrophobicContact CE1-CD2 3.79Å; Y48-L52 WeakPolarHBondContact O-CB 3.28Å; Y48-L52 PolarHBondContact O-N 2.88Å; L49-L52 PolarHBondContact O-N 3.05Å; L52-R114 PolarHBondContact O-NH2 2.96Å; L52-F118 HydrophobicContact CD1-CZ 4.39Å; L52-F118 HydrophobicContact CD2-CE2 3.87Å; L52-F118 HydrophobicContact CD2-CZ 3.78Å; L52-I301 HydrophobicContact CD2-CD1 4.05Å
53	L	96.5	Very high	87	Confident	1 Å²	1	76 Å²	76	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-107.1	-6.7	-172.7	-52.9	179.3	0	0	0	113.2	L49 E51 A55 N56 L57 V107 A110 L111 R114	L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 WeakPolarHBondContact O-CG 3.3Å; L49-L53 PolarHBondContact O-N 3.32Å; E51-L53 PolarHBondContact O-N 3.41Å; L53-A55 VanDerWaalsContact C-N 3.29Å; L53-A55 PolarHBondContact O-N 2.98Å; L53-N56 PolarHBondContact O-N 3.28Å; L53-N56 VanDerWaalsContact O-N 3.1Å; L53-L57 HydrophobicContact CB-CD1 3.84Å; L53-L57 HydrophobicContact CB-CG 4.26Å; L53-L57 WeakPolarHBondContact O-CG 3.25Å; L53-L57 PolarHBondContact O-N 2.93Å; L53-V107 HydrophobicContact CD1-CG1 4.39Å; L53-A110 HydrophobicContact CD2-CB 4.11Å; L53-L111 HydrophobicContact CD1-CD2 3.89Å; L53-L111 HydrophobicContact CD1-CG 3.99Å; L53-L111 HydrophobicContact CD2-CD2 4.49Å; L53-R114 HydrophobicContact CD2-CG 4.2Å
54	G	92.8	Very high	85.1	Confident	11 Å²	11	78.6 Å²	78.6	11%	0.113	41%	0.406	C	S	.	.	H	α-helix	trans	-57.1	-39.2	-171.1	0	0	0	0	0	113.8	V50 L57 S58	V50-G54 WeakPolarHBondContact O-CA 3.5Å; V50-G54 PolarHBondContact O-N 3.47Å; G54-L57 PolarHBondContact O-N 2.99Å; G54-S58 WeakPolarHBondContact O-CB 3.4Å; G54-S58 PolarHBondContact O-N 2.97Å; G54-S58 PolarHBondContact O-OG 2.97Å
55	A	91.2	Very high	83.7	Confident	87 Å²	87	80.8 Å²	80.8	72%	0.719	41%	0.408	S	S	*	.	H	α-helix	trans	-65.3	-42	178.1	0	0	0	0	0	112.5	L53	L53-A55 VanDerWaalsContact C-N 3.29Å; L53-A55 PolarHBondContact O-N 2.98Å
56	N	91.6	Very high	82.8	Confident	75 Å²	75	82.6 Å²	82.6	40%	0.401	42%	0.424	S	S	.	.	H	α-helix	trans	-69.7	-35	178.2	-58.8	74.2	0	0	0	111.8	L53 A110 E113	L53-N56 PolarHBondContact O-N 3.28Å; L53-N56 VanDerWaalsContact O-N 3.1Å; N56-A110 HydrophobicContact CB-CB 4.03Å; N56-E113 PolarHBondContact ND2-OE2 3.49Å
57	L	91.1	Very high	82.3	Confident	5 Å²	5	85.1 Å²	85.1	3%	0.026	44%	0.437	C	S	.	.	H	α-helix	trans	-86.8	-19	-176.2	-63.7	176.2	0	0	0	113.7	L53 G54 P69 Q72 I73 N106 V107 A110	L53-L57 HydrophobicContact CB-CD1 3.84Å; L53-L57 HydrophobicContact CB-CG 4.26Å; L53-L57 WeakPolarHBondContact O-CG 3.25Å; L53-L57 PolarHBondContact O-N 2.93Å; G54-L57 PolarHBondContact O-N 2.99Å; L57-P69 HydrophobicContact CB-CB 3.9Å; L57-P69 HydrophobicContact CB-CG 4.12Å; L57-P69 HydrophobicContact CD1-CB 4.27Å; L57-Q72 PolarHBondContact O-NE2 2.88Å; L57-I73 HydrophobicContact CD1-CD1 3.85Å; L57-I73 HydrophobicContact CD1-CG1 3.7Å; L57-N106 HydrophobicContact CD2-CB 3.87Å; L57-V107 HydrophobicContact CD1-CG2 3.95Å; L57-V107 HydrophobicContact CD2-CG2 3.89Å; L57-A110 HydrophobicContact CD2-CB 4.39Å
58	S	87	Confident	82	Confident	67 Å²	67	82.5 Å²	82.5	47%	0.469	43%	0.431	S	S	.	.			trans	-73.6	127.3	178.6	-69.1	0	0	0	0	110.8	G54 P69	G54-S58 WeakPolarHBondContact O-CB 3.4Å; G54-S58 PolarHBondContact O-N 2.97Å; G54-S58 PolarHBondContact O-OG 2.97Å; S58-P69 WeakPolarHBondContact OG-CG 3.3Å
59	R	75.6	Confident	81.7	Confident	155 Å²	155	80.9 Å²	80.9	59%	0.585	43%	0.427	S	S	*	.			trans	-102.4	126.4	177.3	-63.6	-174.5	-178.3	-116.7	-2.2	109.9	T61 N106	R59-T61 VanDerWaalsContact C-N 3.26Å; R59-T61 HydrophobicContact CB-CG2 4.34Å; R59-T61 PolarHBondContact O-N 2.87Å; R59-N106 PolarHBondContact NH2-ND2 2.8Å; R59-N106 PolarHBondContact NH2-OD1 3.05Å
60	P	63.8	Low	81.5	Confident	141 Å²	141	82.9 Å²	82.9	92%	0.916	44%	0.436	S	S	*	.			trans	-72.8	86.1	170.6	30.1	-32.3	0	0	0	108.2
61	T	66.8	Low	81.2	Confident	61 Å²	61	81.8 Å²	81.8	37%	0.374	43%	0.429	S	S	.	.			trans	-130.4	134.7	179.9	-171.5	0	0	0	0	111.2	R59 R63 A66	R59-T61 VanDerWaalsContact C-N 3.26Å; R59-T61 HydrophobicContact CB-CG2 4.34Å; R59-T61 PolarHBondContact O-N 2.87Å; T61-R63 HydrophobicContact CG2-CB 4.42Å; T61-R63 PolarHBondContact O-N 3.22Å; T61-R63 WeakPolarHBondContact OG1-CB 3.41Å; T61-R63 WeakPolarHBondContact OG1-CG 3.43Å; T61-R63 PolarHBondContact OG1-N 3.39Å; T61-A66 HydrophobicContact CG2-CB 3.67Å
62	Q	56.3	Low	81	Confident	195 Å²	195	74.1 Å²	74.1	91%	0.911	39%	0.394	S	S	*	.			trans	-81.6	3.1	171.4	-62.9	-66.7	-2.9	0	0	112.2	S64	Q62-S64 PolarHBondContact O-N 3.03Å
63	R	59.7	Low	80.9	Confident	205 Å²	205	72.9 Å²	72.9	77%	0.774	39%	0.387	S	S	*	.	S	Bend	trans	-72.4	121.3	175.5	-69.2	-176.5	179.2	-177.2	1.1	109.3	T61 R65	T61-R63 HydrophobicContact CG2-CB 4.42Å; T61-R63 PolarHBondContact O-N 3.22Å; T61-R63 WeakPolarHBondContact OG1-CB 3.41Å; T61-R63 WeakPolarHBondContact OG1-CG 3.43Å; T61-R63 PolarHBondContact OG1-N 3.39Å; R63-R65 PolarHBondContact O-N 3.27Å
64	S	53.5	Low	80.7	Confident	112 Å²	112	72.9 Å²	72.9	78%	0.783	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	124.7	167.1	-43.1	0	0	0	0	108.3	Q62	Q62-S64 PolarHBondContact O-N 3.03Å
65	R	64.1	Low	80.6	Confident	207 Å²	207	72.4 Å²	72.4	78%	0.781	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	32.9	174.9	-47.1	169.4	178.8	-178.6	-0.9	118.3	R63 I67	R63-R65 PolarHBondContact O-N 3.27Å; R65-I67 PolarHBondContact O-N 3.04Å
66	A	75.9	Confident	80.7	Confident	43 Å²	43	68.3 Å²	68.3	36%	0.355	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-55.1	140.9	163	0	0	0	0	0	111.4	R24 T61 S68	R24-A66 PolarHBondContact NH1-O 2.7Å; R24-A66 PolarHBondContact NH2-O 2.96Å; T61-A66 HydrophobicContact CG2-CB 3.67Å; A66-S68 PolarHBondContact O-N 3.16Å
67	I	85	Confident	80.9	Confident	53 Å²	53	64.8 Å²	64.8	27%	0.272	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.1	126	174.2	-57.9	179.4	0	0	0	107.5	R65 T71 Q72 I95	R65-I67 PolarHBondContact O-N 3.04Å; I67-T71 HydrophobicContact CG2-CG2 3.47Å; I67-T71 VanDerWaalsContact CG2-CG2 3.47Å; I67-Q72 HydrophobicContact CB-CG 4.33Å; I67-Q72 HydrophobicContact CG2-CG 3.71Å; I67-Q72 PolarHBondContact O-NE2 3.29Å; I67-I95 HydrophobicContact CD1-CG2 4.29Å
68	S	88.4	Confident	80.9	Confident	28 Å²	28	64.6 Å²	64.6	20%	0.196	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-69.2	156.4	-178.7	59.1	0	0	0	0	111.1	A66 E70 T71 Q72	A66-S68 PolarHBondContact O-N 3.16Å; S68-E70 PolarHBondContact O-N 3.08Å; S68-T71 PolarHBondContact O-N 3.49Å; S68-T71 VanDerWaalsContact O-N 3.16Å; S68-T71 PolarHBondContact OG-N 3.02Å; S68-T71 PolarHBondContact OG-OG1 3.25Å; S68-Q72 WeakPolarHBondContact O-CG 3.38Å; S68-Q72 PolarHBondContact O-N 3Å
69	P	91.4	Very high	81.1	Confident	23 Å²	23	61.6 Å²	61.6	15%	0.149	31%	0.307	C	S	.	.	H	α-helix	trans	-51.3	-42.8	171.8	-29.7	37.2	0	0	0	113.1	L57 S58 T71 Q72 I73	L57-P69 HydrophobicContact CB-CB 3.9Å; L57-P69 HydrophobicContact CB-CG 4.12Å; L57-P69 HydrophobicContact CD1-CB 4.27Å; S58-P69 WeakPolarHBondContact OG-CG 3.3Å; P69-T71 PolarHBondContact O-N 2.93Å; P69-Q72 WeakPolarHBondContact O-CB 3.3Å; P69-Q72 PolarHBondContact O-N 3.46Å; P69-Q72 VanDerWaalsContact O-N 3.15Å; P69-I73 WeakPolarHBondContact O-CG1 3.15Å; P69-I73 PolarHBondContact O-N 3.08Å
70	E	91.5	Very high	82	Confident	46 Å²	46	54.2 Å²	54.2	22%	0.215	28%	0.279	C	S	.	.	H	α-helix	trans	-54.2	-52	174.7	-177.5	-175.4	168.4	0	0	112.4	L27 V50 S68 Q72 I73 L74	L27-E70 HydrophobicContact CD1-CG 3.78Å; L27-E70 WeakPolarHBondContact CD1-OE1 3.42Å; L27-E70 HydrophobicContact CG-CG 4.25Å; L27-E70 WeakPolarHBondContact CG-OE1 3.28Å; L27-E70 PolarHBondContact N-OE1 3.31Å; V50-E70 HydrophobicContact CG2-CB 4.01Å; V50-E70 HydrophobicContact CG2-CG 4.38Å; S68-E70 PolarHBondContact O-N 3.08Å; E70-Q72 VanDerWaalsContact C-N 3.31Å; E70-Q72 PolarHBondContact O-N 3.02Å; E70-I73 PolarHBondContact O-N 3.21Å; E70-L74 HydrophobicContact CG-CD1 4.34Å; E70-L74 WeakPolarHBondContact O-CG 2.9Å; E70-L74 PolarHBondContact O-N 3.11Å
71	T	89.9	Confident	83.3	Confident	10 Å²	10	48.5 Å²	48.5	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-37.4	177.6	-58.7	0	0	0	0	112.3	I67 S68 P69 A75 I93 I95	I67-T71 HydrophobicContact CG2-CG2 3.47Å; I67-T71 VanDerWaalsContact CG2-CG2 3.47Å; S68-T71 PolarHBondContact O-N 3.49Å; S68-T71 VanDerWaalsContact O-N 3.16Å; S68-T71 PolarHBondContact OG-N 3.02Å; S68-T71 PolarHBondContact OG-OG1 3.25Å; P69-T71 PolarHBondContact O-N 2.93Å; T71-A75 WeakPolarHBondContact O-CB 3.34Å; T71-A75 PolarHBondContact O-N 3.16Å; T71-A75 VanDerWaalsContact O-N 3.09Å; T71-I93 HydrophobicContact CG2-CG2 3.35Å; T71-I95 HydrophobicContact CG2-CG2 4.16Å
72	Q	92.8	Very high	84.3	Confident	5 Å²	5	46.8 Å²	46.8	2%	0.023	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-43.7	176.7	-68.1	-178.3	79.5	0	0	111.3	L57 I67 S68 P69 E70 A75 A76 C103 N106 V107	L57-Q72 PolarHBondContact O-NE2 2.88Å; I67-Q72 HydrophobicContact CB-CG 4.33Å; I67-Q72 HydrophobicContact CG2-CG 3.71Å; I67-Q72 PolarHBondContact O-NE2 3.29Å; S68-Q72 WeakPolarHBondContact O-CG 3.38Å; S68-Q72 PolarHBondContact O-N 3Å; P69-Q72 WeakPolarHBondContact O-CB 3.3Å; P69-Q72 PolarHBondContact O-N 3.46Å; P69-Q72 VanDerWaalsContact O-N 3.15Å; E70-Q72 VanDerWaalsContact C-N 3.31Å; E70-Q72 PolarHBondContact O-N 3.02Å; Q72-A75 PolarHBondContact O-N 3.26Å; Q72-A76 PolarHBondContact O-N 3Å; Q72-C103 HydrophobicContact CB-CB 4.11Å; Q72-C103 HydrophobicContact CG-CB 4.2Å; Q72-N106 PolarHBondContact OE1-ND2 3.12Å; Q72-V107 HydrophobicContact CB-CG2 4.08Å
73	I	94.4	Very high	85.7	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-64.6	-46.9	178.8	-72.7	162	0	0	0	110.8	I46 L49 V50 L57 P69 E70 A75 A76 L77 V107	I46-I73 HydrophobicContact CG2-CG2 4.23Å; L49-I73 HydrophobicContact CB-CD1 4.2Å; L49-I73 HydrophobicContact CB-CG2 4.17Å; L49-I73 HydrophobicContact CD1-CG2 4.18Å; V50-I73 VanDerWaalsContact CA-CD1 3.48Å; V50-I73 HydrophobicContact CB-CD1 4.16Å; V50-I73 HydrophobicContact CG2-CD1 3.62Å; L57-I73 HydrophobicContact CD1-CD1 3.85Å; L57-I73 HydrophobicContact CD1-CG1 3.7Å; P69-I73 WeakPolarHBondContact O-CG1 3.15Å; P69-I73 PolarHBondContact O-N 3.08Å; E70-I73 PolarHBondContact O-N 3.21Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.5Å; I73-A76 PolarHBondContact O-N 3.49Å; I73-A76 VanDerWaalsContact O-N 3.09Å; I73-L77 HydrophobicContact CG2-CD1 3.69Å; I73-L77 HydrophobicContact CG2-CG 4.08Å; I73-L77 WeakPolarHBondContact O-CG 3.47Å; I73-L77 PolarHBondContact O-N 2.71Å; I73-V107 HydrophobicContact CG1-CG2 4.28Å
74	L	91.9	Very high	86.6	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-42.9	176.5	-72.4	172.8	0	0	0	112.3	F25 L27 Y39 I46 E70 A76 G78 I93	F25-L74 HydrophobicContact CD1-CD1 3.44Å; F25-L74 VanDerWaalsContact CD1-CD1 3.44Å; F25-L74 HydrophobicContact CE1-CD1 3.51Å; F25-L74 HydrophobicContact CE1-CD2 4.46Å; L27-L74 HydrophobicContact CD2-CD1 4.39Å; L27-L74 HydrophobicContact CD2-CD2 4.05Å; Y39-L74 HydrophobicContact CD1-CB 4.46Å; Y39-L74 HydrophobicContact CD1-CD2 4.02Å; Y39-L74 WeakPolarHBondContact CD1-O 3.39Å; Y39-L74 HydrophobicContact CD2-CD2 3.82Å; Y39-L74 HydrophobicContact CE1-CB 4.02Å; Y39-L74 HydrophobicContact CE1-CD2 4.01Å; Y39-L74 WeakPolarHBondContact CE1-O 3.27Å; Y39-L74 HydrophobicContact CE2-CD2 3.8Å; Y39-L74 HydrophobicContact CG-CD2 3.92Å; I46-L74 HydrophobicContact CD1-CD2 4.01Å; I46-L74 HydrophobicContact CG2-CD2 4.18Å; E70-L74 HydrophobicContact CG-CD1 4.34Å; E70-L74 WeakPolarHBondContact O-CG 2.9Å; E70-L74 PolarHBondContact O-N 3.11Å; L74-A76 VanDerWaalsContact C-N 3.31Å; L74-A76 PolarHBondContact O-N 3.32Å; L74-G78 PolarHBondContact O-N 2.79Å; L74-I93 HydrophobicContact CB-CD1 3.95Å
75	A	90.8	Very high	87.2	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-62.4	-39.3	175.8	0	0	0	0	0	112.2	T71 Q72 I73 F79 I93 I95 M100 C103	T71-A75 WeakPolarHBondContact O-CB 3.34Å; T71-A75 PolarHBondContact O-N 3.16Å; T71-A75 VanDerWaalsContact O-N 3.09Å; Q72-A75 PolarHBondContact O-N 3.26Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.5Å; A75-F79 PolarHBondContact O-N 3.38Å; A75-I93 HydrophobicContact CB-CD1 4.43Å; A75-I95 HydrophobicContact CB-CD1 3.78Å; A75-M100 HydrophobicContact CB-CG 4.41Å; A75-C103 HydrophobicContact CB-CB 3.84Å
76	A	94.5	Very high	87	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-71	-49.7	178.5	0	0	0	0	0	112.8	Q72 I73 L74 G78 F79 Y80 V107	Q72-A76 PolarHBondContact O-N 3Å; I73-A76 PolarHBondContact O-N 3.49Å; I73-A76 VanDerWaalsContact O-N 3.09Å; L74-A76 VanDerWaalsContact C-N 3.31Å; L74-A76 PolarHBondContact O-N 3.32Å; A76-G78 VanDerWaalsContact C-N 3.28Å; A76-G78 PolarHBondContact O-N 3.38Å; A76-F79 WeakPolarHBondContact O-CB 3.47Å; A76-F79 PolarHBondContact O-N 3.23Å; A76-F79 VanDerWaalsContact O-N 3.09Å; A76-Y80 HydrophobicContact CB-CE2 3.89Å; A76-Y80 WeakPolarHBondContact O-CD2 3.46Å; A76-Y80 VanDerWaalsContact O-CG 3.27Å; A76-Y80 PolarHBondContact O-N 2.95Å; A76-V107 HydrophobicContact CB-CB 3.56Å; A76-V107 HydrophobicContact CB-CG1 3.57Å; A76-V107 HydrophobicContact CB-CG2 3.82Å
77	L	94.3	Very high	86	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-58.1	-43.8	176.8	-65.2	173.7	0	0	0	110.9	F41 I46 L49 I73 F79 Y80 T81 L298	F41-L77 HydrophobicContact CD2-CD1 4.14Å; F41-L77 HydrophobicContact CD2-CD2 3.74Å; F41-L77 HydrophobicContact CD2-CG 4.35Å; F41-L77 HydrophobicContact CE2-CD2 3.68Å; I46-L77 HydrophobicContact CG1-CD1 3.99Å; L49-L77 HydrophobicContact CD1-CD1 4.12Å; L49-L77 HydrophobicContact CD1-CD2 4Å; I73-L77 HydrophobicContact CG2-CD1 3.69Å; I73-L77 HydrophobicContact CG2-CG 4.08Å; I73-L77 WeakPolarHBondContact O-CG 3.47Å; I73-L77 PolarHBondContact O-N 2.71Å; L77-F79 VanDerWaalsContact C-N 3.34Å; L77-F79 PolarHBondContact O-N 3.38Å; L77-Y80 PolarHBondContact O-N 2.93Å; L77-T81 WeakPolarHBondContact O-CG2 3.31Å; L77-T81 PolarHBondContact O-N 3.4Å; L77-T81 PolarHBondContact O-OG1 3.29Å; L77-L298 HydrophobicContact CD2-CD1 3.95Å; L77-L298 HydrophobicContact CD2-CD2 4.39Å
78	G	90.8	Very high	84.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.9	-47.3	174.2	0	0	0	0	0	112.8	L74 A76 S82 M89	L74-G78 PolarHBondContact O-N 2.79Å; A76-G78 VanDerWaalsContact C-N 3.28Å; A76-G78 PolarHBondContact O-N 3.38Å; G78-S82 VanDerWaalsContact O-CB 3.23Å; G78-S82 WeakPolarHBondContact O-CB 3.17Å; G78-S82 PolarHBondContact O-N 3.04Å; G78-S82 PolarHBondContact O-OG 2.87Å; G78-M89 VanDerWaalsContact CA-CE 3.43Å; G78-M89 WeakPolarHBondContact CA-SD 3.23Å; G78-M89 WeakPolarHBondContact O-CE 3.44Å
79	F	92.1	Very high	83.5	Confident	5 Å²	5	32.7 Å²	32.7	2%	0.022	17%	0.166	C	C	.	.	H	α-helix	trans	-60.6	-49.3	174.8	166.4	-109	0	0	0	111.9	A75 A76 L77 T81 S82 G83 F85 V104 C273 L281 Y283 I291	A75-F79 PolarHBondContact O-N 3.38Å; A76-F79 WeakPolarHBondContact O-CB 3.47Å; A76-F79 PolarHBondContact O-N 3.23Å; A76-F79 VanDerWaalsContact O-N 3.09Å; L77-F79 VanDerWaalsContact C-N 3.34Å; L77-F79 PolarHBondContact O-N 3.38Å; F79-T81 PolarHBondContact O-N 3.03Å; F79-S82 PolarHBondContact O-N 3.14Å; F79-G83 WeakPolarHBondContact O-CA 3.39Å; F79-G83 PolarHBondContact O-N 3Å; F79-F85 HydrophobicContact CB-CE1 4.45Å; F79-F85 HydrophobicContact CD1-CZ 4.18Å; F79-F85 HydrophobicContact CD2-CD1 4.24Å; F79-F85 HydrophobicContact CD2-CD2 4.16Å; F79-F85 AromaticContact CD2-CE1 3.64Å; F79-F85 HydrophobicContact CD2-CE1 3.64Å; F79-F85 AromaticContact CD2-CE2 3.55Å; F79-F85 HydrophobicContact CD2-CE2 3.55Å; F79-F85 HydrophobicContact CD2-CG 4.42Å; F79-F85 AromaticContact CD2-CZ 3.16Å; F79-F85 HydrophobicContact CD2-CZ 3.16Å; F79-F85 HydrophobicContact CE1-CZ 4.13Å; F79-F85 HydrophobicContact CE2-CD2 4.04Å; F79-F85 HydrophobicContact CE2-CE1 4.08Å; F79-F85 AromaticContact CE2-CE2 3.17Å; F79-F85 HydrophobicContact CE2-CE2 3.17Å; F79-F85 AromaticContact CE2-CZ 3.12Å; F79-F85 HydrophobicContact CE2-CZ 3.12Å; F79-F85 AromaticContact CG-CE1 3.96Å; F79-F85 HydrophobicContact CG-CE1 3.96Å; F79-F85 AromaticContact CG-CZ 3.73Å; F79-F85 HydrophobicContact CG-CZ 3.73Å; F79-F85 AromaticContact CZ-CE2 3.89Å; F79-F85 HydrophobicContact CZ-CE2 3.89Å; F79-F85 AromaticContact CZ-CZ 3.64Å; F79-F85 HydrophobicContact CZ-CZ 3.64Å; F79-V104 HydrophobicContact CB-CG2 3.69Å; F79-V104 HydrophobicContact CD1-CB 4.43Å; F79-V104 HydrophobicContact CD1-CG1 3.54Å; F79-V104 HydrophobicContact CD1-CG2 3.94Å; F79-V104 HydrophobicContact CE1-CG1 3.92Å; F79-V104 HydrophobicContact CG-CG1 4.33Å; F79-V104 HydrophobicContact CG-CG2 3.95Å; F79-C273 HydrophobicContact CE1-CB 4.26Å; F79-C273 HydrophobicContact CE2-CB 4.32Å; F79-C273 HydrophobicContact CZ-CB 3.94Å; F79-L281 HydrophobicContact CZ-CD2 4.1Å; F79-Y283 HydrophobicContact CE1-CE2 4.46Å; F79-Y283 AromaticContact CZ-CE2 3.95Å; F79-Y283 HydrophobicContact CZ-CE2 3.95Å; F79-I291 HydrophobicContact CE1-CD1 4.16Å; F79-I291 HydrophobicContact CE1-CG2 4.19Å
80	Y	94.3	Very high	82	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-43.3	-176.7	-55.5	-41.8	0	0	0	112	A76 L77 V104 T108 L111 F271 R272 C273 I291 L298	A76-Y80 HydrophobicContact CB-CE2 3.89Å; A76-Y80 WeakPolarHBondContact O-CD2 3.46Å; A76-Y80 VanDerWaalsContact O-CG 3.27Å; A76-Y80 PolarHBondContact O-N 2.95Å; L77-Y80 PolarHBondContact O-N 2.93Å; Y80-V104 HydrophobicContact CE1-CG1 4.24Å; Y80-T108 WeakPolarHBondContact OH-CA 3.36Å; Y80-T108 PolarHBondContact OH-N 2.71Å; Y80-T108 PolarHBondContact OH-OG1 2.84Å; Y80-L111 HydrophobicContact CE2-CD1 4.22Å; Y80-F271 CarbonylContact O-C 3.6Å; Y80-F271 WeakPolarHBondContact O-CA 3.43Å; Y80-R272 PolarHBondContact O-N 3.26Å; Y80-C273 PolarHBondContact O-N 3.08Å; Y80-C273 VanDerWaalsContact O-N 3.07Å; Y80-C273 PolarHBondContact O-SG 3.5Å; Y80-I291 HydrophobicContact CD1-CG2 4.27Å; Y80-I291 HydrophobicContact CE1-CG2 4.15Å; Y80-L298 HydrophobicContact CD2-CD1 3.65Å; Y80-L298 HydrophobicContact CE2-CD1 3.8Å
81	T	91.8	Very high	80.6	Confident	21 Å²	21	36.5 Å²	36.5	13%	0.129	19%	0.187	C	C	.	.	H	α-helix	trans	-83.5	-21.1	-175.5	62.7	0	0	0	0	114.2	Y39 F41 L77 F79 R270 F271 R272	Y39-T81 WeakPolarHBondContact O-CG2 3.45Å; F41-T81 HydrophobicContact CE2-CG2 4.04Å; L77-T81 WeakPolarHBondContact O-CG2 3.31Å; L77-T81 PolarHBondContact O-N 3.4Å; L77-T81 PolarHBondContact O-OG1 3.29Å; F79-T81 PolarHBondContact O-N 3.03Å; T81-R270 WeakPolarHBondContact CA-O 3.37Å; T81-R270 WeakPolarHBondContact CG2-O 3.5Å; T81-F271 HydrophobicContact CG2-CD1 4.49Å; T81-R272 VanDerWaalsContact O-CB 3.25Å; T81-R272 WeakPolarHBondContact O-CB 3.31Å; T81-R272 WeakPolarHBondContact O-CG 3.39Å
82	S	87.8	Confident	79.4	Confident	24 Å²	24	37.3 Å²	37.3	17%	0.168	20%	0.195	C	C	.	.	H	α-helix	trans	-96.9	-28.6	176	69.2	0	0	0	0	113.9	G78 F79 S84 M89	G78-S82 VanDerWaalsContact O-CB 3.23Å; G78-S82 WeakPolarHBondContact O-CB 3.17Å; G78-S82 PolarHBondContact O-N 3.04Å; G78-S82 PolarHBondContact O-OG 2.87Å; F79-S82 PolarHBondContact O-N 3.14Å; S82-S84 PolarHBondContact O-N 2.78Å; S82-S84 PolarHBondContact OG-N 2.73Å; S82-S84 PolarHBondContact OG-O 3.29Å; S82-M89 WeakPolarHBondContact OG-CE 3.39Å
83	G	84.1	Confident	78.4	Confident	30 Å²	30	37.5 Å²	37.5	31%	0.309	20%	0.196	S	C	.	.			trans	73.8	7.5	-170.2	0	0	0	0	0	114.6	F79	F79-G83 WeakPolarHBondContact O-CA 3.39Å; F79-G83 PolarHBondContact O-N 3Å
84	S	78.8	Confident	77.5	Confident	44 Å²	44	38.5 Å²	38.5	31%	0.308	21%	0.206	S	C	.	.			trans	-137	134.4	-173.4	178.6	0	0	0	0	113.8	S82 Q86 T87	S82-S84 PolarHBondContact O-N 2.78Å; S82-S84 PolarHBondContact OG-N 2.73Å; S82-S84 PolarHBondContact OG-O 3.29Å; S84-Q86 VanDerWaalsContact C-N 3.31Å; S84-Q86 PolarHBondContact OG-N 2.85Å; S84-Q86 VanDerWaalsContact OG-N 3.09Å; S84-T87 PolarHBondContact O-OG1 3.08Å
85	F	67.1	Low	77	Confident	47 Å²	47	39.7 Å²	39.7	21%	0.206	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-21.2	170.4	-69.3	-75.2	0	0	0	113.1	F79 T87 Q97 M100 V104 Y283	F79-F85 HydrophobicContact CB-CE1 4.45Å; F79-F85 HydrophobicContact CD1-CZ 4.18Å; F79-F85 HydrophobicContact CD2-CD1 4.24Å; F79-F85 HydrophobicContact CD2-CD2 4.16Å; F79-F85 AromaticContact CD2-CE1 3.64Å; F79-F85 HydrophobicContact CD2-CE1 3.64Å; F79-F85 AromaticContact CD2-CE2 3.55Å; F79-F85 HydrophobicContact CD2-CE2 3.55Å; F79-F85 HydrophobicContact CD2-CG 4.42Å; F79-F85 AromaticContact CD2-CZ 3.16Å; F79-F85 HydrophobicContact CD2-CZ 3.16Å; F79-F85 HydrophobicContact CE1-CZ 4.13Å; F79-F85 HydrophobicContact CE2-CD2 4.04Å; F79-F85 HydrophobicContact CE2-CE1 4.08Å; F79-F85 AromaticContact CE2-CE2 3.17Å; F79-F85 HydrophobicContact CE2-CE2 3.17Å; F79-F85 AromaticContact CE2-CZ 3.12Å; F79-F85 HydrophobicContact CE2-CZ 3.12Å; F79-F85 AromaticContact CG-CE1 3.96Å; F79-F85 HydrophobicContact CG-CE1 3.96Å; F79-F85 AromaticContact CG-CZ 3.73Å; F79-F85 HydrophobicContact CG-CZ 3.73Å; F79-F85 AromaticContact CZ-CE2 3.89Å; F79-F85 HydrophobicContact CZ-CE2 3.89Å; F79-F85 AromaticContact CZ-CZ 3.64Å; F79-F85 HydrophobicContact CZ-CZ 3.64Å; F85-T87 PolarHBondContact O-N 3.48Å; F85-Q97 PolarHBondContact O-NE2 2.86Å; F85-Q97 PolarHBondContact O-OE1 2.69Å; F85-Q97 VanDerWaalsContact O-OE1 3.14Å; F85-M100 HydrophobicContact CD1-CG 4.31Å; F85-M100 HydrophobicContact CD1-SD 4.16Å; F85-V104 HydrophobicContact CE1-CG2 4.09Å; F85-Y283 WeakPolarHBondContact CE1-OH 3.22Å; F85-Y283 HydrophobicContact CE2-CE2 4.01Å; F85-Y283 AromaticContact CE2-CZ 3.91Å; F85-Y283 WeakPolarHBondContact CE2-OH 3.18Å; F85-Y283 AromaticContact CZ-CE2 3.94Å; F85-Y283 HydrophobicContact CZ-CE2 3.94Å; F85-Y283 AromaticContact CZ-CZ 3.67Å; F85-Y283 WeakPolarHBondContact CZ-OH 3.34Å
86	Q	59.5	Low	76.7	Confident	179 Å²	179	42.9 Å²	42.9	84%	0.836	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	16.3	-171	-60.9	-175.4	11	0	0	114	S84	S84-Q86 VanDerWaalsContact C-N 3.31Å; S84-Q86 PolarHBondContact OG-N 2.85Å; S84-Q86 VanDerWaalsContact OG-N 3.09Å
87	T	54.7	Low	76.1	Confident	34 Å²	34	47.2 Å²	47.2	21%	0.209	26%	0.255	C	S	.	.	S	Bend	trans	-77.5	155.8	-171.7	38.9	0	0	0	0	112.4	S84 F85 M89 G90	S84-T87 PolarHBondContact O-OG1 3.08Å; F85-T87 PolarHBondContact O-N 3.48Å; T87-M89 VanDerWaalsContact CB-CE 3.43Å; T87-M89 HydrophobicContact CG2-CE 3.7Å; T87-M89 PolarHBondContact O-N 3.22Å; T87-M89 WeakPolarHBondContact OG1-CE 3.36Å; T87-G90 PolarHBondContact O-N 2.9Å
88	R	59.5	Low	75.8	Confident	210 Å²	210	49.8 Å²	49.8	79%	0.792	28%	0.276	S	S	*	.	H	α-helix	trans	-47.8	-13.6	167.9	-68.9	-173.3	-114.4	-166.7	-1.1	113.8	D91 A92	R88-D91 PolarHBondContact O-N 2.78Å; R88-A92 VanDerWaalsContact O-CB 3.31Å; R88-A92 WeakPolarHBondContact O-CB 3.46Å; R88-A92 PolarHBondContact O-N 3.06Å
89	M	62.1	Low	75.6	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.02	28%	0.282	C	S	.	.	H	α-helix	trans	-68.1	-38	179.7	-67.2	-173.6	-75.2	0	0	114	M38 Y39 G78 S82 T87 D91 A92 I93 M100	M38-M89 HydrophobicContact CE-CG 3.37Å; M38-M89 HydrophobicContact CE-SD 4.22Å; M38-M89 VanDerWaalsContact O-SD 3.4Å; Y39-M89 HydrophobicContact CD1-SD 4.15Å; Y39-M89 HydrophobicContact CE1-CG 4.42Å; Y39-M89 HydrophobicContact CE1-SD 3.95Å; G78-M89 VanDerWaalsContact CA-CE 3.43Å; G78-M89 WeakPolarHBondContact CA-SD 3.23Å; G78-M89 WeakPolarHBondContact O-CE 3.44Å; S82-M89 WeakPolarHBondContact OG-CE 3.39Å; T87-M89 VanDerWaalsContact CB-CE 3.43Å; T87-M89 HydrophobicContact CG2-CE 3.7Å; T87-M89 PolarHBondContact O-N 3.22Å; T87-M89 WeakPolarHBondContact OG1-CE 3.36Å; M89-D91 PolarHBondContact O-N 3.4Å; M89-A92 PolarHBondContact O-N 2.85Å; M89-I93 HydrophobicContact CB-CD1 4.46Å; M89-I93 WeakPolarHBondContact O-CB 3.3Å; M89-I93 WeakPolarHBondContact O-CG1 3.45Å; M89-I93 PolarHBondContact O-N 3.43Å; M89-M100 HydrophobicContact CB-CE 4.39Å
90	G	59.1	Low	75.4	Confident	3 Å²	3	50.5 Å²	50.5	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-38.2	176.3	0	0	0	0	0	111.6	T87 G94 I95	T87-G90 PolarHBondContact O-N 2.9Å; G90-G94 CarbonylContact O-C 3.5Å; G90-G94 VanDerWaalsContact O-CA 3.32Å; G90-G94 WeakPolarHBondContact O-CA 3.18Å; G90-G94 PolarHBondContact O-N 3.02Å; G90-I95 PolarHBondContact O-N 3.04Å
91	D	62.3	Low	75.1	Confident	146 Å²	146	52.6 Å²	52.6	78%	0.781	30%	0.296	S	S	*	.	H	α-helix	trans	-74.9	-41.4	176	-62.6	-31.5	0	0	0	111.7	R88 M89 I93 G94	R88-D91 PolarHBondContact O-N 2.78Å; M89-D91 PolarHBondContact O-N 3.4Å; D91-I93 PolarHBondContact O-N 3.19Å; D91-G94 PolarHBondContact O-N 3.27Å
