A0A087YLH9_POEFO Loading...

Golgi associated kinase 1B

AlphaFold DB , UniProt , Accession A0A087YLH9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 504 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	33	Very low	237 Å²	237	185.6 Å²	185.6	100%	1.167	85%	0.845	S	S	*	*				0	124.7	0	-85.1	167.6	160.4	0	0	108.2
2	E	32.6	Very low	33.5	Very low	180 Å²	180	176.5 Å²	176.5	84%	0.841	82%	0.816	S	S	*	*			trans	42.9	96.2	161.3	-69	174.8	142.5	0	0	118.6
3	K	34.1	Very low	33.7	Very low	192 Å²	192	177.6 Å²	177.6	84%	0.835	82%	0.817	S	S	*	*				37.6	99.9	85.9	-77.4	-174.9	-179.3	174.6	0	114.3
4	Y	31.6	Very low	34.1	Very low	222 Å²	222	181.4 Å²	181.4	87%	0.871	82%	0.821	S	S	*	*				-144.6	106.3	120.8	-88.3	-76.7	0	0	0	109.4
5	R	32.8	Very low	34.3	Very low	234 Å²	234	181 Å²	181	88%	0.883	82%	0.817	S	S	*	*			trans	-74.9	114.4	163.6	-74.9	179.7	173.3	178.3	-3	107	N7	R5-N7 PolarHBondContact O-N 3.23Å
6	V	33.9	Very low	34.9	Very low	139 Å²	139	176.4 Å²	176.4	84%	0.842	80%	0.801	S	S	*	*			trans	-88.2	104.8	162.9	179.1	0	0	0	0	107.1	W8	V6-W8 PolarHBondContact O-N 3.15Å
7	N	29.6	Very low	35.6	Very low	131 Å²	131	172.1 Å²	172.1	70%	0.701	79%	0.791	S	S	*	*			trans	-55.9	122.8	174.6	-87	-18.6	0	0	0	110.6	R5 C9	R5-N7 PolarHBondContact O-N 3.23Å; N7-C9 VanDerWaalsContact C-N 3.32Å; N7-C9 PolarHBondContact O-N 3.31Å
8	W	33.1	Very low	36	Very low	221 Å²	221	174.6 Å²	174.6	84%	0.837	79%	0.793	S	S	*	*			trans	-70.2	89.8	164.7	-157.2	-0.8	0	0	0	108.5	V6 Y10	V6-W8 PolarHBondContact O-N 3.15Å; W8-Y10 VanDerWaalsContact C-N 3.33Å; W8-Y10 AromaticContact CD1-CD2 3.83Å; W8-Y10 HydrophobicContact CD2-CD2 4.19Å; W8-Y10 HydrophobicContact CD2-CE2 4.13Å; W8-Y10 AromaticContact CE2-CD2 3.88Å; W8-Y10 AromaticContact CE2-CE2 3.42Å; W8-Y10 VanDerWaalsContact CE2-CE2 3.42Å; W8-Y10 HydrophobicContact CG-CD2 4.21Å; W8-Y10 HydrophobicContact CH2-CE2 4.42Å; W8-Y10 HydrophobicContact CZ2-CD2 4.48Å; W8-Y10 AromaticContact CZ2-CE2 3.62Å; W8-Y10 HydrophobicContact CZ2-CE2 3.62Å; W8-Y10 AromaticContact NE1-CD2 3.61Å; W8-Y10 AromaticContact NE1-CE2 3.39Å; W8-Y10 PolarHBondContact O-N 3.49Å; W8-Y10 VanDerWaalsContact O-N 3.12Å
9	C	31.3	Very low	36.5	Very low	112 Å²	112	172.2 Å²	172.2	76%	0.757	79%	0.787	S	S	*	*			trans	-81.6	84.4	169.9	-70	0	0	0	0	109.1	N7 F11	N7-C9 VanDerWaalsContact C-N 3.32Å; N7-C9 PolarHBondContact O-N 3.31Å; C9-F11 PolarHBondContact O-N 3.41Å
10	Y	36.6	Very low	37.2	Very low	173 Å²	173	168.5 Å²	168.5	68%	0.678	77%	0.769	S	S	*	*			trans	-65.3	118.4	149	-97.9	-86.8	0	0	0	108.1	W8	W8-Y10 VanDerWaalsContact C-N 3.33Å; W8-Y10 AromaticContact CD1-CD2 3.83Å; W8-Y10 HydrophobicContact CD2-CD2 4.19Å; W8-Y10 HydrophobicContact CD2-CE2 4.13Å; W8-Y10 AromaticContact CE2-CD2 3.88Å; W8-Y10 AromaticContact CE2-CE2 3.42Å; W8-Y10 VanDerWaalsContact CE2-CE2 3.42Å; W8-Y10 HydrophobicContact CG-CD2 4.21Å; W8-Y10 HydrophobicContact CH2-CE2 4.42Å; W8-Y10 HydrophobicContact CZ2-CD2 4.48Å; W8-Y10 AromaticContact CZ2-CE2 3.62Å; W8-Y10 HydrophobicContact CZ2-CE2 3.62Å; W8-Y10 AromaticContact NE1-CD2 3.61Å; W8-Y10 AromaticContact NE1-CE2 3.39Å; W8-Y10 PolarHBondContact O-N 3.49Å; W8-Y10 VanDerWaalsContact O-N 3.12Å
11	F	31.9	Very low	37.8	Very low	201 Å²	201	170.8 Å²	170.8	88%	0.882	77%	0.772	S	S	*	*			trans	164.7	150.6	148.8	-91.2	-65.9	0	0	0	108.4	C9	C9-F11 PolarHBondContact O-N 3.41Å
12	P	39.5	Very low	38.7	Very low	76 Å²	76	170.7 Å²	170.7	49%	0.494	76%	0.758	S	S	.	*				-128.1	123.5	-56.7	26.4	-6.5	0	0	0	110.8	R14 K15	P12-R14 PolarHBondContact O-N 3.18Å; P12-K15 PolarHBondContact O-N 3.07Å
13	F	35.4	Very low	39.8	Very low	191 Å²	191	165.1 Å²	165.1	84%	0.838	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-68.8	6.2	170.3	-85.6	-77.6	0	0	0	114.5
14	R	39.7	Very low	41.3	Very low	230 Å²	230	159.1 Å²	159.1	87%	0.868	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-85.7	6	171.5	-85.4	-170.4	171.4	-168.4	-0.9	115.5	P12	P12-R14 PolarHBondContact O-N 3.18Å
15	K	37.6	Very low	42.6	Very low	176 Å²	176	153.1 Å²	153.1	77%	0.765	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-118.1	7.5	174.6	-96.5	-176.8	179.4	177.1	0	116.5	P12	P12-K15 PolarHBondContact O-N 3.07Å
16	L	43	Very low	44.1	Very low	108 Å²	108	145.7 Å²	145.7	57%	0.565	70%	0.695	S	S	*	*	S	Bend	trans	-94.1	-9.1	169.5	-108.2	121.3	0	0	0	114.1	F20	L16-F20 HydrophobicContact CD2-CE2 4.4Å; L16-F20 WeakPolarHBondContact O-CD2 3.46Å
17	T	46.7	Very low	45.7	Very low	102 Å²	102	145 Å²	145	63%	0.626	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-10.1	179.9	50.6	0	0	0	0	114
18	R	43.3	Very low	47.6	Very low	218 Å²	218	143.5 Å²	143.5	82%	0.823	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-27.7	-178.9	-124.6	176.9	168.3	-176.6	-4.6	114.2
19	N	46	Very low	49.6	Very low	128 Å²	128	137.1 Å²	137.1	68%	0.684	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-14.1	176.1	-75.1	-11.7	0	0	0	114	R21 R22	N19-R21 PolarHBondContact O-N 2.96Å; N19-R22 PolarHBondContact O-N 3.13Å
20	F	49.3	Very low	51.8	Low	98 Å²	98	136.9 Å²	136.9	43%	0.43	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.9	-23.9	171.3	-108.1	-91.2	0	0	0	112.9	L16 R28 I31	L16-F20 HydrophobicContact CD2-CE2 4.4Å; L16-F20 WeakPolarHBondContact O-CD2 3.46Å; F20-R28 VanDerWaalsContact O-CZ 3.26Å; F20-R28 PolarHBondContact O-NE 3.29Å; F20-R28 VanDerWaalsContact O-NE 3.08Å; F20-R28 PolarHBondContact O-NH2 3.05Å; F20-I31 HydrophobicContact CZ-CD1 4.2Å; F20-I31 HydrophobicContact CZ-CG2 4.38Å
21	R	50.9	Low	53.8	Low	218 Å²	218	132.1 Å²	132.1	82%	0.823	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-9.9	179.6	-89.2	-174.2	180	-177.8	0.9	115.4	N19	N19-R21 PolarHBondContact O-N 2.96Å
22	R	54	Low	56.2	Low	235 Å²	235	127.5 Å²	127.5	89%	0.887	61%	0.611	S	S	*	*	S	Bend	trans	-114.5	1.8	-178.1	-90.5	-176.1	179.2	168.9	-0.8	116.1	N19	N19-R22 PolarHBondContact O-N 3.13Å
23	C	55.9	Low	58.2	Low	62 Å²	62	126.2 Å²	126.2	42%	0.419	61%	0.606	S	S	.	*	S	Bend	trans	-87.7	140.2	174.6	-87.8	0	0	0	0	112.5	K27	C23-K27 HydrophobicContact CB-CB 4.32Å
24	S	65.1	Low	60.6	Low	67 Å²	67	121.5 Å²	121.5	47%	0.469	59%	0.589	S	S	.	*			trans	-60.1	151.5	175	65.7	0	0	0	0	111.6	S26 K27	S24-S26 PolarHBondContact O-N 3.22Å; S24-S26 PolarHBondContact OG-OG 3.08Å; S24-K27 PolarHBondContact O-N 3.08Å
25	S	58.6	Low	62.7	Low	95 Å²	95	115.7 Å²	115.7	66%	0.664	57%	0.574	S	S	*	*	H	α-helix	trans	-52.2	-30.2	-174	-177.7	0	0	0	0	113.9	R28 T29	S25-R28 PolarHBondContact O-N 3.19Å; S25-T29 PolarHBondContact O-N 3.28Å; S25-T29 PolarHBondContact O-OG1 2.85Å; S25-T29 VanDerWaalsContact O-OG1 3.07Å
26	S	65	Low	64.6	Low	78 Å²	78	110.6 Å²	110.6	55%	0.545	56%	0.56	S	S	.	*	H	α-helix	trans	-68.2	-35.9	-179.9	59.5	0	0	0	0	113.7	S24 R28 T29 L30	S24-S26 PolarHBondContact O-N 3.22Å; S24-S26 PolarHBondContact OG-OG 3.08Å; S26-R28 VanDerWaalsContact C-N 3.35Å; S26-T29 WeakPolarHBondContact CA-OG1 3.45Å; S26-T29 PolarHBondContact O-OG1 3.01Å; S26-L30 PolarHBondContact O-N 3.1Å
27	K	67.9	Low	66.5	Low	125 Å²	125	111 Å²	111	54%	0.543	56%	0.562	S	S	.	*	H	α-helix	trans	-72.9	-29.6	178.6	-67.6	-173.9	178.3	-178	0	111.9	C23 S24 I31	C23-K27 HydrophobicContact CB-CB 4.32Å; S24-K27 PolarHBondContact O-N 3.08Å; K27-I31 WeakPolarHBondContact O-CD1 3.47Å; K27-I31 VanDerWaalsContact O-CG1 3.31Å; K27-I31 WeakPolarHBondContact O-CG1 3.16Å; K27-I31 PolarHBondContact O-N 3.31Å
28	R	69.4	Low	68.2	Low	99 Å²	99	109.7 Å²	109.7	37%	0.374	55%	0.554	S	S	.	*	H	α-helix	trans	-70	-43.3	175	-69.7	-174	-178.6	163.5	6.2	111.9	F20 S25 S26 L30 I31 I32	F20-R28 VanDerWaalsContact O-CZ 3.26Å; F20-R28 PolarHBondContact O-NE 3.29Å; F20-R28 VanDerWaalsContact O-NE 3.08Å; F20-R28 PolarHBondContact O-NH2 3.05Å; S25-R28 PolarHBondContact O-N 3.19Å; S26-R28 VanDerWaalsContact C-N 3.35Å; R28-L30 VanDerWaalsContact C-N 3.3Å; R28-L30 PolarHBondContact O-N 2.03Å; R28-I31 PolarHBondContact O-N 3.4Å; R28-I32 WeakPolarHBondContact O-CG1 3.47Å; R28-I32 PolarHBondContact O-N 3.34Å; R28-I32 VanDerWaalsContact O-N 3.15Å
29	T	74.5	Confident	69.8	Low	87 Å²	87	104.3 Å²	104.3	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-63.4	-36.4	175.4	34.6	0	0	0	0	112.2	S25 S26 I32 A33	S25-T29 PolarHBondContact O-N 3.28Å; S25-T29 PolarHBondContact O-OG1 2.85Å; S25-T29 VanDerWaalsContact O-OG1 3.07Å; S26-T29 WeakPolarHBondContact CA-OG1 3.45Å; S26-T29 PolarHBondContact O-OG1 3.01Å; T29-I32 PolarHBondContact O-N 3.46Å; T29-A33 VanDerWaalsContact O-CB 3.32Å; T29-A33 WeakPolarHBondContact O-CB 3.4Å; T29-A33 PolarHBondContact O-N 2.63Å
30	L	78.1	Confident	71.2	Confident	108 Å²	108	103.3 Å²	103.3	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-63.8	-45.1	176.7	-168.8	79.9	0	0	0	112.1	S26 R28 I32 A33 I34	S26-L30 PolarHBondContact O-N 3.1Å; R28-L30 VanDerWaalsContact C-N 3.3Å; R28-L30 PolarHBondContact O-N 2.03Å; L30-I32 VanDerWaalsContact C-N 3.34Å; L30-I32 PolarHBondContact O-N 3.46Å; L30-A33 PolarHBondContact O-N 3.03Å; L30-I34 HydrophobicContact CD2-CD1 4.46Å; L30-I34 HydrophobicContact CG-CD1 4.07Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.26Å; L30-I34 PolarHBondContact O-N 3.1Å
31	I	77.6	Confident	72.4	Confident	72 Å²	72	104.1 Å²	104.1	37%	0.369	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-40.4	-179.8	-66	166.1	0	0	0	110.9	F20 K27 R28 I34 L35	F20-I31 HydrophobicContact CZ-CD1 4.2Å; F20-I31 HydrophobicContact CZ-CG2 4.38Å; K27-I31 WeakPolarHBondContact O-CD1 3.47Å; K27-I31 VanDerWaalsContact O-CG1 3.31Å; K27-I31 WeakPolarHBondContact O-CG1 3.16Å; K27-I31 PolarHBondContact O-N 3.31Å; R28-I31 PolarHBondContact O-N 3.4Å; I31-I34 PolarHBondContact O-N 3.42Å; I31-L35 HydrophobicContact CG2-CD1 4.14Å; I31-L35 PolarHBondContact O-N 3.44Å
32	I	81.9	Confident	73.3	Confident	105 Å²	105	100.1 Å²	100.1	54%	0.538	53%	0.533	S	S	.	.	H	α-helix	trans	-66.3	-42.3	176.7	-65.5	166.2	0	0	0	110.6	R28 T29 L30 I34 L35 C36	R28-I32 WeakPolarHBondContact O-CG1 3.47Å; R28-I32 PolarHBondContact O-N 3.34Å; R28-I32 VanDerWaalsContact O-N 3.15Å; T29-I32 PolarHBondContact O-N 3.46Å; L30-I32 VanDerWaalsContact C-N 3.34Å; L30-I32 PolarHBondContact O-N 3.46Å; I32-I34 VanDerWaalsContact C-N 3.34Å; I32-I34 PolarHBondContact O-N 3.45Å; I32-L35 PolarHBondContact O-N 3.37Å; I32-C36 PolarHBondContact O-N 2.85Å; I32-C36 PolarHBondContact O-SG 3.31Å
33	A	82.4	Confident	74.1	Confident	49 Å²	49	94.2 Å²	94.2	41%	0.405	52%	0.518	S	S	.	.	H	α-helix	trans	-61.9	-40.4	177.2	0	0	0	0	0	112.3	T29 L30 C36 L37	T29-A33 VanDerWaalsContact O-CB 3.32Å; T29-A33 WeakPolarHBondContact O-CB 3.4Å; T29-A33 PolarHBondContact O-N 2.63Å; L30-A33 PolarHBondContact O-N 3.03Å; A33-C36 PolarHBondContact O-N 3Å; A33-L37 WeakPolarHBondContact O-CB 3.22Å; A33-L37 PolarHBondContact O-N 3.49Å
34	I	84.6	Confident	74.7	Confident	92 Å²	92	96.1 Å²	96.1	47%	0.472	53%	0.528	S	S	.	.	H	α-helix	trans	-65.4	-43.3	176.2	-67.8	165.8	0	0	0	110.8	L30 I31 I32 C36 L37 V38	L30-I34 HydrophobicContact CD2-CD1 4.46Å; L30-I34 HydrophobicContact CG-CD1 4.07Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.26Å; L30-I34 PolarHBondContact O-N 3.1Å; I31-I34 PolarHBondContact O-N 3.42Å; I32-I34 VanDerWaalsContact C-N 3.34Å; I32-I34 PolarHBondContact O-N 3.45Å; I34-C36 VanDerWaalsContact C-N 3.33Å; I34-C36 PolarHBondContact O-N 2.81Å; I34-L37 PolarHBondContact O-N 2.98Å; I34-V38 WeakPolarHBondContact O-CG2 3.24Å; I34-V38 PolarHBondContact O-N 2.71Å
35	L	84.4	Confident	74.6	Confident	107 Å²	107	98.5 Å²	98.5	56%	0.56	54%	0.535	S	S	*	.	H	α-helix	trans	-62.4	-38	175.3	-88.6	155.6	0	0	0	112.6	I31 I32 N39	I31-L35 HydrophobicContact CG2-CD1 4.14Å; I31-L35 PolarHBondContact O-N 3.44Å; I32-L35 PolarHBondContact O-N 3.37Å; L35-N39 PolarHBondContact O-N 2.93Å; L35-N39 VanDerWaalsContact O-N 3.17Å
36	C	78.6	Confident	74.4	Confident	70 Å²	70	101.9 Å²	101.9	47%	0.473	54%	0.537	S	S	.	.	H	α-helix	trans	-67.8	-40.6	174.4	-74.7	0	0	0	0	112.3	I32 A33 I34 N39 L40	I32-C36 PolarHBondContact O-N 2.85Å; I32-C36 PolarHBondContact O-SG 3.31Å; A33-C36 PolarHBondContact O-N 3Å; I34-C36 VanDerWaalsContact C-N 3.33Å; I34-C36 PolarHBondContact O-N 2.81Å; C36-N39 PolarHBondContact O-N 3.39Å; C36-L40 WeakPolarHBondContact O-CB 3.41Å; C36-L40 PolarHBondContact O-N 3.45Å
37	L	82.9	Confident	73.6	Confident	115 Å²	115	103.4 Å²	103.4	60%	0.602	54%	0.543	S	S	*	.	H	α-helix	trans	-63.6	-42	176.5	-91.8	159.1	0	0	0	112.1	A33 I34 L40 L41	A33-L37 WeakPolarHBondContact O-CB 3.22Å; A33-L37 PolarHBondContact O-N 3.49Å; I34-L37 PolarHBondContact O-N 2.98Å; L37-L40 PolarHBondContact O-N 3.13Å; L37-L41 PolarHBondContact O-N 2.93Å
38	V	82.1	Confident	72.5	Confident	76 Å²	76	100.7 Å²	100.7	46%	0.461	55%	0.551	S	S	.	*	H	α-helix	trans	-63.3	-42.9	176.2	173.3	0	0	0	0	110.8	I34 L40 L41 F42	I34-V38 WeakPolarHBondContact O-CG2 3.24Å; I34-V38 PolarHBondContact O-N 2.71Å; V38-L40 PolarHBondContact O-N 2.87Å; V38-L41 PolarHBondContact O-N 3.38Å; V38-F42 HydrophobicContact CG1-CD2 4.01Å; V38-F42 HydrophobicContact CG1-CE2 4.11Å; V38-F42 WeakPolarHBondContact O-CD2 3.23Å; V38-F42 PolarHBondContact O-N 2.86Å
39	N	75.6	Confident	71.3	Confident	105 Å²	105	104.3 Å²	104.3	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-64.6	-39	176	-97.1	-40.4	0	0	0	113.1	L35 C36 L41 F42 L43	L35-N39 PolarHBondContact O-N 2.93Å; L35-N39 VanDerWaalsContact O-N 3.17Å; C36-N39 PolarHBondContact O-N 3.39Å; N39-L41 VanDerWaalsContact C-N 3.34Å; N39-F42 PolarHBondContact O-N 2.89Å; N39-L43 PolarHBondContact O-N 3.33Å
40	L	76.4	Confident	69.8	Low	107 Å²	107	107.1 Å²	107.1	56%	0.56	58%	0.583	S	S	*	*	H	α-helix	trans	-63.1	-40.6	174.4	-104.5	151.2	0	0	0	111.7	C36 L37 V38 F42 L43 V44	C36-L40 WeakPolarHBondContact O-CB 3.41Å; C36-L40 PolarHBondContact O-N 3.45Å; L37-L40 PolarHBondContact O-N 3.13Å; V38-L40 PolarHBondContact O-N 2.87Å; L40-F42 VanDerWaalsContact C-N 3.35Å; L40-F42 PolarHBondContact O-N 2.68Å; L40-L43 PolarHBondContact O-N 2.65Å; L40-V44 WeakPolarHBondContact O-CG2 3.43Å; L40-V44 PolarHBondContact O-N 2.88Å
41	L	74.8	Confident	68	Low	114 Å²	114	111 Å²	111	60%	0.597	60%	0.598	S	S	*	*	H	α-helix	trans	-65	-38.7	177.5	-143.5	114.8	0	0	0	111.8	L37 V38 N39 V44 L45	L37-L41 PolarHBondContact O-N 2.93Å; V38-L41 PolarHBondContact O-N 3.38Å; N39-L41 VanDerWaalsContact C-N 3.34Å; L41-V44 PolarHBondContact O-N 2.68Å; L41-L45 HydrophobicContact CD2-CD1 4.21Å; L41-L45 WeakPolarHBondContact O-CG 3.04Å; L41-L45 PolarHBondContact O-N 3.17Å; L41-L45 VanDerWaalsContact O-N 3.08Å
42	F	70.1	Confident	65.8	Low	134 Å²	134	116.6 Å²	116.6	59%	0.588	62%	0.623	S	S	*	*	H	α-helix	trans	-67.6	-33.3	173.9	-93.4	-80.5	0	0	0	113.4	V38 N39 L40 K46	V38-F42 HydrophobicContact CG1-CD2 4.01Å; V38-F42 HydrophobicContact CG1-CE2 4.11Å; V38-F42 WeakPolarHBondContact O-CD2 3.23Å; V38-F42 PolarHBondContact O-N 2.86Å; N39-F42 PolarHBondContact O-N 2.89Å; L40-F42 VanDerWaalsContact C-N 3.35Å; L40-F42 PolarHBondContact O-N 2.68Å; F42-K46 PolarHBondContact O-N 3.27Å
43	L	70.8	Confident	63.8	Low	112 Å²	112	117.6 Å²	117.6	59%	0.586	64%	0.636	S	S	*	*	H	α-helix	trans	-68.9	-43.1	174.7	-98.3	148.1	0	0	0	111.9	N39 L40 K46 V47	N39-L43 PolarHBondContact O-N 3.33Å; L40-L43 PolarHBondContact O-N 2.65Å; L43-K46 PolarHBondContact O-N 3.27Å; L43-V47 WeakPolarHBondContact O-CG2 3.32Å; L43-V47 PolarHBondContact O-N 2.92Å
44	V	67.2	Low	61.2	Low	102 Å²	102	127.3 Å²	127.3	62%	0.618	66%	0.662	S	S	*	*	H	α-helix	trans	-67.4	-37.8	178.6	174.8	0	0	0	0	111.5	L40 L41 K46 V47 G48	L40-V44 WeakPolarHBondContact O-CG2 3.43Å; L40-V44 PolarHBondContact O-N 2.88Å; L41-V44 PolarHBondContact O-N 2.68Å; V44-K46 VanDerWaalsContact C-N 3.32Å; V44-K46 PolarHBondContact O-N 3.33Å; V44-V47 PolarHBondContact O-N 2.99Å; V44-G48 PolarHBondContact O-N 3.28Å