92	A	65	Low	75.1	Confident	27 Å²	27	57.8 Å²	57.8	22%	0.223	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-37.1	177.3	0	0	0	0	0	113.1	R88 M89	R88-A92 VanDerWaalsContact O-CB 3.31Å; R88-A92 WeakPolarHBondContact O-CB 3.46Å; R88-A92 PolarHBondContact O-N 3.06Å; M89-A92 PolarHBondContact O-N 2.85Å
93	I	72.4	Confident	75.3	Confident	9 Å²	9	56.8 Å²	56.8	5%	0.046	31%	0.306	C	S	.	.	H	α-helix	trans	-86.3	-21.4	177.6	-61.7	171	0	0	0	111.1	Y39 T71 L74 A75 M89 D91 I95	Y39-I93 HydrophobicContact CE1-CD1 4.08Å; T71-I93 HydrophobicContact CG2-CG2 3.35Å; L74-I93 HydrophobicContact CB-CD1 3.95Å; A75-I93 HydrophobicContact CB-CD1 4.43Å; M89-I93 HydrophobicContact CB-CD1 4.46Å; M89-I93 WeakPolarHBondContact O-CB 3.3Å; M89-I93 WeakPolarHBondContact O-CG1 3.45Å; M89-I93 PolarHBondContact O-N 3.43Å; D91-I93 PolarHBondContact O-N 3.19Å; I93-I95 HydrophobicContact CG2-CD1 4.34Å; I93-I95 HydrophobicContact CG2-CG1 4.16Å; I93-I95 HydrophobicContact CG2-CG2 4.18Å
94	G	74.9	Confident	75.8	Confident	22 Å²	22	55.3 Å²	55.3	23%	0.227	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	24.9	178	0	0	0	0	0	115.2	L22 G90 D91	L22-G94 WeakPolarHBondContact CD1-O 3.34Å; G90-G94 CarbonylContact O-C 3.5Å; G90-G94 VanDerWaalsContact O-CA 3.32Å; G90-G94 WeakPolarHBondContact O-CA 3.18Å; G90-G94 PolarHBondContact O-N 3.02Å; D91-G94 PolarHBondContact O-N 3.27Å
95	I	80.9	Confident	76.6	Confident	25 Å²	25	54.1 Å²	54.1	13%	0.128	28%	0.284	C	S	.	.			trans	-110.8	145.7	-178	63.3	171	0	0	0	112.3	I67 T71 A75 G90 I93 M100	I67-I95 HydrophobicContact CD1-CG2 4.29Å; T71-I95 HydrophobicContact CG2-CG2 4.16Å; A75-I95 HydrophobicContact CB-CD1 3.78Å; G90-I95 PolarHBondContact O-N 3.04Å; I93-I95 HydrophobicContact CG2-CD1 4.34Å; I93-I95 HydrophobicContact CG2-CG1 4.16Å; I93-I95 HydrophobicContact CG2-CG2 4.18Å; I95-M100 HydrophobicContact CD1-CB 4.01Å; I95-M100 HydrophobicContact CG1-CB 4.45Å
96	S	83.9	Confident	78	Confident	68 Å²	68	53.4 Å²	53.4	48%	0.476	28%	0.283	S	S	.	.			trans	-66	153.7	175	66.6	0	0	0	0	111.8	A98 S99 M100	S96-A98 VanDerWaalsContact C-N 3.26Å; S96-A98 PolarHBondContact O-N 3.42Å; S96-S99 CarbonylContact O-C 3.57Å; S96-S99 WeakPolarHBondContact O-CA 3.45Å; S96-S99 VanDerWaalsContact O-CB 3.29Å; S96-S99 WeakPolarHBondContact O-CB 3.24Å; S96-S99 PolarHBondContact O-N 2.72Å; S96-S99 PolarHBondContact OG-N 3.22Å; S96-S99 PolarHBondContact OG-OG 3.26Å; S96-M100 PolarHBondContact O-N 2.84Å
97	Q	83.2	Confident	79.8	Confident	92 Å²	92	45 Å²	45	43%	0.43	24%	0.244	S	C	.	.	H	α-helix	trans	-52.6	-41.8	176.3	-74	-62.4	-28.9	0	0	113.4	F85 S99 M100 S101	F85-Q97 PolarHBondContact O-NE2 2.86Å; F85-Q97 PolarHBondContact O-OE1 2.69Å; F85-Q97 VanDerWaalsContact O-OE1 3.14Å; Q97-S99 VanDerWaalsContact C-N 3.26Å; Q97-S99 PolarHBondContact O-N 3.47Å; Q97-M100 PolarHBondContact O-N 3.16Å; Q97-S101 PolarHBondContact O-N 3.45Å
98	A	86.9	Confident	81.9	Confident	56 Å²	56	43.7 Å²	43.7	46%	0.463	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-33.8	175.3	0	0	0	0	0	112.4	S96 R102	S96-A98 VanDerWaalsContact C-N 3.26Å; S96-A98 PolarHBondContact O-N 3.42Å; A98-R102 WeakPolarHBondContact O-CG 3.4Å; A98-R102 VanDerWaalsContact O-CZ 3.26Å; A98-R102 PolarHBondContact O-N 3.15Å; A98-R102 PolarHBondContact O-NH1 3.41Å
99	S	87.1	Confident	83.7	Confident	17 Å²	17	38.9 Å²	38.9	12%	0.119	22%	0.222	C	C	.	.	H	α-helix	trans	-72.8	-43.1	175.2	-55.9	0	0	0	0	111.4	S96 Q97 S101 R102 C103	S96-S99 CarbonylContact O-C 3.57Å; S96-S99 WeakPolarHBondContact O-CA 3.45Å; S96-S99 VanDerWaalsContact O-CB 3.29Å; S96-S99 WeakPolarHBondContact O-CB 3.24Å; S96-S99 PolarHBondContact O-N 2.72Å; S96-S99 PolarHBondContact OG-N 3.22Å; S96-S99 PolarHBondContact OG-OG 3.26Å; Q97-S99 VanDerWaalsContact C-N 3.26Å; Q97-S99 PolarHBondContact O-N 3.47Å; S99-S101 PolarHBondContact O-N 3.34Å; S99-R102 PolarHBondContact O-N 3.11Å; S99-R102 PolarHBondContact OG-NH2 3.39Å; S99-C103 PolarHBondContact O-N 3.27Å; S99-C103 PolarHBondContact O-SG 3.2Å
100	M	87.4	Confident	85.4	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-56.5	-48.2	174.5	179.7	177.2	-81.5	0	0	111.5	A75 F85 M89 I95 S96 Q97 R102 C103 V104	A75-M100 HydrophobicContact CB-CG 4.41Å; F85-M100 HydrophobicContact CD1-CG 4.31Å; F85-M100 HydrophobicContact CD1-SD 4.16Å; M89-M100 HydrophobicContact CB-CE 4.39Å; I95-M100 HydrophobicContact CD1-CB 4.01Å; I95-M100 HydrophobicContact CG1-CB 4.45Å; S96-M100 PolarHBondContact O-N 2.84Å; Q97-M100 PolarHBondContact O-N 3.16Å; M100-R102 VanDerWaalsContact C-N 3.29Å; M100-R102 PolarHBondContact O-N 3.32Å; M100-C103 WeakPolarHBondContact O-CB 3.48Å; M100-C103 PolarHBondContact O-N 3.38Å; M100-V104 WeakPolarHBondContact O-CG2 3.32Å; M100-V104 PolarHBondContact O-N 2.81Å
101	S	89.3	Confident	87.3	Confident	44 Å²	44	38.8 Å²	38.8	31%	0.308	22%	0.221	S	C	.	.	H	α-helix	trans	-58	-39.3	177	-179.4	0	0	0	0	112.9	Q97 S99 A105	Q97-S101 PolarHBondContact O-N 3.45Å; S99-S101 PolarHBondContact O-N 3.34Å; S101-A105 PolarHBondContact O-N 3.01Å; S101-A105 VanDerWaalsContact O-N 3.1Å
102	R	91.4	Very high	89	Confident	130 Å²	130	33.3 Å²	33.3	49%	0.491	19%	0.193	S	C	.	.	H	α-helix	trans	-69	-36.4	173.5	-72.1	-174.5	-62.9	-91.5	1	112.8	A98 S99 M100 A105 N106	A98-R102 WeakPolarHBondContact O-CG 3.4Å; A98-R102 VanDerWaalsContact O-CZ 3.26Å; A98-R102 PolarHBondContact O-N 3.15Å; A98-R102 PolarHBondContact O-NH1 3.41Å; S99-R102 PolarHBondContact O-N 3.11Å; S99-R102 PolarHBondContact OG-NH2 3.39Å; M100-R102 VanDerWaalsContact C-N 3.29Å; M100-R102 PolarHBondContact O-N 3.32Å; R102-A105 PolarHBondContact O-N 3.31Å; R102-N106 PolarHBondContact O-N 3.04Å; R102-N106 PolarHBondContact O-ND2 2.96Å; R102-N106 PolarHBondContact O-OD1 2.85Å
103	C	92.4	Very high	90.5	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-48.8	176.5	-62.4	0	0	0	0	110.5	Q72 A75 S99 M100 A105 N106 V107	Q72-C103 HydrophobicContact CB-CB 4.11Å; Q72-C103 HydrophobicContact CG-CB 4.2Å; A75-C103 HydrophobicContact CB-CB 3.84Å; S99-C103 PolarHBondContact O-N 3.27Å; S99-C103 PolarHBondContact O-SG 3.2Å; M100-C103 WeakPolarHBondContact O-CB 3.48Å; M100-C103 PolarHBondContact O-N 3.38Å; C103-A105 VanDerWaalsContact C-N 3.32Å; C103-A105 PolarHBondContact O-N 3.27Å; C103-N106 PolarHBondContact O-N 3.17Å; C103-V107 WeakPolarHBondContact O-CB 3.42Å; C103-V107 VanDerWaalsContact O-CG2 3.32Å; C103-V107 WeakPolarHBondContact O-CG2 3.38Å; C103-V107 PolarHBondContact O-N 3.26Å
104	V	94.3	Very high	91.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-55.3	-48.3	175.5	173.7	0	0	0	0	110.6	F79 Y80 F85 M100 V107 T108	F79-V104 HydrophobicContact CB-CG2 3.69Å; F79-V104 HydrophobicContact CD1-CB 4.43Å; F79-V104 HydrophobicContact CD1-CG1 3.54Å; F79-V104 HydrophobicContact CD1-CG2 3.94Å; F79-V104 HydrophobicContact CE1-CG1 3.92Å; F79-V104 HydrophobicContact CG-CG1 4.33Å; F79-V104 HydrophobicContact CG-CG2 3.95Å; Y80-V104 HydrophobicContact CE1-CG1 4.24Å; F85-V104 HydrophobicContact CE1-CG2 4.09Å; M100-V104 WeakPolarHBondContact O-CG2 3.32Å; M100-V104 PolarHBondContact O-N 2.81Å; V104-V107 PolarHBondContact O-N 2.76Å; V104-T108 VanDerWaalsContact O-CB 3.24Å; V104-T108 WeakPolarHBondContact O-CB 3.25Å; V104-T108 PolarHBondContact O-N 3.33Å; V104-T108 PolarHBondContact O-OG1 2.92Å
105	A	95.4	Very high	92.8	Very high	19 Å²	19	41 Å²	41	16%	0.157	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-50.9	178.8	0	0	0	0	0	112.5	S101 R102 C103 V107 T108 E109	S101-A105 PolarHBondContact O-N 3.01Å; S101-A105 VanDerWaalsContact O-N 3.1Å; R102-A105 PolarHBondContact O-N 3.31Å; C103-A105 VanDerWaalsContact C-N 3.32Å; C103-A105 PolarHBondContact O-N 3.27Å; A105-V107 PolarHBondContact O-N 3.28Å; A105-T108 PolarHBondContact O-N 3.05Å; A105-E109 WeakPolarHBondContact O-CG 3.46Å; A105-E109 PolarHBondContact O-N 3.07Å
106	N	95.8	Very high	93.5	Very high	32 Å²	32	44.2 Å²	44.2	17%	0.171	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-40.2	-178.4	-56	-22	0	0	0	112.1	L57 R59 Q72 R102 C103 A110	L57-N106 HydrophobicContact CD2-CB 3.87Å; R59-N106 PolarHBondContact NH2-ND2 2.8Å; R59-N106 PolarHBondContact NH2-OD1 3.05Å; Q72-N106 PolarHBondContact OE1-ND2 3.12Å; R102-N106 PolarHBondContact O-N 3.04Å; R102-N106 PolarHBondContact O-ND2 2.96Å; R102-N106 PolarHBondContact O-OD1 2.85Å; C103-N106 PolarHBondContact O-N 3.17Å; N106-A110 WeakPolarHBondContact O-CB 3.41Å; N106-A110 PolarHBondContact O-N 3.27Å
107	V	97.8	Very high	94.1	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-70.7	-41.1	179.4	175	0	0	0	0	110.7	L53 L57 Q72 I73 A76 C103 V104 A105 E109 A110 L111	L53-V107 HydrophobicContact CD1-CG1 4.39Å; L57-V107 HydrophobicContact CD1-CG2 3.95Å; L57-V107 HydrophobicContact CD2-CG2 3.89Å; Q72-V107 HydrophobicContact CB-CG2 4.08Å; I73-V107 HydrophobicContact CG1-CG2 4.28Å; A76-V107 HydrophobicContact CB-CB 3.56Å; A76-V107 HydrophobicContact CB-CG1 3.57Å; A76-V107 HydrophobicContact CB-CG2 3.82Å; C103-V107 WeakPolarHBondContact O-CB 3.42Å; C103-V107 VanDerWaalsContact O-CG2 3.32Å; C103-V107 WeakPolarHBondContact O-CG2 3.38Å; C103-V107 PolarHBondContact O-N 3.26Å; V104-V107 PolarHBondContact O-N 2.76Å; A105-V107 PolarHBondContact O-N 3.28Å; V107-E109 VanDerWaalsContact C-N 3.35Å; V107-E109 PolarHBondContact O-N 3.24Å; V107-A110 PolarHBondContact O-N 3.13Å; V107-L111 HydrophobicContact CG1-CD1 3.84Å; V107-L111 HydrophobicContact CG1-CG 4.36Å; V107-L111 WeakPolarHBondContact O-CB 3.39Å; V107-L111 WeakPolarHBondContact O-CG 3.21Å; V107-L111 PolarHBondContact O-N 2.76Å
108	T	98.4	Very high	94.8	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-56.1	-50.1	172.8	-70.4	0	0	0	0	110.5	Y80 V104 A105 A110 L111 V112 H290 I291 A294	Y80-T108 WeakPolarHBondContact OH-CA 3.36Å; Y80-T108 PolarHBondContact OH-N 2.71Å; Y80-T108 PolarHBondContact OH-OG1 2.84Å; V104-T108 VanDerWaalsContact O-CB 3.24Å; V104-T108 WeakPolarHBondContact O-CB 3.25Å; V104-T108 PolarHBondContact O-N 3.33Å; V104-T108 PolarHBondContact O-OG1 2.92Å; A105-T108 PolarHBondContact O-N 3.05Å; T108-A110 PolarHBondContact O-N 2.95Å; T108-L111 PolarHBondContact O-N 2.87Å; T108-V112 HydrophobicContact CG2-CG2 4.42Å; T108-V112 VanDerWaalsContact O-CG2 3.31Å; T108-V112 WeakPolarHBondContact O-CG2 3.39Å; T108-V112 PolarHBondContact O-N 2.77Å; T108-H290 VanDerWaalsContact CG2-C 3.48Å; T108-H290 HydrophobicContact CG2-CB 3.65Å; T108-H290 WeakPolarHBondContact CG2-O 3.48Å; T108-I291 HydrophobicContact CG2-CG1 4.22Å; T108-A294 HydrophobicContact CG2-CB 4.04Å
109	E	98	Very high	95.3	Very high	110 Å²	110	38.7 Å²	38.7	51%	0.514	20%	0.2	S	C	.	.	H	α-helix	trans	-59.4	-47.7	178.2	-74.2	170.2	-168.4	0	0	111.5	A105 V107 L111 V112 E113	A105-E109 WeakPolarHBondContact O-CG 3.46Å; A105-E109 PolarHBondContact O-N 3.07Å; V107-E109 VanDerWaalsContact C-N 3.35Å; V107-E109 PolarHBondContact O-N 3.24Å; E109-L111 VanDerWaalsContact C-N 3.3Å; E109-L111 PolarHBondContact O-N 2.73Å; E109-V112 PolarHBondContact O-N 3.42Å; E109-E113 WeakPolarHBondContact O-CG 3.37Å; E109-E113 PolarHBondContact O-N 2.85Å
110	A	98.1	Very high	95.6	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.033	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-33.4	179.1	0	0	0	0	0	113.3	L53 N56 L57 N106 V107 T108 R114	L53-A110 HydrophobicContact CD2-CB 4.11Å; N56-A110 HydrophobicContact CB-CB 4.03Å; L57-A110 HydrophobicContact CD2-CB 4.39Å; N106-A110 WeakPolarHBondContact O-CB 3.41Å; N106-A110 PolarHBondContact O-N 3.27Å; V107-A110 PolarHBondContact O-N 3.13Å; T108-A110 PolarHBondContact O-N 2.95Å; A110-R114 WeakPolarHBondContact O-CG 3.27Å
111	L	98.5	Very high	95.9	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-73	-41.3	174.3	-75.1	166	0	0	0	111.8	L53 Y80 V107 T108 E109 E113 R114 A115 A294 V297 L298 I301	L53-L111 HydrophobicContact CD1-CD2 3.89Å; L53-L111 HydrophobicContact CD1-CG 3.99Å; L53-L111 HydrophobicContact CD2-CD2 4.49Å; Y80-L111 HydrophobicContact CE2-CD1 4.22Å; V107-L111 HydrophobicContact CG1-CD1 3.84Å; V107-L111 HydrophobicContact CG1-CG 4.36Å; V107-L111 WeakPolarHBondContact O-CB 3.39Å; V107-L111 WeakPolarHBondContact O-CG 3.21Å; V107-L111 PolarHBondContact O-N 2.76Å; T108-L111 PolarHBondContact O-N 2.87Å; E109-L111 VanDerWaalsContact C-N 3.3Å; E109-L111 PolarHBondContact O-N 2.73Å; L111-E113 VanDerWaalsContact C-N 3.32Å; L111-E113 PolarHBondContact O-N 3.39Å; L111-R114 CarbonylContact O-C 3.19Å; L111-R114 WeakPolarHBondContact O-CA 3.25Å; L111-R114 WeakPolarHBondContact O-CB 3.38Å; L111-R114 PolarHBondContact O-N 2.97Å; L111-A115 PolarHBondContact O-N 3.16Å; L111-A294 HydrophobicContact CB-CB 3.84Å; L111-A294 HydrophobicContact CD1-CB 3.94Å; L111-V297 HydrophobicContact CD2-CG1 4.06Å; L111-L298 HydrophobicContact CD1-CD1 3.8Å; L111-L298 HydrophobicContact CD1-CD2 4.08Å; L111-L298 HydrophobicContact CD1-CG 3.78Å; L111-L298 HydrophobicContact CD2-CD2 3.82Å; L111-L298 HydrophobicContact CD2-CG 4.07Å; L111-I301 HydrophobicContact CD2-CD1 4.41Å
112	V	98.2	Very high	95.9	Very high	30 Å²	30	45.6 Å²	45.6	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-38.8	177.3	168.5	0	0	0	0	111.2	T108 E109 R114 A115 H290 L293 A294	T108-V112 HydrophobicContact CG2-CG2 4.42Å; T108-V112 VanDerWaalsContact O-CG2 3.31Å; T108-V112 WeakPolarHBondContact O-CG2 3.39Å; T108-V112 PolarHBondContact O-N 2.77Å; E109-V112 PolarHBondContact O-N 3.42Å; V112-R114 PolarHBondContact O-N 3.08Å; V112-R114 VanDerWaalsContact O-N 3.13Å; V112-A115 WeakPolarHBondContact O-CB 3.31Å; V112-A115 PolarHBondContact O-N 3.04Å; V112-H290 HydrophobicContact CG2-CB 4.15Å; V112-H290 WeakPolarHBondContact CG2-O 3.48Å; V112-L293 HydrophobicContact CB-CD2 4.47Å; V112-L293 HydrophobicContact CG1-CD2 3.89Å; V112-L293 HydrophobicContact CG2-CB 4.21Å; V112-L293 HydrophobicContact CG2-CD2 4.08Å; V112-L293 HydrophobicContact CG2-CG 4.16Å; V112-A294 HydrophobicContact CG2-CB 4.42Å
113	E	97.4	Very high	95.6	Very high	128 Å²	128	43.9 Å²	43.9	60%	0.598	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.6	172.7	-74.2	179	175.1	0	0	113.2	N56 E109 L111	N56-E113 PolarHBondContact ND2-OE2 3.49Å; E109-E113 WeakPolarHBondContact O-CG 3.37Å; E109-E113 PolarHBondContact O-N 2.85Å; L111-E113 VanDerWaalsContact C-N 3.32Å; L111-E113 PolarHBondContact O-N 3.39Å
114	R	97.2	Very high	95.4	Very high	77 Å²	77	47.5 Å²	47.5	29%	0.291	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	1.7	176.6	-61.1	-76.5	-173.7	-147.3	-1.9	113	L52 L53 A110 L111 V112 S116 Q117 F118	L52-R114 PolarHBondContact O-NH2 2.96Å; L53-R114 HydrophobicContact CD2-CG 4.2Å; A110-R114 WeakPolarHBondContact O-CG 3.27Å; L111-R114 CarbonylContact O-C 3.19Å; L111-R114 WeakPolarHBondContact O-CA 3.25Å; L111-R114 WeakPolarHBondContact O-CB 3.38Å; L111-R114 PolarHBondContact O-N 2.97Å; V112-R114 PolarHBondContact O-N 3.08Å; V112-R114 VanDerWaalsContact O-N 3.13Å; R114-S116 PolarHBondContact O-N 2.99Å; R114-Q117 WeakPolarHBondContact O-CA 3.49Å; R114-Q117 WeakPolarHBondContact O-CB 3.46Å; R114-Q117 PolarHBondContact O-N 2.84Å; R114-F118 HydrophobicContact CB-CD2 4.01Å; R114-F118 HydrophobicContact CB-CE2 3.93Å; R114-F118 WeakPolarHBondContact O-CD2 3.41Å; R114-F118 PolarHBondContact O-N 3.02Å
115	A	97.4	Very high	95.2	Very high	15 Å²	15	55.7 Å²	55.7	12%	0.124	29%	0.291	C	S	.	.	H	α-helix	trans	-56.8	-46.8	-172.7	0	0	0	0	0	112.9	L111 V112 Q117 F118 I119 L293 V297	L111-A115 PolarHBondContact O-N 3.16Å; V112-A115 WeakPolarHBondContact O-CB 3.31Å; V112-A115 PolarHBondContact O-N 3.04Å; A115-Q117 PolarHBondContact O-N 2.79Å; A115-Q117 VanDerWaalsContact O-N 3.08Å; A115-F118 PolarHBondContact O-N 2.96Å; A115-F118 VanDerWaalsContact O-N 3.09Å; A115-I119 WeakPolarHBondContact O-CB 3.46Å; A115-I119 PolarHBondContact O-N 3.3Å; A115-L293 HydrophobicContact CB-CD1 4.18Å; A115-L293 HydrophobicContact CB-CD2 4.16Å; A115-L293 HydrophobicContact CB-CG 4.25Å; A115-V297 HydrophobicContact CB-CG2 3.89Å
116	S	96	Very high	95.1	Very high	93 Å²	93	58.3 Å²	58.3	65%	0.65	31%	0.312	S	S	*	.	H	α-helix	trans	-66.1	-10.4	176.3	62.9	0	0	0	0	114	R114 R120	R114-S116 PolarHBondContact O-N 2.99Å; S116-R120 WeakPolarHBondContact O-CG 3.49Å; S116-R120 PolarHBondContact O-NE 3.01Å
117	Q	96.4	Very high	95	Very high	67 Å²	67	59.1 Å²	59.1	31%	0.313	32%	0.321	S	S	.	.	H	α-helix	trans	-82.1	-33	173.2	-175.2	177.2	-13.9	0	0	112.8	R114 A115 R120	R114-Q117 WeakPolarHBondContact O-CA 3.49Å; R114-Q117 WeakPolarHBondContact O-CB 3.46Å; R114-Q117 PolarHBondContact O-N 2.84Å; A115-Q117 PolarHBondContact O-N 2.79Å; A115-Q117 VanDerWaalsContact O-N 3.08Å; Q117-R120 VanDerWaalsContact CA-NH2 3.29Å; Q117-R120 PolarHBondContact O-NH1 3.13Å; Q117-R120 PolarHBondContact O-NH2 3.32Å
118	F	97.4	Very high	94.7	Very high	12 Å²	12	59.8 Å²	59.8	5%	0.053	32%	0.324	C	S	.	.	H	α-helix	trans	-116.1	-17.5	-170.6	-63.7	-72.8	0	0	0	113.3	L52 R114 A115 V297 N300 I301 E304	L52-F118 HydrophobicContact CD1-CZ 4.39Å; L52-F118 HydrophobicContact CD2-CE2 3.87Å; L52-F118 HydrophobicContact CD2-CZ 3.78Å; R114-F118 HydrophobicContact CB-CD2 4.01Å; R114-F118 HydrophobicContact CB-CE2 3.93Å; R114-F118 WeakPolarHBondContact O-CD2 3.41Å; R114-F118 PolarHBondContact O-N 3.02Å; A115-F118 PolarHBondContact O-N 2.96Å; A115-F118 VanDerWaalsContact O-N 3.09Å; F118-V297 HydrophobicContact CB-CG1 4.31Å; F118-V297 HydrophobicContact CD2-CG1 3.85Å; F118-V297 HydrophobicContact CG-CG1 4.37Å; F118-N300 HydrophobicContact CB-CB 4.3Å; F118-N300 PolarHBondContact O-ND2 3.44Å; F118-I301 HydrophobicContact CB-CG1 4.38Å; F118-I301 HydrophobicContact CD1-CD1 4.42Å; F118-I301 HydrophobicContact CD1-CG1 3.54Å; F118-I301 HydrophobicContact CD2-CD1 3.9Å; F118-I301 HydrophobicContact CD2-CG1 3.85Å; F118-I301 HydrophobicContact CE1-CD1 4.3Å; F118-I301 HydrophobicContact CE1-CG1 3.63Å; F118-I301 HydrophobicContact CE2-CD1 3.77Å; F118-I301 HydrophobicContact CE2-CG1 3.94Å; F118-I301 HydrophobicContact CG-CD1 4.23Å; F118-I301 HydrophobicContact CG-CG1 3.65Å; F118-I301 HydrophobicContact CZ-CD1 3.97Å; F118-I301 HydrophobicContact CZ-CG1 3.82Å; F118-E304 WeakPolarHBondContact CE1-OE2 3.4Å
119	I	97.5	Very high	94.5	Very high	21 Å²	21	64 Å²	64	11%	0.108	34%	0.343	C	S	.	.			trans	-115.4	104	176.7	-61.1	165.7	0	0	0	106.5	A115 M187 V189 L293 C296 V297	A115-I119 WeakPolarHBondContact O-CB 3.46Å; A115-I119 PolarHBondContact O-N 3.3Å; I119-M187 WeakPolarHBondContact CG2-O 3.37Å; I119-V189 HydrophobicContact CD1-CB 4.26Å; I119-V189 HydrophobicContact CD1-CG2 3.84Å; I119-V189 HydrophobicContact CG1-CG2 4.39Å; I119-V189 HydrophobicContact CG2-CB 4.44Å; I119-V189 HydrophobicContact CG2-CG2 3.95Å; I119-L293 HydrophobicContact CD1-CD1 3.76Å; I119-C296 HydrophobicContact CD1-CB 4.07Å; I119-V297 HydrophobicContact CD1-CG2 3.84Å
120	R	94.2	Very high	94.3	Very high	155 Å²	155	60.9 Å²	60.9	59%	0.585	34%	0.336	S	S	*	.			trans	-141	136	-179.7	-62.1	-171	-172.9	112.4	-9.1	110.4	S116 Q117 M187	S116-R120 WeakPolarHBondContact O-CG 3.49Å; S116-R120 PolarHBondContact O-NE 3.01Å; Q117-R120 VanDerWaalsContact CA-NH2 3.29Å; Q117-R120 PolarHBondContact O-NH1 3.13Å; Q117-R120 PolarHBondContact O-NH2 3.32Å; R120-M187 CarbonylContact C-O 3.53Å; R120-M187 PolarHBondContact N-O 3.18Å
121	F	91.9	Very high	94.2	Very high	34 Å²	34	61.5 Å²	61.5	15%	0.149	34%	0.339	C	S	.	.			trans	-79.3	136.8	165.4	-154.1	-92.3	0	0	0	109.4	A123 M145 V179 M187 L208 F212 L222	F121-A123 PolarHBondContact O-N 2.83Å; F121-M145 HydrophobicContact CZ-CB 4.26Å; F121-V179 HydrophobicContact CE2-CG1 4.21Å; F121-M187 HydrophobicContact CD2-CB 3.87Å; F121-M187 HydrophobicContact CD2-CE 4.47Å; F121-M187 HydrophobicContact CE2-CB 4.47Å; F121-M187 HydrophobicContact CE2-CE 4.02Å; F121-M187 HydrophobicContact CE2-SD 4.49Å; F121-M187 PolarHBondContact N-O 2.95Å; F121-L208 HydrophobicContact CD2-CD1 4.33Å; F121-L208 HydrophobicContact CE2-CD1 4.44Å; F121-F212 HydrophobicContact CE1-CE2 4.21Å; F121-F212 HydrophobicContact CE1-CZ 4.02Å; F121-F212 HydrophobicContact CE2-CE2 4.44Å; F121-F212 HydrophobicContact CE2-CZ 4.39Å; F121-F212 AromaticContact CZ-CE2 3.97Å; F121-F212 HydrophobicContact CZ-CE2 3.97Å; F121-F212 AromaticContact CZ-CZ 3.63Å; F121-F212 HydrophobicContact CZ-CZ 3.63Å; F121-L222 HydrophobicContact CE2-CD2 4.26Å; F121-L222 HydrophobicContact CZ-CD2 4.25Å
122	P	89.6	Confident	94	Very high	20 Å²	20	62.9 Å²	62.9	13%	0.13	35%	0.345	C	S	.	.			trans	-59.6	135.8	176.9	30	-41.7	0	0	0	110.7	I128 L131 M187	P122-I128 HydrophobicContact CB-CG1 4.04Å; P122-I128 HydrophobicContact CG-CG1 4.12Å; P122-L131 HydrophobicContact CB-CD1 4.03Å; P122-L131 HydrophobicContact CG-CD1 3.51Å; P122-M187 HydrophobicContact CG-SD 4.43Å
123	A	85.4	Confident	94	Very high	93 Å²	93	66 Å²	66	77%	0.769	36%	0.36	S	S	*	.			trans	-114	-25.2	-179.9	0	0	0	0	0	112.9	F121	F121-A123 PolarHBondContact O-N 2.83Å
124	D	89.6	Confident	93.9	Very high	79 Å²	79	64.2 Å²	64.2	42%	0.422	35%	0.352	S	S	.	.	S	Bend	trans	-88.2	143.1	179.7	62.9	-75	0	0	0	112.1	A126 S127 I128	D124-A126 PolarHBondContact O-N 3.43Å; D124-S127 PolarHBondContact O-N 3.13Å; D124-S127 WeakPolarHBondContact OD1-CB 3.39Å; D124-S127 PolarHBondContact OD1-OG 3.36Å; D124-S127 VanDerWaalsContact OD2-CB 3.23Å; D124-S127 WeakPolarHBondContact OD2-CB 3.32Å; D124-S127 PolarHBondContact OD2-N 2.81Å; D124-S127 PolarHBondContact OD2-OG 3.06Å; D124-I128 WeakPolarHBondContact O-CG1 3.18Å; D124-I128 PolarHBondContact O-N 3.09Å
125	E	89.6	Confident	93.9	Very high	172 Å²	172	60.5 Å²	60.5	80%	0.804	34%	0.338	S	S	*	.	H	α-helix	trans	-59.4	-32.5	-177.9	-67.3	-179.4	174.6	0	0	112.8	Q129	E125-Q129 WeakPolarHBondContact O-CB 3.28Å; E125-Q129 PolarHBondContact O-N 2.71Å
126	A	93.1	Very high	93.8	Very high	74 Å²	74	65.6 Å²	65.6	61%	0.612	36%	0.355	S	S	*	.	H	α-helix	trans	-67.7	-47.2	-179.7	0	0	0	0	0	111.8	D124 I128 Q129 A130	D124-A126 PolarHBondContact O-N 3.43Å; A126-I128 VanDerWaalsContact C-N 3.34Å; A126-Q129 PolarHBondContact O-N 2.91Å; A126-A130 WeakPolarHBondContact O-CB 3.45Å; A126-A130 PolarHBondContact O-N 2.95Å
127	S	92.3	Very high	93.9	Very high	49 Å²	49	64.4 Å²	64.4	34%	0.343	36%	0.357	S	S	.	.	H	α-helix	trans	-66.2	-37.9	176.2	-59.6	0	0	0	0	111.7	D124 A130 L131	D124-S127 PolarHBondContact O-N 3.13Å; D124-S127 WeakPolarHBondContact OD1-CB 3.39Å; D124-S127 PolarHBondContact OD1-OG 3.36Å; D124-S127 VanDerWaalsContact OD2-CB 3.23Å; D124-S127 WeakPolarHBondContact OD2-CB 3.32Å; D124-S127 PolarHBondContact OD2-N 2.81Å; D124-S127 PolarHBondContact OD2-OG 3.06Å; S127-A130 PolarHBondContact O-N 2.61Å; S127-L131 WeakPolarHBondContact O-CG 3.42Å; S127-L131 PolarHBondContact O-N 3.09Å
128	I	92.4	Very high	93.8	Very high	16 Å²	16	65 Å²	65	8%	0.082	36%	0.362	C	S	.	.	H	α-helix	trans	-61.9	-46	174.1	-69.7	166.5	0	0	0	110.7	P122 D124 A126 L131 K132 M145	P122-I128 HydrophobicContact CB-CG1 4.04Å; P122-I128 HydrophobicContact CG-CG1 4.12Å; D124-I128 WeakPolarHBondContact O-CG1 3.18Å; D124-I128 PolarHBondContact O-N 3.09Å; A126-I128 VanDerWaalsContact C-N 3.34Å; I128-L131 PolarHBondContact O-N 3.44Å; I128-K132 HydrophobicContact CG2-CD 4.49Å; I128-K132 WeakPolarHBondContact O-CG 3.33Å; I128-K132 PolarHBondContact O-N 3.49Å; I128-M145 HydrophobicContact CG2-CG 4.16Å; I128-M145 HydrophobicContact CG2-SD 3.62Å
129	Q	94.1	Very high	93.6	Very high	93 Å²	93	66 Å²	66	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-41.5	178.9	-172.7	59	49.2	0	0	111.6	E125 A126 L131 K132 D133	E125-Q129 WeakPolarHBondContact O-CB 3.28Å; E125-Q129 PolarHBondContact O-N 2.71Å; A126-Q129 PolarHBondContact O-N 2.91Å; Q129-L131 VanDerWaalsContact C-N 3.32Å; Q129-L131 PolarHBondContact O-N 2.83Å; Q129-K132 WeakPolarHBondContact O-CB 3.25Å; Q129-K132 PolarHBondContact O-N 3.09Å; Q129-D133 PolarHBondContact NE2-OD1 3.08Å; Q129-D133 VanDerWaalsContact O-CG 3.25Å; Q129-D133 PolarHBondContact O-N 3.03Å
130	A	94.7	Very high	93.5	Very high	45 Å²	45	66.1 Å²	66.1	37%	0.372	38%	0.379	S	S	.	.	H	α-helix	trans	-58.4	-44.6	175.3	0	0	0	0	0	111.7	A126 S127 K132 D133 E134	A126-A130 WeakPolarHBondContact O-CB 3.45Å; A126-A130 PolarHBondContact O-N 2.95Å; S127-A130 PolarHBondContact O-N 2.61Å; A130-K132 PolarHBondContact O-N 3.28Å; A130-D133 PolarHBondContact O-N 3.28Å; A130-E134 WeakPolarHBondContact O-CB 3.43Å; A130-E134 VanDerWaalsContact O-CG 3.31Å; A130-E134 WeakPolarHBondContact O-CG 3.18Å; A130-E134 PolarHBondContact O-N 3.43Å
131	L	94.9	Very high	93.5	Very high	18 Å²	18	58.7 Å²	58.7	9%	0.094	35%	0.351	C	S	.	.	H	α-helix	trans	-61.3	-43	176.2	-77.7	166.4	0	0	0	112.4	P122 S127 I128 Q129 D133 E134 F135 D181 M187	P122-L131 HydrophobicContact CB-CD1 4.03Å; P122-L131 HydrophobicContact CG-CD1 3.51Å; S127-L131 WeakPolarHBondContact O-CG 3.42Å; S127-L131 PolarHBondContact O-N 3.09Å; I128-L131 PolarHBondContact O-N 3.44Å; Q129-L131 VanDerWaalsContact C-N 3.32Å; Q129-L131 PolarHBondContact O-N 2.83Å; L131-D133 VanDerWaalsContact C-N 3.33Å; L131-D133 PolarHBondContact O-N 3.23Å; L131-E134 PolarHBondContact O-N 3Å; L131-F135 VanDerWaalsContact O-CD2 3.25Å; L131-F135 WeakPolarHBondContact O-CD2 3.43Å; L131-F135 PolarHBondContact O-N 3.18Å; L131-D181 HydrophobicContact CD2-CB 3.69Å; L131-M187 HydrophobicContact CD1-SD 4.13Å
132	K	95.6	Very high	93.7	Very high	30 Å²	30	57.8 Å²	57.8	13%	0.13	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-45.4	175.9	-71	179.1	178.4	-167.7	0	111.7	I128 Q129 A130 Y136 V144 M145 D219 S220	I128-K132 HydrophobicContact CG2-CD 4.49Å; I128-K132 WeakPolarHBondContact O-CG 3.33Å; I128-K132 PolarHBondContact O-N 3.49Å; Q129-K132 WeakPolarHBondContact O-CB 3.25Å; Q129-K132 PolarHBondContact O-N 3.09Å; A130-K132 PolarHBondContact O-N 3.28Å; K132-Y136 VanDerWaalsContact O-CB 3.25Å; K132-Y136 WeakPolarHBondContact O-CB 3.42Å; K132-Y136 PolarHBondContact O-N 2.9Å; K132-V144 WeakPolarHBondContact CA-O 3.32Å; K132-M145 HydrophobicContact CG-CG 4.4Å; K132-D219 PolarHBondContact NZ-O 2.86Å; K132-D219 VanDerWaalsContact NZ-O 3.07Å; K132-S220 WeakPolarHBondContact CE-OG 3.44Å; K132-S220 PolarHBondContact NZ-OG 3.48Å
133	D	96.3	Very high	93.9	Very high	94 Å²	94	57.4 Å²	57.4	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-40.7	-179.6	-65.5	-17.2	0	0	0	111.1	Q129 A130 L131 Y136 G137	Q129-D133 PolarHBondContact NE2-OD1 3.08Å; Q129-D133 VanDerWaalsContact O-CG 3.25Å; Q129-D133 PolarHBondContact O-N 3.03Å; A130-D133 PolarHBondContact O-N 3.28Å; L131-D133 VanDerWaalsContact C-N 3.33Å; L131-D133 PolarHBondContact O-N 3.23Å; D133-Y136 PolarHBondContact O-N 3.41Å; D133-G137 PolarHBondContact O-N 3.33Å
134	E	96.3	Very high	94.4	Very high	91 Å²	91	53 Å²	53	43%	0.425	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-49.8	176.3	-75.4	179.2	179.9	0	0	112	A130 L131 Y136 G137 L138 I182	A130-E134 WeakPolarHBondContact O-CB 3.43Å; A130-E134 VanDerWaalsContact O-CG 3.31Å; A130-E134 WeakPolarHBondContact O-CG 3.18Å; A130-E134 PolarHBondContact O-N 3.43Å; L131-E134 PolarHBondContact O-N 3Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 3.41Å; E134-G137 PolarHBondContact O-N 2.93Å; E134-G137 VanDerWaalsContact O-N 3.16Å; E134-L138 PolarHBondContact O-N 3.01Å; E134-I182 HydrophobicContact CB-CD1 4.23Å; E134-I182 HydrophobicContact CB-CG2 4.02Å; E134-I182 WeakPolarHBondContact O-CD1 3.46Å; E134-I182 VanDerWaalsContact OE2-CG2 3.23Å; E134-I182 WeakPolarHBondContact OE2-CG2 3.41Å
135	F	96.8	Very high	94.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-38.8	176.4	-82.9	-64	0	0	0	112.5	L131 G137 L138 V144 V147 D181 I182 T256	L131-F135 VanDerWaalsContact O-CD2 3.25Å; L131-F135 WeakPolarHBondContact O-CD2 3.43Å; L131-F135 PolarHBondContact O-N 3.18Å; F135-G137 VanDerWaalsContact C-N 3.27Å; F135-G137 PolarHBondContact O-N 3.22Å; F135-L138 WeakPolarHBondContact O-CB 3.41Å; F135-L138 PolarHBondContact O-N 3.13Å; F135-L138 VanDerWaalsContact O-N 3.12Å; F135-V144 HydrophobicContact CB-CB 3.74Å; F135-V144 HydrophobicContact CB-CG1 4.09Å; F135-V144 HydrophobicContact CD1-CG1 4Å; F135-V144 HydrophobicContact CD2-CB 4.05Å; F135-V144 HydrophobicContact CD2-CG1 3.69Å; F135-V144 WeakPolarHBondContact CD2-O 3.46Å; F135-V144 HydrophobicContact CE1-CG1 4.29Å; F135-V144 HydrophobicContact CE2-CG1 4.02Å; F135-V144 HydrophobicContact CG-CB 3.9Å; F135-V144 HydrophobicContact CG-CG1 3.67Å; F135-V144 HydrophobicContact CZ-CG1 4.29Å; F135-V147 HydrophobicContact CE1-CG2 3.93Å; F135-V147 HydrophobicContact CZ-CG2 4.25Å; F135-D181 VanDerWaalsContact CZ-C 3.46Å; F135-I182 HydrophobicContact CD1-CB 4.13Å; F135-I182 HydrophobicContact CD1-CG1 4.48Å; F135-I182 HydrophobicContact CE1-CB 3.96Å; F135-I182 HydrophobicContact CZ-CB 4.26Å; F135-I182 VanDerWaalsContact CZ-N 3.27Å; F135-T256 HydrophobicContact CD1-CG2 3.59Å; F135-T256 HydrophobicContact CE1-CG2 4.03Å; F135-T256 HydrophobicContact CG-CG2 4.48Å
136	Y	96.7	Very high	95	Very high	122 Å²	122	41 Å²	41	48%	0.478	25%	0.253	S	S	.	.	H	α-helix	trans	-60.6	-39.9	174.1	-173.9	-105.6	0	0	0	111.4	K132 D133 E134 L138 G140 M141 P142	K132-Y136 VanDerWaalsContact O-CB 3.25Å; K132-Y136 WeakPolarHBondContact O-CB 3.42Å; K132-Y136 PolarHBondContact O-N 2.9Å; D133-Y136 PolarHBondContact O-N 3.41Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 3.41Å; Y136-L138 PolarHBondContact O-N 3.04Å; Y136-G140 VanDerWaalsContact CE2-O 3.28Å; Y136-G140 WeakPolarHBondContact CE2-O 3.47Å; Y136-G140 WeakPolarHBondContact O-CA 3.24Å; Y136-G140 PolarHBondContact O-N 3.03Å; Y136-M141 WeakPolarHBondContact CA-O 3.36Å; Y136-P142 HydrophobicContact CD2-CB 3.97Å; Y136-P142 HydrophobicContact CE2-CB 4.21Å
137	G	96.7	Very high	95.3	Very high	67 Å²	67	37.5 Å²	37.5	69%	0.691	22%	0.223	S	C	*	.	H	α-helix	trans	-63.8	-23.4	175.5	0	0	0	0	0	114.8	D133 E134 F135	D133-G137 PolarHBondContact O-N 3.33Å; E134-G137 PolarHBondContact O-N 2.93Å; E134-G137 VanDerWaalsContact O-N 3.16Å; F135-G137 VanDerWaalsContact C-N 3.27Å; F135-G137 PolarHBondContact O-N 3.22Å
138	L	94.6	Very high	95.5	Very high	81 Å²	81	35.1 Å²	35.1	42%	0.424	21%	0.207	S	C	.	.	H	α-helix	trans	-73.4	-52	-179.2	-178.9	63.1	0	0	0	112.8	E134 F135 Y136 I182 T256 V259	E134-L138 PolarHBondContact O-N 3.01Å; F135-L138 WeakPolarHBondContact O-CB 3.41Å; F135-L138 PolarHBondContact O-N 3.13Å; F135-L138 VanDerWaalsContact O-N 3.12Å; Y136-L138 PolarHBondContact O-N 3.04Å; L138-I182 HydrophobicContact CB-CD1 3.83Å; L138-I182 HydrophobicContact CD2-CD1 4.34Å; L138-I182 HydrophobicContact CD2-CG1 4.3Å; L138-I182 HydrophobicContact CG-CD1 4.48Å; L138-T256 HydrophobicContact CD2-CG2 4.49Å; L138-V259 HydrophobicContact CD2-CG2 3.63Å
139	A	94.2	Very high	95.8	Very high	31 Å²	31	35.2 Å²	35.2	26%	0.256	21%	0.208	S	C	.	.	H	α-helix	trans	-145.4	9.2	-171.3	0	0	0	0	0	114.1	M141 A252 A255	A139-M141 VanDerWaalsContact C-N 3.32Å; A139-M141 PolarHBondContact O-N 2.97Å; A139-A252 HydrophobicContact CB-CB 4.42Å; A139-A252 VanDerWaalsContact O-CB 3.22Å; A139-A252 WeakPolarHBondContact O-CB 3.48Å; A139-A255 HydrophobicContact CB-CB 3.7Å
140	G	94.6	Very high	95.9	Very high	24 Å²	24	31.5 Å²	31.5	25%	0.247	19%	0.192	C	C	.	.	S	Bend	trans	77.7	12	179.5	0	0	0	0	0	114.7	Y136 P142	Y136-G140 VanDerWaalsContact CE2-O 3.28Å; Y136-G140 WeakPolarHBondContact CE2-O 3.47Å; Y136-G140 WeakPolarHBondContact O-CA 3.24Å; Y136-G140 PolarHBondContact O-N 3.03Å; G140-P142 VanDerWaalsContact O-CD 3.3Å; G140-P142 WeakPolarHBondContact O-CD 3.42Å
141	M	94.9	Very high	96	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.18	C	C	.	.			trans	-80.6	111.9	175	-170.7	66.4	76.9	0	0	109.9	Y136 A139 V144 L223 Y249 A252 H253 L343 F348	Y136-M141 WeakPolarHBondContact CA-O 3.36Å; A139-M141 VanDerWaalsContact C-N 3.32Å; A139-M141 PolarHBondContact O-N 2.97Å; M141-V144 HydrophobicContact CB-CG2 3.91Å; M141-V144 HydrophobicContact CG-CG2 3.34Å; M141-L223 HydrophobicContact CG-CD1 4.13Å; M141-L223 HydrophobicContact CG-CD2 4.31Å; M141-Y249 HydrophobicContact CE-CD2 3.81Å; M141-Y249 HydrophobicContact CE-CE2 3.72Å; M141-Y249 HydrophobicContact SD-CD2 4.21Å; M141-Y249 HydrophobicContact SD-CE2 4.06Å; M141-A252 HydrophobicContact CB-CB 4.47Å; M141-A252 HydrophobicContact CE-CB 4.02Å; M141-H253 VanDerWaalsContact CE-CA 3.43Å; M141-H253 HydrophobicContact CE-CB 3.56Å; M141-H253 VanDerWaalsContact CE-N 3.31Å; M141-L343 HydrophobicContact SD-CD2 4.36Å; M141-F348 HydrophobicContact CE-CZ 4.1Å; M141-F348 HydrophobicContact SD-CE2 3.97Å; M141-F348 HydrophobicContact SD-CZ 3.69Å
142	P	94.9	Very high	96	Very high	15 Å²	15	33.1 Å²	33.1	10%	0.097	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	165.5	-177.3	34.1	-34.9	0	0	0	110.8	Y136 G140 V144 W221 L343 H347	Y136-P142 HydrophobicContact CD2-CB 3.97Å; Y136-P142 HydrophobicContact CE2-CB 4.21Å; G140-P142 VanDerWaalsContact O-CD 3.3Å; G140-P142 WeakPolarHBondContact O-CD 3.42Å; P142-V144 PolarHBondContact O-N 3.42Å; P142-W221 HydrophobicContact CG-CZ2 4.11Å; P142-W221 WeakPolarHBondContact O-CZ2 3.36Å; P142-W221 PolarHBondContact O-NE1 3.34Å; P142-L343 HydrophobicContact CG-CD1 3.35Å; P142-H347 HydrophobicContact CG-CB 4.26Å
143	G	94.4	Very high	96	Very high	11 Å²	11	31.9 Å²	31.9	11%	0.113	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	-0.3	168.1	0	0	0	0	0	116.8	M145 S220 W221	G143-M145 PolarHBondContact O-N 3Å; G143-S220 VanDerWaalsContact O-CA 3.3Å; G143-S220 WeakPolarHBondContact O-CA 3.45Å; G143-W221 PolarHBondContact O-N 3.41Å
144	V	96.5	Very high	95.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	127.6	-177	-177.4	0	0	0	0	110.7	K132 F135 M141 P142 W221 L223 T256	K132-V144 WeakPolarHBondContact CA-O 3.32Å; F135-V144 HydrophobicContact CB-CB 3.74Å; F135-V144 HydrophobicContact CB-CG1 4.09Å; F135-V144 HydrophobicContact CD1-CG1 4Å; F135-V144 HydrophobicContact CD2-CB 4.05Å; F135-V144 HydrophobicContact CD2-CG1 3.69Å; F135-V144 WeakPolarHBondContact CD2-O 3.46Å; F135-V144 HydrophobicContact CE1-CG1 4.29Å; F135-V144 HydrophobicContact CE2-CG1 4.02Å; F135-V144 HydrophobicContact CG-CB 3.9Å; F135-V144 HydrophobicContact CG-CG1 3.67Å; F135-V144 HydrophobicContact CZ-CG1 4.29Å; M141-V144 HydrophobicContact CB-CG2 3.91Å; M141-V144 HydrophobicContact CG-CG2 3.34Å; P142-V144 PolarHBondContact O-N 3.42Å; V144-W221 WeakPolarHBondContact CA-O 3.45Å; V144-L223 HydrophobicContact CG1-CD1 4.29Å; V144-L223 HydrophobicContact CG1-CG 3.99Å; V144-L223 HydrophobicContact CG2-CD1 3.93Å; V144-L223 HydrophobicContact CG2-CD2 4.08Å; V144-L223 HydrophobicContact CG2-CG 3.87Å; V144-T256 HydrophobicContact CG1-CG2 4.36Å
145	M	95.3	Very high	95.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-13	173.9	-64.1	-170.9	-59.4	0	0	113.2	F121 I128 K132 G143 M187 F212 H217 S220 W221	F121-M145 HydrophobicContact CZ-CB 4.26Å; I128-M145 HydrophobicContact CG2-CG 4.16Å; I128-M145 HydrophobicContact CG2-SD 3.62Å; K132-M145 HydrophobicContact CG-CG 4.4Å; G143-M145 PolarHBondContact O-N 3Å; M145-M187 VanDerWaalsContact O-CE 3.24Å; M145-M187 WeakPolarHBondContact O-CE 3.47Å; M145-F212 HydrophobicContact CE-CD1 4.28Å; M145-F212 HydrophobicContact CE-CE1 3.18Å; M145-F212 HydrophobicContact CE-CZ 3.51Å; M145-H217 HydrophobicContact CE-CB 3.53Å; M145-H217 HydrophobicContact SD-CB 4.01Å; M145-S220 VanDerWaalsContact CE-CB 3.46Å; M145-S220 WeakPolarHBondContact SD-CB 3.43Å; M145-W221 PolarHBondContact N-O 3.21Å
146	G	96.8	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.3	163.4	-178.5	0	0	0	0	0	111.2	C180 L222 L223	G146-C180 WeakPolarHBondContact CA-O 3.2Å; G146-L222 VanDerWaalsContact O-CA 3.32Å; G146-L222 WeakPolarHBondContact O-CA 3.33Å; G146-L223 PolarHBondContact O-N 2.88Å
147	V	97.9	Very high	94.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.7	173	-178.5	0	0	0	0	107.4	F135 V179 C180 L223 T256 H257 I260	F135-V147 HydrophobicContact CE1-CG2 3.93Å; F135-V147 HydrophobicContact CZ-CG2 4.25Å; V147-V179 CarbonylContact O-C 3.57Å; V147-V179 VanDerWaalsContact O-CA 3.24Å; V147-V179 WeakPolarHBondContact O-CA 3.49Å; V147-V179 WeakPolarHBondContact O-CG1 3.43Å; V147-C180 PolarHBondContact N-O 3.03Å; V147-C180 VanDerWaalsContact N-O 3.08Å; V147-C180 PolarHBondContact O-N 3.22Å; V147-L223 CarbonylContact C-O 3.39Å; V147-L223 WeakPolarHBondContact CA-O 3.38Å; V147-L223 HydrophobicContact CG2-CB 4.42Å; V147-T256 HydrophobicContact CG2-CG2 4.13Å; V147-H257 HydrophobicContact CG1-CB 4.33Å; V147-H257 VanDerWaalsContact CG1-CD2 3.46Å; V147-H257 WeakPolarHBondContact CG1-CD2 3.41Å; V147-I260 HydrophobicContact CB-CB 4.27Å; V147-I260 HydrophobicContact CG1-CB 3.76Å; V147-I260 HydrophobicContact CG1-CG2 3.56Å; V147-I260 WeakPolarHBondContact O-CD1 3.15Å
148	V	97.9	Very high	93.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.7	-178.4	63	0	0	0	0	110.6	L177 M178 V179 L203 L222 L223 L234	V148-L177 HydrophobicContact CG2-CD1 3.57Å; V148-L177 HydrophobicContact CG2-CG 4.14Å; V148-M178 WeakPolarHBondContact CA-O 3.44Å; V148-V179 HydrophobicContact CB-CG2 3.99Å; V148-V179 HydrophobicContact CG2-CG2 3.87Å; V148-L203 HydrophobicContact CG2-CD1 4.31Å; V148-L222 HydrophobicContact CG1-CB 4.18Å; V148-L223 PolarHBondContact N-O 3.27Å; V148-L234 HydrophobicContact CG1-CD1 3.52Å
149	D	97.8	Very high	92.6	Very high	18 Å²	18	25.8 Å²	25.8	10%	0.096	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	166.1	176.8	-160.6	-2.3	0	0	0	109.5	M178 H257 I260 F264	D149-M178 PolarHBondContact N-O 3.1Å; D149-M178 VanDerWaalsContact N-O 3.13Å; D149-M178 PolarHBondContact O-N 3.44Å; D149-H257 IonicContact OD2-CE1 2.71Å; D149-H257 PolarHBondContact OD2-CE1 3.38Å; D149-I260 HydrophobicContact CB-CB 4.44Å; D149-I260 HydrophobicContact CB-CD1 3.64Å; D149-I260 HydrophobicContact CB-CG1 4.05Å; D149-I260 HydrophobicContact CB-CG2 3.57Å; D149-I260 VanDerWaalsContact N-CD1 3.31Å; D149-F264 HydrophobicContact CB-CE2 3.81Å; D149-F264 HydrophobicContact CB-CZ 4.05Å
150	C	96.8	Very high	91.4	Very high	14 Å²	14	28.5 Å²	28.5	10%	0.095	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.2	178.7	-81.7	0	0	0	0	111.2	N175 C176 L177 D199	C150-N175 VanDerWaalsContact CB-OD1 3.23Å; C150-N175 WeakPolarHBondContact CB-OD1 3.31Å; C150-N175 PolarHBondContact SG-OD1 3.48Å; C150-C176 CarbonylContact C-O 3.53Å; C150-C176 WeakPolarHBondContact CA-O 3.39Å; C150-L177 VanDerWaalsContact SG-CD1 3.59Å; C150-D199 HydrophobicContact CB-CB 3.97Å; C150-D199 VanDerWaalsContact CB-CG 3.49Å; C150-D199 WeakPolarHBondContact CB-OD1 3.45Å; C150-D199 PolarHBondContact SG-OD1 3.39Å; C150-D199 VanDerWaalsContact SG-OD1 3.38Å
151	I	95.5	Very high	90.2	Very high	25 Å²	25	35.1 Å²	35.1	13%	0.128	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.3	170.7	-173.1	176.9	0	0	0	110.7	C176 M178 F264	I151-C176 HydrophobicContact CG2-CB 3.83Å; I151-C176 PolarHBondContact N-O 3.08Å; I151-C176 WeakPolarHBondContact O-CB 3.07Å; I151-C176 PolarHBondContact O-N 2.94Å; I151-M178 HydrophobicContact CG2-CE 3.78Å; I151-M178 HydrophobicContact CG2-SD 4.37Å; I151-F264 HydrophobicContact CB-CD1 4.31Å; I151-F264 HydrophobicContact CB-CD2 3.95Å; I151-F264 HydrophobicContact CB-CE1 4.19Å; I151-F264 HydrophobicContact CB-CE2 3.81Å; I151-F264 HydrophobicContact CB-CG 4.2Å; I151-F264 HydrophobicContact CB-CZ 3.93Å; I151-F264 HydrophobicContact CD1-CB 3.98Å; I151-F264 HydrophobicContact CD1-CD1 4.31Å; I151-F264 HydrophobicContact CD1-CD2 4.37Å; I151-F264 HydrophobicContact CD1-CG 3.98Å; I151-F264 HydrophobicContact CG1-CD2 4.44Å; I151-F264 HydrophobicContact CG2-CD1 4.26Å; I151-F264 HydrophobicContact CG2-CE1 3.97Å; I151-F264 HydrophobicContact CG2-CE2 4.45Å; I151-F264 HydrophobicContact CG2-CZ 4.06Å
152	H	95.1	Very high	89.3	Confident	73 Å²	73	37.4 Å²	37.4	34%	0.338	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	117.9	172.3	-75.4	-89.9	0	0	0	111.3	S173 L174 G195	H152-S173 PolarHBondContact ND1-OG 2.97Å; H152-L174 WeakPolarHBondContact CA-O 3.41Å; H152-G195 PolarHBondContact CE1-O 2.58Å
153	V	95.6	Very high	88.9	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.3	172.5	-179.9	0	0	0	0	109.6	I155 S173 L174 L274 L281 I292	V153-I155 PolarHBondContact O-N 3.42Å; V153-S173 CarbonylContact O-C 3.49Å; V153-S173 WeakPolarHBondContact O-CA 3.48Å; V153-S173 VanDerWaalsContact O-CB 3.3Å; V153-S173 WeakPolarHBondContact O-CB 3.29Å; V153-L174 PolarHBondContact N-O 2.82Å; V153-L174 PolarHBondContact O-N 2.92Å; V153-L274 HydrophobicContact CG1-CD2 4.24Å; V153-L281 HydrophobicContact CG1-CD1 3.95Å; V153-I292 HydrophobicContact CB-CD1 3.71Å; V153-I292 HydrophobicContact CB-CG1 4.25Å; V153-I292 HydrophobicContact CG1-CD1 3.83Å; V153-I292 HydrophobicContact CG1-CG1 4.01Å; V153-I292 HydrophobicContact CG2-CD1 3.92Å; V153-I292 HydrophobicContact CG2-CG1 4.13Å; V153-I292 HydrophobicContact CG2-CG2 4.44Å
154	A	93.8	Very high	88.6	Confident	25 Å²	25	44.9 Å²	44.9	21%	0.207	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	129.4	-177.7	0	0	0	0	0	111.7	A280 L281	A154-A280 HydrophobicContact CB-CB 3.9Å; A154-L281 PolarHBondContact O-N 3.23Å
155	I	92.9	Very high	88.3	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.026	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-123.6	157.4	177	63.1	162.7	0	0	0	110.8	V153 A157 Y165 H172 L174 L281 P285	V153-I155 PolarHBondContact O-N 3.42Å; I155-A157 PolarHBondContact O-N 2.9Å; I155-Y165 HydrophobicContact CD1-CD1 3.77Å; I155-Y165 HydrophobicContact CD1-CE1 4.33Å; I155-Y165 HydrophobicContact CD1-CG 4.13Å; I155-H172 HydrophobicContact CG1-CB 4.36Å; I155-H172 PolarHBondContact N-O 3.33Å; I155-H172 WeakPolarHBondContact O-CB 3.39Å; I155-L174 HydrophobicContact CD1-CG 4.22Å; I155-L174 HydrophobicContact CG2-CD1 3.94Å; I155-L174 HydrophobicContact CG2-CG 3.98Å; I155-L281 HydrophobicContact CG2-CB 4.41Å; I155-P285 HydrophobicContact CD1-CB 4.3Å; I155-P285 HydrophobicContact CD1-CG 3.96Å
156	K	89.9	Confident	88.2	Confident	116 Å²	116	48.2 Å²	48.2	50%	0.504	27%	0.27	S	S	.	.			trans	-61	134.9	165.7	-178.8	-175.6	176.6	-177.9	0	108.7	P158 L281	K156-P158 WeakPolarHBondContact O-CD 3.29Å; K156-P158 VanDerWaalsContact O-N 3.16Å; K156-L281 WeakPolarHBondContact CB-O 3.3Å; K156-L281 PolarHBondContact N-O 3.32Å
157	A	82.7	Confident	87.9	Confident	30 Å²	30	49.1 Å²	49.1	25%	0.248	28%	0.275	C	S	.	.			trans	-50.8	121.1	171.6	0	0	0	0	0	110	I155 N159 H172	I155-A157 PolarHBondContact O-N 2.9Å; A157-N159 PolarHBondContact O-N 3.2Å; A157-H172 WeakPolarHBondContact CB-NE2 3.19Å
158	P	73.6	Confident	87.3	Confident	61 Å²	61	54.9 Å²	54.9	40%	0.396	30%	0.297	S	S	.	.	S	Bend	trans	-61.4	-40.1	176.5	-7.4	15.6	0	0	0	110.3	K156 Y165 P285	K156-P158 WeakPolarHBondContact O-CD 3.29Å; K156-P158 VanDerWaalsContact O-N 3.16Å; P158-Y165 HydrophobicContact CG-CD2 3.53Å; P158-Y165 HydrophobicContact CG-CE2 3.76Å; P158-Y165 HydrophobicContact CG-CG 4.18Å; P158-P285 HydrophobicContact CB-CG 4.15Å; P158-P285 HydrophobicContact CG-CG 3.67Å
159	N	74.5	Confident	86.7	Confident	91 Å²	91	60.1 Å²	60.1	49%	0.487	32%	0.32	S	S	.	.	S	Bend	trans	-143.4	140.8	168.3	179.7	6.9	0	0	0	107.4	A157 E161 D162	A157-N159 PolarHBondContact O-N 3.2Å; N159-E161 PolarHBondContact O-N 2.9Å; N159-E161 VanDerWaalsContact O-N 3.15Å; N159-E161 PolarHBondContact OD1-N 2.81Å; N159-D162 HydrophobicContact CB-CB 3.95Å; N159-D162 PolarHBondContact O-N 2.96Å; N159-D162 VanDerWaalsContact O-N 3.1Å
160	A	67.8	Low	86.2	Confident	87 Å²	87	61.6 Å²	61.6	72%	0.719	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-21	-177.9	0	0	0	0	0	113.4
161	E	68.8	Low	85.8	Confident	163 Å²	163	65.9 Å²	65.9	76%	0.762	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-7.9	178.7	-60.4	-177.3	169.5	0	0	113.3	N159 L163	N159-E161 PolarHBondContact O-N 2.9Å; N159-E161 VanDerWaalsContact O-N 3.15Å; N159-E161 PolarHBondContact OD1-N 2.81Å; E161-L163 PolarHBondContact O-N 2.95Å; E161-L163 VanDerWaalsContact O-N 3.16Å
162	D	76.6	Confident	85.7	Confident	48 Å²	48	66.6 Å²	66.6	26%	0.257	36%	0.364	S	S	.	.			trans	-83.4	95.9	-177.5	-175.8	7.1	0	0	0	111.2	N159 S164	N159-D162 HydrophobicContact CB-CB 3.95Å; N159-D162 PolarHBondContact O-N 2.96Å; N159-D162 VanDerWaalsContact O-N 3.1Å; D162-S164 PolarHBondContact O-N 2.78Å; D162-S164 WeakPolarHBondContact OD1-CB 3.37Å; D162-S164 PolarHBondContact OD1-N 2.93Å; D162-S164 PolarHBondContact OD1-OG 3.04Å
163	L	86	Confident	85.7	Confident	127 Å²	127	63.2 Å²	63.2	67%	0.665	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-71	-7.5	179.2	-59.4	179.2	0	0	0	113.5	E161 Y165 V166	E161-L163 PolarHBondContact O-N 2.95Å; E161-L163 VanDerWaalsContact O-N 3.16Å; L163-Y165 PolarHBondContact O-N 3.41Å; L163-Y165 VanDerWaalsContact O-N 3.13Å; L163-V166 HydrophobicContact CD2-CG2 4.01Å; L163-V166 WeakPolarHBondContact O-CB 3.43Å; L163-V166 PolarHBondContact O-N 2.85Å
164	S	89.3	Confident	85.7	Confident	56 Å²	56	63.1 Å²	63.1	39%	0.392	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-60.7	-27.4	-177.2	-48.3	0	0	0	0	112.6	D162 P194 S196	D162-S164 PolarHBondContact O-N 2.78Å; D162-S164 WeakPolarHBondContact OD1-CB 3.37Å; D162-S164 PolarHBondContact OD1-N 2.93Å; D162-S164 PolarHBondContact OD1-OG 3.04Å; S164-P194 WeakPolarHBondContact O-CB 3.47Å; S164-S196 WeakPolarHBondContact O-CB 3.36Å; S164-S196 PolarHBondContact O-N 3.42Å; S164-S196 PolarHBondContact O-OG 3.28Å
165	Y	90.9	Very high	85.8	Confident	39 Å²	39	61.9 Å²	61.9	15%	0.153	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-100.4	0.8	179.3	-66.7	-88	0	0	0	113.4	I155 P158 L163 N167 H172 S173 L174 P194 P285	I155-Y165 HydrophobicContact CD1-CD1 3.77Å; I155-Y165 HydrophobicContact CD1-CE1 4.33Å; I155-Y165 HydrophobicContact CD1-CG 4.13Å; P158-Y165 HydrophobicContact CG-CD2 3.53Å; P158-Y165 HydrophobicContact CG-CE2 3.76Å; P158-Y165 HydrophobicContact CG-CG 4.18Å; L163-Y165 PolarHBondContact O-N 3.41Å; L163-Y165 VanDerWaalsContact O-N 3.13Å; Y165-N167 PolarHBondContact O-N 3.11Å; Y165-H172 CarbonylContact O-C 3.55Å; Y165-H172 VanDerWaalsContact O-CA 3.26Å; Y165-H172 WeakPolarHBondContact O-CA 3.29Å; Y165-S173 WeakPolarHBondContact CD1-O 3.27Å; Y165-S173 PolarHBondContact O-N 3.35Å; Y165-L174 HydrophobicContact CD1-CD2 4.08Å; Y165-L174 HydrophobicContact CE1-CD2 3.69Å; Y165-P194 HydrophobicContact CD1-CB 4.06Å; Y165-P194 HydrophobicContact CE1-CB 4.01Å; Y165-P194 HydrophobicContact CE1-CG 4.31Å; Y165-P285 HydrophobicContact CE1-CB 3.76Å; Y165-P285 HydrophobicContact CE1-CG 3.9Å; Y165-P285 HydrophobicContact CE2-CG 4.03Å; Y165-P285 WeakPolarHBondContact OH-CB 3.49Å
166	V	91.8	Very high	86.1	Confident	31 Å²	31	61.7 Å²	61.7	19%	0.188	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-81.8	114.7	-177.5	179.6	0	0	0	0	109.2	L163 L171 S196	L163-V166 HydrophobicContact CD2-CG2 4.01Å; L163-V166 WeakPolarHBondContact O-CB 3.43Å; L163-V166 PolarHBondContact O-N 2.85Å; V166-L171 WeakPolarHBondContact CA-O 3.49Å; V166-S196 VanDerWaalsContact O-CA 3.26Å; V166-S196 WeakPolarHBondContact O-CA 3.02Å; V166-S196 WeakPolarHBondContact O-CB 3.38Å
167	N	90.3	Very high	86.4	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.102	31%	0.312	C	S	.	.			trans	-75.9	176.4	175	68.1	17	0	0	0	111.9	Y165 K169 G170 L171 S173 G195	Y165-N167 PolarHBondContact O-N 3.11Å; N167-K169 PolarHBondContact O-N 3.25Å; N167-K169 WeakPolarHBondContact OD1-CA 3.44Å; N167-K169 WeakPolarHBondContact OD1-CB 3.34Å; N167-K169 PolarHBondContact OD1-N 3.43Å; N167-G170 PolarHBondContact O-N 3.13Å; N167-G170 PolarHBondContact OD1-N 2.87Å; N167-L171 VanDerWaalsContact CG-O 3.23Å; N167-L171 PolarHBondContact N-O 3.33Å; N167-L171 PolarHBondContact OD1-N 3.49Å; N167-L171 PolarHBondContact OD1-O 2.93Å; N167-S173 PolarHBondContact ND2-OG 3.37Å; N167-G195 WeakPolarHBondContact CA-O 3.2Å; N167-G195 WeakPolarHBondContact CB-O 3.23Å
168	R	86.4	Confident	87.2	Confident	122 Å²	122	54.7 Å²	54.7	46%	0.46	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-22	-179.8	-58.9	-175	-160.5	153.5	5	113.7	G170 Y326	R168-G170 VanDerWaalsContact C-N 3.32Å; R168-Y326 VanDerWaalsContact NH1-CD1 3.27Å
169	K	85.5	Confident	88.3	Confident	109 Å²	109	51.8 Å²	51.8	47%	0.474	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	4	176.8	-59	177	-175.8	159.7	0	113.7	N167 L171 E324	N167-K169 PolarHBondContact O-N 3.25Å; N167-K169 WeakPolarHBondContact OD1-CA 3.44Å; N167-K169 WeakPolarHBondContact OD1-CB 3.34Å; N167-K169 PolarHBondContact OD1-N 3.43Å; K169-L171 VanDerWaalsContact C-N 3.28Å; K169-L171 PolarHBondContact O-N 3.21Å; K169-E324 WeakPolarHBondContact CE-OE1 3.44Å; K169-E324 IonicContact NZ-OE1 3.65Å