45	L	62.5	Low	58.7	Low	117 Å²	117	128.3 Å²	128.3	61%	0.613	68%	0.677	S	S	*	*	H	α-helix	trans	-67.9	-28	175	-72.7	169.3	0	0	0	113.4	L41	L41-L45 HydrophobicContact CD2-CD1 4.21Å; L41-L45 WeakPolarHBondContact O-CG 3.04Å; L41-L45 PolarHBondContact O-N 3.17Å; L41-L45 VanDerWaalsContact O-N 3.08Å
46	K	54.5	Low	56	Low	165 Å²	165	135 Å²	135	72%	0.717	70%	0.695	S	S	*	*	H	α-helix	trans	-77.2	-30.5	174.7	-83.5	-165	173.5	-171.7	0	113.6	F42 L43 V44	F42-K46 PolarHBondContact O-N 3.27Å; L43-K46 PolarHBondContact O-N 3.27Å; V44-K46 VanDerWaalsContact C-N 3.32Å; V44-K46 PolarHBondContact O-N 3.33Å
47	V	49.8	Very low	53.7	Low	110 Å²	110	143.3 Å²	143.3	67%	0.667	72%	0.716	S	S	*	*	H	α-helix	trans	-79.6	-25.6	179.8	175.6	0	0	0	0	111.8	L43 V44 H49	L43-V47 WeakPolarHBondContact O-CG2 3.32Å; L43-V47 PolarHBondContact O-N 2.92Å; V44-V47 PolarHBondContact O-N 2.99Å; V47-H49 PolarHBondContact O-N 3.47Å
48	G	43.7	Very low	51.2	Low	69 Å²	69	143.1 Å²	143.1	71%	0.711	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-2.4	176.4	0	0	0	0	0	116.3	V44	V44-G48 PolarHBondContact O-N 3.28Å
49	H	44.9	Very low	48.7	Very low	174 Å²	174	146.5 Å²	146.5	81%	0.806	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	2.8	-175.8	-123.2	-63.6	0	0	0	114.5	V47	V47-H49 PolarHBondContact O-N 3.47Å
50	L	42.4	Very low	46.7	Very low	147 Å²	147	149 Å²	149	77%	0.77	75%	0.748	S	S	*	*	S	Bend	trans	-131.8	31.5	-167.9	-113.5	156.7	0	0	0	113.9
51	E	40.8	Very low	44.5	Very low	188 Å²	188	151.2 Å²	151.2	88%	0.879	76%	0.756	S	S	*	*			trans	-140.6	99	163.7	-90.9	-171.9	176.8	0	0	110.8
52	Q	32.2	Very low	42.3	Very low	191 Å²	191	152.6 Å²	152.6	89%	0.893	76%	0.759	S	S	*	*			trans	-141.3	116.8	156.9	-141.8	172.7	10.3	0	0	109.4
53	P	39.2	Very low	40.4	Very low	125 Å²	125	156.1 Å²	156.1	81%	0.812	77%	0.774	S	S	*	*			trans	-83.7	128.3	-175.7	31.1	-31.2	0	0	0	110.7
54	R	28.7	Very low	38.4	Very low	253 Å²	253	160.4 Å²	160.4	96%	0.955	78%	0.783	S	S	*	*			trans	-102.4	103.3	169.5	-100.3	-176.4	176.3	166.3	0.3	110.8
55	S	31.9	Very low	36.5	Very low	113 Å²	113	163.4 Å²	163.4	79%	0.79	79%	0.79	S	S	*	*			trans	-73.9	133.1	151.2	65.4	0	0	0	0	109.9
56	R	27.2	Very low	34.9	Very low	249 Å²	249	164.1 Å²	164.1	94%	0.94	80%	0.799	S	S	*	*			trans	-162.3	125.8	144.8	-136	173.9	-179.4	166.6	-0.6	113.1
57	R	30.9	Very low	33.6	Very low	244 Å²	244	168.2 Å²	168.2	92%	0.921	81%	0.81	S	S	*	*			trans	-65.4	150.5	162.3	-81.4	170.5	157.3	165.7	-7.1	112.8
58	S	30.2	Very low	32.5	Very low	110 Å²	110	166.5 Å²	166.5	77%	0.769	81%	0.814	S	S	*	*				-171.2	116.8	129.8	55.7	0	0	0	0	108.3
59	N	29.6	Very low	31.7	Very low	148 Å²	148	171.9 Å²	171.9	79%	0.791	82%	0.821	S	S	*	*				47.6	128.6	92.2	-93.7	24.4	0	0	0	112.8
60	E	32.1	Very low	30.9	Very low	156 Å²	156	172.6 Å²	172.6	73%	0.729	82%	0.824	S	S	*	*			cis	-163.3	139.1	35.2	-107.4	-179.6	-170.8	0	0	107.9
61	E	30.8	Very low	30.3	Very low	154 Å²	154	173.1 Å²	173.1	72%	0.72	82%	0.822	S	S	*	*				98.2	132.1	87.2	-138.5	-175.2	-159.7	0	0	115.4
62	Q	29.2	Very low	29.8	Very low	143 Å²	143	172.2 Å²	172.2	67%	0.668	82%	0.823	S	S	*	*			trans	63.7	109.3	149.2	-128.9	77	-26.5	0	0	122.3
63	K	28.9	Very low	29.6	Very low	208 Å²	208	169.8 Å²	169.8	90%	0.904	82%	0.816	S	S	*	*				-176.8	144	109	-100.2	171.3	-177	178.1	0	113.5
64	R	29.8	Very low	29.1	Very low	203 Å²	203	167.5 Å²	167.5	77%	0.766	81%	0.814	S	S	*	*			trans	-90.6	162.5	-175.6	-60.3	175.1	175.5	164.5	-2.7	112.7
65	H	27.7	Very low	29	Very low	165 Å²	165	164.8 Å²	164.8	76%	0.764	81%	0.813	S	S	*	*			trans	70.7	138.8	159.1	-54.8	-63.4	0	0	0	115
66	T	29.3	Very low	29	Very low	131 Å²	131	167.4 Å²	167.4	80%	0.804	82%	0.817	S	S	*	*			cis	-166.8	146.8	41.4	25.1	0	0	0	0	110.7
67	R	27.1	Very low	29.3	Very low	252 Å²	252	161.3 Å²	161.3	95%	0.951	81%	0.809	S	S	*	*			trans	17.1	132.5	131.9	-162.3	179.4	-166.9	170.6	2.9	119.2
68	G	25.8	Very low	29.1	Very low	73 Å²	73	154.2 Å²	154.2	75%	0.753	80%	0.803	S	S	*	*			trans	155.8	106.2	152.5	0	0	0	0	0	114.8
69	E	27.7	Very low	29	Very low	182 Å²	182	155.2 Å²	155.2	85%	0.85	81%	0.805	S	S	*	*			trans	-53.2	149.4	158.2	-66.6	-177.2	124.4	0	0	111.1
70	H	28.3	Very low	28.9	Very low	189 Å²	189	153.3 Å²	153.3	88%	0.875	80%	0.803	S	S	*	*				-166.2	128.8	127.6	-90.1	-56.4	0	0	0	110.6
71	H	28.5	Very low	28.6	Very low	158 Å²	158	152.9 Å²	152.9	73%	0.731	81%	0.806	S	S	*	*			trans	-38.9	146.1	155.7	-122.1	-104.9	0	0	0	112.3	D73	H71-D73 IonicContact ND1-OD2 3.83Å
72	L	31.4	Very low	28.4	Very low	170 Å²	170	153.2 Å²	153.2	89%	0.89	81%	0.811	S	S	*	*			trans	-166.6	123.1	133.4	-100.8	166.3	0	0	0	110.2
73	D	27	Very low	28.2	Very low	140 Å²	140	154.9 Å²	154.9	75%	0.749	82%	0.819	S	S	*	*			trans	-56.1	149.5	166.3	-62.7	-68.5	0	0	0	111.9	H71	H71-D73 IonicContact ND1-OD2 3.83Å
74	G	28.2	Very low	28	Very low	76 Å²	76	150.6 Å²	150.6	78%	0.784	81%	0.811	S	S	*	*			trans	-163.7	102.2	175	0	0	0	0	0	111.2
75	E	28.2	Very low	27.8	Very low	197 Å²	197	150.4 Å²	150.4	92%	0.921	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-52.6	137.8	-176.9	-67.2	161.6	125.2	0	0	114.4
76	L	31.8	Very low	27.7	Very low	168 Å²	168	146.5 Å²	146.5	88%	0.88	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-92.3	129.3	162.3	-80.1	153.3	0	0	0	108.7
77	P	32.2	Very low	27.5	Very low	120 Å²	120	144.7 Å²	144.7	78%	0.779	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.4	135	172.5	30.9	-31.5	0	0	0	111
78	A	27.1	Very low	27.8	Very low	95 Å²	95	141.4 Å²	141.4	79%	0.785	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-67.1	136.1	163.6	0	0	0	0	0	111
79	T	28	Very low	27.8	Very low	132 Å²	132	146.2 Å²	146.2	81%	0.81	81%	0.811	S	S	*	*			trans	-178.4	136.8	152	38.2	0	0	0	0	105.7
80	S	27.5	Very low	27.9	Very low	107 Å²	107	143.4 Å²	143.4	75%	0.748	81%	0.806	S	S	*	*			cis	-162.9	150	-1.7	-72.8	0	0	0	0	106.9
81	D	25.3	Very low	28	Very low	147 Å²	147	140 Å²	140	79%	0.786	80%	0.801	S	S	*	*			trans	-44.7	134.2	165.7	-66.9	-59.3	0	0	0	113.3
82	L	26.4	Very low	28.1	Very low	161 Å²	161	138 Å²	138	84%	0.843	80%	0.8	S	S	*	*			trans	-130.7	94.8	143.6	-120.6	102.7	0	0	0	108.5	T84	L82-T84 PolarHBondContact O-N 2.99Å
83	Q	26.4	Very low	28.1	Very low	179 Å²	179	137.9 Å²	137.9	84%	0.836	80%	0.799	S	S	*	*			trans	-57.4	126.3	156.4	-74.3	172.7	-17.2	0	0	108.4
84	T	25.1	Very low	28.4	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.724	80%	0.803	S	S	*	*			trans	-133.7	102	157.6	-46.7	0	0	0	0	108.2	L82	L82-T84 PolarHBondContact O-N 2.99Å
85	Q	25.8	Very low	28.6	Very low	198 Å²	198	143.9 Å²	143.9	93%	0.925	81%	0.805	S	S	*	*			trans	-83	110	170.3	179.5	178.7	-0.5	0	0	108.5
86	A	24.5	Very low	29.1	Very low	84 Å²	84	139.3 Å²	139.3	69%	0.694	79%	0.79	S	S	*	*			trans	-178.3	134.4	160.2	0	0	0	0	0	105.5
87	S	24.9	Very low	29	Very low	93 Å²	93	137.1 Å²	137.1	65%	0.65	78%	0.783	S	S	*	*			cis	-168.7	148.4	8.6	19.5	0	0	0	0	105.4	E89	S87-E89 PolarHBondContact O-N 3.41Å
88	L	32.8	Very low	29.3	Very low	182 Å²	182	137.9 Å²	137.9	95%	0.953	77%	0.771	S	S	*	*			trans	-53.7	110.3	165.6	-89.1	112.1	0	0	0	109.4
89	E	25.8	Very low	29.8	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	77%	0.771	S	S	*	*			trans	-118.4	120.1	164.2	-75.1	-165.8	164.8	0	0	110.2	S87	S87-E89 PolarHBondContact O-N 3.41Å
90	V	30.6	Very low	30.5	Very low	122 Å²	122	138.2 Å²	138.2	74%	0.739	76%	0.763	S	S	*	*			trans	-54.7	132.3	174.2	175.9	0	0	0	0	110.2	T92	V90-T92 PolarHBondContact O-N 3.46Å
91	P	30	Very low	30.9	Very low	119 Å²	119	140.2 Å²	140.2	77%	0.773	77%	0.765	S	S	*	*			trans	-70.3	109.7	170.8	-13	28.4	0	0	0	109.1
92	T	30.8	Very low	31.2	Very low	116 Å²	116	142.7 Å²	142.7	71%	0.712	77%	0.768	S	S	*	*			trans	-66.2	142.1	175.4	38.7	0	0	0	0	111.1	V90 F94	V90-T92 PolarHBondContact O-N 3.46Å; T92-F94 PolarHBondContact O-N 3Å
93	L	32.3	Very low	31.7	Very low	167 Å²	167	144.3 Å²	144.3	87%	0.874	77%	0.769	S	S	*	*			trans	-35.8	112.8	173.8	-67.9	149.1	0	0	0	113.2	N95	L93-N95 PolarHBondContact O-N 2.9Å
94	F	32.5	Very low	32	Very low	191 Å²	191	145.8 Å²	145.8	84%	0.838	77%	0.773	S	S	*	*			trans	-74.2	94.2	169.6	-70.1	-76.9	0	0	0	110.5	T92 V96	T92-F94 PolarHBondContact O-N 3Å; F94-V96 PolarHBondContact O-N 3.13Å; F94-V96 VanDerWaalsContact O-N 3.14Å
95	N	31.7	Very low	33	Very low	151 Å²	151	151.6 Å²	151.6	81%	0.807	78%	0.782	S	S	*	*			trans	-72.5	93.8	163.2	-90.2	-27.2	0	0	0	109.6	L93 V97	L93-N95 PolarHBondContact O-N 2.9Å; N95-V97 PolarHBondContact O-N 2.77Å
96	V	39.2	Very low	33.9	Very low	100 Å²	100	150.5 Å²	150.5	61%	0.606	78%	0.781	S	S	*	*			trans	-74.2	103.9	170	-177.6	0	0	0	0	109.2	F94 Y98	F94-V96 PolarHBondContact O-N 3.13Å; F94-V96 VanDerWaalsContact O-N 3.14Å; V96-Y98 HydrophobicContact CB-CE2 4.29Å; V96-Y98 HydrophobicContact CG1-CD2 4.16Å; V96-Y98 HydrophobicContact CG1-CE1 4.37Å; V96-Y98 HydrophobicContact CG1-CE2 3.75Å; V96-Y98 PolarHBondContact O-N 3.06Å
97	V	30.8	Very low	34.4	Very low	123 Å²	123	155.7 Å²	155.7	75%	0.745	79%	0.788	S	S	*	*			trans	-81.7	106.8	171.8	178.5	0	0	0	0	108.8	N95 V99	N95-V97 PolarHBondContact O-N 2.77Å; V97-V99 PolarHBondContact O-N 3.07Å
98	Y	38.2	Very low	35.1	Very low	136 Å²	136	157.3 Å²	157.3	53%	0.533	80%	0.796	S	S	.	*			trans	-78	113	169.6	-67.8	-88.2	0	0	0	109.8	V96 T100	V96-Y98 HydrophobicContact CB-CE2 4.29Å; V96-Y98 HydrophobicContact CG1-CD2 4.16Å; V96-Y98 HydrophobicContact CG1-CE1 4.37Å; V96-Y98 HydrophobicContact CG1-CE2 3.75Å; V96-Y98 PolarHBondContact O-N 3.06Å; Y98-T100 PolarHBondContact O-N 3.28Å; Y98-T100 VanDerWaalsContact O-N 3.13Å
99	V	36.6	Very low	35.3	Very low	128 Å²	128	153 Å²	153	78%	0.776	79%	0.787	S	S	*	*			trans	-74.7	98.1	167.1	-178.3	0	0	0	0	108.1	V97	V97-V99 PolarHBondContact O-N 3.07Å
100	T	44	Very low	35.7	Very low	105 Å²	105	152.5 Å²	152.5	64%	0.644	79%	0.79	S	S	*	*			trans	-81.2	116.3	173.3	56.2	0	0	0	0	110.3	Y98 K102	Y98-T100 PolarHBondContact O-N 3.28Å; Y98-T100 VanDerWaalsContact O-N 3.13Å; T100-K102 PolarHBondContact O-N 3.37Å
101	L	36.2	Very low	36.3	Very low	150 Å²	150	154.5 Å²	154.5	79%	0.785	80%	0.795	S	S	*	*			trans	-73	113.5	159.8	-67.7	174.3	0	0	0	108.3	F103	L101-F103 PolarHBondContact O-N 3.47Å; L101-F103 VanDerWaalsContact O-N 3.17Å
102	K	31	Very low	36.8	Very low	198 Å²	198	160.4 Å²	160.4	86%	0.861	80%	0.802	S	S	*	*			trans	-68.8	106.2	-177.6	-70.7	-178.6	178.5	176.7	0	110.7	T100	T100-K102 PolarHBondContact O-N 3.37Å
103	F	35.7	Very low	37.1	Very low	196 Å²	196	158 Å²	158	86%	0.86	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-87.2	129.7	159.2	-84.1	-87.2	0	0	0	110.3	L101 R105	L101-F103 PolarHBondContact O-N 3.47Å; L101-F103 VanDerWaalsContact O-N 3.17Å; F103-R105 PolarHBondContact O-N 3.04Å
104	K	33.6	Very low	37.3	Very low	210 Å²	210	156.9 Å²	156.9	91%	0.913	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.2	119.5	-178.7	-78.3	177.9	176	175.7	0	110.1
105	R	45.1	Very low	37.7	Very low	240 Å²	240	155.5 Å²	155.5	91%	0.906	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.7	127.9	171.1	-66.6	177.2	-179.3	171.3	-1.7	110.2	F103	F103-R105 PolarHBondContact O-N 3.04Å
106	L	46.6	Very low	38.3	Very low	175 Å²	175	159.4 Å²	159.4	92%	0.916	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.7	123.5	159.9	-75	162.7	0	0	0	108.1
107	K	34.7	Very low	38.2	Very low	193 Å²	193	160.5 Å²	160.5	84%	0.839	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-72	135	175.4	-67.4	-179.4	178.4	179.6	0	109.1
108	P	39.5	Very low	38.4	Very low	126 Å²	126	164.7 Å²	164.7	82%	0.818	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-67.5	142.5	166.7	26.3	-29.8	0	0	0	110.5
109	A	35.7	Very low	38.4	Very low	93 Å²	93	166.7 Å²	166.7	77%	0.769	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-64.7	148	-178.3	0	0	0	0	0	112.6	I111	A109-I111 PolarHBondContact O-N 2.87Å
110	N	35	Very low	38.6	Very low	164 Å²	164	172.3 Å²	172.3	88%	0.877	85%	0.847	S	S	*	*			trans	-42.7	117.5	-179.2	-83.1	-56	0	0	0	114.4
111	I	43.7	Very low	38.1	Very low	164 Å²	164	176.7 Å²	176.7	84%	0.841	86%	0.857	S	S	*	*			trans	-99.4	103.8	157.1	-61.7	176.4	0	0	0	107	A109 G113	A109-I111 PolarHBondContact O-N 2.87Å; I111-G113 PolarHBondContact O-N 3.39Å
112	R	39.2	Very low	37.9	Very low	243 Å²	243	179.6 Å²	179.6	92%	0.917	86%	0.863	S	S	*	*			trans	-72.9	106.1	166.5	-81	-178.9	179.1	179.5	0.2	108.1
113	G	38.3	Very low	37.9	Very low	64 Å²	64	176.3 Å²	176.3	66%	0.66	86%	0.859	S	S	*	*			trans	-125.3	103.8	165.6	0	0	0	0	0	109	I111 I115	I111-G113 PolarHBondContact O-N 3.39Å; G113-I115 PolarHBondContact O-N 2.7Å
114	T	36.8	Very low	37.6	Very low	145 Å²	145	178.8 Å²	178.8	89%	0.89	86%	0.863	S	S	*	*			trans	-71.4	102.5	175.5	41.1	0	0	0	0	110.2
115	I	40.8	Very low	37.6	Very low	161 Å²	161	180 Å²	180	83%	0.826	86%	0.862	S	S	*	*			trans	-125.4	110.6	163.8	-59.9	177.7	0	0	0	107.4	G113	G113-I115 PolarHBondContact O-N 2.7Å
116	R	42.7	Very low	36.7	Very low	234 Å²	234	177.8 Å²	177.8	88%	0.883	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-67.7	133	177.2	-69.4	-177.6	178	-176.7	-0.2	109.7	K118	R116-K118 PolarHBondContact O-N 3.06Å
117	P	38.9	Very low	35.9	Very low	123 Å²	123	175.6 Å²	175.6	80%	0.799	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.8	175.6	27.8	-30.1	0	0	0	110.7	L119	P117-L119 PolarHBondContact O-N 3.41Å
118	K	34.5	Very low	35.5	Very low	211 Å²	211	173.9 Å²	173.9	92%	0.917	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-66.7	119.7	170.5	-79	-173.9	175.1	179.4	0	109.9	R116 R120	R116-K118 PolarHBondContact O-N 3.06Å; K118-R120 PolarHBondContact O-N 3.2Å
119	L	37.4	Very low	34.9	Very low	178 Å²	178	174.4 Å²	174.4	93%	0.932	85%	0.848	S	S	*	*			trans	-59.1	115	169.3	-85.3	149.6	0	0	0	110.6	P117	P117-L119 PolarHBondContact O-N 3.41Å
120	R	41.2	Very low	34.7	Very low	246 Å²	246	175.6 Å²	175.6	93%	0.928	85%	0.848	S	S	*	*			trans	-94.3	112.3	168.9	-166.8	173.7	-178.3	176.5	0.4	109.4	K118 K122	K118-R120 PolarHBondContact O-N 3.2Å; R120-K122 PolarHBondContact O-N 2.98Å
121	K	34.4	Very low	34.3	Very low	197 Å²	197	173.4 Å²	173.4	86%	0.857	84%	0.841	S	S	*	*			trans	-57.6	125.9	173	-94.7	176.9	172.3	176.3	0	110.7	V123	K121-V123 PolarHBondContact O-N 3.3Å
122	K	30.4	Very low	33.7	Very low	211 Å²	211	173.5 Å²	173.5	92%	0.917	84%	0.842	S	S	*	*			trans	-74.3	110.9	168.7	-125.8	179	-178.6	179.4	0	108.2	R120	R120-K122 PolarHBondContact O-N 2.98Å
123	V	32.1	Very low	33.1	Very low	129 Å²	129	167.7 Å²	167.7	78%	0.782	83%	0.834	S	S	*	*			trans	-92.4	112.8	168.9	175.8	0	0	0	0	107.9	K121 R125	K121-V123 PolarHBondContact O-N 3.3Å; V123-R125 PolarHBondContact O-N 3.45Å
124	R	29.7	Very low	32.7	Very low	247 Å²	247	174.4 Å²	174.4	93%	0.932	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-65.6	118.9	169	-113.5	175.9	169.9	173.7	-4.1	108.1
125	R	32.3	Very low	32.2	Very low	237 Å²	237	178.4 Å²	178.4	89%	0.894	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-94.7	128.2	160.1	-87.6	-176.5	174.6	164.9	-2.1	108.5	V123	V123-R125 PolarHBondContact O-N 3.45Å
126	K	27.7	Very low	31.5	Very low	193 Å²	193	177.6 Å²	177.6	84%	0.839	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-68.1	138.3	177.7	-78.4	177.6	171.2	-176.7	0	109.9
127	T	28.2	Very low	30.6	Very low	129 Å²	129	177.6 Å²	177.6	79%	0.791	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-70.3	126.1	163.3	-35.9	0	0	0	0	108.2
128	D	28	Very low	29.9	Very low	157 Å²	157	181.2 Å²	181.2	84%	0.84	85%	0.847	S	S	*	*			trans	-127.6	122.7	158.3	-77.5	-39.4	0	0	0	106.6
129	D	25.3	Very low	29.5	Very low	136 Å²	136	176.5 Å²	176.5	73%	0.727	84%	0.841	S	S	*	*			trans	-117.5	133.6	-178.5	-167.7	20.7	0	0	0	106.3
130	P	33.2	Very low	29	Very low	118 Å²	118	174.6 Å²	174.6	77%	0.766	84%	0.836	S	S	*	*			trans	-112.9	109.7	157.5	30.1	-16.2	0	0	0	109.9
131	T	25.2	Very low	28.2	Very low	118 Å²	118	171.7 Å²	171.7	72%	0.724	83%	0.833	S	S	*	*			trans	-43.7	126.3	155.6	45.1	0	0	0	0	112.9
132	I	30.9	Very low	27.9	Very low	166 Å²	166	173.8 Å²	173.8	85%	0.851	84%	0.836	S	S	*	*			trans	-135.5	121.3	139.7	-70.3	-176	0	0	0	109.5
133	T	27	Very low	27.6	Very low	122 Å²	122	172.9 Å²	172.9	75%	0.748	84%	0.835	S	S	*	*			trans	-62.8	143.3	174.8	45.6	0	0	0	0	113.9
134	Q	30.8	Very low	27.4	Very low	205 Å²	205	172.1 Å²	172.1	96%	0.958	84%	0.842	S	S	*	*				-159.3	152.8	123.3	-107.3	179.5	25.8	0	0	112.2
135	R	25.4	Very low	27.2	Very low	228 Å²	228	163.6 Å²	163.6	86%	0.86	83%	0.831	S	S	*	*			trans	-102.1	145.3	-156.4	-129.7	-179.8	-161.8	153.4	2.2	109.7
136	N	25.3	Very low	27.3	Very low	144 Å²	144	161.1 Å²	161.1	77%	0.77	83%	0.83	S	S	*	*				163.4	109.2	129.4	-82.1	-15.5	0	0	0	109.1
137	R	25.5	Very low	27.3	Very low	234 Å²	234	157.6 Å²	157.6	88%	0.883	82%	0.824	S	S	*	*				68.4	102.3	89.6	-103.5	-173.7	176.9	177.3	-0.9	114.5
138	F	23.6	Very low	27.3	Very low	200 Å²	200	158.2 Å²	158.2	88%	0.877	82%	0.822	S	S	*	*			trans	24.9	125	138.1	-86.5	-94.7	0	0	0	120
139	S	25.9	Very low	27.2	Very low	112 Å²	112	161.3 Å²	161.3	78%	0.783	82%	0.822	S	S	*	*				-169.8	137.7	116.7	38.4	0	0	0	0	111.5
140	V	27.9	Very low	27.3	Very low	138 Å²	138	160.1 Å²	160.1	84%	0.836	83%	0.825	S	S	*	*			trans	-81.8	123.8	163.9	166.5	0	0	0	0	106.3
141	E	24.3	Very low	27.1	Very low	184 Å²	184	161.1 Å²	161.1	86%	0.86	83%	0.829	S	S	*	*			trans	-151.1	129.3	156.3	-120.1	163	-167.7	0	0	110.1
142	R	27	Very low	27.2	Very low	241 Å²	241	158.4 Å²	158.4	91%	0.909	82%	0.824	S	S	*	*			trans	-70.6	130.7	169.7	-72.2	173.6	-173.2	156.6	2.9	107.1
143	E	25.1	Very low	27.5	Very low	193 Å²	193	156.2 Å²	156.2	90%	0.902	81%	0.814	S	S	*	*			trans	-147.9	132	148.7	-113.8	174.6	-168.3	0	0	110.4	G145	E143-G145 PolarHBondContact O-N 3.48Å
144	A	27.9	Very low	27.7	Very low	112 Å²	112	159.9 Å²	159.9	93%	0.926	82%	0.819	S	S	*	*			trans	-69.7	119.7	179.8	0	0	0	0	0	109.4
145	G	25.6	Very low	28	Very low	68 Å²	68	155.3 Å²	155.3	70%	0.701	81%	0.806	S	S	*	*			trans	-139	89.7	177.5	0	0	0	0	0	109.9	E143 V147	E143-G145 PolarHBondContact O-N 3.48Å; G145-V147 PolarHBondContact O-N 2.89Å
146	Q	33	Very low	28.4	Very low	186 Å²	186	150 Å²	150	87%	0.869	80%	0.803	S	S	*	*			trans	-58.2	106.7	175.4	-161.1	172.5	9.6	0	0	110.2
147	V	27.5	Very low	28.7	Very low	118 Å²	118	154.5 Å²	154.5	72%	0.715	81%	0.81	S	S	*	*			trans	-137.6	94.6	164.7	-176.6	0	0	0	0	109.6	G145 R149	G145-V147 PolarHBondContact O-N 2.89Å; V147-R149 HydrophobicContact CG1-CG 4.27Å; V147-R149 PolarHBondContact O-N 3.47Å
148	N	29.1	Very low	29	Very low	143 Å²	143	150 Å²	150	77%	0.765	80%	0.803	S	S	*	*			trans	-57.4	113.1	161.3	-70.6	-31.2	0	0	0	109.2
149	R	26	Very low	29.2	Very low	222 Å²	222	144.2 Å²	144.2	84%	0.838	80%	0.8	S	S	*	*			trans	-122.5	71.4	157.6	-84.5	-173	174.8	-178	0.3	109.3	V147 T151	V147-R149 HydrophobicContact CG1-CG 4.27Å; V147-R149 PolarHBondContact O-N 3.47Å; R149-T151 PolarHBondContact O-N 3.28Å; R149-T151 VanDerWaalsContact O-N 3.13Å
150	S	27	Very low	29.8	Very low	111 Å²	111	143.5 Å²	143.5	78%	0.776	81%	0.81	S	S	*	*			trans	-59.6	106.1	151.2	41.4	0	0	0	0	107.4	G152	S150-G152 VanDerWaalsContact C-N 3.26Å; S150-G152 PolarHBondContact O-N 3.49Å
151	T	28.8	Very low	30.4	Very low	138 Å²	138	141.1 Å²	141.1	85%	0.847	80%	0.8	S	S	*	*			trans	-76.1	89.6	173.8	-43.8	0	0	0	0	106.8	R149 L153	R149-T151 PolarHBondContact O-N 3.28Å; R149-T151 VanDerWaalsContact O-N 3.13Å; T151-L153 PolarHBondContact O-N 3.24Å
152	G	26.6	Very low	31.5	Very low	62 Å²	62	135 Å²	135	64%	0.639	77%	0.772	S	S	*	*			trans	-59.2	122.5	-174.1	0	0	0	0	0	112.8	S150 K154	S150-G152 VanDerWaalsContact C-N 3.26Å; S150-G152 PolarHBondContact O-N 3.49Å; G152-K154 PolarHBondContact O-N 3.27Å
153	L	38.3	Very low	32.7	Very low	119 Å²	119	126.7 Å²	126.7	62%	0.623	75%	0.748	S	S	*	*			trans	-58.6	114.6	160.6	-162.2	66.6	0	0	0	107.4	T151 T155 F165	T151-L153 PolarHBondContact O-N 3.24Å; L153-T155 PolarHBondContact O-N 3.09Å; L153-T155 VanDerWaalsContact O-N 3.11Å; L153-F165 HydrophobicContact CD1-CD1 4.21Å; L153-F165 HydrophobicContact CD2-CD1 3.55Å; L153-F165 HydrophobicContact CD2-CE1 3.38Å; L153-F165 HydrophobicContact CG-CD1 3.96Å; L153-F165 HydrophobicContact CG-CE1 4.19Å
154	K	32.1	Very low	33.9	Very low	200 Å²	200	119.7 Å²	119.7	87%	0.87	72%	0.717	S	S	*	*			trans	-75.4	103.9	179.6	-74.6	-170.8	176.6	-173.2	0	109.2	G152	G152-K154 PolarHBondContact O-N 3.27Å
155	T	35.1	Very low	35.3	Very low	109 Å²	109	117 Å²	117	67%	0.669	69%	0.685	S	S	*	*			trans	-78.5	123.9	168.5	36.5	0	0	0	0	109.5	L153	L153-T155 PolarHBondContact O-N 3.09Å; L153-T155 VanDerWaalsContact O-N 3.11Å
156	S	35.3	Very low	36.4	Very low	116 Å²	116	121.2 Å²	121.2	81%	0.811	68%	0.684	S	S	*	*			trans	-95.8	111.3	161.9	-175.4	0	0	0	0	107
157	R	31.6	Very low	37.1	Very low	239 Å²	239	114.2 Å²	114.2	90%	0.902	66%	0.655	S	S	*	*			trans	-101.3	99.5	-176	-153.2	178.1	-173.2	177.8	1	107.6
158	N	30.5	Very low	37.8	Very low	139 Å²	139	117.4 Å²	117.4	74%	0.743	66%	0.66	S	S	*	*			trans	-117.1	134.1	161.6	-101.2	-2.9	0	0	0	108.6
159	G	29	Very low	38.2	Very low	79 Å²	79	115 Å²	115	81%	0.814	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	139.3	-162.4	0	0	0	0	0	115.2	S161	G159-S161 PolarHBondContact O-N 3.27Å
160	G	38.8	Very low	38.9	Very low	97 Å²	97	111.3 Å²	111.3	100%	1	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.2	0.2	166.8	0	0	0	0	0	117.6
161	S	40.8	Very low	39.6	Very low	88 Å²	88	112.4 Å²	112.4	62%	0.615	64%	0.643	S	S	*	*			trans	-128.3	138.9	-158.8	-177.9	0	0	0	0	114.2	G159	G159-S161 PolarHBondContact O-N 3.27Å
162	L	46.8	Very low	40.4	Very low	54 Å²	54	109 Å²	109	28%	0.283	62%	0.619	S	S	.	*			trans	8.2	112.9	155.5	-163.4	70.6	0	0	0	115.8	D164 K212 I214	L162-D164 PolarHBondContact O-N 3.28Å; L162-K212 HydrophobicContact CD1-CB 4.22Å; L162-K212 HydrophobicContact CD1-CD 4.08Å; L162-K212 HydrophobicContact CD2-CD 3.7Å; L162-K212 HydrophobicContact CG-CD 4.05Å; L162-I214 HydrophobicContact CD1-CG1 4.11Å
163	V	51.9	Low	41.1	Very low	67 Å²	67	109.7 Å²	109.7	41%	0.406	63%	0.627	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.3	105.8	176.1	-171.4	0	0	0	0	109.3	F165 E213	V163-F165 HydrophobicContact CB-CE2 4.22Å; V163-F165 HydrophobicContact CB-CZ 4.4Å; V163-F165 HydrophobicContact CG1-CD2 4.3Å; V163-F165 HydrophobicContact CG1-CE1 3.93Å; V163-F165 HydrophobicContact CG1-CE2 3.67Å; V163-F165 HydrophobicContact CG1-CZ 3.47Å; V163-F165 VanDerWaalsContact CG1-CZ 3.47Å; V163-E213 PolarHBondContact O-N 3.46Å
164	D	49.8	Very low	41.5	Very low	47 Å²	47	108.3 Å²	108.3	25%	0.251	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.3	115.9	174.8	-87.3	6	0	0	0	110.1	L162 F166 R210 K212	L162-D164 PolarHBondContact O-N 3.28Å; D164-F166 HydrophobicContact CB-CE2 4.41Å; D164-R210 IonicContact OD1-NH1 2.85Å; D164-R210 WeakPolarHBondContact OD2-CD 3.24Å; D164-R210 IonicContact OD2-CZ 2.89Å; D164-R210 IonicContact OD2-NE 3.99Å; D164-R210 IonicContact OD2-NH1 2.99Å; D164-R210 PolarHBondContact OD2-NH1 3.37Å; D164-K212 WeakPolarHBondContact OD1-CE 3.23Å; D164-K212 WeakPolarHBondContact OD1-CG 3.43Å; D164-K212 IonicContact OD1-NZ 3.11Å
165	F	57	Low	42	Very low	56 Å²	56	103.9 Å²	103.9	25%	0.246	61%	0.61	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.5	115.8	168.8	-59.3	-79.5	0	0	0	109.6	L153 V163 S167 I211	L153-F165 HydrophobicContact CD1-CD1 4.21Å; L153-F165 HydrophobicContact CD2-CD1 3.55Å; L153-F165 HydrophobicContact CD2-CE1 3.38Å; L153-F165 HydrophobicContact CG-CD1 3.96Å; L153-F165 HydrophobicContact CG-CE1 4.19Å; V163-F165 HydrophobicContact CB-CE2 4.22Å; V163-F165 HydrophobicContact CB-CZ 4.4Å; V163-F165 HydrophobicContact CG1-CD2 4.3Å; V163-F165 HydrophobicContact CG1-CE1 3.93Å; V163-F165 HydrophobicContact CG1-CE2 3.67Å; V163-F165 HydrophobicContact CG1-CZ 3.47Å; V163-F165 VanDerWaalsContact CG1-CZ 3.47Å; F165-S167 PolarHBondContact O-N 3.19Å; F165-I211 HydrophobicContact CB-CB 4.3Å; F165-I211 HydrophobicContact CD2-CG2 4.49Å; F165-I211 PolarHBondContact N-O 3.23Å; F165-I211 PolarHBondContact O-N 2.94Å
166	F	48.9	Very low	42.7	Very low	156 Å²	156	103.8 Å²	103.8	68%	0.684	61%	0.611	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.7	110.1	168.7	-67.9	-81.3	0	0	0	108.8	D164 K168	D164-F166 HydrophobicContact CB-CE2 4.41Å; F166-K168 PolarHBondContact O-N 3.3Å
167	S	47.7	Very low	43.5	Very low	38 Å²	38	105.8 Å²	105.8	27%	0.266	61%	0.607	S	S	.	*			trans	-69.1	102.1	167.2	-163.7	0	0	0	0	107.1	F165 S169	F165-S167 PolarHBondContact O-N 3.19Å; S167-S169 PolarHBondContact O-N 3.29Å; S167-S169 VanDerWaalsContact O-N 3.13Å
168	K	41.7	Very low	45	Very low	186 Å²	186	101.8 Å²	101.8	81%	0.809	60%	0.597	S	S	*	*			trans	-52.4	122.7	160	-89.3	-176.6	176.7	179.7	0	105.1	F166 H170	F166-K168 PolarHBondContact O-N 3.3Å; K168-H170 PolarHBondContact O-N 3Å
169	S	38.7	Very low	47.5	Very low	91 Å²	91	97.2 Å²	97.2	64%	0.636	58%	0.575	S	S	*	*			trans	-42.2	84.6	-170.5	63.9	0	0	0	0	112.7	S167 N171	S167-S169 PolarHBondContact O-N 3.29Å; S167-S169 VanDerWaalsContact O-N 3.13Å; S169-N171 PolarHBondContact O-N 3.14Å
170	H	40.7	Very low	50.3	Low	146 Å²	146	94.1 Å²	94.1	68%	0.676	54%	0.541	S	S	*	.			trans	-71.4	111.7	155.7	-97.2	-62.5	0	0	0	102	K168 D172	K168-H170 PolarHBondContact O-N 3Å; H170-D172 PolarHBondContact O-N 3.41Å
171	N	40.5	Very low	52.9	Low	134 Å²	134	89.8 Å²	89.8	72%	0.717	50%	0.495	S	S	*	.			trans	-57.2	89.2	151.9	-73.9	-15.9	0	0	0	104.3	S169 G173	S169-N171 PolarHBondContact O-N 3.14Å; N171-G173 PolarHBondContact O-N 2.93Å
172	D	46.2	Very low	55.4	Low	65 Å²	65	88.7 Å²	88.7	35%	0.348	48%	0.478	S	S	.	.			trans	-55.9	98.4	159.1	-159.9	21.9	0	0	0	102.3	H170 T174 R281	H170-D172 PolarHBondContact O-N 3.41Å; D172-T174 PolarHBondContact O-N 3.22Å; D172-T174 PolarHBondContact O-OG1 3.39Å; D172-R281 IonicContact OD2-NH2 3.97Å
173	G	41.1	Very low	57.3	Low	78 Å²	78	88.4 Å²	88.4	80%	0.804	48%	0.476	S	S	*	.			trans	-67.8	56.5	-155	0	0	0	0	0	114.1	N171 D175	N171-G173 PolarHBondContact O-N 2.93Å; G173-D175 PolarHBondContact O-N 3.27Å
174	T	46.4	Very low	58.7	Low	90 Å²	90	91.7 Å²	91.7	55%	0.552	48%	0.482	S	S	*	.			trans	-87.7	105.2	169.9	22.9	0	0	0	0	106.4	D172	D172-T174 PolarHBondContact O-N 3.22Å; D172-T174 PolarHBondContact O-OG1 3.39Å
175	D	43	Very low	60.3	Low	107 Å²	107	93 Å²	93	57%	0.572	50%	0.495	S	S	*	.			trans	-44.8	129.5	163.7	-139.9	-10.5	0	0	0	108.1	G173 H177 F178	G173-D175 PolarHBondContact O-N 3.27Å; D175-H177 PolarHBondContact O-N 3.03Å; D175-F178 HydrophobicContact CB-CD2 4.39Å; D175-F178 PolarHBondContact O-N 3.33Å
176	P	49.8	Very low	61.5	Low	106 Å²	106	100 Å²	100	69%	0.688	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	5.1	-173.9	21.6	-32.5	0	0	0	115.2
177	H	52	Low	63.4	Low	159 Å²	159	99.8 Å²	99.8	74%	0.736	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-5	-176.9	-74.8	-61.9	0	0	0	115.4	D175	D175-H177 PolarHBondContact O-N 3.03Å
178	F	64.5	Low	65.5	Low	155 Å²	155	99.2 Å²	99.2	68%	0.68	53%	0.529	S	S	*	.			trans	-128.5	100.8	-177.5	-64.5	-77.1	0	0	0	112.7	D175	D175-F178 HydrophobicContact CB-CD2 4.39Å; D175-F178 PolarHBondContact O-N 3.33Å
179	S	81.1	Confident	68.1	Low	43 Å²	43	91.2 Å²	91.2	30%	0.301	50%	0.496	S	S	.	.			trans	-68.3	136.4	167.6	175	0	0	0	0	110.2	I181 D205	S179-I181 PolarHBondContact O-N 2.86Å; S179-I181 PolarHBondContact OG-N 3.37Å; S179-I181 VanDerWaalsContact OG-N 3.07Å; S179-I181 PolarHBondContact OG-O 2.97Å; S179-D205 WeakPolarHBondContact CA-OD2 3.45Å; S179-D205 WeakPolarHBondContact CB-OD2 3.25Å; S179-D205 PolarHBondContact OG-OD2 2.82Å
180	S	88.9	Confident	70.7	Confident	14 Å²	14	92.7 Å²	92.7	10%	0.098	50%	0.503	C	S	.	.	S	Bend	trans	-65.1	-19.1	169.7	59.8	0	0	0	0	112.5	G204 D205 Q462	S180-G204 WeakPolarHBondContact OG-CA 3.36Å; S180-D205 WeakPolarHBondContact CB-OD1 3.22Å; S180-D205 PolarHBondContact N-OD1 3.21Å; S180-D205 PolarHBondContact OG-OD1 3.31Å; S180-Q462 WeakPolarHBondContact O-CB 3.23Å; S180-Q462 PolarHBondContact O-N 2.9Å
181	I	94.1	Very high	73.4	Confident	6 Å²	6	87.1 Å²	87.1	3%	0.031	48%	0.476	C	S	.	.	B	Isolated β-bridge	trans	-96.9	101.8	176.2	-51.7	-53.9	0	0	0	109.9	S179 M200 R201 V279 L460 D461	S179-I181 PolarHBondContact O-N 2.86Å; S179-I181 PolarHBondContact OG-N 3.37Å; S179-I181 VanDerWaalsContact OG-N 3.07Å; S179-I181 PolarHBondContact OG-O 2.97Å; I181-M200 HydrophobicContact CD1-CB 4.32Å; I181-M200 HydrophobicContact CD1-CE 4.27Å; I181-M200 HydrophobicContact CG1-CB 4.13Å; I181-M200 HydrophobicContact CG2-CB 4.23Å; I181-M200 HydrophobicContact CG2-CE 4.15Å; I181-R201 HydrophobicContact CB-CG 4.19Å; I181-R201 HydrophobicContact CG2-CG 4.48Å; I181-V279 HydrophobicContact CD1-CB 4.36Å; I181-V279 HydrophobicContact CD1-CG1 3.95Å; I181-L460 CarbonylContact C-O 3.46Å; I181-L460 VanDerWaalsContact CA-O 3.31Å; I181-L460 WeakPolarHBondContact CA-O 3.48Å; I181-D461 HydrophobicContact CD1-CB 4.42Å
182	R	91.8	Very high	76.1	Confident	65 Å²	65	81.6 Å²	81.6	25%	0.245	45%	0.446	C	S	.	.			trans	-94.3	111	-170.9	-62.9	151.8	158.6	-158.3	5.9	111.7	Y184 L460 Q462 E466	R182-Y184 HydrophobicContact CB-CD2 4.09Å; R182-Y184 HydrophobicContact CB-CE1 4.48Å; R182-Y184 HydrophobicContact CB-CE2 3.32Å; R182-Y184 WeakPolarHBondContact CD-OH 3.19Å; R182-Y184 HydrophobicContact CG-CE2 4.29Å; R182-Y184 PolarHBondContact NH1-OH 2.95Å; R182-L460 PolarHBondContact N-O 3.06Å; R182-L460 WeakPolarHBondContact O-CA 3.46Å; R182-L460 WeakPolarHBondContact O-CG 3.19Å; R182-Q462 HydrophobicContact CG-CB 4.49Å; R182-Q462 VanDerWaalsContact NH2-CG 3.3Å; R182-E466 IonicContact NH2-OE1 3.77Å
183	I	88.5	Confident	78.4	Confident	48 Å²	48	81.1 Å²	81.1	25%	0.246	45%	0.447	C	S	.	.			trans	-102.4	115.8	171	-54.2	-179.3	0	0	0	108.3	S185 A188 V197	I183-S185 WeakPolarHBondContact CG2-O 3.18Å; I183-A188 HydrophobicContact CD1-CB 4.15Å; I183-V197 HydrophobicContact CD1-CG1 3.66Å
184	Y	80	Confident	81	Confident	136 Å²	136	81.7 Å²	81.7	53%	0.533	45%	0.445	S	S	.	.			trans	-97.2	5.4	-171.9	-67.1	-81.5	0	0	0	114.4	R182 F459	R182-Y184 HydrophobicContact CB-CD2 4.09Å; R182-Y184 HydrophobicContact CB-CE1 4.48Å; R182-Y184 HydrophobicContact CB-CE2 3.32Å; R182-Y184 WeakPolarHBondContact CD-OH 3.19Å; R182-Y184 HydrophobicContact CG-CE2 4.29Å; R182-Y184 PolarHBondContact NH1-OH 2.95Å; Y184-F459 AromaticContact CD2-CD1 3.77Å; Y184-F459 HydrophobicContact CD2-CD1 3.77Å; Y184-F459 AromaticContact CD2-CE1 3.61Å; Y184-F459 HydrophobicContact CD2-CE1 3.61Å; Y184-F459 HydrophobicContact CE1-CE1 4.26Å; Y184-F459 AromaticContact CE2-CD1 3.37Å; Y184-F459 HydrophobicContact CE2-CD1 3.37Å; Y184-F459 AromaticContact CE2-CE1 3.03Å; Y184-F459 HydrophobicContact CE2-CE1 3.03Å; Y184-F459 HydrophobicContact CE2-CG 4.46Å; Y184-F459 AromaticContact CE2-CZ 3.89Å; Y184-F459 HydrophobicContact CE2-CZ 3.89Å; Y184-F459 HydrophobicContact CG-CE1 4.38Å; Y184-F459 AromaticContact CZ-CE1 3.39Å; Y184-F459 AromaticContact CZ-CZ 3.85Å
185	S	83.7	Confident	83.2	Confident	75 Å²	75	82.3 Å²	82.3	52%	0.524	44%	0.441	S	S	.	.	S	Bend	trans	-131	170.3	-179.5	40.1	0	0	0	0	110.2	I183 M187	I183-S185 WeakPolarHBondContact CG2-O 3.18Å; S185-M187 PolarHBondContact O-N 3.3Å; S185-M187 VanDerWaalsContact O-N 3.17Å; S185-M187 PolarHBondContact OG-O 3.29Å