170	G	87.2	Confident	89.4	Confident	50 Å²	50	47.5 Å²	47.5	52%	0.515	26%	0.259	S	S	.	.	S	Bend	trans	75.9	13.1	-178	0	0	0	0	0	114.2	N167 R168	N167-G170 PolarHBondContact O-N 3.13Å; N167-G170 PolarHBondContact OD1-N 2.87Å; R168-G170 VanDerWaalsContact C-N 3.32Å
171	L	88.8	Confident	90.8	Very high	104 Å²	104	44.3 Å²	44.3	55%	0.545	23%	0.229	S	C	.	.			trans	-103.1	140.5	-179.2	-61.1	176.4	0	0	0	111.3	V166 N167 K169 S173	V166-L171 WeakPolarHBondContact CA-O 3.49Å; N167-L171 VanDerWaalsContact CG-O 3.23Å; N167-L171 PolarHBondContact N-O 3.33Å; N167-L171 PolarHBondContact OD1-N 3.49Å; N167-L171 PolarHBondContact OD1-O 2.93Å; K169-L171 VanDerWaalsContact C-N 3.28Å; K169-L171 PolarHBondContact O-N 3.21Å; L171-S173 PolarHBondContact O-N 2.88Å
172	H	92.1	Very high	92	Very high	39 Å²	39	38.3 Å²	38.3	18%	0.181	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-73.2	122.2	173.7	-67.4	75.3	0	0	0	109.9	I155 A157 Y165	I155-H172 HydrophobicContact CG1-CB 4.36Å; I155-H172 PolarHBondContact N-O 3.33Å; I155-H172 WeakPolarHBondContact O-CB 3.39Å; A157-H172 WeakPolarHBondContact CB-NE2 3.19Å; Y165-H172 CarbonylContact O-C 3.55Å; Y165-H172 VanDerWaalsContact O-CA 3.26Å; Y165-H172 WeakPolarHBondContact O-CA 3.29Å
173	S	94.7	Very high	92.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	160.3	-177.1	58.2	0	0	0	0	112.4	H152 V153 Y165 N167 L171 G195	H152-S173 PolarHBondContact ND1-OG 2.97Å; V153-S173 CarbonylContact O-C 3.49Å; V153-S173 WeakPolarHBondContact O-CA 3.48Å; V153-S173 VanDerWaalsContact O-CB 3.3Å; V153-S173 WeakPolarHBondContact O-CB 3.29Å; Y165-S173 WeakPolarHBondContact CD1-O 3.27Å; Y165-S173 PolarHBondContact O-N 3.35Å; N167-S173 PolarHBondContact ND2-OG 3.37Å; L171-S173 PolarHBondContact O-N 2.88Å; S173-G195 WeakPolarHBondContact O-CA 3.28Å; S173-G195 PolarHBondContact O-N 3.34Å
174	L	96	Very high	93.3	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.6	158.5	-71.7	167.9	0	0	0	108.1	H152 V153 I155 Y165 W193 P285 I292	H152-L174 WeakPolarHBondContact CA-O 3.41Å; V153-L174 PolarHBondContact N-O 2.82Å; V153-L174 PolarHBondContact O-N 2.92Å; I155-L174 HydrophobicContact CD1-CG 4.22Å; I155-L174 HydrophobicContact CG2-CD1 3.94Å; I155-L174 HydrophobicContact CG2-CG 3.98Å; Y165-L174 HydrophobicContact CD1-CD2 4.08Å; Y165-L174 HydrophobicContact CE1-CD2 3.69Å; L174-W193 CarbonylContact C-O 3.5Å; L174-W193 WeakPolarHBondContact CA-O 3.45Å; L174-P285 WeakPolarHBondContact CD1-O 3.3Å; L174-P285 HydrophobicContact CD2-CB 4.28Å; L174-I292 HydrophobicContact CB-CD1 4.26Å; L174-I292 HydrophobicContact CD1-CD1 3.73Å
175	N	96.7	Very high	93.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	127.2	166.5	-165	-9.8	0	0	0	108	C150 W193 L197 D199 V202	C150-N175 VanDerWaalsContact CB-OD1 3.23Å; C150-N175 WeakPolarHBondContact CB-OD1 3.31Å; C150-N175 PolarHBondContact SG-OD1 3.48Å; N175-W193 HydrophobicContact CB-CB 4.15Å; N175-W193 PolarHBondContact N-O 3.04Å; N175-W193 VanDerWaalsContact O-CB 3.29Å; N175-W193 WeakPolarHBondContact O-CB 3.17Å; N175-W193 PolarHBondContact O-N 3.32Å; N175-L197 PolarHBondContact ND2-O 3.49Å; N175-L197 VanDerWaalsContact ND2-O 3.07Å; N175-D199 PolarHBondContact ND2-OD1 2.64Å; N175-V202 HydrophobicContact CB-CG2 4.38Å
176	C	97.6	Very high	94	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	113.7	-176.6	-56.2	0	0	0	0	109.7	C150 I151 M178 E190	C150-C176 CarbonylContact C-O 3.53Å; C150-C176 WeakPolarHBondContact CA-O 3.39Å; I151-C176 HydrophobicContact CG2-CB 3.83Å; I151-C176 PolarHBondContact N-O 3.08Å; I151-C176 WeakPolarHBondContact O-CB 3.07Å; I151-C176 PolarHBondContact O-N 2.94Å; C176-M178 HydrophobicContact CB-CE 3.91Å; C176-E190 CarbonylContact C-O 3.53Å; C176-E190 WeakPolarHBondContact CA-O 3.13Å
177	L	97.9	Very high	94.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	129.7	174.5	-173.7	75	0	0	0	109.2	V148 C150 V189 E190 V202 L203 F228	V148-L177 HydrophobicContact CG2-CD1 3.57Å; V148-L177 HydrophobicContact CG2-CG 4.14Å; C150-L177 VanDerWaalsContact SG-CD1 3.59Å; L177-V189 WeakPolarHBondContact O-CA 3.27Å; L177-E190 HydrophobicContact CB-CB 4.4Å; L177-E190 PolarHBondContact N-O 2.95Å; L177-E190 PolarHBondContact O-N 2.93Å; L177-V202 HydrophobicContact CB-CG1 3.71Å; L177-V202 HydrophobicContact CD1-CG1 4.36Å; L177-V202 HydrophobicContact CD2-CG1 4.41Å; L177-V202 HydrophobicContact CG-CG1 4.39Å; L177-L203 HydrophobicContact CD1-CB 4.34Å; L177-L203 HydrophobicContact CD1-CD1 4.35Å; L177-L203 HydrophobicContact CD2-CD1 3.9Å; L177-F228 HydrophobicContact CD1-CE1 4.2Å; L177-F228 HydrophobicContact CD1-CZ 4.27Å
178	M	98.1	Very high	94.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.1	176.5	-57.8	-168.9	-171.8	0	0	110.8	V148 D149 I151 C176 L186 T188 V189 I260 F264 L267 I292 C296	V148-M178 WeakPolarHBondContact CA-O 3.44Å; D149-M178 PolarHBondContact N-O 3.1Å; D149-M178 VanDerWaalsContact N-O 3.13Å; D149-M178 PolarHBondContact O-N 3.44Å; I151-M178 HydrophobicContact CG2-CE 3.78Å; I151-M178 HydrophobicContact CG2-SD 4.37Å; C176-M178 HydrophobicContact CB-CE 3.91Å; M178-L186 HydrophobicContact CB-CD2 4.16Å; M178-L186 HydrophobicContact SD-CD1 4.23Å; M178-L186 HydrophobicContact SD-CD2 4Å; M178-T188 CarbonylContact C-O 3.58Å; M178-T188 WeakPolarHBondContact CA-O 3.32Å; M178-V189 HydrophobicContact CE-CG1 4.06Å; M178-V189 HydrophobicContact CG-CG1 4.14Å; M178-V189 HydrophobicContact CG-CG2 4.46Å; M178-V189 HydrophobicContact SD-CG1 4.39Å; M178-I260 VanDerWaalsContact O-CD1 3.26Å; M178-I260 WeakPolarHBondContact O-CD1 3.49Å; M178-F264 HydrophobicContact CB-CE1 3.85Å; M178-F264 HydrophobicContact CB-CZ 4.2Å; M178-F264 HydrophobicContact CG-CE1 4.03Å; M178-F264 HydrophobicContact SD-CD1 4.33Å; M178-F264 HydrophobicContact SD-CE1 3.7Å; M178-L267 HydrophobicContact CE-CD2 4.08Å; M178-L267 HydrophobicContact SD-CD2 4.2Å; M178-I292 HydrophobicContact CE-CG2 4.18Å; M178-C296 VanDerWaalsContact CE-SG 3.57Å
179	V	98	Very high	95.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132	169	-172.9	0	0	0	0	108.3	F121 V147 V148 L186 M187 T188 L208 L222	F121-V179 HydrophobicContact CE2-CG1 4.21Å; V147-V179 CarbonylContact O-C 3.57Å; V147-V179 VanDerWaalsContact O-CA 3.24Å; V147-V179 WeakPolarHBondContact O-CA 3.49Å; V147-V179 WeakPolarHBondContact O-CG1 3.43Å; V148-V179 HydrophobicContact CB-CG2 3.99Å; V148-V179 HydrophobicContact CG2-CG2 3.87Å; V179-L186 CarbonylContact O-C 3.58Å; V179-L186 WeakPolarHBondContact O-CA 3.41Å; V179-M187 HydrophobicContact CG1-CE 3.76Å; V179-M187 PolarHBondContact O-N 3.13Å; V179-T188 PolarHBondContact N-O 2.86Å; V179-T188 PolarHBondContact O-N 2.54Å; V179-L208 HydrophobicContact CG2-CD2 3.41Å; V179-L208 VanDerWaalsContact CG2-CD2 3.41Å; V179-L222 HydrophobicContact CG1-CD2 3.96Å
180	C	97.6	Very high	95.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	154.6	175.7	74.7	0	0	0	0	113.5	G146 V147 A185 L186	G146-C180 WeakPolarHBondContact CA-O 3.2Å; V147-C180 PolarHBondContact N-O 3.03Å; V147-C180 VanDerWaalsContact N-O 3.08Å; V147-C180 PolarHBondContact O-N 3.22Å; C180-A185 CarbonylContact C-O 3.15Å; C180-A185 WeakPolarHBondContact CA-O 3.39Å; C180-A185 WeakPolarHBondContact CB-O 3.46Å; C180-L186 HydrophobicContact CB-CD2 4.21Å
181	D	96.3	Very high	96.1	Very high	20 Å²	20	20.6 Å²	20.6	11%	0.107	10%	0.101	C	C	.	.			trans	-77.8	-177.6	168	74.2	6.3	0	0	0	111.5	L131 F135 R183 G184 A185 M187 V259	L131-D181 HydrophobicContact CD2-CB 3.69Å; F135-D181 VanDerWaalsContact CZ-C 3.46Å; D181-R183 PolarHBondContact O-N 2.94Å; D181-R183 VanDerWaalsContact OD1-CA 3.32Å; D181-R183 WeakPolarHBondContact OD1-CA 3.26Å; D181-R183 WeakPolarHBondContact OD1-CB 3.37Å; D181-R183 PolarHBondContact OD1-N 3.19Å; D181-G184 PolarHBondContact O-N 3.47Å; D181-G184 PolarHBondContact OD1-N 3.29Å; D181-A185 PolarHBondContact N-O 3.32Å; D181-A185 WeakPolarHBondContact OD1-CB 3.36Å; D181-A185 PolarHBondContact OD1-N 2.92Å; D181-A185 WeakPolarHBondContact OD2-CB 3.27Å; D181-M187 HydrophobicContact CB-CE 4.27Å; D181-M187 HydrophobicContact CB-SD 4.05Å; D181-V259 WeakPolarHBondContact O-CG1 3.34Å
182	I	94.4	Very high	96.3	Very high	37 Å²	37	20.2 Å²	20.2	19%	0.19	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.5	178.8	-171.2	166.8	0	0	0	113.5	E134 F135 L138 G184	E134-I182 HydrophobicContact CB-CD1 4.23Å; E134-I182 HydrophobicContact CB-CG2 4.02Å; E134-I182 WeakPolarHBondContact O-CD1 3.46Å; E134-I182 VanDerWaalsContact OE2-CG2 3.23Å; E134-I182 WeakPolarHBondContact OE2-CG2 3.41Å; F135-I182 HydrophobicContact CD1-CB 4.13Å; F135-I182 HydrophobicContact CD1-CG1 4.48Å; F135-I182 HydrophobicContact CE1-CB 3.96Å; F135-I182 HydrophobicContact CZ-CB 4.26Å; F135-I182 VanDerWaalsContact CZ-N 3.27Å; L138-I182 HydrophobicContact CB-CD1 3.83Å; L138-I182 HydrophobicContact CD2-CD1 4.34Å; L138-I182 HydrophobicContact CD2-CG1 4.3Å; L138-I182 HydrophobicContact CG-CD1 4.48Å; I182-G184 VanDerWaalsContact C-N 3.27Å
183	R	93.4	Very high	96.5	Very high	128 Å²	128	20 Å²	20	48%	0.483	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-3	179	-68	177.4	51.8	-145.5	-8.5	112.1	D181 A185 L303 V309	D181-R183 PolarHBondContact O-N 2.94Å; D181-R183 VanDerWaalsContact OD1-CA 3.32Å; D181-R183 WeakPolarHBondContact OD1-CA 3.26Å; D181-R183 WeakPolarHBondContact OD1-CB 3.37Å; D181-R183 PolarHBondContact OD1-N 3.19Å; R183-A185 VanDerWaalsContact C-N 3.31Å; R183-L303 PolarHBondContact NH2-O 3.39Å; R183-V309 VanDerWaalsContact O-CG2 3.29Å; R183-V309 WeakPolarHBondContact O-CG2 3.46Å
184	G	95.7	Very high	96.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.106	C	C	.	.			trans	76.1	16.9	-173.8	0	0	0	0	0	113.6	D181 I182 T263 H299	D181-G184 PolarHBondContact O-N 3.47Å; D181-G184 PolarHBondContact OD1-N 3.29Å; I182-G184 VanDerWaalsContact C-N 3.27Å; G184-T263 WeakPolarHBondContact CA-OG1 3.47Å; G184-T263 VanDerWaalsContact O-CG2 3.3Å; G184-T263 WeakPolarHBondContact O-CG2 3.2Å; G184-H299 PolarHBondContact O-NE2 3.37Å
185	A	96.6	Very high	96.4	Very high	16 Å²	16	21.5 Å²	21.5	13%	0.132	11%	0.107	C	C	.	.			trans	-74.4	131.5	169.9	0	0	0	0	0	109.4	C180 D181 R183 M187 L303	C180-A185 CarbonylContact C-O 3.15Å; C180-A185 WeakPolarHBondContact CA-O 3.39Å; C180-A185 WeakPolarHBondContact CB-O 3.46Å; D181-A185 PolarHBondContact N-O 3.32Å; D181-A185 WeakPolarHBondContact OD1-CB 3.36Å; D181-A185 PolarHBondContact OD1-N 2.92Å; D181-A185 WeakPolarHBondContact OD2-CB 3.27Å; R183-A185 VanDerWaalsContact C-N 3.31Å; A185-M187 PolarHBondContact O-N 3.4Å; A185-L303 HydrophobicContact CB-CD1 3.94Å
186	L	98.1	Very high	96.2	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.1	-175.3	-59.7	170.8	0	0	0	110.1	M178 V179 C180 V189 T263 C296 N300	M178-L186 HydrophobicContact CB-CD2 4.16Å; M178-L186 HydrophobicContact SD-CD1 4.23Å; M178-L186 HydrophobicContact SD-CD2 4Å; V179-L186 CarbonylContact O-C 3.58Å; V179-L186 WeakPolarHBondContact O-CA 3.41Å; C180-L186 HydrophobicContact CB-CD2 4.21Å; L186-V189 HydrophobicContact CB-CG2 3.72Å; L186-V189 HydrophobicContact CD1-CG2 3.99Å; L186-V189 HydrophobicContact CG-CG2 4.33Å; L186-T263 HydrophobicContact CD2-CG2 4.06Å; L186-C296 HydrophobicContact CD1-CB 3.53Å; L186-N300 PolarHBondContact N-ND2 2.71Å; L186-N300 PolarHBondContact N-OD1 3.27Å; L186-N300 PolarHBondContact O-ND2 2.63Å
187	M	96.9	Very high	96.1	Very high	13 Å²	13	26.8 Å²	26.8	6%	0.064	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-31.2	-179.9	-64.9	-175.8	-63.4	0	0	112.1	I119 R120 F121 P122 L131 M145 V179 D181 A185	I119-M187 WeakPolarHBondContact CG2-O 3.37Å; R120-M187 CarbonylContact C-O 3.53Å; R120-M187 PolarHBondContact N-O 3.18Å; F121-M187 HydrophobicContact CD2-CB 3.87Å; F121-M187 HydrophobicContact CD2-CE 4.47Å; F121-M187 HydrophobicContact CE2-CB 4.47Å; F121-M187 HydrophobicContact CE2-CE 4.02Å; F121-M187 HydrophobicContact CE2-SD 4.49Å; F121-M187 PolarHBondContact N-O 2.95Å; P122-M187 HydrophobicContact CG-SD 4.43Å; L131-M187 HydrophobicContact CD1-SD 4.13Å; M145-M187 VanDerWaalsContact O-CE 3.24Å; M145-M187 WeakPolarHBondContact O-CE 3.47Å; V179-M187 HydrophobicContact CG1-CE 3.76Å; V179-M187 PolarHBondContact O-N 3.13Å; D181-M187 HydrophobicContact CB-CE 4.27Å; D181-M187 HydrophobicContact CB-SD 4.05Å; A185-M187 PolarHBondContact O-N 3.4Å
188	T	96.8	Very high	95.8	Very high	17 Å²	17	31.3 Å²	31.3	10%	0.104	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	138	176.9	-58.2	0	0	0	0	108.7	M178 V179 L208	M178-T188 CarbonylContact C-O 3.58Å; M178-T188 WeakPolarHBondContact CA-O 3.32Å; V179-T188 PolarHBondContact N-O 2.86Å; V179-T188 PolarHBondContact O-N 2.54Å; T188-L208 HydrophobicContact CG2-CB 4.45Å; T188-L208 HydrophobicContact CG2-CD1 4.41Å
189	V	97.8	Very high	95.6	Very high	20 Å²	20	31.8 Å²	31.8	12%	0.121	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	120.7	178	-174.1	0	0	0	0	109.1	I119 L177 M178 L186 T191 L293 C296	I119-V189 HydrophobicContact CD1-CB 4.26Å; I119-V189 HydrophobicContact CD1-CG2 3.84Å; I119-V189 HydrophobicContact CG1-CG2 4.39Å; I119-V189 HydrophobicContact CG2-CB 4.44Å; I119-V189 HydrophobicContact CG2-CG2 3.95Å; L177-V189 WeakPolarHBondContact O-CA 3.27Å; M178-V189 HydrophobicContact CE-CG1 4.06Å; M178-V189 HydrophobicContact CG-CG1 4.14Å; M178-V189 HydrophobicContact CG-CG2 4.46Å; M178-V189 HydrophobicContact SD-CG1 4.39Å; L186-V189 HydrophobicContact CB-CG2 3.72Å; L186-V189 HydrophobicContact CD1-CG2 3.99Å; L186-V189 HydrophobicContact CG-CG2 4.33Å; V189-T191 HydrophobicContact CG1-CG2 3.49Å; V189-T191 VanDerWaalsContact CG1-CG2 3.49Å; V189-L293 HydrophobicContact CB-CD1 4.29Å; V189-L293 HydrophobicContact CG1-CD1 4.2Å; V189-C296 HydrophobicContact CG1-CB 4.18Å; V189-C296 HydrophobicContact CG2-CB 4.13Å
190	E	96.9	Very high	95.4	Very high	24 Å²	24	32.3 Å²	32.3	11%	0.112	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.5	171.6	-61.7	-168.2	-174.2	0	0	109.7	C176 L177 W193 S206 S207	C176-E190 CarbonylContact C-O 3.53Å; C176-E190 WeakPolarHBondContact CA-O 3.13Å; L177-E190 HydrophobicContact CB-CB 4.4Å; L177-E190 PolarHBondContact N-O 2.95Å; L177-E190 PolarHBondContact O-N 2.93Å; E190-W193 WeakPolarHBondContact OE2-CZ2 3.14Å; E190-W193 PolarHBondContact OE2-NE1 2.87Å; E190-S206 WeakPolarHBondContact OE1-CB 3.11Å; E190-S206 WeakPolarHBondContact OE2-CA 3.42Å; E190-S206 WeakPolarHBondContact OE2-CB 3.46Å; E190-S207 WeakPolarHBondContact OE1-CB 3.35Å; E190-S207 PolarHBondContact OE1-N 2.84Å; E190-S207 PolarHBondContact OE1-OG 3.11Å
191	T	96.8	Very high	95.2	Very high	8 Å²	8	33.5 Å²	33.5	5%	0.049	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	11.6	-165.4	53.8	0	0	0	0	114.4	V189 S289 I292 L293	V189-T191 HydrophobicContact CG1-CG2 3.49Å; V189-T191 VanDerWaalsContact CG1-CG2 3.49Å; T191-S289 WeakPolarHBondContact CB-OG 3.45Å; T191-S289 VanDerWaalsContact O-CB 3.26Å; T191-S289 WeakPolarHBondContact O-CB 3.44Å; T191-S289 PolarHBondContact O-OG 2.97Å; T191-S289 PolarHBondContact OG1-O 3.43Å; T191-S289 PolarHBondContact OG1-OG 3.47Å; T191-I292 HydrophobicContact CG2-CB 3.97Å; T191-I292 HydrophobicContact CG2-CG2 3.53Å; T191-L293 HydrophobicContact CG2-CB 4.25Å
192	N	94	Very high	95.2	Very high	97 Å²	97	32.5 Å²	32.5	52%	0.519	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	6.5	-167	63.9	-36.9	0	0	0	113.7
193	W	96	Very high	95.3	Very high	35 Å²	35	31.1 Å²	31.1	13%	0.133	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	134.1	-177.7	-59.1	102.4	0	0	0	111.5	L174 N175 E190 L197 V202 Q205	L174-W193 CarbonylContact C-O 3.5Å; L174-W193 WeakPolarHBondContact CA-O 3.45Å; N175-W193 HydrophobicContact CB-CB 4.15Å; N175-W193 PolarHBondContact N-O 3.04Å; N175-W193 VanDerWaalsContact O-CB 3.29Å; N175-W193 WeakPolarHBondContact O-CB 3.17Å; N175-W193 PolarHBondContact O-N 3.32Å; E190-W193 WeakPolarHBondContact OE2-CZ2 3.14Å; E190-W193 PolarHBondContact OE2-NE1 2.87Å; W193-L197 HydrophobicContact CB-CD1 4.45Å; W193-L197 HydrophobicContact CD2-CD1 4.47Å; W193-L197 HydrophobicContact CE3-CD1 3.58Å; W193-L197 HydrophobicContact CZ3-CD1 4.25Å; W193-V202 HydrophobicContact CB-CG1 4.33Å; W193-V202 HydrophobicContact CB-CG2 3.75Å; W193-V202 HydrophobicContact CD2-CG1 4.14Å; W193-V202 HydrophobicContact CD2-CG2 4.22Å; W193-V202 HydrophobicContact CG-CB 4.29Å; W193-V202 HydrophobicContact CG-CG1 3.69Å; W193-V202 HydrophobicContact CG-CG2 3.82Å; W193-Q205 HydrophobicContact CH2-CB 3.35Å; W193-Q205 HydrophobicContact CH2-CG 4.48Å; W193-Q205 HydrophobicContact CZ2-CB 4.02Å; W193-Q205 HydrophobicContact CZ3-CB 3.9Å; W193-Q205 VanDerWaalsContact CZ3-OE1 3.31Å
194	P	94.8	Very high	95.3	Very high	30 Å²	30	30.7 Å²	30.7	20%	0.195	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	140.5	174.2	-21.4	31.1	0	0	0	112	S164 Y165 S196 L197	S164-P194 WeakPolarHBondContact O-CB 3.47Å; Y165-P194 HydrophobicContact CD1-CB 4.06Å; Y165-P194 HydrophobicContact CE1-CB 4.01Å; Y165-P194 HydrophobicContact CE1-CG 4.31Å; P194-S196 PolarHBondContact O-N 3.38Å; P194-L197 WeakPolarHBondContact O-CB 3.37Å; P194-L197 PolarHBondContact O-N 2.98Å
195	G	93.3	Very high	95.1	Very high	3 Å²	3	36.2 Å²	36.2	3%	0.031	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-15.7	-177.1	0	0	0	0	0	115.7	H152 N167 S173 L197	H152-G195 PolarHBondContact CE1-O 2.58Å; N167-G195 WeakPolarHBondContact CA-O 3.2Å; N167-G195 WeakPolarHBondContact CB-O 3.23Å; S173-G195 WeakPolarHBondContact O-CA 3.28Å; S173-G195 PolarHBondContact O-N 3.34Å; G195-L197 VanDerWaalsContact C-N 3.33Å
196	S	93.4	Very high	94.9	Very high	62 Å²	62	35.5 Å²	35.5	43%	0.434	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-19.5	173.4	64.3	0	0	0	0	113.8	S164 V166 P194	S164-S196 WeakPolarHBondContact O-CB 3.36Å; S164-S196 PolarHBondContact O-N 3.42Å; S164-S196 PolarHBondContact O-OG 3.28Å; V166-S196 VanDerWaalsContact O-CA 3.26Å; V166-S196 WeakPolarHBondContact O-CA 3.02Å; V166-S196 WeakPolarHBondContact O-CB 3.38Å; P194-S196 PolarHBondContact O-N 3.38Å
197	L	94.4	Very high	94.5	Very high	50 Å²	50	38.5 Å²	38.5	26%	0.262	21%	0.21	S	C	.	.	S	Bend	trans	-74.1	132.9	179.7	-67	-177.5	0	0	0	110.5	N175 W193 P194 G195 V202	N175-L197 PolarHBondContact ND2-O 3.49Å; N175-L197 VanDerWaalsContact ND2-O 3.07Å; W193-L197 HydrophobicContact CB-CD1 4.45Å; W193-L197 HydrophobicContact CD2-CD1 4.47Å; W193-L197 HydrophobicContact CE3-CD1 3.58Å; W193-L197 HydrophobicContact CZ3-CD1 4.25Å; P194-L197 WeakPolarHBondContact O-CB 3.37Å; P194-L197 PolarHBondContact O-N 2.98Å; G195-L197 VanDerWaalsContact C-N 3.33Å; L197-V202 HydrophobicContact CB-CG2 3.77Å; L197-V202 HydrophobicContact CD1-CG2 4.37Å
198	Q	92.8	Very high	94	Very high	94 Å²	94	37.9 Å²	37.9	44%	0.439	21%	0.207	S	C	.	.			trans	-69.7	150	172.7	-61.2	-177.5	-9.6	0	0	110.7	C200 A201 V202	Q198-C200 VanDerWaalsContact C-N 3.28Å; Q198-C200 PolarHBondContact O-N 3.44Å; Q198-A201 WeakPolarHBondContact O-CB 3.12Å; Q198-A201 PolarHBondContact O-N 2.97Å; Q198-V202 PolarHBondContact O-N 2.97Å
199	D	94.4	Very high	93.6	Very high	10 Å²	10	37.2 Å²	37.2	5%	0.053	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-39.2	-174.9	-54	-39.7	0	0	0	112.7	C150 N175 A201 V202 L203 S227 F228	C150-D199 HydrophobicContact CB-CB 3.97Å; C150-D199 VanDerWaalsContact CB-CG 3.49Å; C150-D199 WeakPolarHBondContact CB-OD1 3.45Å; C150-D199 PolarHBondContact SG-OD1 3.39Å; C150-D199 VanDerWaalsContact SG-OD1 3.38Å; N175-D199 PolarHBondContact ND2-OD1 2.64Å; D199-A201 PolarHBondContact O-N 3.25Å; D199-V202 WeakPolarHBondContact O-CB 3.3Å; D199-V202 PolarHBondContact O-N 3.04Å; D199-L203 PolarHBondContact O-N 2.85Å; D199-S227 WeakPolarHBondContact CB-OG 3.43Å; D199-F228 HydrophobicContact CB-CD1 4.49Å; D199-F228 HydrophobicContact CB-CE1 3.82Å; D199-F228 HydrophobicContact CB-CZ 3.94Å; D199-F228 WeakPolarHBondContact O-CE1 3.31Å
200	C	92.9	Very high	93.1	Very high	11 Å²	11	40.2 Å²	40.2	7%	0.074	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-37.7	174.1	62.5	0	0	0	0	114.5	Q198 V202 L203 Q204 S227 F229 M329	Q198-C200 VanDerWaalsContact C-N 3.28Å; Q198-C200 PolarHBondContact O-N 3.44Å; C200-V202 VanDerWaalsContact C-N 3.35Å; C200-L203 PolarHBondContact O-N 3.48Å; C200-Q204 VanDerWaalsContact O-CB 3.29Å; C200-Q204 WeakPolarHBondContact O-CB 3.48Å; C200-Q204 PolarHBondContact O-N 2.92Å; C200-S227 WeakPolarHBondContact CB-O 3.48Å; C200-F229 HydrophobicContact CB-CD2 3.77Å; C200-F229 HydrophobicContact CB-CE2 3.84Å; C200-M329 HydrophobicContact CB-CE 3.52Å; C200-M329 HydrophobicContact CB-SD 4.26Å
201	A	94.3	Very high	92.5	Very high	25 Å²	25	43.3 Å²	43.3	21%	0.207	24%	0.239	C	C	.	.	H	α-helix	trans	-70.5	-37.7	176.9	0	0	0	0	0	110.5	Q198 D199 Q204 Q205	Q198-A201 WeakPolarHBondContact O-CB 3.12Å; Q198-A201 PolarHBondContact O-N 2.97Å; D199-A201 PolarHBondContact O-N 3.25Å; A201-Q204 PolarHBondContact O-N 3.49Å; A201-Q205 WeakPolarHBondContact O-CB 3.43Å; A201-Q205 VanDerWaalsContact O-CG 3.3Å; A201-Q205 WeakPolarHBondContact O-CG 3.42Å; A201-Q205 PolarHBondContact O-N 3.18Å; A201-Q205 VanDerWaalsContact O-N 3.09Å
202	V	95.7	Very high	92.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.2	-51.5	172	167.9	0	0	0	0	110.5	N175 L177 W193 L197 Q198 D199 C200 Q204 Q205 S206	N175-V202 HydrophobicContact CB-CG2 4.38Å; L177-V202 HydrophobicContact CB-CG1 3.71Å; L177-V202 HydrophobicContact CD1-CG1 4.36Å; L177-V202 HydrophobicContact CD2-CG1 4.41Å; L177-V202 HydrophobicContact CG-CG1 4.39Å; W193-V202 HydrophobicContact CB-CG1 4.33Å; W193-V202 HydrophobicContact CB-CG2 3.75Å; W193-V202 HydrophobicContact CD2-CG1 4.14Å; W193-V202 HydrophobicContact CD2-CG2 4.22Å; W193-V202 HydrophobicContact CG-CB 4.29Å; W193-V202 HydrophobicContact CG-CG1 3.69Å; W193-V202 HydrophobicContact CG-CG2 3.82Å; L197-V202 HydrophobicContact CB-CG2 3.77Å; L197-V202 HydrophobicContact CD1-CG2 4.37Å; Q198-V202 PolarHBondContact O-N 2.97Å; D199-V202 WeakPolarHBondContact O-CB 3.3Å; D199-V202 PolarHBondContact O-N 3.04Å; C200-V202 VanDerWaalsContact C-N 3.35Å; V202-Q204 PolarHBondContact O-N 3.13Å; V202-Q205 PolarHBondContact O-N 3.22Å; V202-S206 PolarHBondContact O-N 2.83Å
203	L	95.4	Very high	91.7	Very high	8 Å²	8	44.3 Å²	44.3	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-46	177.7	179.6	62	0	0	0	111.5	V148 L177 D199 C200 Q205 S206 L208 S209 F228 W233 L234	V148-L203 HydrophobicContact CG2-CD1 4.31Å; L177-L203 HydrophobicContact CD1-CB 4.34Å; L177-L203 HydrophobicContact CD1-CD1 4.35Å; L177-L203 HydrophobicContact CD2-CD1 3.9Å; D199-L203 PolarHBondContact O-N 2.85Å; C200-L203 PolarHBondContact O-N 3.48Å; L203-Q205 VanDerWaalsContact C-N 3.26Å; L203-Q205 PolarHBondContact O-N 3.09Å; L203-S206 VanDerWaalsContact O-CB 3.31Å; L203-S206 WeakPolarHBondContact O-CB 3.14Å; L203-S206 PolarHBondContact O-N 3.33Å; L203-S206 VanDerWaalsContact O-N 3.09Å; L203-S206 PolarHBondContact O-OG 3.19Å; L203-L208 HydrophobicContact CD1-CD2 4.15Å; L203-S209 VanDerWaalsContact O-CB 3.25Å; L203-S209 WeakPolarHBondContact O-CB 3.17Å; L203-F228 HydrophobicContact CB-CD1 3.83Å; L203-F228 HydrophobicContact CB-CE1 3.77Å; L203-F228 HydrophobicContact CD2-CD1 3.48Å; L203-F228 VanDerWaalsContact CD2-CD1 3.48Å; L203-F228 HydrophobicContact CD2-CE1 3.95Å; L203-F228 HydrophobicContact CD2-CG 4.15Å; L203-F228 HydrophobicContact CG-CD1 4.3Å; L203-F228 HydrophobicContact CG-CE1 4.45Å; L203-W233 HydrophobicContact CD1-CH2 4.28Å; L203-W233 HydrophobicContact CD2-CH2 4.14Å; L203-W233 HydrophobicContact CD2-CZ3 4.4Å; L203-W233 HydrophobicContact CG-CH2 4.2Å; L203-L234 HydrophobicContact CD2-CD1 4.48Å; L203-L234 HydrophobicContact CD2-CD2 3.44Å; L203-L234 VanDerWaalsContact CD2-CD2 3.44Å
204	Q	93.4	Very high	91.1	Very high	119 Å²	119	46.3 Å²	46.3	56%	0.556	26%	0.264	S	S	*	.	H	α-helix	trans	-60.8	-33.7	-179.5	-176.3	177.5	-9.1	0	0	113.1	C200 A201 V202	C200-Q204 VanDerWaalsContact O-CB 3.29Å; C200-Q204 WeakPolarHBondContact O-CB 3.48Å; C200-Q204 PolarHBondContact O-N 2.92Å; A201-Q204 PolarHBondContact O-N 3.49Å; V202-Q204 PolarHBondContact O-N 3.13Å