186	E	83.1	Confident	85.8	Confident	203 Å²	203	77.6 Å²	77.6	95%	0.949	42%	0.416	S	S	*	.	S	Bend	trans	-56.3	-30.5	175.3	-65.4	-179.5	175.5	0	0	112.3
187	M	87.9	Confident	87.9	Confident	150 Å²	150	73.2 Å²	73.2	74%	0.739	39%	0.388	S	S	*	.	S	Bend	trans	-131	154.7	179.8	-59.6	-179.5	73.8	0	0	111.2	S185	S185-M187 PolarHBondContact O-N 3.3Å; S185-M187 VanDerWaalsContact O-N 3.17Å; S185-M187 PolarHBondContact OG-O 3.29Å
188	A	91.9	Very high	89.9	Confident	27 Å²	27	69.7 Å²	69.7	22%	0.223	37%	0.37	C	S	.	.			trans	-62.8	157.9	169	0	0	0	0	0	111	I183 V197	I183-A188 HydrophobicContact CD1-CB 4.15Å; A188-V197 HydrophobicContact CB-CG2 3.54Å
189	P	95.3	Very high	91.3	Very high	17 Å²	17	62.5 Å²	62.5	11%	0.11	34%	0.339	C	S	.	.			trans	-51.8	141.4	172.3	-25.4	33.6	0	0	0	111.8	W191 F192 L460	P189-W191 HydrophobicContact CB-CD2 3.8Å; P189-W191 HydrophobicContact CB-CE3 4.12Å; P189-W191 HydrophobicContact CB-CG 4.47Å; P189-W191 HydrophobicContact CB-CH2 3.77Å; P189-W191 HydrophobicContact CB-CZ2 3.39Å; P189-W191 HydrophobicContact CB-CZ3 4.1Å; P189-W191 HydrophobicContact CG-CZ2 4.02Å; P189-W191 PolarHBondContact O-N 3.35Å; P189-F192 HydrophobicContact CB-CD2 4.17Å; P189-F192 HydrophobicContact CG-CD2 4.26Å; P189-F192 HydrophobicContact CG-CE2 4.46Å; P189-F192 PolarHBondContact O-N 3.01Å; P189-L460 HydrophobicContact CG-CD1 3.96Å; P189-L460 HydrophobicContact CG-CD2 4.11Å
190	P	94.9	Very high	92	Very high	122 Å²	122	60.5 Å²	60.5	79%	0.792	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-7.2	-166.5	27.4	-36.8	0	0	0	114.9
191	W	95.9	Very high	92.2	Very high	30 Å²	30	65.6 Å²	65.6	11%	0.114	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-5.9	174.4	53.3	78.7	0	0	0	113.7	P189 R268 V269 K453 Q456 S457	P189-W191 HydrophobicContact CB-CD2 3.8Å; P189-W191 HydrophobicContact CB-CE3 4.12Å; P189-W191 HydrophobicContact CB-CG 4.47Å; P189-W191 HydrophobicContact CB-CH2 3.77Å; P189-W191 HydrophobicContact CB-CZ2 3.39Å; P189-W191 HydrophobicContact CB-CZ3 4.1Å; P189-W191 HydrophobicContact CG-CZ2 4.02Å; P189-W191 PolarHBondContact O-N 3.35Å; W191-R268 WeakPolarHBondContact CB-O 3.24Å; W191-V269 HydrophobicContact CD2-CG2 4.31Å; W191-V269 HydrophobicContact CG-CG2 4.47Å; W191-V269 HydrophobicContact CZ2-CG2 4.26Å; W191-K453 HydrophobicContact CE3-CG 4.45Å; W191-K453 HydrophobicContact CH2-CB 3.94Å; W191-K453 HydrophobicContact CH2-CG 3.93Å; W191-K453 HydrophobicContact CZ2-CB 4.36Å; W191-K453 VanDerWaalsContact CZ2-O 3.24Å; W191-K453 WeakPolarHBondContact CZ2-O 3.36Å; W191-K453 HydrophobicContact CZ3-CB 4.21Å; W191-K453 HydrophobicContact CZ3-CD 4.42Å; W191-K453 HydrophobicContact CZ3-CG 3.77Å; W191-Q456 HydrophobicContact CH2-CB 3.94Å; W191-Q456 HydrophobicContact CZ2-CB 3.97Å; W191-S457 PolarHBondContact NE1-OG 3.24Å
192	F	97	Very high	92.2	Very high	17 Å²	17	65.5 Å²	65.5	8%	0.075	34%	0.342	C	S	.	.	S	Bend	trans	-96	133.5	170.5	-70.9	-64.8	0	0	0	110.5	P189 D196 V197 M200 F264 H265 R268 S457 L460	P189-F192 HydrophobicContact CB-CD2 4.17Å; P189-F192 HydrophobicContact CG-CD2 4.26Å; P189-F192 HydrophobicContact CG-CE2 4.46Å; P189-F192 PolarHBondContact O-N 3.01Å; F192-D196 HydrophobicContact CB-CB 4.3Å; F192-D196 HydrophobicContact CD1-CB 3.93Å; F192-V197 HydrophobicContact CB-CG2 4Å; F192-M200 HydrophobicContact CD1-SD 4.36Å; F192-M200 HydrophobicContact CE1-SD 4.05Å; F192-M200 HydrophobicContact CZ-SD 4.33Å; F192-F264 HydrophobicContact CD1-CZ 4.17Å; F192-F264 AromaticContact CE1-CE1 3.78Å; F192-F264 HydrophobicContact CE1-CE1 3.78Å; F192-F264 AromaticContact CE1-CZ 3.72Å; F192-F264 HydrophobicContact CE1-CZ 3.72Å; F192-H265 AromaticContact CZ-CE1 3.82Å; F192-H265 AromaticContact CZ-ND1 3.55Å; F192-R268 HydrophobicContact CD1-CB 4.2Å; F192-R268 HydrophobicContact CD1-CG 3.93Å; F192-R268 HydrophobicContact CE1-CB 3.98Å; F192-R268 HydrophobicContact CE1-CG 3.81Å; F192-S457 WeakPolarHBondContact CE2-OG 3.28Å; F192-S457 WeakPolarHBondContact CZ-OG 3.14Å; F192-L460 HydrophobicContact CD2-CD2 4.07Å; F192-L460 HydrophobicContact CE2-CD2 3.8Å
193	S	95.9	Very high	92.3	Very high	55 Å²	55	62.4 Å²	62.4	39%	0.385	33%	0.33	S	S	.	.			trans	-73.7	161.7	167.2	69.1	0	0	0	0	110.9	Q195 D196 V197	S193-Q195 PolarHBondContact O-N 3.37Å; S193-D196 WeakPolarHBondContact CB-OD2 3.35Å; S193-D196 PolarHBondContact N-OD2 2.8Å; S193-D196 WeakPolarHBondContact O-CB 3.33Å; S193-D196 PolarHBondContact O-N 3.32Å; S193-D196 VanDerWaalsContact O-N 3.14Å; S193-D196 PolarHBondContact OG-N 3.13Å; S193-D196 PolarHBondContact OG-OD2 3.23Å; S193-V197 PolarHBondContact O-N 3.27Å
194	A	94.3	Very high	92.5	Very high	91 Å²	91	60.5 Å²	60.5	75%	0.752	32%	0.322	S	S	*	.	H	α-helix	trans	-58.4	-34.7	172.3	0	0	0	0	0	111.9	K198	A194-K198 WeakPolarHBondContact O-CB 3.46Å; A194-K198 PolarHBondContact O-N 2.88Å; A194-K198 VanDerWaalsContact O-N 3.07Å
195	Q	93.9	Very high	92.9	Very high	102 Å²	102	56 Å²	56	48%	0.477	31%	0.307	S	S	.	.	H	α-helix	trans	-69.3	-38.2	176.9	-174.8	55	46.3	0	0	111.8	S193 K198 S199	S193-Q195 PolarHBondContact O-N 3.37Å; Q195-K198 PolarHBondContact O-N 3.35Å; Q195-S199 PolarHBondContact NE2-OG 3.49Å; Q195-S199 VanDerWaalsContact NE2-OG 3.1Å; Q195-S199 WeakPolarHBondContact O-CB 3.46Å; Q195-S199 PolarHBondContact O-N 3.35Å; Q195-S199 PolarHBondContact O-OG 2.92Å
196	D	96.3	Very high	93.1	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.043	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-50.2	174.7	-68.3	-42.6	0	0	0	111	F192 S193 K198 S199 M200 F264 R268	F192-D196 HydrophobicContact CB-CB 4.3Å; F192-D196 HydrophobicContact CD1-CB 3.93Å; S193-D196 WeakPolarHBondContact CB-OD2 3.35Å; S193-D196 PolarHBondContact N-OD2 2.8Å; S193-D196 WeakPolarHBondContact O-CB 3.33Å; S193-D196 PolarHBondContact O-N 3.32Å; S193-D196 VanDerWaalsContact O-N 3.14Å; S193-D196 PolarHBondContact OG-N 3.13Å; S193-D196 PolarHBondContact OG-OD2 3.23Å; D196-K198 VanDerWaalsContact C-N 3.3Å; D196-K198 PolarHBondContact O-N 3.43Å; D196-S199 PolarHBondContact O-N 3.39Å; D196-M200 VanDerWaalsContact O-CG 3.27Å; D196-M200 WeakPolarHBondContact O-CG 2.96Å; D196-M200 PolarHBondContact O-N 3.46Å; D196-F264 HydrophobicContact CB-CZ 4.25Å; D196-R268 VanDerWaalsContact CG-NE 3.32Å; D196-R268 IonicContact OD1-CZ 2.68Å; D196-R268 IonicContact OD1-NE 3.74Å; D196-R268 PolarHBondContact OD1-NE 2.98Å; D196-R268 IonicContact OD1-NH2 3.72Å; D196-R268 PolarHBondContact OD1-NH2 2.71Å; D196-R268 IonicContact OD2-CZ 2.99Å; D196-R268 IonicContact OD2-NE 3.55Å; D196-R268 PolarHBondContact OD2-NE 2.94Å; D196-R268 IonicContact OD2-NH2 2.78Å
197	V	95	Very high	93.3	Very high	15 Å²	15	47.8 Å²	47.8	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-42.2	-179.9	177.7	0	0	0	0	111.1	I183 A188 F192 S193 M200 R201	I183-V197 HydrophobicContact CD1-CG1 3.66Å; A188-V197 HydrophobicContact CB-CG2 3.54Å; F192-V197 HydrophobicContact CB-CG2 4Å; S193-V197 PolarHBondContact O-N 3.27Å; V197-M200 PolarHBondContact O-N 3.18Å; V197-R201 WeakPolarHBondContact O-CG 3.46Å; V197-R201 PolarHBondContact O-N 3.28Å
198	K	93.1	Very high	93.3	Very high	85 Å²	85	41.6 Å²	41.6	37%	0.37	23%	0.23	S	C	.	.	H	α-helix	trans	-62.1	-46.4	176	-175.6	177	-178.8	175.5	0	111.6	A194 Q195 D196 R201 F202	A194-K198 WeakPolarHBondContact O-CB 3.46Å; A194-K198 PolarHBondContact O-N 2.88Å; A194-K198 VanDerWaalsContact O-N 3.07Å; Q195-K198 PolarHBondContact O-N 3.35Å; D196-K198 VanDerWaalsContact C-N 3.3Å; D196-K198 PolarHBondContact O-N 3.43Å; K198-R201 PolarHBondContact O-N 3.17Å; K198-F202 PolarHBondContact O-N 2.88Å
199	S	94.7	Very high	92.9	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.028	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-41.6	177.9	-71.5	0	0	0	0	111.8	Q195 D196 R201 F202 L203	Q195-S199 PolarHBondContact NE2-OG 3.49Å; Q195-S199 VanDerWaalsContact NE2-OG 3.1Å; Q195-S199 WeakPolarHBondContact O-CB 3.46Å; Q195-S199 PolarHBondContact O-N 3.35Å; Q195-S199 PolarHBondContact O-OG 2.92Å; D196-S199 PolarHBondContact O-N 3.39Å; S199-R201 PolarHBondContact O-N 2.74Å; S199-F202 PolarHBondContact O-N 3.27Å; S199-L203 VanDerWaalsContact O-CG 3.24Å; S199-L203 WeakPolarHBondContact O-CG 3.33Å; S199-L203 PolarHBondContact O-N 3.41Å
200	M	95.4	Very high	92.4	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-48.1	175.9	-71.3	175.5	74.8	0	0	111.6	I181 F192 D196 V197 F202 L203 G204 F264 V279 L460	I181-M200 HydrophobicContact CD1-CB 4.32Å; I181-M200 HydrophobicContact CD1-CE 4.27Å; I181-M200 HydrophobicContact CG1-CB 4.13Å; I181-M200 HydrophobicContact CG2-CB 4.23Å; I181-M200 HydrophobicContact CG2-CE 4.15Å; F192-M200 HydrophobicContact CD1-SD 4.36Å; F192-M200 HydrophobicContact CE1-SD 4.05Å; F192-M200 HydrophobicContact CZ-SD 4.33Å; D196-M200 VanDerWaalsContact O-CG 3.27Å; D196-M200 WeakPolarHBondContact O-CG 2.96Å; D196-M200 PolarHBondContact O-N 3.46Å; V197-M200 PolarHBondContact O-N 3.18Å; M200-F202 VanDerWaalsContact C-N 3.35Å; M200-F202 PolarHBondContact O-N 3.37Å; M200-L203 PolarHBondContact O-N 2.95Å; M200-G204 PolarHBondContact O-N 3.19Å; M200-F264 HydrophobicContact CE-CE1 4.36Å; M200-F264 HydrophobicContact CG-CE1 3.91Å; M200-F264 HydrophobicContact CG-CZ 4.24Å; M200-F264 HydrophobicContact SD-CE1 3.75Å; M200-F264 HydrophobicContact SD-CZ 4.17Å; M200-V279 HydrophobicContact CB-CG1 3.78Å; M200-V279 HydrophobicContact CE-CG1 4.24Å; M200-V279 HydrophobicContact CG-CG1 3.78Å; M200-L460 HydrophobicContact CE-CB 4.48Å
201	R	93.7	Very high	92	Very high	121 Å²	121	40.8 Å²	40.8	46%	0.457	21%	0.21	S	C	.	.	H	α-helix	trans	-61	-43.3	176.9	-74.5	178.9	178.4	161.8	-1.3	112	I181 V197 K198 S199 G204 D205	I181-R201 HydrophobicContact CB-CG 4.19Å; I181-R201 HydrophobicContact CG2-CG 4.48Å; V197-R201 WeakPolarHBondContact O-CG 3.46Å; V197-R201 PolarHBondContact O-N 3.28Å; K198-R201 PolarHBondContact O-N 3.17Å; S199-R201 PolarHBondContact O-N 2.74Å; R201-G204 PolarHBondContact O-N 3.27Å; R201-D205 WeakPolarHBondContact O-CB 3.34Å; R201-D205 PolarHBondContact O-N 3.47Å
202	F	93	Very high	91.5	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.018	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-51.6	174.4	166.2	-99.1	0	0	0	111.1	K198 S199 M200 G204 A206 F225 Q248 L296	K198-F202 PolarHBondContact O-N 2.88Å; S199-F202 PolarHBondContact O-N 3.27Å; M200-F202 VanDerWaalsContact C-N 3.35Å; M200-F202 PolarHBondContact O-N 3.37Å; F202-G204 VanDerWaalsContact C-N 3.34Å; F202-G204 PolarHBondContact O-N 2.87Å; F202-A206 HydrophobicContact CD2-CB 3.45Å; F202-A206 VanDerWaalsContact CD2-CB 3.45Å; F202-A206 HydrophobicContact CE2-CB 3.47Å; F202-A206 VanDerWaalsContact CE2-CB 3.47Å; F202-A206 HydrophobicContact CG-CB 4.28Å; F202-A206 HydrophobicContact CZ-CB 4.3Å; F202-A206 WeakPolarHBondContact O-CB 3.38Å; F202-A206 PolarHBondContact O-N 3.22Å; F202-F225 HydrophobicContact CE1-CE2 4.27Å; F202-F225 HydrophobicContact CE1-CZ 4.09Å; F202-F225 AromaticContact CZ-CE2 3.87Å; F202-F225 HydrophobicContact CZ-CE2 3.87Å; F202-F225 HydrophobicContact CZ-CZ 4.16Å; F202-Q248 HydrophobicContact CD1-CB 4.16Å; F202-Q248 HydrophobicContact CD2-CB 3.83Å; F202-Q248 HydrophobicContact CE1-CB 3.75Å; F202-Q248 HydrophobicContact CE2-CB 3.37Å; F202-Q248 HydrophobicContact CG-CB 4.22Å; F202-Q248 VanDerWaalsContact CG-OE1 3.3Å; F202-Q248 HydrophobicContact CZ-CB 3.36Å; F202-Q248 WeakPolarHBondContact CZ-O 3.3Å; F202-L296 HydrophobicContact CD1-CD1 4.14Å; F202-L296 HydrophobicContact CE1-CD1 4.35Å
203	L	94.1	Very high	90.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-39.7	-176.3	-64	168.9	0	0	0	112	S199 M200 F225 P277 V279 R281 V294 L296	S199-L203 VanDerWaalsContact O-CG 3.24Å; S199-L203 WeakPolarHBondContact O-CG 3.33Å; S199-L203 PolarHBondContact O-N 3.41Å; M200-L203 PolarHBondContact O-N 2.95Å; L203-F225 HydrophobicContact CD2-CE1 4.45Å; L203-F225 HydrophobicContact CD2-CZ 4.23Å; L203-P277 HydrophobicContact CD1-CB 4.36Å; L203-P277 WeakPolarHBondContact CD1-O 3.42Å; L203-V279 HydrophobicContact CB-CG2 3.35Å; L203-V279 HydrophobicContact CD1-CG2 4.38Å; L203-R281 WeakPolarHBondContact O-CD 3.26Å; L203-R281 PolarHBondContact O-NH1 3.36Å; L203-R281 VanDerWaalsContact O-NH1 3.13Å; L203-V294 HydrophobicContact CB-CG1 4.2Å; L203-V294 HydrophobicContact CD2-CG1 3.87Å; L203-L296 HydrophobicContact CD1-CB 4.13Å; L203-L296 HydrophobicContact CD2-CB 4.37Å; L203-L296 HydrophobicContact CD2-CD1 4.09Å; L203-L296 HydrophobicContact CG-CD1 4.47Å
204	G	92.3	Very high	90.1	Very high	8 Å²	8	40.4 Å²	40.4	8%	0.082	20%	0.204	C	C	.	.	H	α-helix	trans	-74	-41.7	-178.7	0	0	0	0	0	113.6	S180 M200 R201 F202 R281	S180-G204 WeakPolarHBondContact OG-CA 3.36Å; M200-G204 PolarHBondContact O-N 3.19Å; R201-G204 PolarHBondContact O-N 3.27Å; F202-G204 VanDerWaalsContact C-N 3.34Å; F202-G204 PolarHBondContact O-N 2.87Å; G204-R281 WeakPolarHBondContact O-CD 3.48Å
205	D	89.3	Confident	89.3	Confident	41 Å²	41	40 Å²	40	22%	0.219	19%	0.193	C	C	.	.	H	α-helix	trans	-119.4	-13.2	-162.7	-51	-39.5	0	0	0	114.4	S179 S180 R201 K207	S179-D205 WeakPolarHBondContact CA-OD2 3.45Å; S179-D205 WeakPolarHBondContact CB-OD2 3.25Å; S179-D205 PolarHBondContact OG-OD2 2.82Å; S180-D205 WeakPolarHBondContact CB-OD1 3.22Å; S180-D205 PolarHBondContact N-OD1 3.21Å; S180-D205 PolarHBondContact OG-OD1 3.31Å; R201-D205 WeakPolarHBondContact O-CB 3.34Å; R201-D205 PolarHBondContact O-N 3.47Å; D205-K207 PolarHBondContact O-N 3.48Å
206	A	88.9	Confident	88.4	Confident	3 Å²	3	38.2 Å²	38.2	3%	0.025	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-62.2	142	-175.9	0	0	0	0	0	112	F202 V208 R281	F202-A206 HydrophobicContact CD2-CB 3.45Å; F202-A206 VanDerWaalsContact CD2-CB 3.45Å; F202-A206 HydrophobicContact CE2-CB 3.47Å; F202-A206 VanDerWaalsContact CE2-CB 3.47Å; F202-A206 HydrophobicContact CG-CB 4.28Å; F202-A206 HydrophobicContact CZ-CB 4.3Å; F202-A206 WeakPolarHBondContact O-CB 3.38Å; F202-A206 PolarHBondContact O-N 3.22Å; A206-V208 PolarHBondContact O-N 2.61Å; A206-R281 VanDerWaalsContact O-CZ 3.27Å; A206-R281 PolarHBondContact O-NH1 2.91Å; A206-R281 PolarHBondContact O-NH2 3.43Å
207	K	86.1	Confident	87	Confident	102 Å²	102	44.5 Å²	44.5	44%	0.443	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	120.8	173.9	-175.5	174.9	-177.7	173.1	0	109.5	D205 L209 G227 A228	D205-K207 PolarHBondContact O-N 3.48Å; K207-L209 PolarHBondContact O-N 3.36Å; K207-G227 VanDerWaalsContact O-CA 3.3Å; K207-G227 WeakPolarHBondContact O-CA 3.48Å; K207-A228 PolarHBondContact N-O 3.05Å; K207-A228 PolarHBondContact O-N 2.81Å; K207-A228 VanDerWaalsContact O-N 3.11Å
208	V	87.3	Confident	85.7	Confident	21 Å²	21	51.2 Å²	51.2	13%	0.127	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	117.3	176.4	178.7	0	0	0	0	109.3	A206 I211 F225 F283	A206-V208 PolarHBondContact O-N 2.61Å; V208-I211 HydrophobicContact CG1-CD1 4.13Å; V208-I211 HydrophobicContact CG1-CG1 3.73Å; V208-F225 HydrophobicContact CG1-CB 3.97Å; V208-F225 HydrophobicContact CG2-CB 4.39Å; V208-F225 HydrophobicContact CG2-CD2 3.87Å; V208-F225 HydrophobicContact CG2-CG 4.26Å; V208-F283 HydrophobicContact CG2-CD1 4.26Å; V208-F283 HydrophobicContact CG2-CE1 3.91Å
209	L	85.3	Confident	84.5	Confident	85 Å²	85	48.7 Å²	48.7	45%	0.445	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-44.4	177.5	-60.8	-178.2	0	0	0	111.6	K207 E226 A228	K207-L209 PolarHBondContact O-N 3.36Å; L209-E226 WeakPolarHBondContact CB-O 3.38Å; L209-E226 PolarHBondContact N-O 3.21Å; L209-A228 HydrophobicContact CD1-CB 3.84Å; L209-A228 HydrophobicContact CD2-CB 4.13Å; L209-A228 HydrophobicContact CG-CB 4.1Å
210	R	83.8	Confident	83.6	Confident	52 Å²	52	53.9 Å²	53.9	20%	0.196	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	147.9	-175.5	-176.8	167.8	58.3	164.1	-6.4	110	D164 K212 F225 E226	D164-R210 IonicContact OD1-NH1 2.85Å; D164-R210 WeakPolarHBondContact OD2-CD 3.24Å; D164-R210 IonicContact OD2-CZ 2.89Å; D164-R210 IonicContact OD2-NE 3.99Å; D164-R210 IonicContact OD2-NH1 2.99Å; D164-R210 PolarHBondContact OD2-NH1 3.37Å; R210-K212 HydrophobicContact CG-CG 4.27Å; R210-K212 VanDerWaalsContact NH1-NZ 3.16Å; R210-F225 CarbonylContact O-C 3.58Å; R210-F225 WeakPolarHBondContact O-CA 3.43Å; R210-E226 HydrophobicContact CB-CB 4.31Å; R210-E226 IonicContact CZ-OE2 3.65Å; R210-E226 PolarHBondContact N-O 3.17Å; R210-E226 IonicContact NE-OE2 3.69Å; R210-E226 PolarHBondContact NE-OE2 3.01Å; R210-E226 IonicContact NH2-OE2 3.74Å; R210-E226 PolarHBondContact NH2-OE2 3.23Å; R210-E226 PolarHBondContact O-N 3.08Å
211	I	86.8	Confident	82.8	Confident	12 Å²	12	56.1 Å²	56.1	6%	0.062	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.3	171.8	-59.5	149.5	0	0	0	107.8	F165 V208 V223 I224 F225 F285	F165-I211 HydrophobicContact CB-CB 4.3Å; F165-I211 HydrophobicContact CD2-CG2 4.49Å; F165-I211 PolarHBondContact N-O 3.23Å; F165-I211 PolarHBondContact O-N 2.94Å; V208-I211 HydrophobicContact CG1-CD1 4.13Å; V208-I211 HydrophobicContact CG1-CG1 3.73Å; I211-V223 HydrophobicContact CG2-CG1 3.54Å; I211-I224 CarbonylContact C-O 3.32Å; I211-I224 WeakPolarHBondContact CA-O 3.5Å; I211-F225 HydrophobicContact CG1-CB 4.3Å; I211-F285 HydrophobicContact CD1-CD1 4Å; I211-F285 HydrophobicContact CD1-CD2 3.96Å; I211-F285 HydrophobicContact CD1-CE1 3.47Å; I211-F285 VanDerWaalsContact CD1-CE1 3.47Å; I211-F285 HydrophobicContact CD1-CE2 3.45Å; I211-F285 VanDerWaalsContact CD1-CE2 3.45Å; I211-F285 HydrophobicContact CD1-CG 4.23Å; I211-F285 HydrophobicContact CD1-CZ 3.19Å; I211-F285 HydrophobicContact CG1-CE1 4.45Å; I211-F285 HydrophobicContact CG1-CE2 4.47Å; I211-F285 HydrophobicContact CG1-CZ 4.02Å
212	K	84.6	Confident	82.3	Confident	5 Å²	5	51.3 Å²	51.3	2%	0.022	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139	-179.9	-60.6	-167.4	172.4	-169.9	0	110.2	L162 D164 R210 V223 I224 N243 I244	L162-K212 HydrophobicContact CD1-CB 4.22Å; L162-K212 HydrophobicContact CD1-CD 4.08Å; L162-K212 HydrophobicContact CD2-CD 3.7Å; L162-K212 HydrophobicContact CG-CD 4.05Å; D164-K212 WeakPolarHBondContact OD1-CE 3.23Å; D164-K212 WeakPolarHBondContact OD1-CG 3.43Å; D164-K212 IonicContact OD1-NZ 3.11Å; R210-K212 HydrophobicContact CG-CG 4.27Å; R210-K212 VanDerWaalsContact NH1-NZ 3.16Å; K212-V223 CarbonylContact O-C 3.53Å; K212-V223 WeakPolarHBondContact O-CA 3.22Å; K212-I224 PolarHBondContact N-O 3.42Å; K212-I224 PolarHBondContact O-N 3.44Å; K212-N243 PolarHBondContact NZ-O 3.19Å; K212-I244 WeakPolarHBondContact CD-O 3.42Å; K212-I244 WeakPolarHBondContact CE-O 3.38Å; K212-I244 PolarHBondContact NZ-O 3Å
213	E	85.4	Confident	82.1	Confident	75 Å²	75	53.3 Å²	53.3	35%	0.35	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.9	167.4	-169.6	177.7	169.4	0	0	109.6	V163 S221 H222	V163-E213 PolarHBondContact O-N 3.46Å; E213-S221 VanDerWaalsContact CG-CB 3.48Å; E213-S221 WeakPolarHBondContact OE1-CB 3.4Å; E213-S221 PolarHBondContact OE1-OG 3.33Å; E213-H222 WeakPolarHBondContact CA-O 3.46Å
214	I	79.4	Confident	81.8	Confident	13 Å²	13	53.5 Å²	53.5	7%	0.067	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	110.3	178.1	-56.7	-170.6	0	0	0	108.4	L162 S221 H222 I224 I244 L306	L162-I214 HydrophobicContact CD1-CG1 4.11Å; I214-S221 CarbonylContact O-C 3.57Å; I214-S221 VanDerWaalsContact O-CA 3.25Å; I214-S221 WeakPolarHBondContact O-CA 3.46Å; I214-S221 WeakPolarHBondContact O-CB 3.45Å; I214-H222 PolarHBondContact N-O 3.46Å; I214-H222 PolarHBondContact O-N 2.87Å; I214-I224 HydrophobicContact CD1-CD1 3.37Å; I214-I224 HydrophobicContact CD1-CG1 4.22Å; I214-I224 HydrophobicContact CG1-CD1 4.19Å; I214-I244 HydrophobicContact CD1-CG1 4.3Å; I214-I244 HydrophobicContact CD1-CG2 3.55Å; I214-L306 HydrophobicContact CD1-CD2 4.22Å; I214-L306 HydrophobicContact CG2-CB 4.24Å
215	P	77.6	Confident	81.7	Confident	82 Å²	82	53.1 Å²	53.1	53%	0.532	29%	0.287	S	S	.	.			trans	-66.3	144.5	174.8	28.7	-33.5	0	0	0	110.1
216	R	74.1	Confident	81.6	Confident	66 Å²	66	52.4 Å²	52.4	25%	0.249	28%	0.282	C	S	.	.			trans	-121.1	146.6	173.5	-72.8	-170.1	60.3	-158.5	-1.2	109.8	A219 H222	R216-A219 HydrophobicContact CB-CB 4.14Å; R216-H222 WeakPolarHBondContact CD-CE1 3.35Å; R216-H222 WeakPolarHBondContact CD-ND1 3.32Å; R216-H222 PolarHBondContact NH1-CE1 2.84Å
217	L	66.8	Low	81.5	Confident	139 Å²	139	52.6 Å²	52.6	73%	0.728	28%	0.284	S	S	*	.	S	Bend	trans	-62.6	-48.6	-177.8	-99.6	70.6	0	0	0	112.2	A307	L217-A307 HydrophobicContact CD1-CB 4.01Å
218	D	67.8	Low	81.1	Confident	157 Å²	157	48.8 Å²	48.8	84%	0.84	27%	0.272	S	S	*	.	S	Bend	trans	-120.9	21.9	-170	-55	-46.9	0	0	0	113.3
219	A	68.7	Low	80.2	Confident	31 Å²	31	49.4 Å²	49.4	26%	0.256	28%	0.275	S	S	.	.	S	Bend	trans	-153.5	162.2	-176.9	0	0	0	0	0	111.7	R216	R216-A219 HydrophobicContact CB-CB 4.14Å
220	P	74.4	Confident	78.8	Confident	113 Å²	113	50.7 Å²	50.7	73%	0.734	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-55.2	145.9	170.9	-22.8	33.2	0	0	0	111.6
221	S	79.4	Confident	77.3	Confident	49 Å²	49	55 Å²	55	34%	0.343	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-54.6	141.1	175.4	-55.2	0	0	0	0	111.2	E213 I214	E213-S221 VanDerWaalsContact CG-CB 3.48Å; E213-S221 WeakPolarHBondContact OE1-CB 3.4Å; E213-S221 PolarHBondContact OE1-OG 3.33Å; I214-S221 CarbonylContact O-C 3.57Å; I214-S221 VanDerWaalsContact O-CA 3.25Å; I214-S221 WeakPolarHBondContact O-CA 3.46Å; I214-S221 WeakPolarHBondContact O-CB 3.45Å
222	H	83.2	Confident	75.6	Confident	20 Å²	20	62 Å²	62	9%	0.093	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.2	167.9	-73.9	119.2	0	0	0	110	E213 I214 R216 I224 I251 H253	E213-H222 WeakPolarHBondContact CA-O 3.46Å; I214-H222 PolarHBondContact N-O 3.46Å; I214-H222 PolarHBondContact O-N 2.87Å; R216-H222 WeakPolarHBondContact CD-CE1 3.35Å; R216-H222 WeakPolarHBondContact CD-ND1 3.32Å; R216-H222 PolarHBondContact NH1-CE1 2.84Å; H222-I224 HydrophobicContact CB-CG1 4.46Å; H222-I251 HydrophobicContact CB-CG2 4.21Å; H222-H253 AromaticContact CD2-CE1 3.63Å; H222-H253 AromaticContact NE2-CE1 3.83Å
223	V	87.8	Confident	73.9	Confident	46 Å²	46	67 Å²	67	28%	0.279	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.6	168.1	-176.5	0	0	0	0	107.6	I211 K212 I252	I211-V223 HydrophobicContact CG2-CG1 3.54Å; K212-V223 CarbonylContact O-C 3.53Å; K212-V223 WeakPolarHBondContact O-CA 3.22Å; V223-I252 HydrophobicContact CB-CB 4.32Å; V223-I252 HydrophobicContact CG1-CB 4.41Å; V223-I252 HydrophobicContact CG1-CD1 4.22Å; V223-I252 PolarHBondContact O-N 3.25Å
224	I	88.8	Confident	71.7	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.015	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	135.7	-179.7	-57.8	-171.3	0	0	0	108.7	I211 K212 I214 H222 I244 C249 G250 I251 W297	I211-I224 CarbonylContact C-O 3.32Å; I211-I224 WeakPolarHBondContact CA-O 3.5Å; K212-I224 PolarHBondContact N-O 3.42Å; K212-I224 PolarHBondContact O-N 3.44Å; I214-I224 HydrophobicContact CD1-CD1 3.37Å; I214-I224 HydrophobicContact CD1-CG1 4.22Å; I214-I224 HydrophobicContact CG1-CD1 4.19Å; H222-I224 HydrophobicContact CB-CG1 4.46Å; I224-I244 HydrophobicContact CD1-CG2 4.48Å; I224-C249 HydrophobicContact CG2-CB 3.8Å; I224-G250 WeakPolarHBondContact CA-O 3.34Å; I224-I251 HydrophobicContact CG1-CG1 4.45Å; I224-W297 HydrophobicContact CD1-CD2 3.86Å; I224-W297 HydrophobicContact CD1-CE3 3.39Å; I224-W297 HydrophobicContact CD1-CH2 3.93Å; I224-W297 HydrophobicContact CD1-CZ2 4.36Å; I224-W297 HydrophobicContact CD1-CZ3 3.41Å; I224-W297 VanDerWaalsContact CD1-CZ3 3.41Å; I224-W297 HydrophobicContact CG1-CE3 4.38Å
225	F	89.4	Confident	70	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	144.2	165.4	81.2	-82.7	0	0	0	111	F202 L203 V208 R210 I211 C249 G250 I252 F283 V294	F202-F225 HydrophobicContact CE1-CE2 4.27Å; F202-F225 HydrophobicContact CE1-CZ 4.09Å; F202-F225 AromaticContact CZ-CE2 3.87Å; F202-F225 HydrophobicContact CZ-CE2 3.87Å; F202-F225 HydrophobicContact CZ-CZ 4.16Å; L203-F225 HydrophobicContact CD2-CE1 4.45Å; L203-F225 HydrophobicContact CD2-CZ 4.23Å; V208-F225 HydrophobicContact CG1-CB 3.97Å; V208-F225 HydrophobicContact CG2-CB 4.39Å; V208-F225 HydrophobicContact CG2-CD2 3.87Å; V208-F225 HydrophobicContact CG2-CG 4.26Å; R210-F225 CarbonylContact O-C 3.58Å; R210-F225 WeakPolarHBondContact O-CA 3.43Å; I211-F225 HydrophobicContact CG1-CB 4.3Å; F225-C249 CarbonylContact O-C 3.55Å; F225-C249 WeakPolarHBondContact O-CA 3.34Å; F225-C249 WeakPolarHBondContact O-CB 3.47Å; F225-G250 WeakPolarHBondContact CD1-O 3.41Å; F225-G250 VanDerWaalsContact CE1-CA 3.46Å; F225-G250 PolarHBondContact N-O 2.71Å; F225-G250 PolarHBondContact O-N 2.94Å; F225-I252 HydrophobicContact CB-CD1 4.11Å; F225-I252 HydrophobicContact CD1-CD1 4.04Å; F225-I252 HydrophobicContact CD1-CG1 3.85Å; F225-I252 HydrophobicContact CG-CD1 4.48Å; F225-F283 HydrophobicContact CD1-CE1 4.47Å; F225-F283 HydrophobicContact CD1-CZ 4.22Å; F225-F283 HydrophobicContact CE1-CZ 4.44Å; F225-V294 HydrophobicContact CD1-CG1 4.33Å; F225-V294 HydrophobicContact CE1-CG1 3.41Å; F225-V294 VanDerWaalsContact CE1-CG1 3.41Å; F225-V294 HydrophobicContact CZ-CG1 4.17Å
226	E	88.7	Confident	68.4	Low	27 Å²	27	81.8 Å²	81.8	13%	0.126	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.4	168.7	-179.6	171.4	-160.2	0	0	108.1	L209 R210 G246 G247	L209-E226 WeakPolarHBondContact CB-O 3.38Å; L209-E226 PolarHBondContact N-O 3.21Å; R210-E226 HydrophobicContact CB-CB 4.31Å; R210-E226 IonicContact CZ-OE2 3.65Å; R210-E226 PolarHBondContact N-O 3.17Å; R210-E226 IonicContact NE-OE2 3.69Å; R210-E226 PolarHBondContact NE-OE2 3.01Å; R210-E226 IonicContact NH2-OE2 3.74Å; R210-E226 PolarHBondContact NH2-OE2 3.23Å; R210-E226 PolarHBondContact O-N 3.08Å; E226-G246 VanDerWaalsContact OE1-CA 3.24Å; E226-G246 WeakPolarHBondContact OE1-CA 3.45Å; E226-G246 PolarHBondContact OE1-N 2.97Å; E226-G247 PolarHBondContact OE1-N 3.27Å
227	G	85.3	Confident	67	Low	6 Å²	6	87.4 Å²	87.4	6%	0.062	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	148.6	-176.4	0	0	0	0	0	112.6	K207 Q248	K207-G227 VanDerWaalsContact O-CA 3.3Å; K207-G227 WeakPolarHBondContact O-CA 3.48Å; G227-Q248 PolarHBondContact N-O 2.75Å
228	A	78.4	Confident	65.7	Low	23 Å²	23	89.3 Å²	89.3	19%	0.19	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130.8	162.4	0	0	0	0	0	109.7	K207 L209	K207-A228 PolarHBondContact N-O 3.05Å; K207-A228 PolarHBondContact O-N 2.81Å; K207-A228 VanDerWaalsContact O-N 3.11Å; L209-A228 HydrophobicContact CD1-CB 3.84Å; L209-A228 HydrophobicContact CD2-CB 4.13Å; L209-A228 HydrophobicContact CG-CB 4.1Å
229	D	68	Low	64.7	Low	34 Å²	34	87.1 Å²	87.1	18%	0.182	45%	0.447	C	S	.	.			trans	-69.4	138.3	165.3	-165	-3.7	0	0	0	109.1	D231 R232	D229-D231 PolarHBondContact O-N 3.45Å; D229-R232 HydrophobicContact CB-CB 4.29Å; D229-R232 HydrophobicContact CB-CG 4.45Å; D229-R232 PolarHBondContact O-N 2.9Å
230	M	55.8	Low	63.4	Low	111 Å²	111	93.4 Å²	93.4	55%	0.547	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-60.7	-31.5	-178.5	-69.7	-66	-74.4	0	0	111.3	R232 L233	M230-R232 VanDerWaalsContact C-N 3.33Å; M230-R232 PolarHBondContact O-N 3.26Å; M230-L233 HydrophobicContact SD-CD1 4.47Å
231	D	52.1	Low	62.1	Low	142 Å²	142	98 Å²	98	76%	0.759	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-75.8	-16.3	178.9	-72.9	-15.9	0	0	0	113.8	D229	D229-D231 PolarHBondContact O-N 3.45Å
232	R	51.3	Low	60.8	Low	160 Å²	160	100 Å²	100	60%	0.604	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-105.5	7.3	-173	-75.6	-172.1	162.6	-167.8	-4.2	115	D229 M230 F234 S235	D229-R232 HydrophobicContact CB-CB 4.29Å; D229-R232 HydrophobicContact CB-CG 4.45Å; D229-R232 PolarHBondContact O-N 2.9Å; M230-R232 VanDerWaalsContact C-N 3.33Å; M230-R232 PolarHBondContact O-N 3.26Å; R232-F234 PolarHBondContact O-N 3.08Å; R232-S235 PolarHBondContact O-N 3.2Å
233	L	48.6	Very low	59.6	Low	111 Å²	111	105.8 Å²	105.8	58%	0.581	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-11.6	173.9	-78.9	160	0	0	0	113.8	M230	M230-L233 HydrophobicContact SD-CD1 4.47Å
234	F	40.8	Very low	58.4	Low	188 Å²	188	105.1 Å²	105.1	83%	0.825	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	3.7	-176.7	-66.6	-75.7	0	0	0	116.4	R232	R232-F234 PolarHBondContact O-N 3.08Å
235	S	43.1	Very low	57.5	Low	100 Å²	100	105.6 Å²	105.6	70%	0.699	52%	0.516	S	S	*	.			trans	-135.3	67	-177	-66.1	0	0	0	0	112.8	R232 K237	R232-S235 PolarHBondContact O-N 3.2Å; S235-K237 PolarHBondContact O-N 3.41Å; S235-K237 VanDerWaalsContact O-N 3.09Å
236	Q	44.5	Very low	56	Low	191 Å²	191	106.1 Å²	106.1	89%	0.893	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	20.9	-178.6	-112.3	175.6	6.3	0	0	115.4
237	K	43.4	Very low	55	Low	184 Å²	184	106.5 Å²	106.5	80%	0.8	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-2.9	-167.9	-86.8	-170.1	175.8	-177.5	0	118.9	S235	S235-K237 PolarHBondContact O-N 3.41Å; S235-K237 VanDerWaalsContact O-N 3.09Å
238	H	39.4	Very low	54.9	Low	179 Å²	179	108.6 Å²	108.6	83%	0.829	54%	0.541	S	S	*	.			trans	-144.4	84.6	174.6	-67.2	-68.3	0	0	0	112.1
239	L	47	Very low	55.4	Low	111 Å²	111	107.6 Å²	107.6	58%	0.581	53%	0.533	S	S	*	.			trans	-122.2	99.8	163.4	-70.3	171.1	0	0	0	107.3	R241 G246	L239-R241 VanDerWaalsContact C-N 3.34Å; L239-R241 PolarHBondContact O-N 3.16Å; L239-G246 WeakPolarHBondContact CB-O 3.22Å; L239-G246 VanDerWaalsContact CD1-O 3.25Å; L239-G246 WeakPolarHBondContact CD1-O 3.4Å; L239-G246 WeakPolarHBondContact CD2-O 3.24Å; L239-G246 VanDerWaalsContact CG-O 3.28Å; L239-G246 WeakPolarHBondContact CG-O 3.46Å
240	N	43.1	Very low	56.6	Low	163 Å²	163	106 Å²	106	87%	0.872	52%	0.524	S	S	*	.			trans	-62.6	102.6	165.7	-153.9	8.3	0	0	0	105.9	N242	N240-N242 PolarHBondContact O-N 3.14Å
241	R	46.3	Very low	58.2	Low	209 Å²	209	101.2 Å²	101.2	79%	0.789	50%	0.5	S	S	*	.			trans	-68	98.2	-172.2	-83.9	175.9	160.4	176.7	-5.3	109.3	L239	L239-R241 VanDerWaalsContact C-N 3.34Å; L239-R241 PolarHBondContact O-N 3.16Å
242	N	51.2	Low	60.1	Low	91 Å²	91	94.9 Å²	94.9	49%	0.487	47%	0.467	S	S	.	.			trans	-64.8	134.6	148.5	-83.5	-4.1	0	0	0	107.3	N240 I244	N240-N242 PolarHBondContact O-N 3.14Å; N242-I244 PolarHBondContact O-N 3.1Å
243	N	59	Low	61.8	Low	142 Å²	142	89.5 Å²	89.5	76%	0.759	45%	0.448	S	S	*	.	S	Bend	trans	-60.5	-16.9	-173.1	-75.8	-20.4	0	0	0	113.7	K212	K212-N243 PolarHBondContact NZ-O 3.19Å
244	I	62.9	Low	63.3	Low	33 Å²	33	86.8 Å²	86.8	17%	0.169	44%	0.438	C	S	.	.	S	Bend	trans	-97.7	-54.6	-178.2	-71.7	77	0	0	0	112.1	K212 I214 I224 N242 L306	K212-I244 WeakPolarHBondContact CD-O 3.42Å; K212-I244 WeakPolarHBondContact CE-O 3.38Å; K212-I244 PolarHBondContact NZ-O 3Å; I214-I244 HydrophobicContact CD1-CG1 4.3Å; I214-I244 HydrophobicContact CD1-CG2 3.55Å; I224-I244 HydrophobicContact CD1-CG2 4.48Å; N242-I244 PolarHBondContact O-N 3.1Å; I244-L306 HydrophobicContact CB-CD1 4.47Å; I244-L306 HydrophobicContact CB-CD2 4.36Å; I244-L306 HydrophobicContact CD1-CD1 3.13Å; I244-L306 HydrophobicContact CD1-CD2 4.48Å; I244-L306 HydrophobicContact CD1-CG 4.41Å; I244-L306 HydrophobicContact CG1-CD1 3.52Å; I244-L306 HydrophobicContact CG1-CD2 4.08Å; I244-L306 HydrophobicContact CG1-CG 4.43Å; I244-L306 HydrophobicContact CG2-CD2 4.23Å