205	Q	93.6	Very high	90	Very high	116 Å²	116	47.1 Å²	47.1	54%	0.542	28%	0.278	S	S	.	.	H	α-helix	trans	-90	-7	178.9	-63.2	176.9	37.7	0	0	113.2	W193 A201 V202 L203	W193-Q205 HydrophobicContact CH2-CB 3.35Å; W193-Q205 HydrophobicContact CH2-CG 4.48Å; W193-Q205 HydrophobicContact CZ2-CB 4.02Å; W193-Q205 HydrophobicContact CZ3-CB 3.9Å; W193-Q205 VanDerWaalsContact CZ3-OE1 3.31Å; A201-Q205 WeakPolarHBondContact O-CB 3.43Å; A201-Q205 VanDerWaalsContact O-CG 3.3Å; A201-Q205 WeakPolarHBondContact O-CG 3.42Å; A201-Q205 PolarHBondContact O-N 3.18Å; A201-Q205 VanDerWaalsContact O-N 3.09Å; V202-Q205 PolarHBondContact O-N 3.22Å; L203-Q205 VanDerWaalsContact C-N 3.26Å; L203-Q205 PolarHBondContact O-N 3.09Å
206	S	92.3	Very high	88.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-68.9	153.3	-179.6	74.9	0	0	0	0	112.6	E190 V202 L203 L208 S209	E190-S206 WeakPolarHBondContact OE1-CB 3.11Å; E190-S206 WeakPolarHBondContact OE2-CA 3.42Å; E190-S206 WeakPolarHBondContact OE2-CB 3.46Å; V202-S206 PolarHBondContact O-N 2.83Å; L203-S206 VanDerWaalsContact O-CB 3.31Å; L203-S206 WeakPolarHBondContact O-CB 3.14Å; L203-S206 PolarHBondContact O-N 3.33Å; L203-S206 VanDerWaalsContact O-N 3.09Å; L203-S206 PolarHBondContact O-OG 3.19Å; S206-L208 PolarHBondContact O-N 2.96Å; S206-L208 PolarHBondContact OG-N 3.31Å; S206-S209 PolarHBondContact O-N 2.82Å; S206-S209 PolarHBondContact OG-N 2.99Å
207	S	88	Confident	88	Confident	67 Å²	67	52.3 Å²	52.3	47%	0.469	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-23.2	172.3	62.2	0	0	0	0	112.8	E190 Q211	E190-S207 WeakPolarHBondContact OE1-CB 3.35Å; E190-S207 PolarHBondContact OE1-N 2.84Å; E190-S207 PolarHBondContact OE1-OG 3.11Å; S207-Q211 WeakPolarHBondContact O-CG 3.5Å; S207-Q211 PolarHBondContact O-NE2 2.94Å
208	L	86.5	Confident	87.2	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-69	-47.2	177.8	-173	72.1	0	0	0	111.7	F121 V179 T188 L203 S206 S210 Q211 F212 L222	F121-L208 HydrophobicContact CD2-CD1 4.33Å; F121-L208 HydrophobicContact CE2-CD1 4.44Å; V179-L208 HydrophobicContact CG2-CD2 3.41Å; V179-L208 VanDerWaalsContact CG2-CD2 3.41Å; T188-L208 HydrophobicContact CG2-CB 4.45Å; T188-L208 HydrophobicContact CG2-CD1 4.41Å; L203-L208 HydrophobicContact CD1-CD2 4.15Å; S206-L208 PolarHBondContact O-N 2.96Å; S206-L208 PolarHBondContact OG-N 3.31Å; L208-S210 VanDerWaalsContact C-N 3.25Å; L208-S210 PolarHBondContact O-N 3.46Å; L208-Q211 WeakPolarHBondContact O-CB 3.22Å; L208-Q211 PolarHBondContact O-N 3.45Å; L208-F212 HydrophobicContact CD1-CD2 3.97Å; L208-F212 HydrophobicContact CD1-CE2 3.57Å; L208-F212 HydrophobicContact CG-CD2 4.05Å; L208-F212 HydrophobicContact CG-CE2 4.04Å; L208-F212 WeakPolarHBondContact O-CD2 3.48Å; L208-F212 PolarHBondContact O-N 2.86Å; L208-F212 VanDerWaalsContact O-N 3.16Å; L208-L222 HydrophobicContact CD2-CD1 3.62Å; L208-L222 HydrophobicContact CG-CD1 4.2Å
209	S	89.3	Confident	86.7	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-57	-42.6	-179.8	-164.9	0	0	0	0	111.3	L203 S206 Q211 F212 E213 W233	L203-S209 VanDerWaalsContact O-CB 3.25Å; L203-S209 WeakPolarHBondContact O-CB 3.17Å; S206-S209 PolarHBondContact O-N 2.82Å; S206-S209 PolarHBondContact OG-N 2.99Å; S209-Q211 VanDerWaalsContact C-N 3.29Å; S209-Q211 PolarHBondContact O-N 3.1Å; S209-F212 PolarHBondContact O-N 2.96Å; S209-E213 WeakPolarHBondContact O-CB 3.44Å; S209-E213 VanDerWaalsContact O-CG 3.31Å; S209-E213 WeakPolarHBondContact O-CG 3.39Å; S209-E213 PolarHBondContact O-N 2.94Å; S209-E213 PolarHBondContact OG-OE1 3.26Å; S209-E213 VanDerWaalsContact OG-OE1 3.11Å; S209-W233 WeakPolarHBondContact OG-CZ2 3.37Å
210	S	87.2	Confident	86.5	Confident	82 Å²	82	60 Å²	60	57%	0.573	33%	0.333	S	S	*	.	H	α-helix	trans	-61	-35	177.5	-63.9	0	0	0	0	113.2	L208 A214	L208-S210 VanDerWaalsContact C-N 3.25Å; L208-S210 PolarHBondContact O-N 3.46Å; S210-A214 PolarHBondContact O-N 3.47Å
211	Q	84.1	Confident	86.5	Confident	90 Å²	90	60.5 Å²	60.5	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-72.6	-39.4	179.1	-70.7	172.1	55.8	0	0	112	S207 L208 S209	S207-Q211 WeakPolarHBondContact O-CG 3.5Å; S207-Q211 PolarHBondContact O-NE2 2.94Å; L208-Q211 WeakPolarHBondContact O-CB 3.22Å; L208-Q211 PolarHBondContact O-N 3.45Å; S209-Q211 VanDerWaalsContact C-N 3.29Å; S209-Q211 PolarHBondContact O-N 3.1Å
212	F	87.5	Confident	86.6	Confident	8 Å²	8	59.3 Å²	59.3	4%	0.035	32%	0.323	C	S	.	.	H	α-helix	trans	-76.3	-37.9	-179.6	-84.5	-96.9	0	0	0	112.8	F121 M145 L208 S209 A214 G215 L222 W233	F121-F212 HydrophobicContact CE1-CE2 4.21Å; F121-F212 HydrophobicContact CE1-CZ 4.02Å; F121-F212 HydrophobicContact CE2-CE2 4.44Å; F121-F212 HydrophobicContact CE2-CZ 4.39Å; F121-F212 AromaticContact CZ-CE2 3.97Å; F121-F212 HydrophobicContact CZ-CE2 3.97Å; F121-F212 AromaticContact CZ-CZ 3.63Å; F121-F212 HydrophobicContact CZ-CZ 3.63Å; M145-F212 HydrophobicContact CE-CD1 4.28Å; M145-F212 HydrophobicContact CE-CE1 3.18Å; M145-F212 HydrophobicContact CE-CZ 3.51Å; L208-F212 HydrophobicContact CD1-CD2 3.97Å; L208-F212 HydrophobicContact CD1-CE2 3.57Å; L208-F212 HydrophobicContact CG-CD2 4.05Å; L208-F212 HydrophobicContact CG-CE2 4.04Å; L208-F212 WeakPolarHBondContact O-CD2 3.48Å; L208-F212 PolarHBondContact O-N 2.86Å; L208-F212 VanDerWaalsContact O-N 3.16Å; S209-F212 PolarHBondContact O-N 2.96Å; F212-A214 PolarHBondContact O-N 3.32Å; F212-G215 PolarHBondContact O-N 3.48Å; F212-L222 HydrophobicContact CD2-CD1 4.48Å; F212-L222 HydrophobicContact CE1-CD1 4.33Å; F212-L222 HydrophobicContact CE1-CD2 4.47Å; F212-L222 HydrophobicContact CE1-CG 3.93Å; F212-L222 HydrophobicContact CE2-CD1 3.91Å; F212-L222 HydrophobicContact CE2-CG 4.28Å; F212-L222 HydrophobicContact CZ-CD1 3.79Å; F212-L222 HydrophobicContact CZ-CD2 3.87Å; F212-L222 HydrophobicContact CZ-CG 3.64Å; F212-W233 HydrophobicContact CB-CB 4.23Å; F212-W233 HydrophobicContact CB-CD2 3.51Å; F212-W233 HydrophobicContact CB-CE3 3.77Å; F212-W233 HydrophobicContact CB-CG 3.7Å; F212-W233 HydrophobicContact CB-CZ2 4.48Å; F212-W233 HydrophobicContact CB-CZ3 4.38Å; F212-W233 HydrophobicContact CD1-CB 3.77Å; F212-W233 HydrophobicContact CD1-CD2 4.16Å; F212-W233 AromaticContact CD1-CE3 3.96Å; F212-W233 HydrophobicContact CD1-CE3 3.96Å; F212-W233 HydrophobicContact CD1-CG 4.11Å; F212-W233 HydrophobicContact CG-CB 4.46Å; F212-W233 HydrophobicContact CG-CD2 4.07Å; F212-W233 AromaticContact CG-CE3 3.88Å; F212-W233 HydrophobicContact CG-CE3 3.88Å; F212-W233 HydrophobicContact CG-CG 4.33Å
213	E	86.1	Confident	86.7	Confident	117 Å²	117	59.3 Å²	59.3	55%	0.547	32%	0.323	S	S	.	.	H	α-helix	trans	-63.9	-25	175.5	-74.8	177.1	-168.4	0	0	113.2	S209 G215 W233	S209-E213 WeakPolarHBondContact O-CB 3.44Å; S209-E213 VanDerWaalsContact O-CG 3.31Å; S209-E213 WeakPolarHBondContact O-CG 3.39Å; S209-E213 PolarHBondContact O-N 2.94Å; S209-E213 PolarHBondContact OG-OE1 3.26Å; S209-E213 VanDerWaalsContact OG-OE1 3.11Å; E213-G215 PolarHBondContact O-N 3.43Å; E213-G215 VanDerWaalsContact O-N 3.1Å; E213-W233 HydrophobicContact CG-CZ2 4.5Å
214	A	83.3	Confident	86.8	Confident	78 Å²	78	59 Å²	59	65%	0.645	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-4.1	173.3	0	0	0	0	0	113.7	S210 F212 M216	S210-A214 PolarHBondContact O-N 3.47Å; F212-A214 PolarHBondContact O-N 3.32Å; A214-M216 VanDerWaalsContact C-N 3.33Å; A214-M216 HydrophobicContact CB-CG 4.19Å; A214-M216 PolarHBondContact O-N 3.44Å
215	G	73.3	Confident	86.8	Confident	47 Å²	47	54.5 Å²	54.5	49%	0.485	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	22.9	175.2	0	0	0	0	0	114	F212 E213 H217	F212-G215 PolarHBondContact O-N 3.48Å; E213-G215 PolarHBondContact O-N 3.43Å; E213-G215 VanDerWaalsContact O-N 3.1Å; G215-H217 VanDerWaalsContact C-N 3.26Å; G215-H217 PolarHBondContact O-N 3Å
216	M	68.8	Low	86.8	Confident	140 Å²	140	52 Å²	52	69%	0.69	30%	0.297	S	S	*	.			trans	-65.3	-27.8	-177.3	-69.7	-94.1	-74.5	0	0	112.9	A214	A214-M216 VanDerWaalsContact C-N 3.33Å; A214-M216 HydrophobicContact CB-CG 4.19Å; A214-M216 PolarHBondContact O-N 3.44Å
217	H	74.3	Confident	86.8	Confident	33 Å²	33	52.1 Å²	52.1	15%	0.153	30%	0.298	C	S	.	.	S	Bend	trans	-123.7	81.5	-172.3	-55.6	-69	0	0	0	111.3	M145 G215	M145-H217 HydrophobicContact CE-CB 3.53Å; M145-H217 HydrophobicContact SD-CB 4.01Å; G215-H217 VanDerWaalsContact C-N 3.26Å; G215-H217 PolarHBondContact O-N 3Å
218	K	77.4	Confident	87	Confident	172 Å²	172	49.1 Å²	49.1	75%	0.748	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	145.6	174.9	-64.8	-174.4	179.7	-178.1	0	110.8	S220	K218-S220 PolarHBondContact O-N 3.49Å; K218-S220 VanDerWaalsContact O-N 3.1Å; K218-S220 PolarHBondContact O-OG 2.86Å
219	D	83.5	Confident	87.3	Confident	137 Å²	137	51.8 Å²	51.8	73%	0.733	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	41.4	176.7	-48	-40.2	0	0	0	112.5	K132	K132-D219 PolarHBondContact NZ-O 2.86Å; K132-D219 VanDerWaalsContact NZ-O 3.07Å
220	S	90.8	Very high	87.5	Confident	7 Å²	7	52 Å²	52	5%	0.049	29%	0.288	C	S	.	.			trans	-144.5	142.8	-176.7	-42.8	0	0	0	0	109.5	K132 G143 M145 K218	K132-S220 WeakPolarHBondContact CE-OG 3.44Å; K132-S220 PolarHBondContact NZ-OG 3.48Å; G143-S220 VanDerWaalsContact O-CA 3.3Å; G143-S220 WeakPolarHBondContact O-CA 3.45Å; M145-S220 VanDerWaalsContact CE-CB 3.46Å; M145-S220 WeakPolarHBondContact SD-CB 3.43Å; K218-S220 PolarHBondContact O-N 3.49Å; K218-S220 VanDerWaalsContact O-N 3.1Å; K218-S220 PolarHBondContact O-OG 2.86Å
221	W	92.6	Very high	87.8	Confident	22 Å²	22	50.8 Å²	50.8	8%	0.083	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	157.5	-179.4	44.8	81.8	0	0	0	112.9	P142 G143 V144 M145 W233 M235 L343	P142-W221 HydrophobicContact CG-CZ2 4.11Å; P142-W221 WeakPolarHBondContact O-CZ2 3.36Å; P142-W221 PolarHBondContact O-NE1 3.34Å; G143-W221 PolarHBondContact O-N 3.41Å; V144-W221 WeakPolarHBondContact CA-O 3.45Å; M145-W221 PolarHBondContact N-O 3.21Å; W221-W233 CarbonylContact C-O 3.6Å; W221-W233 WeakPolarHBondContact CA-O 3.36Å; W221-W233 VanDerWaalsContact CB-O 3.3Å; W221-W233 WeakPolarHBondContact CB-O 3.26Å; W221-M235 HydrophobicContact CB-CE 4.46Å; W221-M235 HydrophobicContact CB-CG 3.89Å; W221-M235 HydrophobicContact CD2-CG 3.9Å; W221-M235 HydrophobicContact CG-CB 4.4Å; W221-M235 HydrophobicContact CG-CG 3.47Å; W221-M235 VanDerWaalsContact CG-CG 3.47Å; W221-L343 HydrophobicContact CH2-CD1 3.76Å; W221-L343 HydrophobicContact CH2-CD2 4.08Å; W221-L343 HydrophobicContact CH2-CG 4.42Å; W221-L343 HydrophobicContact CZ2-CD1 3.56Å; W221-L343 HydrophobicContact CZ2-CD2 3.53Å; W221-L343 HydrophobicContact CZ2-CG 4.16Å
222	L	96.1	Very high	88.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	153.8	159.6	-61.4	177.8	0	0	0	109.3	F121 G146 V148 V179 L208 F212 W233 L234 M235	F121-L222 HydrophobicContact CE2-CD2 4.26Å; F121-L222 HydrophobicContact CZ-CD2 4.25Å; G146-L222 VanDerWaalsContact O-CA 3.32Å; G146-L222 WeakPolarHBondContact O-CA 3.33Å; V148-L222 HydrophobicContact CG1-CB 4.18Å; V179-L222 HydrophobicContact CG1-CD2 3.96Å; L208-L222 HydrophobicContact CD2-CD1 3.62Å; L208-L222 HydrophobicContact CG-CD1 4.2Å; F212-L222 HydrophobicContact CD2-CD1 4.48Å; F212-L222 HydrophobicContact CE1-CD1 4.33Å; F212-L222 HydrophobicContact CE1-CD2 4.47Å; F212-L222 HydrophobicContact CE1-CG 3.93Å; F212-L222 HydrophobicContact CE2-CD1 3.91Å; F212-L222 HydrophobicContact CE2-CG 4.28Å; F212-L222 HydrophobicContact CZ-CD1 3.79Å; F212-L222 HydrophobicContact CZ-CD2 3.87Å; F212-L222 HydrophobicContact CZ-CG 3.64Å; L222-W233 HydrophobicContact CD1-CZ3 4.33Å; L222-W233 PolarHBondContact N-O 2.94Å; L222-L234 HydrophobicContact CB-CD1 3.76Å; L222-L234 WeakPolarHBondContact O-CA 3.38Å; L222-M235 PolarHBondContact O-N 3.36Å
223	L	97.1	Very high	88.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.9	167.5	-61.8	-170.6	0	0	0	109.8	M141 V144 G146 V147 V148 M235 T256	M141-L223 HydrophobicContact CG-CD1 4.13Å; M141-L223 HydrophobicContact CG-CD2 4.31Å; V144-L223 HydrophobicContact CG1-CD1 4.29Å; V144-L223 HydrophobicContact CG1-CG 3.99Å; V144-L223 HydrophobicContact CG2-CD1 3.93Å; V144-L223 HydrophobicContact CG2-CD2 4.08Å; V144-L223 HydrophobicContact CG2-CG 3.87Å; G146-L223 PolarHBondContact O-N 2.88Å; V147-L223 CarbonylContact C-O 3.39Å; V147-L223 WeakPolarHBondContact CA-O 3.38Å; V147-L223 HydrophobicContact CG2-CB 4.42Å; V148-L223 PolarHBondContact N-O 3.27Å; L223-M235 WeakPolarHBondContact CA-O 3.43Å; L223-M235 HydrophobicContact CD2-CB 3.68Å; L223-T256 HydrophobicContact CD1-CG2 3.45Å; L223-T256 VanDerWaalsContact CD1-CG2 3.45Å
224	G	96.9	Very high	88.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.244	C	C	.	.			trans	-115.5	163.1	168.6	0	0	0	0	0	111	M235 P237 H253	G224-M235 PolarHBondContact N-O 2.88Å; G224-P237 WeakPolarHBondContact O-CD 3.35Å; G224-H253 PolarHBondContact O-CE1 3.17Å; G224-H253 PolarHBondContact O-NE2 3.34Å
225	D	94.8	Very high	89.5	Confident	26 Å²	26	40.4 Å²	40.4	14%	0.139	21%	0.213	C	C	.	.			trans	-75.2	-168.1	172.2	77.9	-13.3	0	0	0	112.3	S227 F228 T236 H257	D225-S227 PolarHBondContact O-N 2.98Å; D225-S227 WeakPolarHBondContact OD1-CA 3.2Å; D225-S227 WeakPolarHBondContact OD1-CB 3.44Å; D225-S227 PolarHBondContact OD1-N 3Å; D225-S227 PolarHBondContact OD1-OG 3.18Å; D225-F228 WeakPolarHBondContact OD1-CD2 3.37Å; D225-F228 VanDerWaalsContact OD1-CE2 3.27Å; D225-F228 WeakPolarHBondContact OD1-CE2 3.35Å; D225-T236 WeakPolarHBondContact O-CG2 3.29Å; D225-H257 PolarHBondContact N-NE2 3.25Å
226	S	92.9	Very high	90.6	Very high	64 Å²	64	38.6 Å²	38.6	45%	0.448	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-7.8	177.6	52.7	0	0	0	0	114.4	F228	S226-F228 PolarHBondContact O-N 3.36Å
227	S	91.6	Very high	91.9	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.014	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-12.5	176.4	80.2	0	0	0	0	112.5	D199 C200 D225 M329	D199-S227 WeakPolarHBondContact CB-OG 3.43Å; C200-S227 WeakPolarHBondContact CB-O 3.48Å; D225-S227 PolarHBondContact O-N 2.98Å; D225-S227 WeakPolarHBondContact OD1-CA 3.2Å; D225-S227 WeakPolarHBondContact OD1-CB 3.44Å; D225-S227 PolarHBondContact OD1-N 3Å; D225-S227 PolarHBondContact OD1-OG 3.18Å; S227-M329 WeakPolarHBondContact O-CE 3.31Å
228	F	93.4	Very high	92.8	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.018	17%	0.168	C	C	.	.	S	Bend	trans	-105.7	153.8	179.9	-56.1	-78.1	0	0	0	112.5	L177 D199 L203 D225 S226 L234 T236	L177-F228 HydrophobicContact CD1-CE1 4.2Å; L177-F228 HydrophobicContact CD1-CZ 4.27Å; D199-F228 HydrophobicContact CB-CD1 4.49Å; D199-F228 HydrophobicContact CB-CE1 3.82Å; D199-F228 HydrophobicContact CB-CZ 3.94Å; D199-F228 WeakPolarHBondContact O-CE1 3.31Å; L203-F228 HydrophobicContact CB-CD1 3.83Å; L203-F228 HydrophobicContact CB-CE1 3.77Å; L203-F228 HydrophobicContact CD2-CD1 3.48Å; L203-F228 VanDerWaalsContact CD2-CD1 3.48Å; L203-F228 HydrophobicContact CD2-CE1 3.95Å; L203-F228 HydrophobicContact CD2-CG 4.15Å; L203-F228 HydrophobicContact CG-CD1 4.3Å; L203-F228 HydrophobicContact CG-CE1 4.45Å; D225-F228 WeakPolarHBondContact OD1-CD2 3.37Å; D225-F228 VanDerWaalsContact OD1-CE2 3.27Å; D225-F228 WeakPolarHBondContact OD1-CE2 3.35Å; S226-F228 PolarHBondContact O-N 3.36Å; F228-L234 HydrophobicContact CB-CD2 3.65Å; F228-L234 HydrophobicContact CG-CD2 4.25Å; F228-T236 HydrophobicContact CB-CG2 4.24Å
229	F	92.4	Very high	93.3	Very high	55 Å²	55	31.7 Å²	31.7	24%	0.241	16%	0.164	C	C	.	.			trans	-83	136.7	171.5	-63.9	-77.1	0	0	0	110.8	C200 R231 M329	C200-F229 HydrophobicContact CB-CD2 3.77Å; C200-F229 HydrophobicContact CB-CE2 3.84Å; F229-R231 PolarHBondContact O-N 3.44Å; F229-M329 HydrophobicContact CD1-CB 3.57Å; F229-M329 HydrophobicContact CD1-CE 3.69Å; F229-M329 HydrophobicContact CD1-CG 4.09Å; F229-M329 HydrophobicContact CD1-SD 4.31Å; F229-M329 HydrophobicContact CD2-CE 3.52Å; F229-M329 HydrophobicContact CD2-SD 4.27Å; F229-M329 HydrophobicContact CE1-CB 3.27Å; F229-M329 HydrophobicContact CE1-CE 3.64Å; F229-M329 HydrophobicContact CE1-CG 3.31Å; F229-M329 HydrophobicContact CE1-SD 3.63Å; F229-M329 HydrophobicContact CE2-CE 3.44Å; F229-M329 VanDerWaalsContact CE2-CE 3.44Å; F229-M329 HydrophobicContact CE2-CG 4.4Å; F229-M329 HydrophobicContact CE2-SD 3.57Å; F229-M329 VanDerWaalsContact CE2-SD 3.57Å; F229-M329 HydrophobicContact CG-CB 4.46Å; F229-M329 HydrophobicContact CG-CE 3.62Å; F229-M329 HydrophobicContact CZ-CB 3.96Å; F229-M329 HydrophobicContact CZ-CE 3.5Å; F229-M329 HydrophobicContact CZ-CG 3.49Å; F229-M329 VanDerWaalsContact CZ-CG 3.49Å; F229-M329 HydrophobicContact CZ-SD 3.19Å; F229-M329 WeakPolarHBondContact CZ-SD 3.3Å
230	L	93.9	Very high	93.6	Very high	7 Å²	7	30.5 Å²	30.5	4%	0.037	16%	0.157	C	C	.	.			trans	-53.5	134.6	170.4	-173.8	74.1	0	0	0	111.4	L234 M235 S331 A336 D337 R340	L230-L234 WeakPolarHBondContact CD1-O 3.4Å; L230-M235 HydrophobicContact CD1-SD 4.17Å; L230-S331 WeakPolarHBondContact O-CB 3.41Å; L230-S331 PolarHBondContact O-OG 2.89Å; L230-A336 HydrophobicContact CD2-CB 4.04Å; L230-A336 HydrophobicContact CG-CB 3.87Å; L230-D337 HydrophobicContact CD2-CB 4.15Å; L230-R340 HydrophobicContact CD1-CB 4.43Å
231	R	93.5	Very high	93.6	Very high	58 Å²	58	31.2 Å²	31.2	22%	0.219	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-135.8	163.9	174.6	-61.5	-71.3	-179.4	-94.4	-1.5	109.7	F229 W233 L234 M235 S331	F229-R231 PolarHBondContact O-N 3.44Å; R231-W233 HydrophobicContact CB-CD2 4.22Å; R231-W233 HydrophobicContact CB-CG 4.33Å; R231-W233 HydrophobicContact CB-CZ2 4.45Å; R231-W233 HydrophobicContact CG-CZ2 4.16Å; R231-W233 PolarHBondContact O-N 2.96Å; R231-L234 HydrophobicContact CB-CB 3.91Å; R231-L234 HydrophobicContact CG-CB 4.34Å; R231-L234 PolarHBondContact N-O 3.29Å; R231-L234 CarbonylContact O-C 3.56Å; R231-L234 PolarHBondContact O-N 3.46Å; R231-L234 VanDerWaalsContact O-N 3.08Å; R231-M235 WeakPolarHBondContact O-CE 3.44Å; R231-S331 PolarHBondContact NH1-OG 3.43Å
232	T	92.7	Very high	93.7	Very high	59 Å²	59	37.6 Å²	37.6	36%	0.362	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-21	174.8	56.8	0	0	0	0	113.5	E335 A336 I339	T232-E335 HydrophobicContact CG2-CB 4.25Å; T232-E335 HydrophobicContact CG2-CG 3.82Å; T232-A336 HydrophobicContact CG2-CB 4.24Å; T232-I339 HydrophobicContact CG2-CD1 3.84Å
233	W	93.4	Very high	93.7	Very high	14 Å²	14	40.5 Å²	40.5	5%	0.053	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	2.2	178.6	56	-97.7	0	0	0	114.3	L203 S209 F212 E213 W221 L222 R231	L203-W233 HydrophobicContact CD1-CH2 4.28Å; L203-W233 HydrophobicContact CD2-CH2 4.14Å; L203-W233 HydrophobicContact CD2-CZ3 4.4Å; L203-W233 HydrophobicContact CG-CH2 4.2Å; S209-W233 WeakPolarHBondContact OG-CZ2 3.37Å; F212-W233 HydrophobicContact CB-CB 4.23Å; F212-W233 HydrophobicContact CB-CD2 3.51Å; F212-W233 HydrophobicContact CB-CE3 3.77Å; F212-W233 HydrophobicContact CB-CG 3.7Å; F212-W233 HydrophobicContact CB-CZ2 4.48Å; F212-W233 HydrophobicContact CB-CZ3 4.38Å; F212-W233 HydrophobicContact CD1-CB 3.77Å; F212-W233 HydrophobicContact CD1-CD2 4.16Å; F212-W233 AromaticContact CD1-CE3 3.96Å; F212-W233 HydrophobicContact CD1-CE3 3.96Å; F212-W233 HydrophobicContact CD1-CG 4.11Å; F212-W233 HydrophobicContact CG-CB 4.46Å; F212-W233 HydrophobicContact CG-CD2 4.07Å; F212-W233 AromaticContact CG-CE3 3.88Å; F212-W233 HydrophobicContact CG-CE3 3.88Å; F212-W233 HydrophobicContact CG-CG 4.33Å; E213-W233 HydrophobicContact CG-CZ2 4.5Å; W221-W233 CarbonylContact C-O 3.6Å; W221-W233 WeakPolarHBondContact CA-O 3.36Å; W221-W233 VanDerWaalsContact CB-O 3.3Å; W221-W233 WeakPolarHBondContact CB-O 3.26Å; L222-W233 HydrophobicContact CD1-CZ3 4.33Å; L222-W233 PolarHBondContact N-O 2.94Å; R231-W233 HydrophobicContact CB-CD2 4.22Å; R231-W233 HydrophobicContact CB-CG 4.33Å; R231-W233 HydrophobicContact CB-CZ2 4.45Å; R231-W233 HydrophobicContact CG-CZ2 4.16Å; R231-W233 PolarHBondContact O-N 2.96Å
234	L	95.2	Very high	93.6	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	113.4	179.8	-176.6	70.8	0	0	0	109.7	V148 L203 L222 F228 L230 R231 T236	V148-L234 HydrophobicContact CG1-CD1 3.52Å; L203-L234 HydrophobicContact CD2-CD1 4.48Å; L203-L234 HydrophobicContact CD2-CD2 3.44Å; L203-L234 VanDerWaalsContact CD2-CD2 3.44Å; L222-L234 HydrophobicContact CB-CD1 3.76Å; L222-L234 WeakPolarHBondContact O-CA 3.38Å; F228-L234 HydrophobicContact CB-CD2 3.65Å; F228-L234 HydrophobicContact CG-CD2 4.25Å; L230-L234 WeakPolarHBondContact CD1-O 3.4Å; R231-L234 HydrophobicContact CB-CB 3.91Å; R231-L234 HydrophobicContact CG-CB 4.34Å; R231-L234 PolarHBondContact N-O 3.29Å; R231-L234 CarbonylContact O-C 3.56Å; R231-L234 PolarHBondContact O-N 3.46Å; R231-L234 VanDerWaalsContact O-N 3.08Å; L234-T236 HydrophobicContact CG-CG2 4.44Å
235	M	95.7	Very high	93.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.3	178.1	-62.5	-62.7	126.5	0	0	110.8	W221 L222 L223 G224 L230 R231 H253 I339 R340 L343	W221-M235 HydrophobicContact CB-CE 4.46Å; W221-M235 HydrophobicContact CB-CG 3.89Å; W221-M235 HydrophobicContact CD2-CG 3.9Å; W221-M235 HydrophobicContact CG-CB 4.4Å; W221-M235 HydrophobicContact CG-CG 3.47Å; W221-M235 VanDerWaalsContact CG-CG 3.47Å; L222-M235 PolarHBondContact O-N 3.36Å; L223-M235 WeakPolarHBondContact CA-O 3.43Å; L223-M235 HydrophobicContact CD2-CB 3.68Å; G224-M235 PolarHBondContact N-O 2.88Å; L230-M235 HydrophobicContact CD1-SD 4.17Å; R231-M235 WeakPolarHBondContact O-CE 3.44Å; M235-H253 PolarHBondContact O-NE2 3.22Å; M235-H253 VanDerWaalsContact O-NE2 3.16Å; M235-I339 HydrophobicContact CE-CG2 3.92Å; M235-R340 HydrophobicContact SD-CB 3.93Å; M235-R340 HydrophobicContact SD-CG 4.16Å; M235-L343 HydrophobicContact CG-CD2 4.41Å; M235-L343 HydrophobicContact SD-CD2 4.38Å
236	T	96.1	Very high	93.6	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.055	24%	0.241	C	C	.	.			trans	-119.5	155.8	179.8	61	0	0	0	0	110.2	D225 F228 L234 Y249 R340	D225-T236 WeakPolarHBondContact O-CG2 3.29Å; F228-T236 HydrophobicContact CB-CG2 4.24Å; L234-T236 HydrophobicContact CG-CG2 4.44Å; T236-Y249 PolarHBondContact O-OH 3.11Å; T236-R340 PolarHBondContact O-NH1 2.97Å
237	P	95.6	Very high	93.8	Very high	32 Å²	32	48.4 Å²	48.4	21%	0.208	24%	0.244	C	C	.	.			trans	-66.8	155	-179.6	29.4	-33.4	0	0	0	110.8	G224 H253	G224-P237 WeakPolarHBondContact O-CD 3.35Å; P237-H253 VanDerWaalsContact CD-CE1 3.48Å; P237-H253 WeakPolarHBondContact CD-CE1 3.15Å
238	L	93.2	Very high	94	Very high	21 Å²	21	54 Å²	54	11%	0.11	27%	0.265	C	S	.	.			trans	-77.4	134.5	169.7	-71.5	169.4	0	0	0	110	E246 Y249 N250 M344	L238-E246 HydrophobicContact CD1-CB 3.53Å; L238-E246 HydrophobicContact CD1-CG 3.43Å; L238-E246 VanDerWaalsContact CD1-CG 3.43Å; L238-Y249 HydrophobicContact CD1-CD1 4.28Å; L238-Y249 HydrophobicContact CG-CD1 4.37Å; L238-Y249 HydrophobicContact CG-CE1 4.35Å; L238-N250 PolarHBondContact N-OD1 3.29Å; L238-N250 PolarHBondContact O-ND2 3.07Å; L238-M344 HydrophobicContact CD1-CE 4.02Å; L238-M344 HydrophobicContact CD1-SD 3.48Å; L238-M344 WeakPolarHBondContact CD1-SD 2.95Å; L238-M344 HydrophobicContact CG-SD 4.39Å
239	H	87.4	Confident	94.2	Very high	147 Å²	147	53.9 Å²	53.9	68%	0.681	26%	0.264	S	S	*	.	S	Bend	trans	-68.6	-45.4	177.5	-178.5	-103	0	0	0	111.7
240	I	89.9	Confident	94.5	Very high	112 Å²	112	52.5 Å²	52.5	57%	0.574	26%	0.259	S	S	*	.	S	Bend	trans	-126.1	94.1	179.6	-62.6	155.1	0	0	0	108.2	E242	I240-E242 HydrophobicContact CG2-CG 4.11Å
241	P	92.1	Very high	94.6	Very high	22 Å²	22	58.8 Å²	58.8	14%	0.143	29%	0.29	C	S	.	.			trans	-73.8	125.8	170.1	29.1	-32.5	0	0	0	110.2	E246 Y247	P241-E246 HydrophobicContact CB-CB 3.79Å; P241-Y247 HydrophobicContact CB-CD1 4.1Å; P241-Y247 HydrophobicContact CB-CD2 4.23Å; P241-Y247 HydrophobicContact CB-CE1 4.15Å; P241-Y247 HydrophobicContact CB-CE2 4.21Å; P241-Y247 HydrophobicContact CB-CG 4.13Å; P241-Y247 HydrophobicContact CG-CD1 3.85Å; P241-Y247 HydrophobicContact CG-CE1 3.62Å; P241-Y247 HydrophobicContact CG-CE2 4.47Å; P241-Y247 HydrophobicContact CG-CG 4.39Å; P241-Y247 VanDerWaalsContact O-CE2 3.25Å; P241-Y247 WeakPolarHBondContact O-CE2 3.23Å; P241-Y247 PolarHBondContact O-OH 3.19Å
242	E	94.1	Very high	94.8	Very high	157 Å²	157	56.3 Å²	56.3	73%	0.734	28%	0.282	S	S	*	.			trans	-108.7	-30.7	-179.4	-60.6	-169	151.1	0	0	112.1	I240 E246	I240-E242 HydrophobicContact CG2-CG 4.11Å; E242-E246 WeakPolarHBondContact CA-OE2 3.49Å; E242-E246 PolarHBondContact N-OE2 3.11Å