245	C	69.3	Low	64.7	Low	13 Å²	13	80.8 Å²	80.8	9%	0.088	42%	0.419	C	S	.	.			trans	-125.5	112.4	-177.9	-178.2	0	0	0	0	108.7	G247 C249	C245-G247 PolarHBondContact SG-O 3.07Å; C245-C249 HydrophobicContact CB-CB 4.01Å; C245-C249 WeakPolarHBondContact CB-SG 3.44Å; C245-C249 WeakPolarHBondContact SG-CB 3.34Å; C245-C249 CovalentContact SG-SG 2.02Å; C245-C249 PolarHBondContact SG-SG 3.25Å
246	G	56.9	Low	65.7	Low	11 Å²	11	82.3 Å²	82.3	11%	0.113	42%	0.424	C	S	.	.	S	Bend	trans	-85.9	-9.8	177.7	0	0	0	0	0	113.1	E226 L239	E226-G246 VanDerWaalsContact OE1-CA 3.24Å; E226-G246 WeakPolarHBondContact OE1-CA 3.45Å; E226-G246 PolarHBondContact OE1-N 2.97Å; L239-G246 WeakPolarHBondContact CB-O 3.22Å; L239-G246 VanDerWaalsContact CD1-O 3.25Å; L239-G246 WeakPolarHBondContact CD1-O 3.4Å; L239-G246 WeakPolarHBondContact CD2-O 3.24Å; L239-G246 VanDerWaalsContact CG-O 3.28Å; L239-G246 WeakPolarHBondContact CG-O 3.46Å
247	G	68.9	Low	66.8	Low	35 Å²	35	74.8 Å²	74.8	36%	0.361	40%	0.397	S	S	.	.	S	Bend	trans	-143.8	-138.7	-175.2	0	0	0	0	0	113.3	E226 C245	E226-G247 PolarHBondContact OE1-N 3.27Å; C245-G247 PolarHBondContact SG-O 3.07Å
248	Q	82.6	Confident	68.3	Low	49 Å²	49	66.7 Å²	66.7	23%	0.229	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	135.9	168.2	-70.4	-176.4	-21.5	0	0	108.7	F202 G227	F202-Q248 HydrophobicContact CD1-CB 4.16Å; F202-Q248 HydrophobicContact CD2-CB 3.83Å; F202-Q248 HydrophobicContact CE1-CB 3.75Å; F202-Q248 HydrophobicContact CE2-CB 3.37Å; F202-Q248 HydrophobicContact CG-CB 4.22Å; F202-Q248 VanDerWaalsContact CG-OE1 3.3Å; F202-Q248 HydrophobicContact CZ-CB 3.36Å; F202-Q248 WeakPolarHBondContact CZ-O 3.3Å; G227-Q248 PolarHBondContact N-O 2.75Å
249	C	89.8	Confident	70.8	Confident	3 Å²	3	59 Å²	59	2%	0.02	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	160	-177.9	-64.7	0	0	0	0	111.6	I224 F225 C245 W297	I224-C249 HydrophobicContact CG2-CB 3.8Å; F225-C249 CarbonylContact O-C 3.55Å; F225-C249 WeakPolarHBondContact O-CA 3.34Å; F225-C249 WeakPolarHBondContact O-CB 3.47Å; C245-C249 HydrophobicContact CB-CB 4.01Å; C245-C249 WeakPolarHBondContact CB-SG 3.44Å; C245-C249 WeakPolarHBondContact SG-CB 3.34Å; C245-C249 CovalentContact SG-SG 2.02Å; C245-C249 PolarHBondContact SG-SG 3.25Å; C249-W297 HydrophobicContact CB-CB 3.7Å; C249-W297 HydrophobicContact CB-CG 4.1Å; C249-W297 VanDerWaalsContact O-CB 3.32Å; C249-W297 WeakPolarHBondContact O-CB 3.29Å; C249-W297 PolarHBondContact O-N 2.96Å
250	G	91.8	Very high	73.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.9	170.3	0	0	0	0	0	111.9	I224 F225 V295	I224-G250 WeakPolarHBondContact CA-O 3.34Å; F225-G250 WeakPolarHBondContact CD1-O 3.41Å; F225-G250 VanDerWaalsContact CE1-CA 3.46Å; F225-G250 PolarHBondContact N-O 2.71Å; F225-G250 PolarHBondContact O-N 2.94Å; G250-V295 CarbonylContact C-O 3.08Å; G250-V295 WeakPolarHBondContact CA-O 3.35Å
251	I	91.1	Very high	75.6	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.051	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	129	173.3	-49.3	175.8	0	0	0	108.1	H222 I224 H253 V294 V295 W297	H222-I251 HydrophobicContact CB-CG2 4.21Å; I224-I251 HydrophobicContact CG1-CG1 4.45Å; I251-H253 VanDerWaalsContact CG2-NE2 3.28Å; I251-H253 WeakPolarHBondContact CG2-NE2 3.48Å; I251-V294 CarbonylContact O-C 3.57Å; I251-V294 VanDerWaalsContact O-CA 3.27Å; I251-V294 WeakPolarHBondContact O-CA 3.36Å; I251-V295 PolarHBondContact N-O 3.37Å; I251-V295 PolarHBondContact O-N 2.86Å; I251-W297 HydrophobicContact CD1-CE3 3.59Å; I251-W297 HydrophobicContact CD1-CZ3 3.83Å; I251-W297 HydrophobicContact CG1-CE3 3.53Å; I251-W297 HydrophobicContact CG1-CZ3 4.11Å
252	I	90.8	Very high	78.1	Confident	10 Å²	10	36.7 Å²	36.7	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.7	177.2	-55.9	177	0	0	0	108.4	V223 F225 C254 F283 F285 L286 C292	V223-I252 HydrophobicContact CB-CB 4.32Å; V223-I252 HydrophobicContact CG1-CB 4.41Å; V223-I252 HydrophobicContact CG1-CD1 4.22Å; V223-I252 PolarHBondContact O-N 3.25Å; F225-I252 HydrophobicContact CB-CD1 4.11Å; F225-I252 HydrophobicContact CD1-CD1 4.04Å; F225-I252 HydrophobicContact CD1-CG1 3.85Å; F225-I252 HydrophobicContact CG-CD1 4.48Å; I252-C254 VanDerWaalsContact CG2-SG 3.5Å; I252-F283 HydrophobicContact CB-CE2 4.4Å; I252-F283 HydrophobicContact CD1-CD1 4.37Å; I252-F283 HydrophobicContact CD1-CD2 4.17Å; I252-F283 HydrophobicContact CD1-CE1 3.87Å; I252-F283 HydrophobicContact CD1-CE2 3.68Å; I252-F283 HydrophobicContact CD1-CG 4.49Å; I252-F283 HydrophobicContact CD1-CZ 3.49Å; I252-F283 VanDerWaalsContact CD1-CZ 3.49Å; I252-F283 HydrophobicContact CG1-CE2 3.79Å; I252-F283 HydrophobicContact CG1-CZ 3.72Å; I252-F283 HydrophobicContact CG2-CD2 4.16Å; I252-F283 HydrophobicContact CG2-CE2 3.77Å; I252-F285 HydrophobicContact CD1-CZ 4.36Å; I252-L286 HydrophobicContact CG2-CD1 4.29Å; I252-C292 HydrophobicContact CG2-CB 4.02Å
253	H	87.3	Confident	80.3	Confident	46 Å²	46	32.4 Å²	32.4	21%	0.213	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117.1	167.9	-52.7	-87	0	0	0	109.3	H222 I251 C292 Q293	H222-H253 AromaticContact CD2-CE1 3.63Å; H222-H253 AromaticContact NE2-CE1 3.83Å; I251-H253 VanDerWaalsContact CG2-NE2 3.28Å; I251-H253 WeakPolarHBondContact CG2-NE2 3.48Å; H253-C292 WeakPolarHBondContact O-CB 3.31Å; H253-Q293 HydrophobicContact CB-CG 3.65Å; H253-Q293 PolarHBondContact N-O 2.87Å; H253-Q293 WeakPolarHBondContact O-CG 3.49Å; H253-Q293 PolarHBondContact O-N 3.47Å; H253-Q293 VanDerWaalsContact O-O 3.14Å
254	C	79.8	Confident	82.2	Confident	54 Å²	54	25.6 Å²	25.6	37%	0.365	17%	0.166	S	C	.	.			trans	-105.8	43.2	-179.5	-58.3	0	0	0	0	111.6	I252 L286 C292	I252-C254 VanDerWaalsContact CG2-SG 3.5Å; C254-L286 WeakPolarHBondContact SG-CD1 3.35Å; C254-C292 HydrophobicContact CB-CB 4.01Å; C254-C292 WeakPolarHBondContact CB-SG 3.46Å; C254-C292 WeakPolarHBondContact SG-CB 3.36Å; C254-C292 CovalentContact SG-SG 2.04Å; C254-C292 PolarHBondContact SG-SG 3.43Å
255	S	70.3	Confident	83.8	Confident	62 Å²	62	24 Å²	24	43%	0.434	16%	0.158	S	C	.	.			trans	-88.2	155.5	175	65.9	0	0	0	0	110.9	G257	S255-G257 PolarHBondContact O-N 3.01Å
256	V	63.5	Low	85.2	Confident	133 Å²	133	23.4 Å²	23.4	81%	0.806	15%	0.154	S	C	*	.	S	Bend	trans	-63.8	-15.8	-173.7	-178.2	0	0	0	0	113.2
257	G	68	Low	87.2	Confident	32 Å²	32	22.9 Å²	22.9	33%	0.33	15%	0.148	S	C	.	.			trans	-103.6	96.7	177.8	0	0	0	0	0	111.8	S255 T259 Q293	S255-G257 PolarHBondContact O-N 3.01Å; G257-T259 PolarHBondContact O-N 3.14Å; G257-T259 PolarHBondContact O-OG1 3.17Å; G257-Q293 PolarHBondContact O-OE1 3.48Å
258	N	75.5	Confident	88.6	Confident	14 Å²	14	22 Å²	22	8%	0.075	13%	0.134	C	C	.	.			trans	-71.7	52.4	173.9	-69.1	-23.1	0	0	0	111.9	Y464 S467 Q468	N258-Y464 HydrophobicContact CB-CD2 4.04Å; N258-Y464 HydrophobicContact CB-CE2 3.63Å; N258-Y464 VanDerWaalsContact O-CE2 3.28Å; N258-Y464 WeakPolarHBondContact O-CE2 3.36Å; N258-S467 PolarHBondContact ND2-OG 3.19Å; N258-Q468 PolarHBondContact ND2-NE2 3.19Å
259	T	91.8	Very high	89.4	Confident	17 Å²	17	19.9 Å²	19.9	10%	0.104	12%	0.124	C	C	.	.	H	α-helix	trans	-81.9	-30.7	-169.3	51.9	0	0	0	0	112	G257 V261 F262 A263 Q293 N415 G417 F419	G257-T259 PolarHBondContact O-N 3.14Å; G257-T259 PolarHBondContact O-OG1 3.17Å; T259-V261 VanDerWaalsContact C-N 3.33Å; T259-V261 PolarHBondContact O-N 3.34Å; T259-F262 PolarHBondContact O-N 3.49Å; T259-A263 WeakPolarHBondContact O-CB 3.44Å; T259-A263 PolarHBondContact O-N 2.9Å; T259-Q293 VanDerWaalsContact N-OE1 3.12Å; T259-N415 WeakPolarHBondContact CB-O 3.49Å; T259-N415 PolarHBondContact OG1-O 3.29Å; T259-G417 VanDerWaalsContact CG2-O 3.32Å; T259-G417 WeakPolarHBondContact CG2-O 3.49Å; T259-F419 HydrophobicContact CG2-CE2 4.17Å
260	E	94.8	Very high	89.7	Confident	16 Å²	16	19.7 Å²	19.7	8%	0.075	12%	0.123	C	C	.	.	H	α-helix	trans	-62.8	-40.7	177	-72.5	-71.6	176.5	0	0	111.7	A263 F264 A278 Q293 V295 N414 N415	E260-A263 WeakPolarHBondContact O-CB 3.35Å; E260-A263 PolarHBondContact O-N 3.21Å; E260-F264 WeakPolarHBondContact O-CB 3.43Å; E260-F264 PolarHBondContact O-N 2.94Å; E260-A278 HydrophobicContact CB-CB 4.25Å; E260-Q293 HydrophobicContact CB-CG 4.46Å; E260-V295 HydrophobicContact CB-CG2 4.08Å; E260-V295 HydrophobicContact CG-CG2 4.16Å; E260-N414 WeakPolarHBondContact OE1-CA 3.33Å; E260-N414 PolarHBondContact OE1-N 2.88Å; E260-N414 VanDerWaalsContact OE1-N 3.15Å; E260-N415 PolarHBondContact OE1-N 3.17Å; E260-N415 WeakPolarHBondContact OE2-CB 3.03Å; E260-N415 PolarHBondContact OE2-ND2 3.34Å
261	V	96.6	Very high	90	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.5	-50.4	178.4	-174.7	0	0	0	0	109.9	T259 A263 F264 H265 A278 V279 Q293 Y464	T259-V261 VanDerWaalsContact C-N 3.33Å; T259-V261 PolarHBondContact O-N 3.34Å; V261-A263 VanDerWaalsContact C-N 3.28Å; V261-A263 PolarHBondContact O-N 3.44Å; V261-F264 PolarHBondContact O-N 3.09Å; V261-H265 PolarHBondContact O-CD2 3.35Å; V261-H265 PolarHBondContact O-N 3.41Å; V261-H265 VanDerWaalsContact O-N 3.09Å; V261-A278 HydrophobicContact CG2-CB 4.44Å; V261-V279 VanDerWaalsContact CG2-C 3.45Å; V261-Q293 HydrophobicContact CG2-CB 3.8Å; V261-Y464 HydrophobicContact CB-CD2 3.61Å; V261-Y464 HydrophobicContact CB-CE2 3.84Å; V261-Y464 HydrophobicContact CB-CG 4.25Å; V261-Y464 HydrophobicContact CG1-CD1 4.3Å; V261-Y464 HydrophobicContact CG1-CD2 3.53Å; V261-Y464 HydrophobicContact CG1-CE2 4.1Å; V261-Y464 HydrophobicContact CG1-CG 3.65Å; V261-Y464 HydrophobicContact CG2-CD2 4.13Å
262	F	97.4	Very high	90.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.9	-43.3	177.2	-167	-80.4	0	0	0	111.8	T259 F264 H265 L266 L359 F419 L454 L458 Y464 L477 I478 I481	T259-F262 PolarHBondContact O-N 3.49Å; F262-F264 PolarHBondContact O-N 3.16Å; F262-H265 PolarHBondContact O-N 3.3Å; F262-L266 HydrophobicContact CD1-CB 4.34Å; F262-L266 HydrophobicContact CE1-CB 4.25Å; F262-L266 HydrophobicContact CE1-CD2 4.31Å; F262-L266 WeakPolarHBondContact O-CB 3.34Å; F262-L266 PolarHBondContact O-N 2.81Å; F262-L359 HydrophobicContact CD1-CD2 3.92Å; F262-L359 HydrophobicContact CE1-CD2 4.12Å; F262-F419 HydrophobicContact CB-CZ 4.26Å; F262-F419 HydrophobicContact CD1-CE1 4.08Å; F262-F419 AromaticContact CD1-CZ 3.57Å; F262-F419 HydrophobicContact CD1-CZ 3.57Å; F262-F419 HydrophobicContact CD2-CE1 4.49Å; F262-F419 HydrophobicContact CD2-CZ 4.22Å; F262-F419 AromaticContact CE1-CE1 3.91Å; F262-F419 HydrophobicContact CE1-CE1 3.91Å; F262-F419 AromaticContact CE1-CZ 3.89Å; F262-F419 HydrophobicContact CE1-CZ 3.89Å; F262-F419 HydrophobicContact CE2-CE1 4.33Å; F262-F419 HydrophobicContact CE2-CZ 4.49Å; F262-F419 HydrophobicContact CG-CE1 4.36Å; F262-F419 AromaticContact CG-CZ 3.75Å; F262-F419 HydrophobicContact CG-CZ 3.75Å; F262-F419 HydrophobicContact CZ-CE1 4.04Å; F262-F419 HydrophobicContact CZ-CZ 4.33Å; F262-L454 HydrophobicContact CZ-CD1 4.11Å; F262-L458 HydrophobicContact CD2-CD1 3.9Å; F262-L458 HydrophobicContact CD2-CD2 4.25Å; F262-L458 HydrophobicContact CE2-CD1 3.7Å; F262-Y464 WeakPolarHBondContact CB-OH 3.41Å; F262-Y464 WeakPolarHBondContact CD2-OH 3.41Å; F262-L477 HydrophobicContact CD2-CB 4.39Å; F262-L477 HydrophobicContact CD2-CD1 4.23Å; F262-L477 HydrophobicContact CE2-CB 3.85Å; F262-L477 HydrophobicContact CE2-CD1 4.47Å; F262-I478 HydrophobicContact CE2-CG1 4.35Å; F262-I478 HydrophobicContact CZ-CG1 4.48Å; F262-I481 HydrophobicContact CE1-CD1 4.31Å; F262-I481 HydrophobicContact CE1-CG1 3.77Å; F262-I481 HydrophobicContact CZ-CG1 3.8Å
263	A	97.9	Very high	90.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.2	-46.7	178.5	0	0	0	0	0	111.8	T259 E260 V261 L266 D267 F355 L359 N415	T259-A263 WeakPolarHBondContact O-CB 3.44Å; T259-A263 PolarHBondContact O-N 2.9Å; E260-A263 WeakPolarHBondContact O-CB 3.35Å; E260-A263 PolarHBondContact O-N 3.21Å; V261-A263 VanDerWaalsContact C-N 3.28Å; V261-A263 PolarHBondContact O-N 3.44Å; A263-L266 PolarHBondContact O-N 2.88Å; A263-D267 WeakPolarHBondContact O-CB 3.27Å; A263-D267 PolarHBondContact O-N 3.05Å; A263-F355 HydrophobicContact CB-CE1 4.44Å; A263-F355 HydrophobicContact CB-CZ 3.79Å; A263-F355 WeakPolarHBondContact O-CE2 3.44Å; A263-F355 WeakPolarHBondContact O-CZ 3.4Å; A263-L359 HydrophobicContact CB-CD1 3.79Å; A263-N415 HydrophobicContact CB-CB 3.42Å; A263-N415 VanDerWaalsContact CB-CB 3.42Å
264	F	98.3	Very high	91	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.2	-49.2	175.7	166.6	-113.4	0	0	0	112.5	F192 D196 M200 E260 V261 F262 L266 D267 R268 T275 P277 A278	F192-F264 HydrophobicContact CD1-CZ 4.17Å; F192-F264 AromaticContact CE1-CE1 3.78Å; F192-F264 HydrophobicContact CE1-CE1 3.78Å; F192-F264 AromaticContact CE1-CZ 3.72Å; F192-F264 HydrophobicContact CE1-CZ 3.72Å; D196-F264 HydrophobicContact CB-CZ 4.25Å; M200-F264 HydrophobicContact CE-CE1 4.36Å; M200-F264 HydrophobicContact CG-CE1 3.91Å; M200-F264 HydrophobicContact CG-CZ 4.24Å; M200-F264 HydrophobicContact SD-CE1 3.75Å; M200-F264 HydrophobicContact SD-CZ 4.17Å; E260-F264 WeakPolarHBondContact O-CB 3.43Å; E260-F264 PolarHBondContact O-N 2.94Å; V261-F264 PolarHBondContact O-N 3.09Å; F262-F264 PolarHBondContact O-N 3.16Å; F264-L266 VanDerWaalsContact C-N 3.33Å; F264-L266 PolarHBondContact O-N 2.98Å; F264-D267 PolarHBondContact O-N 3.1Å; F264-R268 HydrophobicContact CD2-CG 4.29Å; F264-R268 HydrophobicContact CE2-CG 3.85Å; F264-R268 HydrophobicContact CZ-CG 4.25Å; F264-R268 PolarHBondContact O-N 3.37Å; F264-R268 VanDerWaalsContact O-N 3.16Å; F264-T275 WeakPolarHBondContact CA-OG1 3.43Å; F264-P277 HydrophobicContact CE2-CB 4.12Å; F264-P277 HydrophobicContact CE2-CG 4.19Å; F264-P277 HydrophobicContact CZ-CB 4.14Å; F264-A278 HydrophobicContact CB-CB 4.01Å; F264-A278 VanDerWaalsContact CD1-O 3.27Å; F264-A278 WeakPolarHBondContact CD1-O 3.49Å; F264-A278 HydrophobicContact CG-CB 4.48Å
265	H	98.4	Very high	91.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.1	-36.5	179.3	-79.8	-93.1	0	0	0	112.7	F192 V261 F262 V269 S457 L458	F192-H265 AromaticContact CZ-CE1 3.82Å; F192-H265 AromaticContact CZ-ND1 3.55Å; V261-H265 PolarHBondContact O-CD2 3.35Å; V261-H265 PolarHBondContact O-N 3.41Å; V261-H265 VanDerWaalsContact O-N 3.09Å; F262-H265 PolarHBondContact O-N 3.3Å; H265-V269 WeakPolarHBondContact O-CB 3.42Å; H265-V269 VanDerWaalsContact O-CG2 3.28Å; H265-V269 WeakPolarHBondContact O-CG2 3.37Å; H265-V269 PolarHBondContact O-N 2.82Å; H265-V269 VanDerWaalsContact O-N 3.08Å; H265-S457 PolarHBondContact CE1-O 2.98Å; H265-S457 VanDerWaalsContact ND1-C 3.26Å; H265-S457 PolarHBondContact ND1-O 2.67Å; H265-S457 PolarHBondContact ND1-OG 2.85Å; H265-L458 HydrophobicContact CB-CD2 3.5Å; H265-L458 HydrophobicContact CB-CG 4.19Å
266	L	98.6	Very high	93	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.4	-46.4	175.6	178.2	65.5	0	0	0	111.6	F262 A263 F264 R268 V269 L270 F355 L358 L359 L450 L454 I481	F262-L266 HydrophobicContact CD1-CB 4.34Å; F262-L266 HydrophobicContact CE1-CB 4.25Å; F262-L266 HydrophobicContact CE1-CD2 4.31Å; F262-L266 WeakPolarHBondContact O-CB 3.34Å; F262-L266 PolarHBondContact O-N 2.81Å; A263-L266 PolarHBondContact O-N 2.88Å; F264-L266 VanDerWaalsContact C-N 3.33Å; F264-L266 PolarHBondContact O-N 2.98Å; L266-R268 VanDerWaalsContact C-N 3.33Å; L266-R268 PolarHBondContact O-N 2.82Å; L266-V269 PolarHBondContact O-N 3.38Å; L266-L270 HydrophobicContact CD1-CD1 3.78Å; L266-L270 HydrophobicContact CD1-CG 3.94Å; L266-L270 HydrophobicContact CD2-CD1 4.4Å; L266-L270 HydrophobicContact CG-CD1 3.78Å; L266-L270 HydrophobicContact CG-CG 4.28Å; L266-L270 WeakPolarHBondContact O-CB 3.45Å; L266-L270 VanDerWaalsContact O-CG 3.29Å; L266-L270 WeakPolarHBondContact O-CG 3.41Å; L266-L270 PolarHBondContact O-N 3.37Å; L266-F355 HydrophobicContact CB-CE2 4.42Å; L266-F355 HydrophobicContact CD2-CD2 4.45Å; L266-F355 HydrophobicContact CD2-CE2 4.2Å; L266-F355 HydrophobicContact CG-CE2 4.32Å; L266-L358 HydrophobicContact CD2-CB 4.43Å; L266-L359 HydrophobicContact CD2-CD1 4.12Å; L266-L359 HydrophobicContact CD2-CD2 3.77Å; L266-L359 HydrophobicContact CD2-CG 3.81Å; L266-L450 HydrophobicContact CD1-CD1 3.95Å; L266-L454 HydrophobicContact CB-CD2 4.23Å; L266-L454 HydrophobicContact CD1-CD1 4.14Å; L266-L454 HydrophobicContact CD1-CD2 4.1Å; L266-I481 HydrophobicContact CD1-CG2 4.43Å