243	T	95.3	Very high	95	Very high	60 Å²	60	53.6 Å²	53.6	37%	0.368	27%	0.266	S	S	.	.	S	Bend	trans	-105.9	153.7	-177.1	76.1	0	0	0	0	112.9	A245 E246 Y247	T243-A245 PolarHBondContact O-N 2.7Å; T243-A245 VanDerWaalsContact O-N 3.14Å; T243-E246 PolarHBondContact N-OE2 3.05Å; T243-E246 WeakPolarHBondContact O-CB 3.3Å; T243-E246 PolarHBondContact O-N 2.97Å; T243-E246 VanDerWaalsContact OG1-CG 3.25Å; T243-E246 WeakPolarHBondContact OG1-CG 3.42Å; T243-E246 PolarHBondContact OG1-N 3.45Å; T243-E246 PolarHBondContact OG1-OE2 3.39Å; T243-Y247 WeakPolarHBondContact O-CD2 3.47Å; T243-Y247 PolarHBondContact O-N 3.36Å
244	P	95.9	Very high	95.2	Very high	90 Å²	90	56.3 Å²	56.3	58%	0.584	29%	0.286	S	S	*	.	H	α-helix	trans	-54.4	-33.2	175.5	-27.8	35.7	0	0	0	114.4	R248	P244-R248 WeakPolarHBondContact O-CG 3.37Å; P244-R248 PolarHBondContact O-N 2.76Å; P244-R248 VanDerWaalsContact O-N 3.08Å
245	A	95.8	Very high	95.2	Very high	11 Å²	11	58.3 Å²	58.3	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-43.6	176.5	0	0	0	0	0	111.5	T243 Y247 R248 Y249 F348	T243-A245 PolarHBondContact O-N 2.7Å; T243-A245 VanDerWaalsContact O-N 3.14Å; A245-Y247 PolarHBondContact O-N 3.1Å; A245-R248 PolarHBondContact O-N 2.68Å; A245-Y249 WeakPolarHBondContact O-CB 3.02Å; A245-Y249 PolarHBondContact O-N 2.82Å; A245-F348 WeakPolarHBondContact CA-O 3.33Å; A245-F348 HydrophobicContact CB-CB 4.42Å; A245-F348 WeakPolarHBondContact O-CB 3.29Å
246	E	95.9	Very high	95.3	Very high	26 Å²	26	58.3 Å²	58.3	12%	0.121	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-40.3	176.3	-68.2	171.4	161.9	0	0	112	L238 P241 E242 T243 Y249 N250 M344	L238-E246 HydrophobicContact CD1-CB 3.53Å; L238-E246 HydrophobicContact CD1-CG 3.43Å; L238-E246 VanDerWaalsContact CD1-CG 3.43Å; P241-E246 HydrophobicContact CB-CB 3.79Å; E242-E246 WeakPolarHBondContact CA-OE2 3.49Å; E242-E246 PolarHBondContact N-OE2 3.11Å; T243-E246 PolarHBondContact N-OE2 3.05Å; T243-E246 WeakPolarHBondContact O-CB 3.3Å; T243-E246 PolarHBondContact O-N 2.97Å; T243-E246 VanDerWaalsContact OG1-CG 3.25Å; T243-E246 WeakPolarHBondContact OG1-CG 3.42Å; T243-E246 PolarHBondContact OG1-N 3.45Å; T243-E246 PolarHBondContact OG1-OE2 3.39Å; E246-Y249 PolarHBondContact O-N 3.07Å; E246-N250 PolarHBondContact O-N 3.04Å; E246-M344 HydrophobicContact CB-SD 4.48Å; E246-M344 HydrophobicContact CG-CE 4.4Å; E246-M344 HydrophobicContact CG-SD 3.89Å
247	Y	96.2	Very high	95.3	Very high	129 Å²	129	58.3 Å²	58.3	51%	0.506	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-46	173.3	-79.8	-77.1	0	0	0	111.8	P241 T243 A245 N250 M251	P241-Y247 HydrophobicContact CB-CD1 4.1Å; P241-Y247 HydrophobicContact CB-CD2 4.23Å; P241-Y247 HydrophobicContact CB-CE1 4.15Å; P241-Y247 HydrophobicContact CB-CE2 4.21Å; P241-Y247 HydrophobicContact CB-CG 4.13Å; P241-Y247 HydrophobicContact CG-CD1 3.85Å; P241-Y247 HydrophobicContact CG-CE1 3.62Å; P241-Y247 HydrophobicContact CG-CE2 4.47Å; P241-Y247 HydrophobicContact CG-CG 4.39Å; P241-Y247 VanDerWaalsContact O-CE2 3.25Å; P241-Y247 WeakPolarHBondContact O-CE2 3.23Å; P241-Y247 PolarHBondContact O-OH 3.19Å; T243-Y247 WeakPolarHBondContact O-CD2 3.47Å; T243-Y247 PolarHBondContact O-N 3.36Å; A245-Y247 PolarHBondContact O-N 3.1Å; Y247-N250 PolarHBondContact O-N 2.76Å; Y247-M251 VanDerWaalsContact O-CG 3.31Å; Y247-M251 WeakPolarHBondContact O-CG 3.46Å; Y247-M251 PolarHBondContact O-N 3.29Å
248	R	97.4	Very high	95.4	Very high	121 Å²	121	57.8 Å²	57.8	46%	0.457	30%	0.3	S	S	.	.	H	α-helix	trans	-65.9	-38.8	178.3	-71.3	170.2	-173	161.1	4.6	112.1	P244 A245 M251 A252 F348 S349	P244-R248 WeakPolarHBondContact O-CG 3.37Å; P244-R248 PolarHBondContact O-N 2.76Å; P244-R248 VanDerWaalsContact O-N 3.08Å; A245-R248 PolarHBondContact O-N 2.68Å; R248-M251 PolarHBondContact O-N 2.86Å; R248-A252 WeakPolarHBondContact O-CB 3.4Å; R248-A252 PolarHBondContact O-N 2.61Å; R248-F348 HydrophobicContact CB-CB 4.19Å; R248-F348 HydrophobicContact CB-CD1 3.99Å; R248-F348 WeakPolarHBondContact CD-O 3.36Å; R248-F348 PolarHBondContact NH1-O 3.43Å; R248-S349 PolarHBondContact NH1-O 3.4Å; R248-S349 PolarHBondContact NH1-OXT 3.18Å
249	Y	97.6	Very high	95.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-51.7	172.7	167.2	-95	0	0	0	111.1	M141 T236 L238 A245 E246 M251 A252 H253 R340 L343 M344 F348	M141-Y249 HydrophobicContact CE-CD2 3.81Å; M141-Y249 HydrophobicContact CE-CE2 3.72Å; M141-Y249 HydrophobicContact SD-CD2 4.21Å; M141-Y249 HydrophobicContact SD-CE2 4.06Å; T236-Y249 PolarHBondContact O-OH 3.11Å; L238-Y249 HydrophobicContact CD1-CD1 4.28Å; L238-Y249 HydrophobicContact CG-CD1 4.37Å; L238-Y249 HydrophobicContact CG-CE1 4.35Å; A245-Y249 WeakPolarHBondContact O-CB 3.02Å; A245-Y249 PolarHBondContact O-N 2.82Å; E246-Y249 PolarHBondContact O-N 3.07Å; Y249-M251 VanDerWaalsContact C-N 3.33Å; Y249-M251 PolarHBondContact O-N 2.79Å; Y249-A252 PolarHBondContact O-N 2.88Å; Y249-H253 VanDerWaalsContact O-CB 3.3Å; Y249-H253 WeakPolarHBondContact O-CB 3.19Å; Y249-H253 PolarHBondContact O-N 3.2Å; Y249-R340 HydrophobicContact CE2-CG 4.35Å; Y249-L343 HydrophobicContact CE2-CD2 4.02Å; Y249-M344 HydrophobicContact CD1-CG 4.36Å; Y249-M344 HydrophobicContact CD1-SD 3.87Å; Y249-M344 HydrophobicContact CD2-CG 3.81Å; Y249-M344 HydrophobicContact CD2-SD 4.37Å; Y249-M344 HydrophobicContact CG-CG 3.7Å; Y249-M344 HydrophobicContact CG-SD 3.79Å; Y249-F348 HydrophobicContact CD2-CD2 4.24Å; Y249-F348 AromaticContact CD2-CE2 3.93Å; Y249-F348 HydrophobicContact CD2-CE2 3.93Å; Y249-F348 HydrophobicContact CD2-CZ 4.44Å
250	N	97.2	Very high	96	Very high	26 Å²	26	50 Å²	50	14%	0.139	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-40.5	178	-90.6	16.6	0	0	0	112	L238 E246 Y247 A252 H253 S254	L238-N250 PolarHBondContact N-OD1 3.29Å; L238-N250 PolarHBondContact O-ND2 3.07Å; E246-N250 PolarHBondContact O-N 3.04Å; Y247-N250 PolarHBondContact O-N 2.76Å; N250-A252 PolarHBondContact O-N 3.43Å; N250-H253 PolarHBondContact O-N 3.08Å; N250-S254 WeakPolarHBondContact O-CB 3.4Å; N250-S254 PolarHBondContact O-N 3.47Å; N250-S254 PolarHBondContact O-OG 3.01Å; N250-S254 VanDerWaalsContact O-OG 3.07Å
251	M	96.8	Very high	96.2	Very high	140 Å²	140	47.8 Å²	47.8	69%	0.69	25%	0.251	S	S	*	.	H	α-helix	trans	-59.7	-46.7	175.4	-75.6	-173.9	69.3	0	0	112.1	Y247 R248 Y249 A255	Y247-M251 VanDerWaalsContact O-CG 3.31Å; Y247-M251 WeakPolarHBondContact O-CG 3.46Å; Y247-M251 PolarHBondContact O-N 3.29Å; R248-M251 PolarHBondContact O-N 2.86Å; Y249-M251 VanDerWaalsContact C-N 3.33Å; Y249-M251 PolarHBondContact O-N 2.79Å; M251-A255 VanDerWaalsContact O-CB 3.27Å; M251-A255 WeakPolarHBondContact O-CB 3.12Å; M251-A255 PolarHBondContact O-N 3.32Å
252	A	97.5	Very high	96.3	Very high	6 Å²	6	50.4 Å²	50.4	5%	0.05	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-39.8	177.2	0	0	0	0	0	112	A139 M141 R248 Y249 N250 T256 F348	A139-A252 HydrophobicContact CB-CB 4.42Å; A139-A252 VanDerWaalsContact O-CB 3.22Å; A139-A252 WeakPolarHBondContact O-CB 3.48Å; M141-A252 HydrophobicContact CB-CB 4.47Å; M141-A252 HydrophobicContact CE-CB 4.02Å; R248-A252 WeakPolarHBondContact O-CB 3.4Å; R248-A252 PolarHBondContact O-N 2.61Å; Y249-A252 PolarHBondContact O-N 2.88Å; N250-A252 PolarHBondContact O-N 3.43Å; A252-T256 WeakPolarHBondContact O-CB 3.37Å; A252-T256 PolarHBondContact O-N 3.08Å; A252-T256 PolarHBondContact O-OG1 3.16Å; A252-F348 HydrophobicContact CB-CE1 3.49Å; A252-F348 VanDerWaalsContact CB-CE1 3.49Å; A252-F348 HydrophobicContact CB-CZ 3.9Å
253	H	97.6	Very high	96.4	Very high	2 Å²	2	43 Å²	43	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-57.1	176.8	-177.4	-69.5	0	0	0	110.2	M141 G224 M235 P237 Y249 N250 A255 T256 H257	M141-H253 VanDerWaalsContact CE-CA 3.43Å; M141-H253 HydrophobicContact CE-CB 3.56Å; M141-H253 VanDerWaalsContact CE-N 3.31Å; G224-H253 PolarHBondContact O-CE1 3.17Å; G224-H253 PolarHBondContact O-NE2 3.34Å; M235-H253 PolarHBondContact O-NE2 3.22Å; M235-H253 VanDerWaalsContact O-NE2 3.16Å; P237-H253 VanDerWaalsContact CD-CE1 3.48Å; P237-H253 WeakPolarHBondContact CD-CE1 3.15Å; Y249-H253 VanDerWaalsContact O-CB 3.3Å; Y249-H253 WeakPolarHBondContact O-CB 3.19Å; Y249-H253 PolarHBondContact O-N 3.2Å; N250-H253 PolarHBondContact O-N 3.08Å; H253-A255 VanDerWaalsContact C-N 3.32Å; H253-A255 PolarHBondContact O-N 3.47Å; H253-T256 PolarHBondContact O-N 3.04Å; H253-T256 VanDerWaalsContact O-N 3.13Å; H253-H257 WeakPolarHBondContact O-CB 3.37Å; H253-H257 PolarHBondContact O-N 2.85Å
254	S	96.4	Very high	96.4	Very high	70 Å²	70	40.8 Å²	40.8	49%	0.49	21%	0.211	S	C	.	.	H	α-helix	trans	-60.6	-39.9	-179.3	-58.8	0	0	0	0	112.4	N250 S258	N250-S254 WeakPolarHBondContact O-CB 3.4Å; N250-S254 PolarHBondContact O-N 3.47Å; N250-S254 PolarHBondContact O-OG 3.01Å; N250-S254 VanDerWaalsContact O-OG 3.07Å; S254-S258 WeakPolarHBondContact O-CB 3.35Å; S254-S258 PolarHBondContact O-N 2.81Å
255	A	96.5	Very high	96.3	Very high	43 Å²	43	40 Å²	40	36%	0.355	20%	0.196	S	C	.	.	H	α-helix	trans	-62.6	-43.4	176.4	0	0	0	0	0	112	A139 M251 H253 S258	A139-A255 HydrophobicContact CB-CB 3.7Å; M251-A255 VanDerWaalsContact O-CB 3.27Å; M251-A255 WeakPolarHBondContact O-CB 3.12Å; M251-A255 PolarHBondContact O-N 3.32Å; H253-A255 VanDerWaalsContact C-N 3.32Å; H253-A255 PolarHBondContact O-N 3.47Å; A255-S258 PolarHBondContact O-OG 3.15Å
256	T	97.2	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.5	-46	177.8	-50.8	0	0	0	0	111.2	F135 L138 V144 V147 L223 A252 H253 S258 V259	F135-T256 HydrophobicContact CD1-CG2 3.59Å; F135-T256 HydrophobicContact CE1-CG2 4.03Å; F135-T256 HydrophobicContact CG-CG2 4.48Å; L138-T256 HydrophobicContact CD2-CG2 4.49Å; V144-T256 HydrophobicContact CG1-CG2 4.36Å; V147-T256 HydrophobicContact CG2-CG2 4.13Å; L223-T256 HydrophobicContact CD1-CG2 3.45Å; L223-T256 VanDerWaalsContact CD1-CG2 3.45Å; A252-T256 WeakPolarHBondContact O-CB 3.37Å; A252-T256 PolarHBondContact O-N 3.08Å; A252-T256 PolarHBondContact O-OG1 3.16Å; H253-T256 PolarHBondContact O-N 3.04Å; H253-T256 VanDerWaalsContact O-N 3.13Å; T256-S258 PolarHBondContact O-N 2.8Å; T256-V259 WeakPolarHBondContact O-CB 3.41Å; T256-V259 VanDerWaalsContact O-CG2 3.28Å; T256-V259 WeakPolarHBondContact O-CG2 3.38Å; T256-V259 PolarHBondContact O-N 3.46Å
257	H	96.9	Very high	96.1	Very high	9 Å²	9	38.9 Å²	38.9	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-34.9	178.3	-169.1	-88.8	0	0	0	111.8	V147 D149 D225 H253 V259 I260 E261	V147-H257 HydrophobicContact CG1-CB 4.33Å; V147-H257 VanDerWaalsContact CG1-CD2 3.46Å; V147-H257 WeakPolarHBondContact CG1-CD2 3.41Å; D149-H257 IonicContact OD2-CE1 2.71Å; D149-H257 PolarHBondContact OD2-CE1 3.38Å; D225-H257 PolarHBondContact N-NE2 3.25Å; H253-H257 WeakPolarHBondContact O-CB 3.37Å; H253-H257 PolarHBondContact O-N 2.85Å; H257-V259 PolarHBondContact O-N 2.95Å; H257-I260 WeakPolarHBondContact O-CG2 3.23Å; H257-I260 PolarHBondContact O-N 2.87Å; H257-E261 IonicContact ND1-OE1 2.71Å
258	S	96	Very high	95.9	Very high	22 Å²	22	33.4 Å²	33.4	15%	0.154	17%	0.17	C	C	.	.	H	α-helix	trans	-54.6	-19.1	179.7	80.7	0	0	0	0	114.8	S254 A255 T256 K262	S254-S258 WeakPolarHBondContact O-CB 3.35Å; S254-S258 PolarHBondContact O-N 2.81Å; A255-S258 PolarHBondContact O-OG 3.15Å; T256-S258 PolarHBondContact O-N 2.8Å; S258-K262 WeakPolarHBondContact O-CD 3.21Å; S258-K262 WeakPolarHBondContact O-CG 3.45Å; S258-K262 PolarHBondContact O-N 2.63Å; S258-K262 VanDerWaalsContact O-N 3.11Å; S258-K262 PolarHBondContact OG-NZ 2.88Å
259	V	96.5	Very high	95.6	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-44.1	175.8	177.9	0	0	0	0	111.3	L138 D181 T256 H257 K262 T263	L138-V259 HydrophobicContact CD2-CG2 3.63Å; D181-V259 WeakPolarHBondContact O-CG1 3.34Å; T256-V259 WeakPolarHBondContact O-CB 3.41Å; T256-V259 VanDerWaalsContact O-CG2 3.28Å; T256-V259 WeakPolarHBondContact O-CG2 3.38Å; T256-V259 PolarHBondContact O-N 3.46Å; H257-V259 PolarHBondContact O-N 2.95Å; V259-K262 PolarHBondContact O-N 2.78Å; V259-T263 WeakPolarHBondContact O-CB 3.2Å; V259-T263 PolarHBondContact O-N 2.78Å; V259-T263 PolarHBondContact O-OG1 3.47Å
260	I	96.9	Very high	95.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-71.2	-39.5	-177.7	-163.5	157.8	0	0	0	111.8	V147 D149 M178 H257 K262 T263 F264	V147-I260 HydrophobicContact CB-CB 4.27Å; V147-I260 HydrophobicContact CG1-CB 3.76Å; V147-I260 HydrophobicContact CG1-CG2 3.56Å; V147-I260 WeakPolarHBondContact O-CD1 3.15Å; D149-I260 HydrophobicContact CB-CB 4.44Å; D149-I260 HydrophobicContact CB-CD1 3.64Å; D149-I260 HydrophobicContact CB-CG1 4.05Å; D149-I260 HydrophobicContact CB-CG2 3.57Å; D149-I260 VanDerWaalsContact N-CD1 3.31Å; M178-I260 VanDerWaalsContact O-CD1 3.26Å; M178-I260 WeakPolarHBondContact O-CD1 3.49Å; H257-I260 WeakPolarHBondContact O-CG2 3.23Å; H257-I260 PolarHBondContact O-N 2.87Å; I260-K262 VanDerWaalsContact C-N 3.3Å; I260-K262 PolarHBondContact O-N 3.36Å; I260-T263 CarbonylContact O-C 3.55Å; I260-T263 WeakPolarHBondContact O-CA 3.48Å; I260-T263 VanDerWaalsContact O-CB 3.28Å; I260-T263 WeakPolarHBondContact O-CB 3.4Å; I260-T263 PolarHBondContact O-N 3.29Å; I260-F264 HydrophobicContact CD1-CE1 4.27Å; I260-F264 HydrophobicContact CD1-CZ 3.93Å; I260-F264 HydrophobicContact CG1-CD1 4.35Å; I260-F264 HydrophobicContact CG1-CE1 3.85Å; I260-F264 HydrophobicContact CG1-CE2 4.11Å; I260-F264 HydrophobicContact CG1-CZ 3.72Å; I260-F264 WeakPolarHBondContact O-CG 3.21Å; I260-F264 PolarHBondContact O-N 3.38Å
261	E	94.3	Very high	95.2	Very high	65 Å²	65	28.6 Å²	28.6	30%	0.304	15%	0.153	S	C	.	.	H	α-helix	trans	-60.7	-41.6	175.6	-64.5	176.3	-157.9	0	0	112	H257 T263 F264 R265	H257-E261 IonicContact ND1-OE1 2.71Å; E261-T263 VanDerWaalsContact C-N 3.3Å; E261-F264 PolarHBondContact O-N 3.34Å; E261-R265 WeakPolarHBondContact O-CG 3.2Å; E261-R265 PolarHBondContact O-N 3.01Å; E261-R265 PolarHBondContact O-NE 3.3Å; E261-R265 IonicContact OE2-NH2 3.67Å; E261-R265 PolarHBondContact OE2-NH2 2.89Å; E261-R265 VanDerWaalsContact OE2-NH2 3.1Å
262	K	94.7	Very high	94.9	Very high	77 Å²	77	23.7 Å²	23.7	34%	0.335	13%	0.127	S	C	.	.	H	α-helix	trans	-69.3	-33.1	176.3	-61.1	161.6	178.6	155.5	0	110.7	S258 V259 I260 R265 T266 W310	S258-K262 WeakPolarHBondContact O-CD 3.21Å; S258-K262 WeakPolarHBondContact O-CG 3.45Å; S258-K262 PolarHBondContact O-N 2.63Å; S258-K262 VanDerWaalsContact O-N 3.11Å; S258-K262 PolarHBondContact OG-NZ 2.88Å; V259-K262 PolarHBondContact O-N 2.78Å; I260-K262 VanDerWaalsContact C-N 3.3Å; I260-K262 PolarHBondContact O-N 3.36Å; K262-R265 PolarHBondContact O-N 3.46Å; K262-T266 WeakPolarHBondContact O-CB 3.32Å; K262-T266 PolarHBondContact O-N 3.09Å; K262-T266 PolarHBondContact O-OG1 3.41Å; K262-W310 HydrophobicContact CB-CE3 4.06Å; K262-W310 HydrophobicContact CB-CH2 3.66Å; K262-W310 HydrophobicContact CB-CZ3 3.15Å; K262-W310 HydrophobicContact CD-CH2 4.18Å; K262-W310 HydrophobicContact CD-CZ3 4.07Å; K262-W310 HydrophobicContact CG-CZ3 4.19Å
263	T	96.3	Very high	94.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.1	-47.9	173.4	-59.1	0	0	0	0	110.8	G184 L186 V259 I260 E261 R265 T266 L267	G184-T263 WeakPolarHBondContact CA-OG1 3.47Å; G184-T263 VanDerWaalsContact O-CG2 3.3Å; G184-T263 WeakPolarHBondContact O-CG2 3.2Å; L186-T263 HydrophobicContact CD2-CG2 4.06Å; V259-T263 WeakPolarHBondContact O-CB 3.2Å; V259-T263 PolarHBondContact O-N 2.78Å; V259-T263 PolarHBondContact O-OG1 3.47Å; I260-T263 CarbonylContact O-C 3.55Å; I260-T263 WeakPolarHBondContact O-CA 3.48Å; I260-T263 VanDerWaalsContact O-CB 3.28Å; I260-T263 WeakPolarHBondContact O-CB 3.4Å; I260-T263 PolarHBondContact O-N 3.29Å; E261-T263 VanDerWaalsContact C-N 3.3Å; T263-R265 PolarHBondContact O-N 3.16Å; T263-T266 WeakPolarHBondContact O-CB 3.24Å; T263-T266 PolarHBondContact O-N 3.03Å; T263-T266 VanDerWaalsContact O-N 3.11Å; T263-L267 WeakPolarHBondContact O-CB 3.44Å; T263-L267 PolarHBondContact O-N 3.2Å
264	F	95.9	Very high	94.6	Very high	15 Å²	15	24 Å²	24	7%	0.066	13%	0.128	C	C	.	.	H	α-helix	trans	-58.2	-46.5	173.9	-71	-12.7	0	0	0	112.6	D149 I151 M178 I260 E261 T266 L267 C268	D149-F264 HydrophobicContact CB-CE2 3.81Å; D149-F264 HydrophobicContact CB-CZ 4.05Å; I151-F264 HydrophobicContact CB-CD1 4.31Å; I151-F264 HydrophobicContact CB-CD2 3.95Å; I151-F264 HydrophobicContact CB-CE1 4.19Å; I151-F264 HydrophobicContact CB-CE2 3.81Å; I151-F264 HydrophobicContact CB-CG 4.2Å; I151-F264 HydrophobicContact CB-CZ 3.93Å; I151-F264 HydrophobicContact CD1-CB 3.98Å; I151-F264 HydrophobicContact CD1-CD1 4.31Å; I151-F264 HydrophobicContact CD1-CD2 4.37Å; I151-F264 HydrophobicContact CD1-CG 3.98Å; I151-F264 HydrophobicContact CG1-CD2 4.44Å; I151-F264 HydrophobicContact CG2-CD1 4.26Å; I151-F264 HydrophobicContact CG2-CE1 3.97Å; I151-F264 HydrophobicContact CG2-CE2 4.45Å; I151-F264 HydrophobicContact CG2-CZ 4.06Å; M178-F264 HydrophobicContact CB-CE1 3.85Å; M178-F264 HydrophobicContact CB-CZ 4.2Å; M178-F264 HydrophobicContact CG-CE1 4.03Å; M178-F264 HydrophobicContact SD-CD1 4.33Å; M178-F264 HydrophobicContact SD-CE1 3.7Å; I260-F264 HydrophobicContact CD1-CE1 4.27Å; I260-F264 HydrophobicContact CD1-CZ 3.93Å; I260-F264 HydrophobicContact CG1-CD1 4.35Å; I260-F264 HydrophobicContact CG1-CE1 3.85Å; I260-F264 HydrophobicContact CG1-CE2 4.11Å; I260-F264 HydrophobicContact CG1-CZ 3.72Å; I260-F264 WeakPolarHBondContact O-CG 3.21Å; I260-F264 PolarHBondContact O-N 3.38Å; E261-F264 PolarHBondContact O-N 3.34Å; F264-T266 PolarHBondContact O-N 3.37Å; F264-L267 PolarHBondContact O-N 2.9Å; F264-C268 PolarHBondContact O-N 3.15Å
265	R	93.1	Very high	94.3	Very high	73 Å²	73	22.2 Å²	22.2	28%	0.275	11%	0.113	S	C	.	.	H	α-helix	trans	-57.9	-39	174.9	-78.6	178.5	-100.3	150.4	-14.3	111.9	E261 K262 T263 S269 M318	E261-R265 WeakPolarHBondContact O-CG 3.2Å; E261-R265 PolarHBondContact O-N 3.01Å; E261-R265 PolarHBondContact O-NE 3.3Å; E261-R265 IonicContact OE2-NH2 3.67Å; E261-R265 PolarHBondContact OE2-NH2 2.89Å; E261-R265 VanDerWaalsContact OE2-NH2 3.1Å; K262-R265 PolarHBondContact O-N 3.46Å; T263-R265 PolarHBondContact O-N 3.16Å; R265-S269 VanDerWaalsContact O-CA 3.23Å; R265-S269 WeakPolarHBondContact O-CA 3.46Å; R265-S269 WeakPolarHBondContact O-CB 3.49Å; R265-S269 PolarHBondContact O-N 3.18Å; R265-M318 HydrophobicContact CG-SD 4.02Å
266	T	92.9	Very high	93.5	Very high	11 Å²	11	22.3 Å²	22.3	7%	0.067	12%	0.118	C	C	.	.	H	α-helix	trans	-73.6	-37.4	177.8	-56.5	0	0	0	0	112.5	K262 T263 F264 S269 R270 V309	K262-T266 WeakPolarHBondContact O-CB 3.32Å; K262-T266 PolarHBondContact O-N 3.09Å; K262-T266 PolarHBondContact O-OG1 3.41Å; T263-T266 WeakPolarHBondContact O-CB 3.24Å; T263-T266 PolarHBondContact O-N 3.03Å; T263-T266 VanDerWaalsContact O-N 3.11Å; F264-T266 PolarHBondContact O-N 3.37Å; T266-S269 CarbonylContact O-C 3.58Å; T266-S269 VanDerWaalsContact O-CA 3.22Å; T266-S269 WeakPolarHBondContact O-CA 3.49Å; T266-S269 PolarHBondContact O-N 2.83Å; T266-R270 WeakPolarHBondContact O-CB 3.47Å; T266-R270 PolarHBondContact O-N 3.4Å; T266-V309 HydrophobicContact CG2-CB 4.33Å; T266-V309 HydrophobicContact CG2-CG1 3.63Å; T266-V309 WeakPolarHBondContact CG2-O 3.48Å; T266-V309 VanDerWaalsContact OG1-CG1 3.27Å; T266-V309 WeakPolarHBondContact OG1-CG1 2.73Å; T266-V309 PolarHBondContact OG1-O 2.95Å; T266-V309 VanDerWaalsContact OG1-O 3.09Å
267	L	94.1	Very high	92.6	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-63.7	-50.8	177.5	-168.9	71.8	0	0	0	110.4	M178 T263 F264 S269 R270 F271 L274 H299	M178-L267 HydrophobicContact CE-CD2 4.08Å; M178-L267 HydrophobicContact SD-CD2 4.2Å; T263-L267 WeakPolarHBondContact O-CB 3.44Å; T263-L267 PolarHBondContact O-N 3.2Å; F264-L267 PolarHBondContact O-N 2.9Å; L267-S269 VanDerWaalsContact C-N 3.32Å; L267-R270 PolarHBondContact O-N 2.99Å; L267-F271 HydrophobicContact CD1-CD2 3.71Å; L267-F271 HydrophobicContact CD1-CE2 3.84Å; L267-F271 HydrophobicContact CG-CD2 4.28Å; L267-F271 WeakPolarHBondContact O-CB 3.24Å; L267-F271 WeakPolarHBondContact O-CD2 3.49Å; L267-F271 PolarHBondContact O-N 3Å; L267-L274 HydrophobicContact CD2-CD1 4.04Å; L267-L274 HydrophobicContact CG-CD1 3.9Å; L267-H299 HydrophobicContact CD1-CB 3.66Å
268	C	92.7	Very high	91.4	Very high	14 Å²	14	33.2 Å²	33.2	10%	0.095	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-38.7	173.2	-66.4	0	0	0	0	111.6	F264 F271 R272 D275	F264-C268 PolarHBondContact O-N 3.15Å; C268-F271 CarbonylContact O-C 3.54Å; C268-R272 PolarHBondContact O-NE 3.09Å; C268-R272 PolarHBondContact O-NH1 2.91Å; C268-D275 HydrophobicContact CB-CB 4.37Å
269	S	90.5	Very high	90.7	Very high	22 Å²	22	34.1 Å²	34.1	15%	0.154	19%	0.191	C	C	.	.	H	α-helix	trans	-27.6	-70.8	158.6	-168.7	0	0	0	0	115.2	R265 T266 L267 R272	R265-S269 VanDerWaalsContact O-CA 3.23Å; R265-S269 WeakPolarHBondContact O-CA 3.46Å; R265-S269 WeakPolarHBondContact O-CB 3.49Å; R265-S269 PolarHBondContact O-N 3.18Å; T266-S269 CarbonylContact O-C 3.58Å; T266-S269 VanDerWaalsContact O-CA 3.22Å; T266-S269 WeakPolarHBondContact O-CA 3.49Å; T266-S269 PolarHBondContact O-N 2.83Å; L267-S269 VanDerWaalsContact C-N 3.32Å; S269-R272 VanDerWaalsContact C-NH2 3.26Å; S269-R272 VanDerWaalsContact CA-NH2 3.3Å; S269-R272 VanDerWaalsContact CB-CZ 3.5Å; S269-R272 PolarHBondContact O-NE 3.41Å; S269-R272 PolarHBondContact O-NH2 3.5Å; S269-R272 PolarHBondContact OG-NH2 3.07Å
270	R	91.4	Very high	90.3	Very high	25 Å²	25	35.5 Å²	35.5	9%	0.094	20%	0.203	C	C	.	.	H	α-helix	trans	-80.5	-39.2	-171.8	-169.8	176	-67.8	149.4	-7.9	111.2	F41 T81 T266 L267 H299 S302 D308	F41-R270 HydrophobicContact CZ-CG 4.09Å; T81-R270 WeakPolarHBondContact CA-O 3.37Å; T81-R270 WeakPolarHBondContact CG2-O 3.5Å; T266-R270 WeakPolarHBondContact O-CB 3.47Å; T266-R270 PolarHBondContact O-N 3.4Å; L267-R270 PolarHBondContact O-N 2.99Å; R270-H299 PolarHBondContact NH1-ND1 2.96Å; R270-S302 PolarHBondContact NH1-OG 3.18Å; R270-D308 PolarHBondContact NH2-O 3.02Å
271	F	94.2	Very high	90	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.205	C	C	.	.			trans	-112.1	81.3	-176.3	-51.5	-65.8	0	0	0	110.6	F41 Y80 T81 L267 C268 C273 L274 C295 L298 H299	F41-F271 HydrophobicContact CE2-CE1 4.04Å; F41-F271 AromaticContact CZ-CE1 3.72Å; F41-F271 HydrophobicContact CZ-CE1 3.72Å; F41-F271 AromaticContact CZ-CZ 3.9Å; F41-F271 HydrophobicContact CZ-CZ 3.9Å; Y80-F271 CarbonylContact O-C 3.6Å; Y80-F271 WeakPolarHBondContact O-CA 3.43Å; T81-F271 HydrophobicContact CG2-CD1 4.49Å; L267-F271 HydrophobicContact CD1-CD2 3.71Å; L267-F271 HydrophobicContact CD1-CE2 3.84Å; L267-F271 HydrophobicContact CG-CD2 4.28Å; L267-F271 WeakPolarHBondContact O-CB 3.24Å; L267-F271 WeakPolarHBondContact O-CD2 3.49Å; L267-F271 PolarHBondContact O-N 3Å; C268-F271 CarbonylContact O-C 3.54Å; F271-C273 PolarHBondContact O-N 2.9Å; F271-L274 HydrophobicContact CB-CD1 4.06Å; F271-L274 HydrophobicContact CB-CG 4.07Å; F271-L274 WeakPolarHBondContact O-CB 3.47Å; F271-L274 PolarHBondContact O-N 3.17Å; F271-C295 HydrophobicContact CB-CB 4.19Å; F271-C295 HydrophobicContact CD1-CB 4.36Å; F271-C295 HydrophobicContact CD2-CB 3.72Å; F271-C295 HydrophobicContact CE2-CB 4.15Å; F271-C295 WeakPolarHBondContact CE2-O 3.41Å; F271-C295 HydrophobicContact CG-CB 3.82Å; F271-L298 HydrophobicContact CE1-CB 4.06Å; F271-L298 HydrophobicContact CE1-CD1 4.06Å; F271-L298 HydrophobicContact CZ-CB 3.58Å; F271-L298 HydrophobicContact CZ-CD1 4.43Å; F271-H299 HydrophobicContact CE2-CB 4.13Å
272	R	92.4	Very high	89.8	Confident	36 Å²	36	38.6 Å²	38.6	14%	0.136	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.5	-178.7	-57.7	-81.6	75.8	144.2	124.3	113.7	Y80 T81 C268 S269 L274 D275	Y80-R272 PolarHBondContact O-N 3.26Å; T81-R272 VanDerWaalsContact O-CB 3.25Å; T81-R272 WeakPolarHBondContact O-CB 3.31Å; T81-R272 WeakPolarHBondContact O-CG 3.39Å; C268-R272 PolarHBondContact O-NE 3.09Å; C268-R272 PolarHBondContact O-NH1 2.91Å; S269-R272 VanDerWaalsContact C-NH2 3.26Å; S269-R272 VanDerWaalsContact CA-NH2 3.3Å; S269-R272 VanDerWaalsContact CB-CZ 3.5Å; S269-R272 PolarHBondContact O-NE 3.41Å; S269-R272 PolarHBondContact O-NH2 3.5Å; S269-R272 PolarHBondContact OG-NH2 3.07Å; R272-L274 PolarHBondContact O-N 3.37Å; R272-D275 IonicContact CZ-OD2 3.92Å; R272-D275 IonicContact NE-OD2 3.85Å; R272-D275 PolarHBondContact NE-OD2 3.38Å; R272-D275 IonicContact NH1-OD2 3.49Å; R272-D275 PolarHBondContact NH1-OD2 2.97Å; R272-D275 PolarHBondContact O-N 3.45Å