267	D	98.6	Very high	94.6	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-56.8	-45.5	178.8	168.4	94.4	0	0	0	111.9	A263 F264 L270 G271 L272 N273 R274 T275 F355	A263-D267 WeakPolarHBondContact O-CB 3.27Å; A263-D267 PolarHBondContact O-N 3.05Å; F264-D267 PolarHBondContact O-N 3.1Å; D267-L270 PolarHBondContact O-N 3.46Å; D267-G271 PolarHBondContact O-N 2.59Å; D267-L272 PolarHBondContact O-N 2.82Å; D267-L272 VanDerWaalsContact OD1-CB 3.26Å; D267-L272 WeakPolarHBondContact OD1-CB 3.35Å; D267-N273 PolarHBondContact OD1-N 2.95Å; D267-N273 VanDerWaalsContact OD2-CA 3.27Å; D267-N273 WeakPolarHBondContact OD2-CA 3.29Å; D267-N273 PolarHBondContact OD2-N 2.75Å; D267-R274 PolarHBondContact OD1-N 2.84Å; D267-R274 PolarHBondContact OD2-N 3.29Å; D267-R274 VanDerWaalsContact OD2-N 3.16Å; D267-T275 HydrophobicContact CB-CG2 3.5Å; D267-T275 VanDerWaalsContact CB-CG2 3.5Å; D267-T275 VanDerWaalsContact CB-OG1 3.27Å; D267-T275 WeakPolarHBondContact CB-OG1 3.28Å; D267-T275 PolarHBondContact OD1-N 2.94Å; D267-T275 PolarHBondContact OD2-N 3.11Å; D267-T275 PolarHBondContact OD2-OG1 2.89Å; D267-F355 HydrophobicContact CB-CD2 4.41Å; D267-F355 HydrophobicContact CB-CE2 3.72Å; D267-F355 HydrophobicContact CB-CZ 4.26Å
268	R	98.3	Very high	96	Very high	17 Å²	17	10.2 Å²	10.2	6%	0.064	6%	0.057	C	C	.	.	H	α-helix	trans	-65.3	-46.1	174.6	-63.5	-54.4	-170	-101.8	1.3	112	W191 F192 D196 F264 L266 L270 G271 N273 T275	W191-R268 WeakPolarHBondContact CB-O 3.24Å; F192-R268 HydrophobicContact CD1-CB 4.2Å; F192-R268 HydrophobicContact CD1-CG 3.93Å; F192-R268 HydrophobicContact CE1-CB 3.98Å; F192-R268 HydrophobicContact CE1-CG 3.81Å; D196-R268 VanDerWaalsContact CG-NE 3.32Å; D196-R268 IonicContact OD1-CZ 2.68Å; D196-R268 IonicContact OD1-NE 3.74Å; D196-R268 PolarHBondContact OD1-NE 2.98Å; D196-R268 IonicContact OD1-NH2 3.72Å; D196-R268 PolarHBondContact OD1-NH2 2.71Å; D196-R268 IonicContact OD2-CZ 2.99Å; D196-R268 IonicContact OD2-NE 3.55Å; D196-R268 PolarHBondContact OD2-NE 2.94Å; D196-R268 IonicContact OD2-NH2 2.78Å; F264-R268 HydrophobicContact CD2-CG 4.29Å; F264-R268 HydrophobicContact CE2-CG 3.85Å; F264-R268 HydrophobicContact CZ-CG 4.25Å; F264-R268 PolarHBondContact O-N 3.37Å; F264-R268 VanDerWaalsContact O-N 3.16Å; L266-R268 VanDerWaalsContact C-N 3.33Å; L266-R268 PolarHBondContact O-N 2.82Å; R268-L270 PolarHBondContact O-N 3.44Å; R268-G271 PolarHBondContact O-N 3Å; R268-N273 VanDerWaalsContact CD-OD1 3.24Å; R268-N273 WeakPolarHBondContact CD-OD1 3.48Å; R268-T275 PolarHBondContact NH1-O 3.39Å; R268-T275 VanDerWaalsContact NH1-O 3.09Å; R268-T275 PolarHBondContact NH1-OG1 3.31Å; R268-T275 PolarHBondContact NH2-O 3.06Å
269	V	98.2	Very high	96.9	Very high	3 Å²	3	9.5 Å²	9.5	2%	0.018	5%	0.053	C	C	.	.	H	α-helix	trans	-58.6	-36.3	177.9	161	0	0	0	0	112.8	W191 H265 L266 G271 V444 L450 K453 L454	W191-V269 HydrophobicContact CD2-CG2 4.31Å; W191-V269 HydrophobicContact CG-CG2 4.47Å; W191-V269 HydrophobicContact CZ2-CG2 4.26Å; H265-V269 WeakPolarHBondContact O-CB 3.42Å; H265-V269 VanDerWaalsContact O-CG2 3.28Å; H265-V269 WeakPolarHBondContact O-CG2 3.37Å; H265-V269 PolarHBondContact O-N 2.82Å; H265-V269 VanDerWaalsContact O-N 3.08Å; L266-V269 PolarHBondContact O-N 3.38Å; V269-G271 VanDerWaalsContact C-N 3.34Å; V269-V444 HydrophobicContact CG1-CG1 4.21Å; V269-L450 HydrophobicContact CG1-CD1 4.1Å; V269-K453 HydrophobicContact CB-CB 4.4Å; V269-K453 HydrophobicContact CG1-CB 3.56Å; V269-K453 HydrophobicContact CG1-CD 4.19Å; V269-K453 HydrophobicContact CG2-CB 3.98Å; V269-L454 HydrophobicContact CB-CD2 4.31Å; V269-L454 HydrophobicContact CG1-CD2 4.47Å; V269-L454 HydrophobicContact CG1-CG 4.3Å; V269-L454 HydrophobicContact CG2-CD2 4.16Å
270	L	97.9	Very high	97.1	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-81.1	-12.1	176.6	-66.2	177.7	0	0	0	113.3	L266 D267 R268 L272 L354 L358 A441 V444 L445 L450	L266-L270 HydrophobicContact CD1-CD1 3.78Å; L266-L270 HydrophobicContact CD1-CG 3.94Å; L266-L270 HydrophobicContact CD2-CD1 4.4Å; L266-L270 HydrophobicContact CG-CD1 3.78Å; L266-L270 HydrophobicContact CG-CG 4.28Å; L266-L270 WeakPolarHBondContact O-CB 3.45Å; L266-L270 VanDerWaalsContact O-CG 3.29Å; L266-L270 WeakPolarHBondContact O-CG 3.41Å; L266-L270 PolarHBondContact O-N 3.37Å; D267-L270 PolarHBondContact O-N 3.46Å; R268-L270 PolarHBondContact O-N 3.44Å; L270-L272 HydrophobicContact CB-CD1 4.23Å; L270-L272 HydrophobicContact CB-CG 3.91Å; L270-L272 HydrophobicContact CD1-CD1 4.19Å; L270-L354 HydrophobicContact CD1-CD2 3.86Å; L270-L358 HydrophobicContact CD1-CD1 3.77Å; L270-A441 HydrophobicContact CB-CB 3.96Å; L270-A441 HydrophobicContact CD2-CB 4.23Å; L270-A441 WeakPolarHBondContact O-CA 3.35Å; L270-A441 WeakPolarHBondContact O-CB 3.5Å; L270-A441 PolarHBondContact O-N 2.92Å; L270-V444 HydrophobicContact CD2-CB 4.38Å; L270-V444 HydrophobicContact CD2-CG1 4.32Å; L270-L445 HydrophobicContact CD2-CD2 3.91Å; L270-L445 HydrophobicContact CD2-CG 4.43Å; L270-L450 HydrophobicContact CD2-CD1 4.3Å
271	G	96.6	Very high	97	Very high	17 Å²	17	8.5 Å²	8.5	18%	0.175	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	26.8	-179	0	0	0	0	0	113.9	D267 R268 V269	D267-G271 PolarHBondContact O-N 2.59Å; R268-G271 PolarHBondContact O-N 3Å; V269-G271 VanDerWaalsContact C-N 3.34Å
272	L	97.1	Very high	96.6	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.016	7%	0.067	C	C	.	.			trans	-81.8	-36.1	-179.8	-58.8	179.5	0	0	0	111.8	D267 L270 R274 K351 L354 F355 F412 P438 A441	D267-L272 PolarHBondContact O-N 2.82Å; D267-L272 VanDerWaalsContact OD1-CB 3.26Å; D267-L272 WeakPolarHBondContact OD1-CB 3.35Å; L270-L272 HydrophobicContact CB-CD1 4.23Å; L270-L272 HydrophobicContact CB-CG 3.91Å; L270-L272 HydrophobicContact CD1-CD1 4.19Å; L272-R274 VanDerWaalsContact C-N 3.29Å; L272-R274 WeakPolarHBondContact O-CG 3.43Å; L272-R274 PolarHBondContact O-N 3.39Å; L272-R274 PolarHBondContact O-NH1 3.48Å; L272-K351 HydrophobicContact CD2-CB 4.09Å; L272-K351 HydrophobicContact CD2-CG 3.95Å; L272-L354 HydrophobicContact CD1-CD2 4.42Å; L272-F355 HydrophobicContact CD1-CB 3.83Å; L272-F355 HydrophobicContact CD1-CD2 3.75Å; L272-F355 HydrophobicContact CD1-CG 4.17Å; L272-F412 HydrophobicContact CD1-CE2 4.4Å; L272-P438 HydrophobicContact CD2-CG 3.97Å; L272-A441 HydrophobicContact CD2-CB 4.14Å
273	N	96.6	Very high	96	Very high	75 Å²	75	13.5 Å²	13.5	40%	0.401	7%	0.068	S	C	.	.			trans	54.9	36.3	176.6	-56.8	-35.4	0	0	0	114.5	D267 R268	D267-N273 PolarHBondContact OD1-N 2.95Å; D267-N273 VanDerWaalsContact OD2-CA 3.27Å; D267-N273 WeakPolarHBondContact OD2-CA 3.29Å; D267-N273 PolarHBondContact OD2-N 2.75Å; R268-N273 VanDerWaalsContact CD-OD1 3.24Å; R268-N273 WeakPolarHBondContact CD-OD1 3.48Å
274	R	96.3	Very high	95.1	Very high	21 Å²	21	16.3 Å²	16.3	8%	0.079	10%	0.098	C	C	.	.			trans	-110.8	-20	-177.1	-64.7	-44.4	-173.2	-119.3	9.8	114.8	D267 L272 E348 H409 L410 F412 D504	D267-R274 PolarHBondContact OD1-N 2.84Å; D267-R274 PolarHBondContact OD2-N 3.29Å; D267-R274 VanDerWaalsContact OD2-N 3.16Å; L272-R274 VanDerWaalsContact C-N 3.29Å; L272-R274 WeakPolarHBondContact O-CG 3.43Å; L272-R274 PolarHBondContact O-N 3.39Å; L272-R274 PolarHBondContact O-NH1 3.48Å; R274-E348 IonicContact CZ-OE1 2.89Å; R274-E348 IonicContact CZ-OE2 3.55Å; R274-E348 IonicContact NE-OE1 2.65Å; R274-E348 PolarHBondContact NE-OE1 3.32Å; R274-E348 IonicContact NE-OE2 3.33Å; R274-E348 PolarHBondContact NE-OE2 2.85Å; R274-E348 IonicContact NH2-OE1 2.68Å; R274-E348 PolarHBondContact NH2-OE1 2.71Å; R274-E348 IonicContact NH2-OE2 3.4Å; R274-H409 PolarHBondContact NH2-CD2 3.17Å; R274-H409 VanDerWaalsContact NH2-CD2 3.28Å; R274-L410 WeakPolarHBondContact CD-O 3.16Å; R274-F412 HydrophobicContact CB-CB 4.36Å; R274-F412 HydrophobicContact CB-CD1 3.77Å; R274-F412 HydrophobicContact CB-CD2 3.67Å; R274-F412 HydrophobicContact CB-CE1 3.81Å; R274-F412 HydrophobicContact CB-CE2 3.73Å; R274-F412 HydrophobicContact CB-CG 3.67Å; R274-F412 HydrophobicContact CB-CZ 3.78Å; R274-F412 HydrophobicContact CG-CE1 4.07Å; R274-F412 HydrophobicContact CG-CE2 4.19Å; R274-F412 HydrophobicContact CG-CZ 3.88Å; R274-F412 PolarHBondContact O-N 3.2Å; R274-D504 IonicContact CZ-OD1 3.7Å; R274-D504 IonicContact CZ-OD2 3.65Å; R274-D504 IonicContact NH1-OD1 3.63Å; R274-D504 PolarHBondContact NH1-OD1 2.97Å; R274-D504 IonicContact NH1-OD2 2.79Å; R274-D504 PolarHBondContact NH1-OD2 3.46Å; R274-D504 VanDerWaalsContact NH2-CG 3.29Å; R274-D504 IonicContact NH2-OD1 2.71Å; R274-D504 PolarHBondContact NH2-OD1 3.34Å; R274-D504 IonicContact NH2-OD2 3.77Å
275	T	96.9	Very high	94.1	Very high	5 Å²	5	19.8 Å²	19.8	3%	0.031	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-76.4	154.5	174.5	60.2	0	0	0	0	112.6	F264 D267 R268 F355 F412	F264-T275 WeakPolarHBondContact CA-OG1 3.43Å; D267-T275 HydrophobicContact CB-CG2 3.5Å; D267-T275 VanDerWaalsContact CB-CG2 3.5Å; D267-T275 VanDerWaalsContact CB-OG1 3.27Å; D267-T275 WeakPolarHBondContact CB-OG1 3.28Å; D267-T275 PolarHBondContact OD1-N 2.94Å; D267-T275 PolarHBondContact OD2-N 3.11Å; D267-T275 PolarHBondContact OD2-OG1 2.89Å; R268-T275 PolarHBondContact NH1-O 3.39Å; R268-T275 VanDerWaalsContact NH1-O 3.09Å; R268-T275 PolarHBondContact NH1-OG1 3.31Å; R268-T275 PolarHBondContact NH2-O 3.06Å; T275-F355 HydrophobicContact CG2-CE1 4.15Å; T275-F355 HydrophobicContact CG2-CE2 4.31Å; T275-F355 HydrophobicContact CG2-CZ 3.64Å; T275-F412 HydrophobicContact CG2-CB 3.79Å; T275-F412 HydrophobicContact CG2-CD2 4.34Å
276	I	95.6	Very high	93	Very high	14 Å²	14	23 Å²	23	7%	0.072	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-81.9	141.5	172.9	-56.8	175.4	0	0	0	109.1	A278 V295 L296 L301 V411 T413	I276-A278 PolarHBondContact O-N 2.65Å; I276-V295 HydrophobicContact CB-CG1 3.87Å; I276-V295 HydrophobicContact CD1-CG1 4.46Å; I276-V295 HydrophobicContact CG2-CG1 3.61Å; I276-L296 HydrophobicContact CG2-CB 3.71Å; I276-L296 WeakPolarHBondContact CG2-O 3.46Å; I276-L301 HydrophobicContact CD1-CD1 3.38Å; I276-L301 HydrophobicContact CG1-CD1 4.46Å; I276-V411 HydrophobicContact CD1-CG1 4.17Å; I276-V411 HydrophobicContact CG1-CG1 3.84Å; I276-T413 HydrophobicContact CD1-CG2 3.65Å; I276-T413 HydrophobicContact CG1-CG2 4.37Å
277	P	97	Very high	90.7	Very high	12 Å²	12	30.1 Å²	30.1	8%	0.078	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-51.1	126.6	174.5	-28.3	36.3	0	0	0	112.6	L203 F264 L296	L203-P277 HydrophobicContact CD1-CB 4.36Å; L203-P277 WeakPolarHBondContact CD1-O 3.42Å; F264-P277 HydrophobicContact CE2-CB 4.12Å; F264-P277 HydrophobicContact CE2-CG 4.19Å; F264-P277 HydrophobicContact CZ-CB 4.14Å; P277-L296 HydrophobicContact CB-CB 4.38Å; P277-L296 HydrophobicContact CG-CD2 4.34Å; P277-L296 PolarHBondContact O-N 3.06Å
278	A	96.6	Very high	89	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.3	-179.3	0	0	0	0	0	110.3	E260 V261 F264 I276 V294 V295	E260-A278 HydrophobicContact CB-CB 4.25Å; V261-A278 HydrophobicContact CG2-CB 4.44Å; F264-A278 HydrophobicContact CB-CB 4.01Å; F264-A278 VanDerWaalsContact CD1-O 3.27Å; F264-A278 WeakPolarHBondContact CD1-O 3.49Å; F264-A278 HydrophobicContact CG-CB 4.48Å; I276-A278 PolarHBondContact O-N 2.65Å; A278-V294 CarbonylContact C-O 3.57Å; A278-V294 VanDerWaalsContact CA-O 3.24Å; A278-V294 WeakPolarHBondContact CA-O 3.45Å; A278-V295 HydrophobicContact CB-CG2 4.03Å
279	V	96.3	Very high	87.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	165.7	176.6	-56.9	0	0	0	0	110.3	I181 M200 L203 V261 V294 D461	I181-V279 HydrophobicContact CD1-CB 4.36Å; I181-V279 HydrophobicContact CD1-CG1 3.95Å; M200-V279 HydrophobicContact CB-CG1 3.78Å; M200-V279 HydrophobicContact CE-CG1 4.24Å; M200-V279 HydrophobicContact CG-CG1 3.78Å; L203-V279 HydrophobicContact CB-CG2 3.35Å; L203-V279 HydrophobicContact CD1-CG2 4.38Å; V261-V279 VanDerWaalsContact CG2-C 3.45Å; V279-V294 HydrophobicContact CG2-CB 4.39Å; V279-V294 PolarHBondContact N-O 3.19Å; V279-V294 PolarHBondContact O-N 2.97Å; V279-D461 WeakPolarHBondContact CA-OD2 3.24Å; V279-D461 WeakPolarHBondContact CB-OD2 3.34Å
280	S	94.3	Very high	86.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139	169.1	-163.4	0	0	0	0	110.9	A291 C292 D461 M463	S280-A291 WeakPolarHBondContact OG-CB 3.34Å; S280-C292 CarbonylContact C-O 3.57Å; S280-C292 VanDerWaalsContact CA-O 3.29Å; S280-C292 WeakPolarHBondContact CA-O 3.27Å; S280-C292 PolarHBondContact OG-O 3.39Å; S280-D461 PolarHBondContact N-OD2 2.79Å; S280-M463 VanDerWaalsContact O-CB 3.27Å; S280-M463 WeakPolarHBondContact O-CB 3.27Å
281	R	92.5	Very high	85.9	Confident	12 Å²	12	43.1 Å²	43.1	5%	0.045	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	143.3	178.3	178.3	167.9	177.3	167.5	8.5	110.8	D172 L203 G204 A206 F283 C292 V294	D172-R281 IonicContact OD2-NH2 3.97Å; L203-R281 WeakPolarHBondContact O-CD 3.26Å; L203-R281 PolarHBondContact O-NH1 3.36Å; L203-R281 VanDerWaalsContact O-NH1 3.13Å; G204-R281 WeakPolarHBondContact O-CD 3.48Å; A206-R281 VanDerWaalsContact O-CZ 3.27Å; A206-R281 PolarHBondContact O-NH1 2.91Å; A206-R281 PolarHBondContact O-NH2 3.43Å; R281-F283 HydrophobicContact CB-CE2 4.22Å; R281-F283 HydrophobicContact CB-CZ 4.34Å; R281-F283 HydrophobicContact CG-CD2 4.49Å; R281-F283 HydrophobicContact CG-CE1 4.2Å; R281-F283 HydrophobicContact CG-CE2 4.1Å; R281-F283 HydrophobicContact CG-CZ 3.96Å; R281-C292 PolarHBondContact N-O 3.41Å; R281-C292 PolarHBondContact O-N 2.92Å; R281-V294 HydrophobicContact CB-CG2 3.79Å
282	K	89	Confident	85.6	Confident	98 Å²	98	42.4 Å²	42.4	43%	0.426	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	140.8	167.7	-73	-179	-174	-174.2	0	109.3	G289 A291 M463	K282-G289 WeakPolarHBondContact CD-O 3.27Å; K282-G289 WeakPolarHBondContact CE-O 3.35Å; K282-G289 PolarHBondContact NZ-O 3.49Å; K282-A291 HydrophobicContact CG-CB 4.08Å; K282-M463 HydrophobicContact CB-CE 4.13Å; K282-M463 HydrophobicContact CD-CE 3.41Å; K282-M463 VanDerWaalsContact CD-CE 3.41Å; K282-M463 VanDerWaalsContact CE-CE 3.47Å; K282-M463 HydrophobicContact CG-CE 3.5Å; K282-M463 VanDerWaalsContact CG-CE 3.5Å