273	C	93.2	Very high	89.7	Confident	8 Å²	8	36.5 Å²	36.5	5%	0.054	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.6	170.1	69	0	0	0	0	113.7	F79 Y80 F271 L281	F79-C273 HydrophobicContact CE1-CB 4.26Å; F79-C273 HydrophobicContact CE2-CB 4.32Å; F79-C273 HydrophobicContact CZ-CB 3.94Å; Y80-C273 PolarHBondContact O-N 3.08Å; Y80-C273 VanDerWaalsContact O-N 3.07Å; Y80-C273 PolarHBondContact O-SG 3.5Å; F271-C273 PolarHBondContact O-N 2.9Å; C273-L281 HydrophobicContact CB-CD2 4.12Å; C273-L281 WeakPolarHBondContact O-CD2 3.16Å
274	L	94.8	Very high	89.5	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.037	23%	0.227	C	C	.	.	S	Bend	trans	-90.7	-15.6	176.2	-52	-175.7	0	0	0	112.6	V153 L267 F271 R272 G276 I292 C295	V153-L274 HydrophobicContact CG1-CD2 4.24Å; L267-L274 HydrophobicContact CD2-CD1 4.04Å; L267-L274 HydrophobicContact CG-CD1 3.9Å; F271-L274 HydrophobicContact CB-CD1 4.06Å; F271-L274 HydrophobicContact CB-CG 4.07Å; F271-L274 WeakPolarHBondContact O-CB 3.47Å; F271-L274 PolarHBondContact O-N 3.17Å; R272-L274 PolarHBondContact O-N 3.37Å; L274-G276 PolarHBondContact O-N 2.93Å; L274-I292 HydrophobicContact CD2-CB 4.35Å; L274-I292 HydrophobicContact CD2-CG1 3.78Å; L274-C295 HydrophobicContact CD1-CB 3.78Å; L274-C295 HydrophobicContact CG-CB 4.48Å
275	D	89.1	Confident	89.4	Confident	32 Å²	32	39 Å²	39	17%	0.171	23%	0.227	C	C	.	.			trans	-81.9	111.2	-177.7	-177.6	-10.6	0	0	0	110.7	C268 R272 S277 K278	C268-D275 HydrophobicContact CB-CB 4.37Å; R272-D275 IonicContact CZ-OD2 3.92Å; R272-D275 IonicContact NE-OD2 3.85Å; R272-D275 PolarHBondContact NE-OD2 3.38Å; R272-D275 IonicContact NH1-OD2 3.49Å; R272-D275 PolarHBondContact NH1-OD2 2.97Å; R272-D275 PolarHBondContact O-N 3.45Å; D275-S277 PolarHBondContact O-N 3.39Å; D275-S277 VanDerWaalsContact O-N 3.12Å; D275-S277 VanDerWaalsContact OD1-CB 3.25Å; D275-S277 WeakPolarHBondContact OD1-CB 3.35Å; D275-S277 PolarHBondContact OD1-N 2.97Å; D275-S277 PolarHBondContact OD1-OG 2.68Å; D275-S277 PolarHBondContact OD2-OG 3.41Å; D275-K278 PolarHBondContact O-N 3.29Å
276	G	80.8	Confident	89.5	Confident	45 Å²	45	41 Å²	41	46%	0.464	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-61.3	-18.2	-179.5	0	0	0	0	0	114.8	L274 K278 G279	L274-G276 PolarHBondContact O-N 2.93Å; G276-K278 PolarHBondContact O-N 2.67Å; G276-G279 WeakPolarHBondContact CA-O 3.39Å; G276-G279 PolarHBondContact O-N 3.3Å; G276-G279 VanDerWaalsContact O-N 3.14Å
277	S	78.9	Confident	89.6	Confident	96 Å²	96	43.5 Å²	43.5	67%	0.671	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-64.9	-26.9	-178.6	66.2	0	0	0	0	113.6	D275	D275-S277 PolarHBondContact O-N 3.39Å; D275-S277 VanDerWaalsContact O-N 3.12Å; D275-S277 VanDerWaalsContact OD1-CB 3.25Å; D275-S277 WeakPolarHBondContact OD1-CB 3.35Å; D275-S277 PolarHBondContact OD1-N 2.97Å; D275-S277 PolarHBondContact OD1-OG 2.68Å; D275-S277 PolarHBondContact OD2-OG 3.41Å
278	K	70.1	Confident	89.7	Confident	143 Å²	143	43.4 Å²	43.4	62%	0.622	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-96.3	1.7	177.8	-67.4	-172.4	179.3	-179.7	0	113.5	D275 G276	D275-K278 PolarHBondContact O-N 3.29Å; G276-K278 PolarHBondContact O-N 2.67Å
279	G	81.5	Confident	90	Very high	41 Å²	41	43.2 Å²	43.2	42%	0.423	25%	0.248	S	C	.	.			trans	121.9	-172.5	-178.2	0	0	0	0	0	112.5	G276	G276-G279 WeakPolarHBondContact CA-O 3.39Å; G276-G279 PolarHBondContact O-N 3.3Å; G276-G279 VanDerWaalsContact O-N 3.14Å
280	A	87.9	Confident	90.3	Very high	34 Å²	34	46.1 Å²	46.1	28%	0.281	26%	0.258	S	S	.	.			trans	-106.3	154.5	-178.5	0	0	0	0	0	111.7	A154 Q282	A154-A280 HydrophobicContact CB-CB 3.9Å; A280-Q282 PolarHBondContact O-N 3.24Å; A280-Q282 PolarHBondContact O-NE2 2.97Å
281	L	91.5	Very high	90.7	Very high	7 Å²	7	44.9 Å²	44.9	4%	0.037	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-60.3	118.4	171.7	-73.8	173.8	0	0	0	110.3	F79 V153 A154 I155 K156 C273 Y283 I291 I292	F79-L281 HydrophobicContact CZ-CD2 4.1Å; V153-L281 HydrophobicContact CG1-CD1 3.95Å; A154-L281 PolarHBondContact O-N 3.23Å; I155-L281 HydrophobicContact CG2-CB 4.41Å; K156-L281 WeakPolarHBondContact CB-O 3.3Å; K156-L281 PolarHBondContact N-O 3.32Å; C273-L281 HydrophobicContact CB-CD2 4.12Å; C273-L281 WeakPolarHBondContact O-CD2 3.16Å; L281-Y283 PolarHBondContact O-N 3.2Å; L281-I291 HydrophobicContact CD1-CG2 4.48Å; L281-I291 HydrophobicContact CD2-CG2 4.32Å; L281-I292 HydrophobicContact CD1-CG1 4.33Å
282	Q	90.5	Very high	90.9	Very high	123 Å²	123	44.9 Å²	44.9	58%	0.575	25%	0.254	S	S	*	.			trans	-82.9	41.7	-175.8	-59.5	-59.4	-45.1	0	0	112.9	A280	A280-Q282 PolarHBondContact O-N 3.24Å; A280-Q282 PolarHBondContact O-NE2 2.97Å
283	Y	90.9	Very high	91.2	Very high	33 Å²	33	44.6 Å²	44.6	13%	0.129	26%	0.255	C	S	.	.	S	Bend	trans	-127.9	164	-173.6	-67.7	-63.8	0	0	0	111.7	F79 F85 L281 K287 I291	F79-Y283 HydrophobicContact CE1-CE2 4.46Å; F79-Y283 AromaticContact CZ-CE2 3.95Å; F79-Y283 HydrophobicContact CZ-CE2 3.95Å; F85-Y283 WeakPolarHBondContact CE1-OH 3.22Å; F85-Y283 HydrophobicContact CE2-CE2 4.01Å; F85-Y283 AromaticContact CE2-CZ 3.91Å; F85-Y283 WeakPolarHBondContact CE2-OH 3.18Å; F85-Y283 AromaticContact CZ-CE2 3.94Å; F85-Y283 HydrophobicContact CZ-CE2 3.94Å; F85-Y283 AromaticContact CZ-CZ 3.67Å; F85-Y283 WeakPolarHBondContact CZ-OH 3.34Å; L281-Y283 PolarHBondContact O-N 3.2Å; Y283-K287 HydrophobicContact CD1-CD 3.5Å; Y283-K287 VanDerWaalsContact CD1-CD 3.5Å; Y283-K287 HydrophobicContact CD1-CG 4Å; Y283-K287 HydrophobicContact CE1-CD 3.93Å; Y283-K287 HydrophobicContact CG-CD 4.02Å; Y283-K287 HydrophobicContact CG-CG 3.98Å; Y283-I291 HydrophobicContact CD2-CD1 3.36Å; Y283-I291 HydrophobicContact CE2-CD1 3.46Å; Y283-I291 VanDerWaalsContact CE2-CD1 3.46Å; Y283-I291 HydrophobicContact CG-CD1 4.15Å
284	S	93	Very high	91.4	Very high	59 Å²	59	44.2 Å²	44.2	41%	0.413	25%	0.252	S	S	.	.			trans	-60.9	156.3	169.6	77.7	0	0	0	0	110.2	E286 K287 S288	S284-E286 WeakPolarHBondContact CB-OE2 3.49Å; S284-E286 PolarHBondContact O-N 3.46Å; S284-E286 PolarHBondContact OG-OE2 3.02Å; S284-K287 PolarHBondContact O-N 3.1Å; S284-K287 VanDerWaalsContact O-N 3.15Å; S284-K287 PolarHBondContact OG-N 2.87Å; S284-S288 WeakPolarHBondContact O-CB 3.26Å; S284-S288 PolarHBondContact O-N 2.84Å; S284-S288 PolarHBondContact O-OG 3.12Å; S284-S288 VanDerWaalsContact O-OG 3.12Å
285	P	94.4	Very high	91.6	Very high	8 Å²	8	43.9 Å²	43.9	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-49.9	-43.5	176.6	-30.2	37.5	0	0	0	113.2	I155 P158 Y165 L174 K287 S288 S289	I155-P285 HydrophobicContact CD1-CB 4.3Å; I155-P285 HydrophobicContact CD1-CG 3.96Å; P158-P285 HydrophobicContact CB-CG 4.15Å; P158-P285 HydrophobicContact CG-CG 3.67Å; Y165-P285 HydrophobicContact CE1-CB 3.76Å; Y165-P285 HydrophobicContact CE1-CG 3.9Å; Y165-P285 HydrophobicContact CE2-CG 4.03Å; Y165-P285 WeakPolarHBondContact OH-CB 3.49Å; L174-P285 WeakPolarHBondContact CD1-O 3.3Å; L174-P285 HydrophobicContact CD2-CB 4.28Å; P285-K287 PolarHBondContact O-N 3.35Å; P285-S288 PolarHBondContact O-N 3.36Å; P285-S289 VanDerWaalsContact O-CB 3.3Å; P285-S289 WeakPolarHBondContact O-CB 3.44Å; P285-S289 PolarHBondContact O-N 2.91Å
286	E	95.1	Very high	92	Very high	116 Å²	116	42.4 Å²	42.4	54%	0.542	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-45.8	-178.2	-51.5	77.4	-169.2	0	0	110.9	S284 S289 H290	S284-E286 WeakPolarHBondContact CB-OE2 3.49Å; S284-E286 PolarHBondContact O-N 3.46Å; S284-E286 PolarHBondContact OG-OE2 3.02Å; E286-S289 WeakPolarHBondContact O-CB 3.19Å; E286-S289 PolarHBondContact O-N 2.91Å; E286-H290 PolarHBondContact O-N 3.34Å; E286-H290 VanDerWaalsContact O-N 3.1Å; E286-H290 PolarHBondContact O-ND1 3.41Å
287	K	95.3	Very high	92.9	Very high	62 Å²	62	40.2 Å²	40.2	27%	0.27	22%	0.22	S	C	.	.	H	α-helix	trans	-71.1	-36.5	179.5	179	163.6	179.7	172.1	0	112.1	Y283 S284 P285 S289 H290 I291	Y283-K287 HydrophobicContact CD1-CD 3.5Å; Y283-K287 VanDerWaalsContact CD1-CD 3.5Å; Y283-K287 HydrophobicContact CD1-CG 4Å; Y283-K287 HydrophobicContact CE1-CD 3.93Å; Y283-K287 HydrophobicContact CG-CD 4.02Å; Y283-K287 HydrophobicContact CG-CG 3.98Å; S284-K287 PolarHBondContact O-N 3.1Å; S284-K287 VanDerWaalsContact O-N 3.15Å; S284-K287 PolarHBondContact OG-N 2.87Å; P285-K287 PolarHBondContact O-N 3.35Å; K287-S289 VanDerWaalsContact C-N 3.33Å; K287-H290 PolarHBondContact O-N 2.94Å; K287-I291 HydrophobicContact CG-CD1 4.28Å; K287-I291 WeakPolarHBondContact O-CG1 3.1Å; K287-I291 PolarHBondContact O-N 3.15Å
288	S	96.2	Very high	93.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-44.7	172.4	-64.6	0	0	0	0	110.7	S284 P285 H290 I291 I292	S284-S288 WeakPolarHBondContact O-CB 3.26Å; S284-S288 PolarHBondContact O-N 2.84Å; S284-S288 PolarHBondContact O-OG 3.12Å; S284-S288 VanDerWaalsContact O-OG 3.12Å; P285-S288 PolarHBondContact O-N 3.36Å; S288-H290 VanDerWaalsContact C-N 3.34Å; S288-H290 PolarHBondContact O-N 3.32Å; S288-I291 WeakPolarHBondContact O-CB 3.26Å; S288-I291 PolarHBondContact O-N 3.46Å; S288-I291 VanDerWaalsContact O-N 3.11Å; S288-I292 WeakPolarHBondContact O-CD1 3.21Å; S288-I292 VanDerWaalsContact O-CG1 3.24Å; S288-I292 WeakPolarHBondContact O-CG1 3.38Å; S288-I292 PolarHBondContact O-N 2.68Å
289	S	97.6	Very high	95.1	Very high	11 Å²	11	28.9 Å²	28.9	8%	0.077	16%	0.159	C	C	.	.	H	α-helix	trans	-55.7	-46.2	175.1	-169.5	0	0	0	0	112.4	T191 P285 E286 K287 I291 I292 L293	T191-S289 WeakPolarHBondContact CB-OG 3.45Å; T191-S289 VanDerWaalsContact O-CB 3.26Å; T191-S289 WeakPolarHBondContact O-CB 3.44Å; T191-S289 PolarHBondContact O-OG 2.97Å; T191-S289 PolarHBondContact OG1-O 3.43Å; T191-S289 PolarHBondContact OG1-OG 3.47Å; P285-S289 VanDerWaalsContact O-CB 3.3Å; P285-S289 WeakPolarHBondContact O-CB 3.44Å; P285-S289 PolarHBondContact O-N 2.91Å; E286-S289 WeakPolarHBondContact O-CB 3.19Å; E286-S289 PolarHBondContact O-N 2.91Å; K287-S289 VanDerWaalsContact C-N 3.33Å; S289-I291 PolarHBondContact O-N 3.22Å; S289-I292 PolarHBondContact O-N 2.91Å; S289-L293 PolarHBondContact O-N 3.19Å
290	H	98.3	Very high	95.8	Very high	82 Å²	82	27.3 Å²	27.3	38%	0.38	14%	0.141	S	C	.	.	H	α-helix	trans	-64.3	-38.3	176.2	-74.7	72.7	0	0	0	112.7	T108 V112 E286 K287 S288 L293 A294	T108-H290 VanDerWaalsContact CG2-C 3.48Å; T108-H290 HydrophobicContact CG2-CB 3.65Å; T108-H290 WeakPolarHBondContact CG2-O 3.48Å; V112-H290 HydrophobicContact CG2-CB 4.15Å; V112-H290 WeakPolarHBondContact CG2-O 3.48Å; E286-H290 PolarHBondContact O-N 3.34Å; E286-H290 VanDerWaalsContact O-N 3.1Å; E286-H290 PolarHBondContact O-ND1 3.41Å; K287-H290 PolarHBondContact O-N 2.94Å; S288-H290 VanDerWaalsContact C-N 3.34Å; S288-H290 PolarHBondContact O-N 3.32Å; H290-L293 PolarHBondContact O-N 3.4Å; H290-A294 VanDerWaalsContact O-CB 3.31Å; H290-A294 WeakPolarHBondContact O-CB 3.41Å; H290-A294 PolarHBondContact O-N 3.13Å
291	I	98.1	Very high	96.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.5	-44.3	175.6	-70	164.6	0	0	0	110.6	F79 Y80 T108 L281 Y283 K287 S288 S289 A294 C295	F79-I291 HydrophobicContact CE1-CD1 4.16Å; F79-I291 HydrophobicContact CE1-CG2 4.19Å; Y80-I291 HydrophobicContact CD1-CG2 4.27Å; Y80-I291 HydrophobicContact CE1-CG2 4.15Å; T108-I291 HydrophobicContact CG2-CG1 4.22Å; L281-I291 HydrophobicContact CD1-CG2 4.48Å; L281-I291 HydrophobicContact CD2-CG2 4.32Å; Y283-I291 HydrophobicContact CD2-CD1 3.36Å; Y283-I291 HydrophobicContact CE2-CD1 3.46Å; Y283-I291 VanDerWaalsContact CE2-CD1 3.46Å; Y283-I291 HydrophobicContact CG-CD1 4.15Å; K287-I291 HydrophobicContact CG-CD1 4.28Å; K287-I291 WeakPolarHBondContact O-CG1 3.1Å; K287-I291 PolarHBondContact O-N 3.15Å; S288-I291 WeakPolarHBondContact O-CB 3.26Å; S288-I291 PolarHBondContact O-N 3.46Å; S288-I291 VanDerWaalsContact O-N 3.11Å; S289-I291 PolarHBondContact O-N 3.22Å; I291-A294 PolarHBondContact O-N 3.23Å; I291-C295 PolarHBondContact O-N 2.61Å; I291-C295 PolarHBondContact O-SG 2.94Å
292	I	98.4	Very high	96.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.4	-48.9	177.6	-60.7	159.4	0	0	0	109.6	V153 L174 M178 T191 L274 L281 S288 S289 A294 C295 C296	V153-I292 HydrophobicContact CB-CD1 3.71Å; V153-I292 HydrophobicContact CB-CG1 4.25Å; V153-I292 HydrophobicContact CG1-CD1 3.83Å; V153-I292 HydrophobicContact CG1-CG1 4.01Å; V153-I292 HydrophobicContact CG2-CD1 3.92Å; V153-I292 HydrophobicContact CG2-CG1 4.13Å; V153-I292 HydrophobicContact CG2-CG2 4.44Å; L174-I292 HydrophobicContact CB-CD1 4.26Å; L174-I292 HydrophobicContact CD1-CD1 3.73Å; M178-I292 HydrophobicContact CE-CG2 4.18Å; T191-I292 HydrophobicContact CG2-CB 3.97Å; T191-I292 HydrophobicContact CG2-CG2 3.53Å; L274-I292 HydrophobicContact CD2-CB 4.35Å; L274-I292 HydrophobicContact CD2-CG1 3.78Å; L281-I292 HydrophobicContact CD1-CG1 4.33Å; S288-I292 WeakPolarHBondContact O-CD1 3.21Å; S288-I292 VanDerWaalsContact O-CG1 3.24Å; S288-I292 WeakPolarHBondContact O-CG1 3.38Å; S288-I292 PolarHBondContact O-N 2.68Å; S289-I292 PolarHBondContact O-N 2.91Å; I292-A294 PolarHBondContact O-N 3Å; I292-C295 WeakPolarHBondContact O-CB 3.41Å; I292-C295 PolarHBondContact O-N 3.17Å; I292-C296 PolarHBondContact O-N 3.5Å; I292-C296 PolarHBondContact O-SG 3.11Å
293	L	98.7	Very high	96.6	Very high	30 Å²	30	20 Å²	20	16%	0.157	10%	0.101	C	C	.	.	H	α-helix	trans	-62.1	-42.1	178.7	-178	57.5	0	0	0	112.1	V112 A115 I119 V189 T191 S289 H290 C295 C296 V297	V112-L293 HydrophobicContact CB-CD2 4.47Å; V112-L293 HydrophobicContact CG1-CD2 3.89Å; V112-L293 HydrophobicContact CG2-CB 4.21Å; V112-L293 HydrophobicContact CG2-CD2 4.08Å; V112-L293 HydrophobicContact CG2-CG 4.16Å; A115-L293 HydrophobicContact CB-CD1 4.18Å; A115-L293 HydrophobicContact CB-CD2 4.16Å; A115-L293 HydrophobicContact CB-CG 4.25Å; I119-L293 HydrophobicContact CD1-CD1 3.76Å; V189-L293 HydrophobicContact CB-CD1 4.29Å; V189-L293 HydrophobicContact CG1-CD1 4.2Å; T191-L293 HydrophobicContact CG2-CB 4.25Å; S289-L293 PolarHBondContact O-N 3.19Å; H290-L293 PolarHBondContact O-N 3.4Å; L293-C295 VanDerWaalsContact C-N 3.32Å; L293-C295 PolarHBondContact O-N 2.81Å; L293-C296 WeakPolarHBondContact O-CB 3.17Å; L293-C296 PolarHBondContact O-N 2.59Å; L293-C296 VanDerWaalsContact O-N 3.13Å; L293-V297 WeakPolarHBondContact O-CG2 3.35Å; L293-V297 PolarHBondContact O-N 2.9Å
294	A	98.6	Very high	96.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.7	-39.1	175.1	0	0	0	0	0	112.5	T108 L111 V112 H290 I291 I292 V297 L298	T108-A294 HydrophobicContact CG2-CB 4.04Å; L111-A294 HydrophobicContact CB-CB 3.84Å; L111-A294 HydrophobicContact CD1-CB 3.94Å; V112-A294 HydrophobicContact CG2-CB 4.42Å; H290-A294 VanDerWaalsContact O-CB 3.31Å; H290-A294 WeakPolarHBondContact O-CB 3.41Å; H290-A294 PolarHBondContact O-N 3.13Å; I291-A294 PolarHBondContact O-N 3.23Å; I292-A294 PolarHBondContact O-N 3Å; A294-V297 PolarHBondContact O-N 3.27Å; A294-L298 WeakPolarHBondContact O-CG 3.2Å; A294-L298 PolarHBondContact O-N 3.21Å
295	C	98.3	Very high	96.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.3	-39.1	173.7	-65.1	0	0	0	0	111.8	F271 L274 I291 I292 L293 L298 H299	F271-C295 HydrophobicContact CB-CB 4.19Å; F271-C295 HydrophobicContact CD1-CB 4.36Å; F271-C295 HydrophobicContact CD2-CB 3.72Å; F271-C295 HydrophobicContact CE2-CB 4.15Å; F271-C295 WeakPolarHBondContact CE2-O 3.41Å; F271-C295 HydrophobicContact CG-CB 3.82Å; L274-C295 HydrophobicContact CD1-CB 3.78Å; L274-C295 HydrophobicContact CG-CB 4.48Å; I291-C295 PolarHBondContact O-N 2.61Å; I291-C295 PolarHBondContact O-SG 2.94Å; I292-C295 WeakPolarHBondContact O-CB 3.41Å; I292-C295 PolarHBondContact O-N 3.17Å; L293-C295 VanDerWaalsContact C-N 3.32Å; L293-C295 PolarHBondContact O-N 2.81Å; C295-L298 PolarHBondContact O-N 2.96Å; C295-H299 WeakPolarHBondContact O-CB 3.43Å; C295-H299 PolarHBondContact O-N 2.92Å
296	C	98.5	Very high	96.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63	-41	174.7	-63.1	0	0	0	0	111.9	I119 M178 L186 V189 I292 L293 H299 N300	I119-C296 HydrophobicContact CD1-CB 4.07Å; M178-C296 VanDerWaalsContact CE-SG 3.57Å; L186-C296 HydrophobicContact CD1-CB 3.53Å; V189-C296 HydrophobicContact CG1-CB 4.18Å; V189-C296 HydrophobicContact CG2-CB 4.13Å; I292-C296 PolarHBondContact O-N 3.5Å; I292-C296 PolarHBondContact O-SG 3.11Å; L293-C296 WeakPolarHBondContact O-CB 3.17Å; L293-C296 PolarHBondContact O-N 2.59Å; L293-C296 VanDerWaalsContact O-N 3.13Å; C296-H299 WeakPolarHBondContact O-CB 3.43Å; C296-H299 PolarHBondContact O-N 2.97Å; C296-N300 PolarHBondContact O-N 3.49Å; C296-N300 VanDerWaalsContact O-N 3.13Å
297	V	98.5	Very high	95.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-48.7	173.9	172.4	0	0	0	0	110.8	L111 A115 F118 I119 L293 A294 H299 N300 I301	L111-V297 HydrophobicContact CD2-CG1 4.06Å; A115-V297 HydrophobicContact CB-CG2 3.89Å; F118-V297 HydrophobicContact CB-CG1 4.31Å; F118-V297 HydrophobicContact CD2-CG1 3.85Å; F118-V297 HydrophobicContact CG-CG1 4.37Å; I119-V297 HydrophobicContact CD1-CG2 3.84Å; L293-V297 WeakPolarHBondContact O-CG2 3.35Å; L293-V297 PolarHBondContact O-N 2.9Å; A294-V297 PolarHBondContact O-N 3.27Å; V297-H299 VanDerWaalsContact C-N 3.27Å; V297-H299 PolarHBondContact O-N 3.44Å; V297-N300 PolarHBondContact O-N 3Å; V297-I301 HydrophobicContact CG1-CD1 3.7Å; V297-I301 HydrophobicContact CG1-CG1 4.29Å; V297-I301 VanDerWaalsContact O-CG1 3.27Å; V297-I301 WeakPolarHBondContact O-CG1 3.22Å; V297-I301 PolarHBondContact O-N 2.8Å
298	L	97.9	Very high	94.5	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-60.6	-36	177	-73.9	173	0	0	0	112.6	F45 L49 L77 Y80 L111 F271 A294 C295 S302	F45-L298 HydrophobicContact CE1-CD2 4.49Å; L49-L298 HydrophobicContact CD1-CD2 3.77Å; L49-L298 HydrophobicContact CD2-CD2 3.81Å; L49-L298 HydrophobicContact CG-CD2 4.46Å; L77-L298 HydrophobicContact CD2-CD1 3.95Å; L77-L298 HydrophobicContact CD2-CD2 4.39Å; Y80-L298 HydrophobicContact CD2-CD1 3.65Å; Y80-L298 HydrophobicContact CE2-CD1 3.8Å; L111-L298 HydrophobicContact CD1-CD1 3.8Å; L111-L298 HydrophobicContact CD1-CD2 4.08Å; L111-L298 HydrophobicContact CD1-CG 3.78Å; L111-L298 HydrophobicContact CD2-CD2 3.82Å; L111-L298 HydrophobicContact CD2-CG 4.07Å; F271-L298 HydrophobicContact CE1-CB 4.06Å; F271-L298 HydrophobicContact CE1-CD1 4.06Å; F271-L298 HydrophobicContact CZ-CB 3.58Å; F271-L298 HydrophobicContact CZ-CD1 4.43Å; A294-L298 WeakPolarHBondContact O-CG 3.2Å; A294-L298 PolarHBondContact O-N 3.21Å; C295-L298 PolarHBondContact O-N 2.96Å; L298-S302 VanDerWaalsContact O-CB 3.29Å; L298-S302 WeakPolarHBondContact O-CB 3.23Å; L298-S302 PolarHBondContact O-N 3.49Å; L298-S302 PolarHBondContact O-OG 2.65Å
299	H	97.2	Very high	92.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-50.3	173.9	177.2	75.2	0	0	0	111.7	G184 L267 R270 F271 C295 C296 V297 S302 L303	G184-H299 PolarHBondContact O-NE2 3.37Å; L267-H299 HydrophobicContact CD1-CB 3.66Å; R270-H299 PolarHBondContact NH1-ND1 2.96Å; F271-H299 HydrophobicContact CE2-CB 4.13Å; C295-H299 WeakPolarHBondContact O-CB 3.43Å; C295-H299 PolarHBondContact O-N 2.92Å; C296-H299 WeakPolarHBondContact O-CB 3.43Å; C296-H299 PolarHBondContact O-N 2.97Å; V297-H299 VanDerWaalsContact C-N 3.27Å; V297-H299 PolarHBondContact O-N 3.44Å; H299-S302 WeakPolarHBondContact O-CB 3.25Å; H299-S302 PolarHBondContact O-N 3.09Å; H299-S302 PolarHBondContact O-OG 2.86Å; H299-L303 WeakPolarHBondContact NE2-CD1 2.94Å; H299-L303 PolarHBondContact O-N 3.2Å; H299-L303 VanDerWaalsContact O-N 3.08Å
300	N	97.8	Very high	91	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-43.2	178.8	-76.8	13	0	0	0	112.6	F118 L186 C296 V297 S302 L303 E304	F118-N300 HydrophobicContact CB-CB 4.3Å; F118-N300 PolarHBondContact O-ND2 3.44Å; L186-N300 PolarHBondContact N-ND2 2.71Å; L186-N300 PolarHBondContact N-OD1 3.27Å; L186-N300 PolarHBondContact O-ND2 2.63Å; C296-N300 PolarHBondContact O-N 3.49Å; C296-N300 VanDerWaalsContact O-N 3.13Å; V297-N300 PolarHBondContact O-N 3Å; N300-S302 PolarHBondContact O-N 2.95Å; N300-L303 WeakPolarHBondContact O-CB 3.38Å; N300-L303 PolarHBondContact O-N 3.47Å; N300-E304 PolarHBondContact O-N 3.31Å
301	I	97	Very high	88.7	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-40.8	174.5	-61.8	170	0	0	0	109.8	F45 Y48 L49 L52 L111 F118 V297 L303 E304 H305	F45-I301 HydrophobicContact CE2-CB 4.29Å; F45-I301 HydrophobicContact CE2-CG2 3.62Å; F45-I301 HydrophobicContact CZ-CB 4.26Å; F45-I301 HydrophobicContact CZ-CG2 3.89Å; Y48-I301 HydrophobicContact CD1-CG2 3.95Å; Y48-I301 HydrophobicContact CE1-CG2 3.42Å; Y48-I301 VanDerWaalsContact CE1-CG2 3.42Å; L49-I301 HydrophobicContact CD2-CD1 4.26Å; L52-I301 HydrophobicContact CD2-CD1 4.05Å; L111-I301 HydrophobicContact CD2-CD1 4.41Å; F118-I301 HydrophobicContact CB-CG1 4.38Å; F118-I301 HydrophobicContact CD1-CD1 4.42Å; F118-I301 HydrophobicContact CD1-CG1 3.54Å; F118-I301 HydrophobicContact CD2-CD1 3.9Å; F118-I301 HydrophobicContact CD2-CG1 3.85Å; F118-I301 HydrophobicContact CE1-CD1 4.3Å; F118-I301 HydrophobicContact CE1-CG1 3.63Å; F118-I301 HydrophobicContact CE2-CD1 3.77Å; F118-I301 HydrophobicContact CE2-CG1 3.94Å; F118-I301 HydrophobicContact CG-CD1 4.23Å; F118-I301 HydrophobicContact CG-CG1 3.65Å; F118-I301 HydrophobicContact CZ-CD1 3.97Å; F118-I301 HydrophobicContact CZ-CG1 3.82Å; V297-I301 HydrophobicContact CG1-CD1 3.7Å; V297-I301 HydrophobicContact CG1-CG1 4.29Å; V297-I301 VanDerWaalsContact O-CG1 3.27Å; V297-I301 WeakPolarHBondContact O-CG1 3.22Å; V297-I301 PolarHBondContact O-N 2.8Å; I301-L303 VanDerWaalsContact C-N 3.29Å; I301-L303 PolarHBondContact O-N 3.25Å; I301-E304 PolarHBondContact O-N 3.15Å; I301-H305 PolarHBondContact O-N 2.67Å; I301-H305 PolarHBondContact O-ND1 3.41Å
302	S	94.6	Very high	86.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-37.1	178.3	76.3	0	0	0	0	112.6	R270 L298 H299 N300 H305 G306 M307	R270-S302 PolarHBondContact NH1-OG 3.18Å; L298-S302 VanDerWaalsContact O-CB 3.29Å; L298-S302 WeakPolarHBondContact O-CB 3.23Å; L298-S302 PolarHBondContact O-N 3.49Å; L298-S302 PolarHBondContact O-OG 2.65Å; H299-S302 WeakPolarHBondContact O-CB 3.25Å; H299-S302 PolarHBondContact O-N 3.09Å; H299-S302 PolarHBondContact O-OG 2.86Å; N300-S302 PolarHBondContact O-N 2.95Å; S302-H305 CarbonylContact O-C 3.53Å; S302-H305 PolarHBondContact O-N 2.94Å; S302-G306 PolarHBondContact O-N 3.49Å; S302-M307 WeakPolarHBondContact O-CB 3.25Å; S302-M307 PolarHBondContact O-N 2.91Å
303	L	93.8	Very high	83.4	Confident	10 Å²	10	37 Å²	37	5%	0.052	21%	0.214	C	C	.	.	H	α-helix	trans	-69.4	-37.9	176.8	-74.5	172.6	0	0	0	113.3	R183 A185 H299 N300 I301 H305 G306 M307 V309	R183-L303 PolarHBondContact NH2-O 3.39Å; A185-L303 HydrophobicContact CB-CD1 3.94Å; H299-L303 WeakPolarHBondContact NE2-CD1 2.94Å; H299-L303 PolarHBondContact O-N 3.2Å; H299-L303 VanDerWaalsContact O-N 3.08Å; N300-L303 WeakPolarHBondContact O-CB 3.38Å; N300-L303 PolarHBondContact O-N 3.47Å; I301-L303 VanDerWaalsContact C-N 3.29Å; I301-L303 PolarHBondContact O-N 3.25Å; L303-H305 PolarHBondContact O-N 3.12Å; L303-G306 PolarHBondContact O-N 3.21Å; L303-G306 VanDerWaalsContact O-N 3.15Å; L303-M307 WeakPolarHBondContact CD2-O 3.38Å; L303-V309 HydrophobicContact CD1-CG2 4.08Å; L303-V309 HydrophobicContact CD2-CB 4.49Å; L303-V309 HydrophobicContact CD2-CG2 3.14Å; L303-V309 HydrophobicContact CG-CG2 4.1Å
304	E	93.4	Very high	80.5	Confident	118 Å²	118	43.5 Å²	43.5	55%	0.551	25%	0.245	S	C	*	.	H	α-helix	trans	-63.2	-30.3	173.6	-69.8	-179.6	178.9	0	0	111.9	F118 N300 I301 G306	F118-E304 WeakPolarHBondContact CE1-OE2 3.4Å; N300-E304 PolarHBondContact O-N 3.31Å; I301-E304 PolarHBondContact O-N 3.15Å; E304-G306 VanDerWaalsContact C-N 3.27Å; E304-G306 PolarHBondContact O-N 3.09Å
305	H	91.3	Very high	77.6	Confident	77 Å²	77	48 Å²	48	36%	0.356	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	10.5	176.8	-70.2	74.7	0	0	0	113.6	F45 Y48 I301 S302 L303 M307	F45-H305 HydrophobicContact CD2-CB 4.11Å; F45-H305 AromaticContact CD2-CG 3.98Å; F45-H305 HydrophobicContact CE2-CB 4.41Å; Y48-H305 AromaticContact CD1-CE1 3.58Å; Y48-H305 AromaticContact CD1-NE2 3.68Å; Y48-H305 AromaticContact CD2-CE1 3.84Å; Y48-H305 AromaticContact CD2-NE2 3.38Å; Y48-H305 WeakPolarHBondContact CD2-NE2 3.41Å; Y48-H305 AromaticContact CE1-CE1 3.49Å; Y48-H305 VanDerWaalsContact CE1-CE1 3.49Å; Y48-H305 WeakPolarHBondContact CE1-CE1 3.45Å; Y48-H305 AromaticContact CE1-NE2 3.99Å; Y48-H305 AromaticContact CE2-CE1 3.72Å; Y48-H305 AromaticContact CE2-NE2 3.67Å; Y48-H305 AromaticContact CG-CE1 3.75Å; Y48-H305 AromaticContact CG-NE2 3.37Å; Y48-H305 AromaticContact CZ-CE1 3.54Å; Y48-H305 AromaticContact CZ-NE2 3.96Å; I301-H305 PolarHBondContact O-N 2.67Å; I301-H305 PolarHBondContact O-ND1 3.41Å; S302-H305 CarbonylContact O-C 3.53Å; S302-H305 PolarHBondContact O-N 2.94Å; L303-H305 PolarHBondContact O-N 3.12Å; H305-M307 VanDerWaalsContact C-N 3.31Å; H305-M307 PolarHBondContact O-N 3.46Å
306	G	87.3	Confident	74.8	Confident	66 Å²	66	50.5 Å²	50.5	68%	0.68	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	17	175.8	0	0	0	0	0	114.7	S302 L303 E304 D308	S302-G306 PolarHBondContact O-N 3.49Å; L303-G306 PolarHBondContact O-N 3.21Å; L303-G306 VanDerWaalsContact O-N 3.15Å; E304-G306 VanDerWaalsContact C-N 3.27Å; E304-G306 PolarHBondContact O-N 3.09Å; G306-D308 PolarHBondContact O-N 3.18Å
307	M	83.6	Confident	71.4	Confident	35 Å²	35	56.7 Å²	56.7	17%	0.172	34%	0.339	C	S	.	.			trans	-74.4	120.9	167.6	-73.2	-176.3	-90.2	0	0	109.2	F41 F45 S302 L303 H305	F41-M307 HydrophobicContact CD1-CE 3.74Å; F41-M307 HydrophobicContact CD1-SD 3.78Å; F41-M307 HydrophobicContact CE1-CE 4.12Å; F41-M307 HydrophobicContact CE1-SD 4.25Å; F45-M307 HydrophobicContact CB-CE 4.09Å; F45-M307 HydrophobicContact CD1-CE 4.02Å; F45-M307 HydrophobicContact CD2-CE 3.12Å; F45-M307 HydrophobicContact CE1-CE 4.17Å; F45-M307 HydrophobicContact CE2-CE 3.29Å; F45-M307 HydrophobicContact CG-CE 3.48Å; F45-M307 VanDerWaalsContact CG-CE 3.48Å; F45-M307 HydrophobicContact CZ-CE 3.83Å; S302-M307 WeakPolarHBondContact O-CB 3.25Å; S302-M307 PolarHBondContact O-N 2.91Å; L303-M307 WeakPolarHBondContact CD2-O 3.38Å; H305-M307 VanDerWaalsContact C-N 3.31Å; H305-M307 PolarHBondContact O-N 3.46Å
308	D	68.8	Low	68.6	Low	79 Å²	79	61.9 Å²	61.9	42%	0.422	36%	0.364	S	S	.	.			trans	-67.9	141.8	-177	-166.4	-0	0	0	0	111.1	R270 G306 W310 S311	R270-D308 PolarHBondContact NH2-O 3.02Å; G306-D308 PolarHBondContact O-N 3.18Å; D308-W310 VanDerWaalsContact C-N 3.28Å; D308-W310 PolarHBondContact OD1-N 3.3Å; D308-S311 PolarHBondContact O-OG 3.33Å
309	V	60.6	Low	65.4	Low	2 Å²	2	70.4 Å²	70.4	1%	0.012	40%	0.404	C	S	.	.	S	Bend	trans	-68.9	-35.4	171.2	-174.2	0	0	0	0	109.3	R183 T266 L303	R183-V309 VanDerWaalsContact O-CG2 3.29Å; R183-V309 WeakPolarHBondContact O-CG2 3.46Å; T266-V309 HydrophobicContact CG2-CB 4.33Å; T266-V309 HydrophobicContact CG2-CG1 3.63Å; T266-V309 WeakPolarHBondContact CG2-O 3.48Å; T266-V309 VanDerWaalsContact OG1-CG1 3.27Å; T266-V309 WeakPolarHBondContact OG1-CG1 2.73Å; T266-V309 PolarHBondContact OG1-O 2.95Å; T266-V309 VanDerWaalsContact OG1-O 3.09Å; L303-V309 HydrophobicContact CD1-CG2 4.08Å; L303-V309 HydrophobicContact CD2-CB 4.49Å; L303-V309 HydrophobicContact CD2-CG2 3.14Å; L303-V309 HydrophobicContact CG-CG2 4.1Å
310	W	61.1	Low	62.4	Low	116 Å²	116	77.1 Å²	77.1	44%	0.439	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-3	-164.6	-43.2	119.3	0	0	0	114.7	K262 D308	K262-W310 HydrophobicContact CB-CE3 4.06Å; K262-W310 HydrophobicContact CB-CH2 3.66Å; K262-W310 HydrophobicContact CB-CZ3 3.15Å; K262-W310 HydrophobicContact CD-CH2 4.18Å; K262-W310 HydrophobicContact CD-CZ3 4.07Å; K262-W310 HydrophobicContact CG-CZ3 4.19Å; D308-W310 VanDerWaalsContact C-N 3.28Å; D308-W310 PolarHBondContact OD1-N 3.3Å
311	S	50.3	Low	59.4	Low	87 Å²	87	79.3 Å²	79.3	61%	0.608	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-8	-173.6	62.1	0	0	0	0	115	D308	D308-S311 PolarHBondContact O-OG 3.33Å
312	S	48	Very low	56.2	Low	42 Å²	42	84.6 Å²	84.6	29%	0.294	49%	0.485	S	S	.	.	S	Bend	trans	-70.6	130.1	175.9	-84.7	0	0	0	0	110.3	M314	S312-M314 PolarHBondContact O-N 3.18Å; S312-M314 VanDerWaalsContact O-N 3.16Å
313	P	37.2	Very low	53.4	Low	108 Å²	108	94 Å²	94	70%	0.701	53%	0.529	S	S	*	.			trans	-57.4	126.2	176.8	22.4	-30.5	0	0	0	108.7	T315	P313-T315 PolarHBondContact O-N 2.95Å
314	M	36.2	Very low	50.9	Low	166 Å²	166	96.7 Å²	96.7	82%	0.818	54%	0.541	S	S	*	.			trans	-57.2	102.1	178	-59.8	-159.7	108.5	0	0	108.7	S312 G316	S312-M314 PolarHBondContact O-N 3.18Å; S312-M314 VanDerWaalsContact O-N 3.16Å; M314-G316 VanDerWaalsContact C-N 3.27Å; M314-G316 PolarHBondContact O-N 2.81Å
315	T	37.9	Very low	48.3	Very low	93 Å²	93	100.2 Å²	100.2	57%	0.571	56%	0.557	S	S	*	*			trans	-76.6	85.9	172.9	45.6	0	0	0	0	108.1	P313	P313-T315 PolarHBondContact O-N 2.95Å
316	G	39.6	Very low	46.1	Very low	54 Å²	54	100.4 Å²	100.4	56%	0.557	56%	0.555	S	S	*	*	S	Bend	trans	59.9	175.5	174.2	0	0	0	0	0	114.6	M314 M318	M314-G316 VanDerWaalsContact C-N 3.27Å; M314-G316 PolarHBondContact O-N 2.81Å; G316-M318 PolarHBondContact O-N 2.95Å
317	P	27.9	Very low	44	Very low	129 Å²	129	105.7 Å²	105.7	84%	0.838	56%	0.563	S	S	*	*			trans	-57.5	124.6	157.6	-7.8	23.3	0	0	0	106.2	E319	P317-E319 PolarHBondContact O-N 2.99Å
318	M	38.6	Very low	42.5	Very low	109 Å²	109	109.2 Å²	109.2	54%	0.537	58%	0.578	S	S	.	*			trans	-51.7	130.6	144.8	-153.8	168.2	85.9	0	0	103.5	R265 G316 Q320	R265-M318 HydrophobicContact CG-SD 4.02Å; G316-M318 PolarHBondContact O-N 2.95Å; M318-Q320 PolarHBondContact O-N 3.44Å
319	E	32.1	Very low	41.8	Very low	180 Å²	180	107.5 Å²	107.5	84%	0.841	57%	0.568	S	S	*	*			trans	-54.9	96.7	160.6	-84.4	178.9	163.9	0	0	104	P317 P321	P317-E319 PolarHBondContact O-N 2.99Å; E319-P321 VanDerWaalsContact C-N 3.31Å; E319-P321 WeakPolarHBondContact O-CD 3.32Å
320	Q	32.4	Very low	41.4	Very low	141 Å²	141	114.3 Å²	114.3	66%	0.659	60%	0.6	S	S	*	*			trans	-53.9	114.6	155.5	-85	-179.7	-34.5	0	0	101.1	M318	M318-Q320 PolarHBondContact O-N 3.44Å
321	P	36.3	Very low	41.4	Very low	54 Å²	54	110.1 Å²	110.1	35%	0.351	59%	0.589	S	S	.	*			trans	-49.8	142.2	170.4	-16.1	29.8	0	0	0	105.9	E319 E323	E319-P321 VanDerWaalsContact C-N 3.31Å; E319-P321 WeakPolarHBondContact O-CD 3.32Å; P321-E323 PolarHBondContact O-N 3.44Å; P321-E323 VanDerWaalsContact O-N 3.17Å
322	P	28.3	Very low	42.3	Very low	110 Å²	110	114 Å²	114	71%	0.714	60%	0.602	S	S	*	*			trans	-43.8	133.8	169.8	19.8	-30.4	0	0	0	107.4	E324	P322-E324 WeakPolarHBondContact O-CG 3.46Å; P322-E324 PolarHBondContact O-N 3.02Å
323	E	36.2	Very low	44.1	Very low	199 Å²	199	114.5 Å²	114.5	93%	0.93	60%	0.601	S	S	*	*			trans	-46.7	98.7	173.9	-73.7	174.7	169.9	0	0	106.6	P321 E325	P321-E323 PolarHBondContact O-N 3.44Å; P321-E323 VanDerWaalsContact O-N 3.17Å; E323-E325 PolarHBondContact O-N 3.04Å
324	E	42.1	Very low	46.6	Very low	66 Å²	66	116.4 Å²	116.4	31%	0.308	60%	0.604	S	S	.	*			trans	-70.4	125	-178.6	-74.9	177.9	-164.4	0	0	103.8	K169 P322 Y326	K169-E324 WeakPolarHBondContact CE-OE1 3.44Å; K169-E324 IonicContact NZ-OE1 3.65Å; P322-E324 WeakPolarHBondContact O-CG 3.46Å; P322-E324 PolarHBondContact O-N 3.02Å; E324-Y326 VanDerWaalsContact O-CD2 3.3Å; E324-Y326 WeakPolarHBondContact O-CD2 2.87Å; E324-Y326 PolarHBondContact O-N 3.31Å
325	E	37.6	Very low	49.2	Very low	192 Å²	192	112.2 Å²	112.2	90%	0.897	58%	0.583	S	S	*	*			trans	-55.7	90.6	172.1	-73.5	177	166.3	0	0	107.6	E323 E327	E323-E325 PolarHBondContact O-N 3.04Å; E325-E327 PolarHBondContact O-N 2.96Å; E325-E327 VanDerWaalsContact O-N 3.11Å
326	Y	46	Very low	51.8	Low	80 Å²	80	107.8 Å²	107.8	31%	0.314	56%	0.555	S	S	.	*			trans	-58.4	118.4	166	-72.3	-85.8	0	0	0	105.2	R168 E324 H328	R168-Y326 VanDerWaalsContact NH1-CD1 3.27Å; E324-Y326 VanDerWaalsContact O-CD2 3.3Å; E324-Y326 WeakPolarHBondContact O-CD2 2.87Å; E324-Y326 PolarHBondContact O-N 3.31Å; Y326-H328 PolarHBondContact O-N 3.2Å
327	E	43.7	Very low	54.3	Low	178 Å²	178	108 Å²	108	83%	0.832	54%	0.544	S	S	*	.			trans	-50.7	122.5	167.6	-83.2	-172.1	163.6	0	0	107.3	E325 M329	E325-E327 PolarHBondContact O-N 2.96Å; E325-E327 VanDerWaalsContact O-N 3.11Å; E327-M329 PolarHBondContact O-N 3.4Å
328	H	51	Low	57.4	Low	109 Å²	109	108.8 Å²	108.8	51%	0.505	53%	0.53	S	S	.	.			trans	-53.9	110.6	-168.3	-174.4	58.6	0	0	0	110.9	Y326 E330	Y326-H328 PolarHBondContact O-N 3.2Å; H328-E330 VanDerWaalsContact C-N 3.3Å; H328-E330 IonicContact CD2-OE1 3.48Å; H328-E330 IonicContact CE1-OE1 3.47Å; H328-E330 WeakPolarHBondContact NE2-CG 3.46Å; H328-E330 IonicContact NE2-OE1 3.96Å; H328-E330 PolarHBondContact NE2-OE1 2.87Å; H328-E330 IonicContact NE2-OE2 3.82Å; H328-E330 PolarHBondContact O-N 3.03Å
329	M	53.8	Low	60	Low	43 Å²	43	105.5 Å²	105.5	21%	0.212	51%	0.514	C	S	.	.			trans	-94.7	69.1	178.4	-86.3	-170.7	1.1	0	0	109.2	C200 S227 F229 E327 S331	C200-M329 HydrophobicContact CB-CE 3.52Å; C200-M329 HydrophobicContact CB-SD 4.26Å; S227-M329 WeakPolarHBondContact O-CE 3.31Å; F229-M329 HydrophobicContact CD1-CB 3.57Å; F229-M329 HydrophobicContact CD1-CE 3.69Å; F229-M329 HydrophobicContact CD1-CG 4.09Å; F229-M329 HydrophobicContact CD1-SD 4.31Å; F229-M329 HydrophobicContact CD2-CE 3.52Å; F229-M329 HydrophobicContact CD2-SD 4.27Å; F229-M329 HydrophobicContact CE1-CB 3.27Å; F229-M329 HydrophobicContact CE1-CE 3.64Å; F229-M329 HydrophobicContact CE1-CG 3.31Å; F229-M329 HydrophobicContact CE1-SD 3.63Å; F229-M329 HydrophobicContact CE2-CE 3.44Å; F229-M329 VanDerWaalsContact CE2-CE 3.44Å; F229-M329 HydrophobicContact CE2-CG 4.4Å; F229-M329 HydrophobicContact CE2-SD 3.57Å; F229-M329 VanDerWaalsContact CE2-SD 3.57Å; F229-M329 HydrophobicContact CG-CB 4.46Å; F229-M329 HydrophobicContact CG-CE 3.62Å; F229-M329 HydrophobicContact CZ-CB 3.96Å; F229-M329 HydrophobicContact CZ-CE 3.5Å; F229-M329 HydrophobicContact CZ-CG 3.49Å; F229-M329 VanDerWaalsContact CZ-CG 3.49Å; F229-M329 HydrophobicContact CZ-SD 3.19Å; F229-M329 WeakPolarHBondContact CZ-SD 3.3Å; E327-M329 PolarHBondContact O-N 3.4Å; M329-S331 PolarHBondContact O-N 2.89Å
330	E	53.9	Low	63	Low	145 Å²	145	98.2 Å²	98.2	68%	0.678	48%	0.479	S	S	*	.			trans	-67.7	107.4	172.1	-128.8	168.1	-136.9	0	0	108.5	H328 L332	H328-E330 VanDerWaalsContact C-N 3.3Å; H328-E330 IonicContact CD2-OE1 3.48Å; H328-E330 IonicContact CE1-OE1 3.47Å; H328-E330 WeakPolarHBondContact NE2-CG 3.46Å; H328-E330 IonicContact NE2-OE1 3.96Å; H328-E330 PolarHBondContact NE2-OE1 2.87Å; H328-E330 IonicContact NE2-OE2 3.82Å; H328-E330 PolarHBondContact O-N 3.03Å; E330-L332 PolarHBondContact O-N 3.18Å
331	S	60	Low	65.9	Low	28 Å²	28	94.5 Å²	94.5	20%	0.196	46%	0.462	C	S	.	.			trans	-64.3	124.7	173.1	-173.8	0	0	0	0	108.8	L230 R231 M329 D333	L230-S331 WeakPolarHBondContact O-CB 3.41Å; L230-S331 PolarHBondContact O-OG 2.89Å; R231-S331 PolarHBondContact NH1-OG 3.43Å; M329-S331 PolarHBondContact O-N 2.89Å; S331-D333 PolarHBondContact O-N 3.21Å; S331-D333 VanDerWaalsContact O-N 3.16Å; S331-D333 VanDerWaalsContact OG-CB 3.31Å; S331-D333 WeakPolarHBondContact OG-CB 3.44Å; S331-D333 PolarHBondContact OG-N 3.16Å
332	L	68.9	Low	68.6	Low	169 Å²	169	97.5 Å²	97.5	89%	0.885	47%	0.471	S	S	*	.			trans	-74.4	9	171.4	-69.6	166.3	0	0	0	112.8	E330 L334	E330-L332 PolarHBondContact O-N 3.18Å; L332-L334 PolarHBondContact O-N 3.3Å
333	D	85.6	Confident	71.7	Confident	51 Å²	51	92.7 Å²	92.7	27%	0.273	44%	0.44	S	S	.	.			trans	-75.3	89.3	178.7	-169.2	-16.6	0	0	0	110.6	S331 E335 A336 D337	S331-D333 PolarHBondContact O-N 3.21Å; S331-D333 VanDerWaalsContact O-N 3.16Å; S331-D333 VanDerWaalsContact OG-CB 3.31Å; S331-D333 WeakPolarHBondContact OG-CB 3.44Å; S331-D333 PolarHBondContact OG-N 3.16Å; D333-E335 PolarHBondContact O-N 2.86Å; D333-E335 PolarHBondContact OD1-N 3.08Å; D333-E335 VanDerWaalsContact OD1-N 3.16Å; D333-A336 HydrophobicContact CB-CB 3.87Å; D333-A336 PolarHBondContact O-N 2.87Å; D333-A336 PolarHBondContact OD1-N 3.39Å; D333-A336 VanDerWaalsContact OD1-N 3.11Å; D333-D337 PolarHBondContact O-N 2.81Å
334	L	89.7	Confident	74.5	Confident	149 Å²	149	83.4 Å²	83.4	78%	0.78	40%	0.396	S	S	*	.	H	α-helix	trans	-58.5	-29.6	179.1	-64.3	174.7	0	0	0	113	L332 R338	L332-L334 PolarHBondContact O-N 3.3Å; L334-R338 WeakPolarHBondContact O-CB 3.42Å; L334-R338 PolarHBondContact O-N 2.97Å; L334-R338 VanDerWaalsContact O-N 3.08Å
335	E	91.5	Very high	76.9	Confident	77 Å²	77	85.8 Å²	85.8	36%	0.36	41%	0.41	S	S	.	.	H	α-helix	trans	-73.5	-45.3	178.3	-179.3	58.1	-146.3	0	0	110.3	T232 D333 D337 R338 I339	T232-E335 HydrophobicContact CG2-CB 4.25Å; T232-E335 HydrophobicContact CG2-CG 3.82Å; D333-E335 PolarHBondContact O-N 2.86Å; D333-E335 PolarHBondContact OD1-N 3.08Å; D333-E335 VanDerWaalsContact OD1-N 3.16Å; E335-D337 VanDerWaalsContact C-N 3.32Å; E335-D337 PolarHBondContact O-N 3.49Å; E335-R338 WeakPolarHBondContact O-CB 3.14Å; E335-R338 PolarHBondContact O-N 2.84Å; E335-R338 IonicContact OE1-CZ 3.4Å; E335-R338 IonicContact OE1-NE 3.1Å; E335-R338 PolarHBondContact OE1-NE 3.34Å; E335-R338 IonicContact OE1-NH2 2.63Å; E335-R338 PolarHBondContact OE1-NH2 3.09Å; E335-R338 IonicContact OE2-CZ 3.15Å; E335-R338 IonicContact OE2-NE 3.45Å; E335-R338 PolarHBondContact OE2-NE 3.17Å; E335-R338 IonicContact OE2-NH1 3.97Å; E335-R338 IonicContact OE2-NH2 2.7Å; E335-R338 PolarHBondContact OE2-NH2 3.27Å; E335-I339 HydrophobicContact CG-CD1 4.2Å; E335-I339 WeakPolarHBondContact O-CG1 3.47Å; E335-I339 PolarHBondContact O-N 2.76Å
336	A	92.2	Very high	79.6	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-61.7	-40.6	176.3	0	0	0	0	0	112.3	L230 T232 D333 I339 R340	L230-A336 HydrophobicContact CD2-CB 4.04Å; L230-A336 HydrophobicContact CG-CB 3.87Å; T232-A336 HydrophobicContact CG2-CB 4.24Å; D333-A336 HydrophobicContact CB-CB 3.87Å; D333-A336 PolarHBondContact O-N 2.87Å; D333-A336 PolarHBondContact OD1-N 3.39Å; D333-A336 VanDerWaalsContact OD1-N 3.11Å; A336-I339 PolarHBondContact O-N 3.14Å; A336-R340 PolarHBondContact O-N 3.29Å
337	D	92.2	Very high	81.8	Confident	59 Å²	59	81.9 Å²	81.9	32%	0.316	40%	0.401	S	S	.	.	H	α-helix	trans	-64.5	-43.2	175.5	-168.9	65.4	0	0	0	111.6	L230 D333 E335 I339 R340 Q341	L230-D337 HydrophobicContact CD2-CB 4.15Å; D333-D337 PolarHBondContact O-N 2.81Å; E335-D337 VanDerWaalsContact C-N 3.32Å; E335-D337 PolarHBondContact O-N 3.49Å; D337-I339 VanDerWaalsContact C-N 3.34Å; D337-I339 PolarHBondContact O-N 3.47Å; D337-R340 PolarHBondContact O-N 2.88Å; D337-R340 IonicContact OD1-CZ 3.41Å; D337-R340 IonicContact OD1-NE 2.85Å; D337-R340 IonicContact OD1-NH2 3.77Å; D337-R340 PolarHBondContact OD1-NH2 3.45Å; D337-Q341 WeakPolarHBondContact O-CB 3.5Å; D337-Q341 VanDerWaalsContact O-CG 3.27Å; D337-Q341 WeakPolarHBondContact O-CG 3.39Å; D337-Q341 PolarHBondContact O-N 2.84Å
338	R	93.4	Very high	84.2	Confident	146 Å²	146	74 Å²	74	55%	0.551	36%	0.364	S	S	*	.	H	α-helix	trans	-57.3	-45.6	174.2	-174.3	-177.4	70.5	170	-0.9	112.1	L334 E335 Q341 E342	L334-R338 WeakPolarHBondContact O-CB 3.42Å; L334-R338 PolarHBondContact O-N 2.97Å; L334-R338 VanDerWaalsContact O-N 3.08Å; E335-R338 WeakPolarHBondContact O-CB 3.14Å; E335-R338 PolarHBondContact O-N 2.84Å; E335-R338 IonicContact OE1-CZ 3.4Å; E335-R338 IonicContact OE1-NE 3.1Å; E335-R338 PolarHBondContact OE1-NE 3.34Å; E335-R338 IonicContact OE1-NH2 2.63Å; E335-R338 PolarHBondContact OE1-NH2 3.09Å; E335-R338 IonicContact OE2-CZ 3.15Å; E335-R338 IonicContact OE2-NE 3.45Å; E335-R338 PolarHBondContact OE2-NE 3.17Å; E335-R338 IonicContact OE2-NH1 3.97Å; E335-R338 IonicContact OE2-NH2 2.7Å; E335-R338 PolarHBondContact OE2-NH2 3.27Å; R338-Q341 PolarHBondContact O-N 3.2Å; R338-E342 WeakPolarHBondContact O-CB 3.47Å; R338-E342 PolarHBondContact O-N 3.34Å
339	I	93.6	Very high	85.8	Confident	39 Å²	39	74 Å²	74	20%	0.2	38%	0.376	C	S	.	.	H	α-helix	trans	-60	-46.6	178.1	-70.6	167.2	0	0	0	110.5	T232 M235 E335 A336 D337 Q341 E342 L343	T232-I339 HydrophobicContact CG2-CD1 3.84Å; M235-I339 HydrophobicContact CE-CG2 3.92Å; E335-I339 HydrophobicContact CG-CD1 4.2Å; E335-I339 WeakPolarHBondContact O-CG1 3.47Å; E335-I339 PolarHBondContact O-N 2.76Å; A336-I339 PolarHBondContact O-N 3.14Å; D337-I339 VanDerWaalsContact C-N 3.34Å; D337-I339 PolarHBondContact O-N 3.47Å; I339-Q341 PolarHBondContact O-N 3.48Å; I339-E342 PolarHBondContact O-N 3.22Å; I339-L343 WeakPolarHBondContact O-CB 3.47Å; I339-L343 PolarHBondContact O-N 3.14Å
340	R	94.2	Very high	87.4	Confident	27 Å²	27	75.5 Å²	75.5	10%	0.102	38%	0.384	C	S	.	.	H	α-helix	trans	-63	-41.8	177.7	-173.1	177.1	57.3	174.9	-1.2	111.6	L230 M235 T236 Y249 A336 D337 L343 M344	L230-R340 HydrophobicContact CD1-CB 4.43Å; M235-R340 HydrophobicContact SD-CB 3.93Å; M235-R340 HydrophobicContact SD-CG 4.16Å; T236-R340 PolarHBondContact O-NH1 2.97Å; Y249-R340 HydrophobicContact CE2-CG 4.35Å; A336-R340 PolarHBondContact O-N 3.29Å; D337-R340 PolarHBondContact O-N 2.88Å; D337-R340 IonicContact OD1-CZ 3.41Å; D337-R340 IonicContact OD1-NE 2.85Å; D337-R340 IonicContact OD1-NH2 3.77Å; D337-R340 PolarHBondContact OD1-NH2 3.45Å; R340-L343 WeakPolarHBondContact O-CB 3.22Å; R340-L343 PolarHBondContact O-N 3.22Å; R340-M344 HydrophobicContact CG-CE 4.14Å; R340-M344 VanDerWaalsContact O-CG 3.28Å; R340-M344 WeakPolarHBondContact O-CG 3.31Å; R340-M344 PolarHBondContact O-N 2.9Å
341	Q	93.1	Very high	89.2	Confident	64 Å²	64	71.8 Å²	71.8	30%	0.299	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-43.7	176.3	-70.2	-66.9	-17.4	0	0	112.1	D337 R338 I339 M344 L345	D337-Q341 WeakPolarHBondContact O-CB 3.5Å; D337-Q341 VanDerWaalsContact O-CG 3.27Å; D337-Q341 WeakPolarHBondContact O-CG 3.39Å; D337-Q341 PolarHBondContact O-N 2.84Å; R338-Q341 PolarHBondContact O-N 3.2Å; I339-Q341 PolarHBondContact O-N 3.48Å; Q341-M344 HydrophobicContact CB-CE 4.45Å; Q341-M344 HydrophobicContact CG-CE 4.14Å; Q341-M344 PolarHBondContact O-N 3.15Å; Q341-M344 VanDerWaalsContact OE1-CE 3.31Å; Q341-L345 WeakPolarHBondContact O-CG 3.15Å; Q341-L345 PolarHBondContact O-N 3.48Å
342	E	93.6	Very high	90.8	Very high	117 Å²	117	74.3 Å²	74.3	55%	0.547	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-41.9	175.8	-177	172.9	-173	0	0	112.1	R338 I339 M344 L345 T346	R338-E342 WeakPolarHBondContact O-CB 3.47Å; R338-E342 PolarHBondContact O-N 3.34Å; I339-E342 PolarHBondContact O-N 3.22Å; E342-M344 VanDerWaalsContact C-N 3.34Å; E342-M344 PolarHBondContact O-N 2.91Å; E342-L345 PolarHBondContact O-N 3.27Å; E342-T346 VanDerWaalsContact O-CB 3.29Å; E342-T346 WeakPolarHBondContact O-CB 3.41Å; E342-T346 PolarHBondContact O-N 3.42Å; E342-T346 PolarHBondContact O-OG1 3.24Å
343	L	93.8	Very high	92.1	Very high	9 Å²	9	68.7 Å²	68.7	5%	0.047	35%	0.349	C	S	.	.	H	α-helix	trans	-56.9	-47.1	173.3	170	63	0	0	0	111.2	M141 P142 W221 M235 Y249 I339 R340 T346 H347 F348	M141-L343 HydrophobicContact SD-CD2 4.36Å; P142-L343 HydrophobicContact CG-CD1 3.35Å; W221-L343 HydrophobicContact CH2-CD1 3.76Å; W221-L343 HydrophobicContact CH2-CD2 4.08Å; W221-L343 HydrophobicContact CH2-CG 4.42Å; W221-L343 HydrophobicContact CZ2-CD1 3.56Å; W221-L343 HydrophobicContact CZ2-CD2 3.53Å; W221-L343 HydrophobicContact CZ2-CG 4.16Å; M235-L343 HydrophobicContact CG-CD2 4.41Å; M235-L343 HydrophobicContact SD-CD2 4.38Å; Y249-L343 HydrophobicContact CE2-CD2 4.02Å; I339-L343 WeakPolarHBondContact O-CB 3.47Å; I339-L343 PolarHBondContact O-N 3.14Å; R340-L343 WeakPolarHBondContact O-CB 3.22Å; R340-L343 PolarHBondContact O-N 3.22Å; L343-T346 PolarHBondContact O-N 3.15Å; L343-H347 HydrophobicContact CD1-CB 4.45Å; L343-H347 WeakPolarHBondContact O-CB 2.92Å; L343-H347 PolarHBondContact O-N 3.12Å; L343-F348 HydrophobicContact CD1-CE2 4.32Å; L343-F348 HydrophobicContact CG-CE2 4.31Å
344	M	94.4	Very high	92.5	Very high	3 Å²	3	69.8 Å²	69.8	2%	0.015	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-48.1	177.6	-70.3	-174.1	-65.1	0	0	112.1	L238 E246 Y249 R340 Q341 E342 T346 F348 S349	L238-M344 HydrophobicContact CD1-CE 4.02Å; L238-M344 HydrophobicContact CD1-SD 3.48Å; L238-M344 WeakPolarHBondContact CD1-SD 2.95Å; L238-M344 HydrophobicContact CG-SD 4.39Å; E246-M344 HydrophobicContact CB-SD 4.48Å; E246-M344 HydrophobicContact CG-CE 4.4Å; E246-M344 HydrophobicContact CG-SD 3.89Å; Y249-M344 HydrophobicContact CD1-CG 4.36Å; Y249-M344 HydrophobicContact CD1-SD 3.87Å; Y249-M344 HydrophobicContact CD2-CG 3.81Å; Y249-M344 HydrophobicContact CD2-SD 4.37Å; Y249-M344 HydrophobicContact CG-CG 3.7Å; Y249-M344 HydrophobicContact CG-SD 3.79Å; R340-M344 HydrophobicContact CG-CE 4.14Å; R340-M344 VanDerWaalsContact O-CG 3.28Å; R340-M344 WeakPolarHBondContact O-CG 3.31Å; R340-M344 PolarHBondContact O-N 2.9Å; Q341-M344 HydrophobicContact CB-CE 4.45Å; Q341-M344 HydrophobicContact CG-CE 4.14Å; Q341-M344 PolarHBondContact O-N 3.15Å; Q341-M344 VanDerWaalsContact OE1-CE 3.31Å; E342-M344 VanDerWaalsContact C-N 3.34Å; E342-M344 PolarHBondContact O-N 2.91Å; M344-T346 VanDerWaalsContact C-N 3.33Å; M344-T346 PolarHBondContact O-N 3.1Å; M344-F348 CarbonylContact O-C 3.55Å; M344-F348 WeakPolarHBondContact O-CA 3.32Å; M344-F348 WeakPolarHBondContact O-CB 3.35Å; M344-F348 PolarHBondContact O-N 3.45Å; M344-S349 PolarHBondContact O-N 2.88Å
345	L	92.7	Very high	92.7	Very high	117 Å²	117	64.5 Å²	64.5	61%	0.613	33%	0.325	S	S	*	.	H	α-helix	trans	-64	-37.7	-179.9	-71.8	171.6	0	0	0	112.6	Q341 E342 S349	Q341-L345 WeakPolarHBondContact O-CG 3.15Å; Q341-L345 PolarHBondContact O-N 3.48Å; E342-L345 PolarHBondContact O-N 3.27Å; L345-S349 WeakPolarHBondContact CA-OG 3.34Å; L345-S349 WeakPolarHBondContact O-CB 3.48Å; L345-S349 PolarHBondContact O-OG 2.77Å
346	T	93.4	Very high	92.8	Very high	93 Å²	93	63.6 Å²	63.6	57%	0.571	32%	0.322	S	S	*	.	H	α-helix	trans	-81.4	-37.4	-174.2	-54.3	0	0	0	0	112.7	E342 L343 M344	E342-T346 VanDerWaalsContact O-CB 3.29Å; E342-T346 WeakPolarHBondContact O-CB 3.41Å; E342-T346 PolarHBondContact O-N 3.42Å; E342-T346 PolarHBondContact O-OG1 3.24Å; L343-T346 PolarHBondContact O-N 3.15Å; M344-T346 VanDerWaalsContact C-N 3.33Å; M344-T346 PolarHBondContact O-N 3.1Å
347	H	93.8	Very high	92.8	Very high	96 Å²	96	68.5 Å²	68.5	44%	0.444	35%	0.347	S	S	.	.	H	α-helix	trans	-113	-17.6	-169.2	-68	-83.5	0	0	0	114.9	P142 L343	P142-H347 HydrophobicContact CG-CB 4.26Å; L343-H347 HydrophobicContact CD1-CB 4.45Å; L343-H347 WeakPolarHBondContact O-CB 2.92Å; L343-H347 PolarHBondContact O-N 3.12Å
348	F	93.8	Very high	92.9	Very high	14 Å²	14	69.3 Å²	69.3	6%	0.061	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-4.6	-172.8	-62.5	-80.2	0	0	0	114.3	M141 A245 R248 Y249 A252 L343 M344	M141-F348 HydrophobicContact CE-CZ 4.1Å; M141-F348 HydrophobicContact SD-CE2 3.97Å; M141-F348 HydrophobicContact SD-CZ 3.69Å; A245-F348 WeakPolarHBondContact CA-O 3.33Å; A245-F348 HydrophobicContact CB-CB 4.42Å; A245-F348 WeakPolarHBondContact O-CB 3.29Å; R248-F348 HydrophobicContact CB-CB 4.19Å; R248-F348 HydrophobicContact CB-CD1 3.99Å; R248-F348 WeakPolarHBondContact CD-O 3.36Å; R248-F348 PolarHBondContact NH1-O 3.43Å; Y249-F348 HydrophobicContact CD2-CD2 4.24Å; Y249-F348 AromaticContact CD2-CE2 3.93Å; Y249-F348 HydrophobicContact CD2-CE2 3.93Å; Y249-F348 HydrophobicContact CD2-CZ 4.44Å; A252-F348 HydrophobicContact CB-CE1 3.49Å; A252-F348 VanDerWaalsContact CB-CE1 3.49Å; A252-F348 HydrophobicContact CB-CZ 3.9Å; L343-F348 HydrophobicContact CD1-CE2 4.32Å; L343-F348 HydrophobicContact CG-CE2 4.31Å; M344-F348 CarbonylContact O-C 3.55Å; M344-F348 WeakPolarHBondContact O-CA 3.32Å; M344-F348 WeakPolarHBondContact O-CB 3.35Å; M344-F348 PolarHBondContact O-N 3.45Å
349	S	84.7	Confident	92.8	Very high	107 Å²	107	62.4 Å²	62.4	75%	0.748	33%	0.332	S	S	*	.			trans	-63	0	176.2	-62.3	0	0	0	0	114.6	R248 M344 L345	R248-S349 PolarHBondContact NH1-O 3.4Å; R248-S349 PolarHBondContact NH1-OXT 3.18Å; M344-S349 PolarHBondContact O-N 2.88Å; L345-S349 WeakPolarHBondContact CA-OG 3.34Å; L345-S349 WeakPolarHBondContact O-CB 3.48Å; L345-S349 PolarHBondContact O-OG 2.77Å

Retrieved 349 of 349 residues in 1700.6 ms (Link to these results)

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