283	F	85.9	Confident	85.4	Confident	6 Å²	6	42.7 Å²	42.7	3%	0.026	24%	0.237	C	C	.	.			trans	-118.2	117.1	175.7	-67.8	-78.2	0	0	0	108.5	V208 F225 I252 R281 F285 L286 C292 V294	V208-F283 HydrophobicContact CG2-CD1 4.26Å; V208-F283 HydrophobicContact CG2-CE1 3.91Å; F225-F283 HydrophobicContact CD1-CE1 4.47Å; F225-F283 HydrophobicContact CD1-CZ 4.22Å; F225-F283 HydrophobicContact CE1-CZ 4.44Å; I252-F283 HydrophobicContact CB-CE2 4.4Å; I252-F283 HydrophobicContact CD1-CD1 4.37Å; I252-F283 HydrophobicContact CD1-CD2 4.17Å; I252-F283 HydrophobicContact CD1-CE1 3.87Å; I252-F283 HydrophobicContact CD1-CE2 3.68Å; I252-F283 HydrophobicContact CD1-CG 4.49Å; I252-F283 HydrophobicContact CD1-CZ 3.49Å; I252-F283 VanDerWaalsContact CD1-CZ 3.49Å; I252-F283 HydrophobicContact CG1-CE2 3.79Å; I252-F283 HydrophobicContact CG1-CZ 3.72Å; I252-F283 HydrophobicContact CG2-CD2 4.16Å; I252-F283 HydrophobicContact CG2-CE2 3.77Å; R281-F283 HydrophobicContact CB-CE2 4.22Å; R281-F283 HydrophobicContact CB-CZ 4.34Å; R281-F283 HydrophobicContact CG-CD2 4.49Å; R281-F283 HydrophobicContact CG-CE1 4.2Å; R281-F283 HydrophobicContact CG-CE2 4.1Å; R281-F283 HydrophobicContact CG-CZ 3.96Å; F283-F285 HydrophobicContact CB-CD1 4.06Å; F283-F285 HydrophobicContact CB-CE1 3.58Å; F283-F285 HydrophobicContact CB-CE2 4.13Å; F283-F285 HydrophobicContact CB-CZ 3.59Å; F283-F285 AromaticContact CD1-CE1 3.49Å; F283-F285 HydrophobicContact CD1-CE1 3.49Å; F283-F285 VanDerWaalsContact CD1-CE1 3.49Å; F283-F285 AromaticContact CD1-CZ 3.58Å; F283-F285 HydrophobicContact CD1-CZ 3.58Å; F283-F285 HydrophobicContact CE1-CE1 4.48Å; F283-F285 HydrophobicContact CE1-CZ 4.4Å; F283-F285 AromaticContact CG-CE1 3.86Å; F283-F285 HydrophobicContact CG-CE1 3.86Å; F283-F285 AromaticContact CG-CZ 3.69Å; F283-F285 HydrophobicContact CG-CZ 3.69Å; F283-F285 PolarHBondContact O-N 3.11Å; F283-F285 VanDerWaalsContact O-N 3.09Å; F283-L286 HydrophobicContact CB-CB 4.34Å; F283-L286 HydrophobicContact CB-CD1 3.91Å; F283-L286 HydrophobicContact CB-CG 4Å; F283-L286 HydrophobicContact CD2-CD1 4.01Å; F283-L286 HydrophobicContact CG-CD1 4.27Å; F283-L286 PolarHBondContact O-N 3.29Å; F283-C292 HydrophobicContact CD2-CB 4.37Å; F283-C292 HydrophobicContact CE2-CB 4.36Å; F283-V294 HydrophobicContact CE2-CG2 3.59Å; F283-V294 HydrophobicContact CZ-CG2 3.75Å
284	G	78.2	Confident	85.2	Confident	60 Å²	60	39.1 Å²	39.1	62%	0.619	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-20.4	-177.4	0	0	0	0	0	115
285	F	76.3	Confident	85.1	Confident	73 Å²	73	38.6 Å²	38.6	32%	0.32	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.6	177.4	60.8	-96.6	0	0	0	113.9	I211 I252 F283 N287	I211-F285 HydrophobicContact CD1-CD1 4Å; I211-F285 HydrophobicContact CD1-CD2 3.96Å; I211-F285 HydrophobicContact CD1-CE1 3.47Å; I211-F285 VanDerWaalsContact CD1-CE1 3.47Å; I211-F285 HydrophobicContact CD1-CE2 3.45Å; I211-F285 VanDerWaalsContact CD1-CE2 3.45Å; I211-F285 HydrophobicContact CD1-CG 4.23Å; I211-F285 HydrophobicContact CD1-CZ 3.19Å; I211-F285 HydrophobicContact CG1-CE1 4.45Å; I211-F285 HydrophobicContact CG1-CE2 4.47Å; I211-F285 HydrophobicContact CG1-CZ 4.02Å; I252-F285 HydrophobicContact CD1-CZ 4.36Å; F283-F285 HydrophobicContact CB-CD1 4.06Å; F283-F285 HydrophobicContact CB-CE1 3.58Å; F283-F285 HydrophobicContact CB-CE2 4.13Å; F283-F285 HydrophobicContact CB-CZ 3.59Å; F283-F285 AromaticContact CD1-CE1 3.49Å; F283-F285 HydrophobicContact CD1-CE1 3.49Å; F283-F285 VanDerWaalsContact CD1-CE1 3.49Å; F283-F285 AromaticContact CD1-CZ 3.58Å; F283-F285 HydrophobicContact CD1-CZ 3.58Å; F283-F285 HydrophobicContact CE1-CE1 4.48Å; F283-F285 HydrophobicContact CE1-CZ 4.4Å; F283-F285 AromaticContact CG-CE1 3.86Å; F283-F285 HydrophobicContact CG-CE1 3.86Å; F283-F285 AromaticContact CG-CZ 3.69Å; F283-F285 HydrophobicContact CG-CZ 3.69Å; F283-F285 PolarHBondContact O-N 3.11Å; F283-F285 VanDerWaalsContact O-N 3.09Å; F285-N287 PolarHBondContact O-N 3.37Å
286	L	75.9	Confident	85	Confident	66 Å²	66	40 Å²	40	35%	0.346	22%	0.224	S	C	.	.	S	Bend	trans	-90.3	102.3	172.7	-63	177.4	0	0	0	107.1	I252 C254 F283 E288	I252-L286 HydrophobicContact CG2-CD1 4.29Å; C254-L286 WeakPolarHBondContact SG-CD1 3.35Å; F283-L286 HydrophobicContact CB-CB 4.34Å; F283-L286 HydrophobicContact CB-CD1 3.91Å; F283-L286 HydrophobicContact CB-CG 4Å; F283-L286 HydrophobicContact CD2-CD1 4.01Å; F283-L286 HydrophobicContact CG-CD1 4.27Å; F283-L286 PolarHBondContact O-N 3.29Å; L286-E288 PolarHBondContact O-N 3.12Å
287	N	50.8	Low	84.7	Confident	150 Å²	150	40.4 Å²	40.4	80%	0.802	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	97.3	179.4	-72	-23.2	0	0	0	109.3	F285	F285-N287 PolarHBondContact O-N 3.37Å
288	E	61.7	Low	84.2	Confident	165 Å²	165	41.4 Å²	41.4	77%	0.771	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	173.2	-8.3	160.6	-100.2	164.6	-143.6	0	0	112.3	L286 Q290	L286-E288 PolarHBondContact O-N 3.12Å; E288-Q290 HydrophobicContact CB-CB 4.24Å; E288-Q290 PolarHBondContact O-N 3.3Å
289	G	63.1	Low	83.5	Confident	49 Å²	49	44.6 Å²	44.6	51%	0.505	25%	0.249	S	C	.	.			trans	63.4	8.5	-176.8	0	0	0	0	0	113.3	K282	K282-G289 WeakPolarHBondContact CD-O 3.27Å; K282-G289 WeakPolarHBondContact CE-O 3.35Å; K282-G289 PolarHBondContact NZ-O 3.49Å
290	Q	78.4	Confident	82.9	Confident	72 Å²	72	45.5 Å²	45.5	34%	0.336	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-69.6	138.1	177.1	-169.9	177.2	21.7	0	0	109.5	E288	E288-Q290 HydrophobicContact CB-CB 4.24Å; E288-Q290 PolarHBondContact O-N 3.3Å
291	A	87.7	Confident	82.4	Confident	7 Å²	7	45.7 Å²	45.7	6%	0.058	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	122.8	173.3	0	0	0	0	0	108.8	S280 K282	S280-A291 WeakPolarHBondContact OG-CB 3.34Å; K282-A291 HydrophobicContact CG-CB 4.08Å
292	C	90.8	Very high	81.7	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.014	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	152.9	174.7	-56.2	0	0	0	0	109.6	I252 H253 C254 S280 R281 F283	I252-C292 HydrophobicContact CG2-CB 4.02Å; H253-C292 WeakPolarHBondContact O-CB 3.31Å; C254-C292 HydrophobicContact CB-CB 4.01Å; C254-C292 WeakPolarHBondContact CB-SG 3.46Å; C254-C292 WeakPolarHBondContact SG-CB 3.36Å; C254-C292 CovalentContact SG-SG 2.04Å; C254-C292 PolarHBondContact SG-SG 3.43Å; S280-C292 CarbonylContact C-O 3.57Å; S280-C292 VanDerWaalsContact CA-O 3.29Å; S280-C292 WeakPolarHBondContact CA-O 3.27Å; S280-C292 PolarHBondContact OG-O 3.39Å; R281-C292 PolarHBondContact N-O 3.41Å; R281-C292 PolarHBondContact O-N 2.92Å; F283-C292 HydrophobicContact CD2-CB 4.37Å; F283-C292 HydrophobicContact CE2-CB 4.36Å
293	Q	92.9	Very high	80.6	Confident	10 Å²	10	44.4 Å²	44.4	5%	0.047	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	139.5	165.8	66.3	-175.3	11.9	0	0	109.1	H253 G257 T259 E260 V261	H253-Q293 HydrophobicContact CB-CG 3.65Å; H253-Q293 PolarHBondContact N-O 2.87Å; H253-Q293 WeakPolarHBondContact O-CG 3.49Å; H253-Q293 PolarHBondContact O-N 3.47Å; H253-Q293 VanDerWaalsContact O-O 3.14Å; G257-Q293 PolarHBondContact O-OE1 3.48Å; T259-Q293 VanDerWaalsContact N-OE1 3.12Å; E260-Q293 HydrophobicContact CB-CG 4.46Å; V261-Q293 HydrophobicContact CG2-CB 3.8Å
294	V	93.9	Very high	79.6	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.7	-174.2	-178	0	0	0	0	108.7	L203 F225 I251 A278 V279 R281 F283	L203-V294 HydrophobicContact CB-CG1 4.2Å; L203-V294 HydrophobicContact CD2-CG1 3.87Å; F225-V294 HydrophobicContact CD1-CG1 4.33Å; F225-V294 HydrophobicContact CE1-CG1 3.41Å; F225-V294 VanDerWaalsContact CE1-CG1 3.41Å; F225-V294 HydrophobicContact CZ-CG1 4.17Å; I251-V294 CarbonylContact O-C 3.57Å; I251-V294 VanDerWaalsContact O-CA 3.27Å; I251-V294 WeakPolarHBondContact O-CA 3.36Å; A278-V294 CarbonylContact C-O 3.57Å; A278-V294 VanDerWaalsContact CA-O 3.24Å; A278-V294 WeakPolarHBondContact CA-O 3.45Å; V279-V294 HydrophobicContact CG2-CB 4.39Å; V279-V294 PolarHBondContact N-O 3.19Å; V279-V294 PolarHBondContact O-N 2.97Å; R281-V294 HydrophobicContact CB-CG2 3.79Å; F283-V294 HydrophobicContact CE2-CG2 3.59Å; F283-V294 HydrophobicContact CZ-CG2 3.75Å
295	V	94.4	Very high	79	Confident	10 Å²	10	55.6 Å²	55.6	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138	-175.6	-176.9	0	0	0	0	109.3	G250 I251 E260 I276 A278 W297	G250-V295 CarbonylContact C-O 3.08Å; G250-V295 WeakPolarHBondContact CA-O 3.35Å; I251-V295 PolarHBondContact N-O 3.37Å; I251-V295 PolarHBondContact O-N 2.86Å; E260-V295 HydrophobicContact CB-CG2 4.08Å; E260-V295 HydrophobicContact CG-CG2 4.16Å; I276-V295 HydrophobicContact CB-CG1 3.87Å; I276-V295 HydrophobicContact CD1-CG1 4.46Å; I276-V295 HydrophobicContact CG2-CG1 3.61Å; A278-V295 HydrophobicContact CB-CG2 4.03Å; V295-W297 PolarHBondContact O-N 3.03Å
296	L	93.8	Very high	78.3	Confident	33 Å²	33	54.1 Å²	54.1	17%	0.173	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	133.5	177.8	-171.9	69.6	0	0	0	111.1	F202 L203 I276 P277 D298	F202-L296 HydrophobicContact CD1-CD1 4.14Å; F202-L296 HydrophobicContact CE1-CD1 4.35Å; L203-L296 HydrophobicContact CD1-CB 4.13Å; L203-L296 HydrophobicContact CD2-CB 4.37Å; L203-L296 HydrophobicContact CD2-CD1 4.09Å; L203-L296 HydrophobicContact CG-CD1 4.47Å; I276-L296 HydrophobicContact CG2-CB 3.71Å; I276-L296 WeakPolarHBondContact CG2-O 3.46Å; P277-L296 HydrophobicContact CB-CB 4.38Å; P277-L296 HydrophobicContact CG-CD2 4.34Å; P277-L296 PolarHBondContact O-N 3.06Å; L296-D298 PolarHBondContact O-N 3.25Å
297	W	89.6	Confident	77.6	Confident	23 Å²	23	52.8 Å²	52.8	9%	0.087	29%	0.287	C	S	.	.			trans	-76.6	114.7	172.4	178.7	-99.6	0	0	0	110.3	I224 C249 I251 V295 Y302 L306	I224-W297 HydrophobicContact CD1-CD2 3.86Å; I224-W297 HydrophobicContact CD1-CE3 3.39Å; I224-W297 HydrophobicContact CD1-CH2 3.93Å; I224-W297 HydrophobicContact CD1-CZ2 4.36Å; I224-W297 HydrophobicContact CD1-CZ3 3.41Å; I224-W297 VanDerWaalsContact CD1-CZ3 3.41Å; I224-W297 HydrophobicContact CG1-CE3 4.38Å; C249-W297 HydrophobicContact CB-CB 3.7Å; C249-W297 HydrophobicContact CB-CG 4.1Å; C249-W297 VanDerWaalsContact O-CB 3.32Å; C249-W297 WeakPolarHBondContact O-CB 3.29Å; C249-W297 PolarHBondContact O-N 2.96Å; I251-W297 HydrophobicContact CD1-CE3 3.59Å; I251-W297 HydrophobicContact CD1-CZ3 3.83Å; I251-W297 HydrophobicContact CG1-CE3 3.53Å; I251-W297 HydrophobicContact CG1-CZ3 4.11Å; V295-W297 PolarHBondContact O-N 3.03Å; W297-Y302 HydrophobicContact CE3-CE2 4.15Å; W297-Y302 HydrophobicContact CH2-CD1 4.29Å; W297-Y302 AromaticContact CH2-CD2 3.52Å; W297-Y302 HydrophobicContact CH2-CD2 3.52Å; W297-Y302 HydrophobicContact CH2-CE1 4.2Å; W297-Y302 AromaticContact CH2-CE2 3.4Å; W297-Y302 HydrophobicContact CH2-CE2 3.4Å; W297-Y302 VanDerWaalsContact CH2-CE2 3.4Å; W297-Y302 AromaticContact CH2-CG 3.98Å; W297-Y302 HydrophobicContact CH2-CG 3.98Å; W297-Y302 AromaticContact CH2-CZ 3.77Å; W297-Y302 AromaticContact CZ2-CD2 3.71Å; W297-Y302 HydrophobicContact CZ2-CD2 3.71Å; W297-Y302 AromaticContact CZ2-CE2 3.97Å; W297-Y302 HydrophobicContact CZ2-CE2 3.97Å; W297-Y302 HydrophobicContact CZ2-CG 4.27Å; W297-Y302 HydrophobicContact CZ3-CD2 4.12Å; W297-Y302 HydrophobicContact CZ3-CE1 4.49Å; W297-Y302 AromaticContact CZ3-CE2 3.52Å; W297-Y302 HydrophobicContact CZ3-CE2 3.52Å; W297-Y302 AromaticContact CZ3-CZ 3.74Å; W297-L306 HydrophobicContact CH2-CD2 3.57Å; W297-L306 HydrophobicContact CZ2-CD2 3.3Å
298	D	87.1	Confident	78.1	Confident	34 Å²	34	48.9 Å²	48.9	18%	0.182	28%	0.276	C	S	.	.			trans	-109.2	106	174.8	-174.8	-10.1	0	0	0	109.8	L296 S300 L301 Y302 R403	L296-D298 PolarHBondContact O-N 3.25Å; D298-S300 VanDerWaalsContact CG-OG 3.28Å; D298-S300 PolarHBondContact O-N 3.37Å; D298-S300 WeakPolarHBondContact OD1-CB 3.46Å; D298-S300 PolarHBondContact OD1-N 2.92Å; D298-S300 PolarHBondContact OD1-OG 3.42Å; D298-S300 PolarHBondContact OD2-OG 2.83Å; D298-L301 HydrophobicContact CB-CD1 3.81Å; D298-L301 HydrophobicContact CB-CG 4.02Å; D298-L301 PolarHBondContact O-N 3.28Å; D298-Y302 WeakPolarHBondContact O-CD2 3.35Å; D298-R403 IonicContact OD2-CZ 3.68Å; D298-R403 IonicContact OD2-NE 2.77Å; D298-R403 PolarHBondContact OD2-NE 2.02Å; D298-R403 IonicContact OD2-NH2 3.85Å; D298-R403 PolarHBondContact OD2-NH2 2.98Å; D298-R403 VanDerWaalsContact OD2-NH2 3.11Å
299	V	81.8	Confident	78.5	Confident	67 Å²	67	41.3 Å²	41.3	41%	0.406	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-59.8	-31.7	-179.2	178.2	0	0	0	0	111.5	L301 Y302	V299-L301 PolarHBondContact O-N 2.8Å; V299-L301 VanDerWaalsContact O-N 3.11Å; V299-Y302 PolarHBondContact O-N 2.8Å
300	S	82.9	Confident	79.1	Confident	19 Å²	19	39.9 Å²	39.9	13%	0.133	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-69	-10.8	-175.6	71.7	0	0	0	0	114.1	D298 Y302 R403 E404	D298-S300 VanDerWaalsContact CG-OG 3.28Å; D298-S300 PolarHBondContact O-N 3.37Å; D298-S300 WeakPolarHBondContact OD1-CB 3.46Å; D298-S300 PolarHBondContact OD1-N 2.92Å; D298-S300 PolarHBondContact OD1-OG 3.42Å; D298-S300 PolarHBondContact OD2-OG 2.83Å; S300-Y302 VanDerWaalsContact C-N 3.34Å; S300-R403 WeakPolarHBondContact OG-CD 2.94Å; S300-R403 WeakPolarHBondContact OG-CG 3.43Å; S300-E404 PolarHBondContact O-N 2.97Å
301	L	83.8	Confident	79.1	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.016	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-81.3	-16.8	172.8	-59.3	175.1	0	0	0	112.2	I276 D298 V299 P303 P310 A311 V401 R403 V411 T413	I276-L301 HydrophobicContact CD1-CD1 3.38Å; I276-L301 HydrophobicContact CG1-CD1 4.46Å; D298-L301 HydrophobicContact CB-CD1 3.81Å; D298-L301 HydrophobicContact CB-CG 4.02Å; D298-L301 PolarHBondContact O-N 3.28Å; V299-L301 PolarHBondContact O-N 2.8Å; V299-L301 VanDerWaalsContact O-N 3.11Å; L301-P303 WeakPolarHBondContact O-CD 3.4Å; L301-P310 HydrophobicContact CB-CB 4.44Å; L301-P310 CarbonylContact O-C 3.59Å; L301-P310 WeakPolarHBondContact O-CA 3.45Å; L301-A311 PolarHBondContact O-N 3.35Å; L301-V401 HydrophobicContact CD2-CG1 3.85Å; L301-R403 HydrophobicContact CD2-CG 3.75Å; L301-V411 HydrophobicContact CD1-CG1 4.46Å; L301-V411 HydrophobicContact CD2-CB 4.1Å; L301-V411 HydrophobicContact CD2-CG1 4.13Å; L301-V411 HydrophobicContact CD2-CG2 3.92Å; L301-T413 HydrophobicContact CD1-CG2 4.29Å
302	Y	77.5	Confident	78.9	Confident	30 Å²	30	40.1 Å²	40.1	12%	0.118	23%	0.231	C	C	.	.			trans	-120.4	70.8	-174.6	-55.9	-89.5	0	0	0	110.4	W297 D298 V299 S300 K304 G309 P310	W297-Y302 HydrophobicContact CE3-CE2 4.15Å; W297-Y302 HydrophobicContact CH2-CD1 4.29Å; W297-Y302 AromaticContact CH2-CD2 3.52Å; W297-Y302 HydrophobicContact CH2-CD2 3.52Å; W297-Y302 HydrophobicContact CH2-CE1 4.2Å; W297-Y302 AromaticContact CH2-CE2 3.4Å; W297-Y302 HydrophobicContact CH2-CE2 3.4Å; W297-Y302 VanDerWaalsContact CH2-CE2 3.4Å; W297-Y302 AromaticContact CH2-CG 3.98Å; W297-Y302 HydrophobicContact CH2-CG 3.98Å; W297-Y302 AromaticContact CH2-CZ 3.77Å; W297-Y302 AromaticContact CZ2-CD2 3.71Å; W297-Y302 HydrophobicContact CZ2-CD2 3.71Å; W297-Y302 AromaticContact CZ2-CE2 3.97Å; W297-Y302 HydrophobicContact CZ2-CE2 3.97Å; W297-Y302 HydrophobicContact CZ2-CG 4.27Å; W297-Y302 HydrophobicContact CZ3-CD2 4.12Å; W297-Y302 HydrophobicContact CZ3-CE1 4.49Å; W297-Y302 AromaticContact CZ3-CE2 3.52Å; W297-Y302 HydrophobicContact CZ3-CE2 3.52Å; W297-Y302 AromaticContact CZ3-CZ 3.74Å; D298-Y302 WeakPolarHBondContact O-CD2 3.35Å; V299-Y302 PolarHBondContact O-N 2.8Å; S300-Y302 VanDerWaalsContact C-N 3.34Å; Y302-K304 PolarHBondContact O-N 2.88Å; Y302-G309 VanDerWaalsContact CD1-C 3.47Å; Y302-P310 HydrophobicContact CD1-CB 4.45Å; Y302-P310 HydrophobicContact CE1-CB 4.11Å; Y302-P310 HydrophobicContact CE1-CG 4.48Å
303	P	65.3	Low	78.7	Confident	53 Å²	53	41.1 Å²	41.1	34%	0.344	24%	0.237	S	C	.	.			trans	-71.5	-16.2	-177.3	28.9	-36.2	0	0	0	114.1	L301 A311 E404	L301-P303 WeakPolarHBondContact O-CD 3.4Å; P303-A311 HydrophobicContact CG-CB 3.79Å; P303-E404 HydrophobicContact CB-CB 4.02Å; P303-E404 VanDerWaalsContact CB-CD 3.46Å; P303-E404 HydrophobicContact CB-CG 3.83Å
304	K	66.7	Low	78.6	Confident	166 Å²	166	51.2 Å²	51.2	72%	0.722	28%	0.275	S	S	*	.	S	Bend	trans	-102.8	-172.3	175.4	-66.5	-175.1	178.9	179.8	0	110.6	Y302 L306 A308	Y302-K304 PolarHBondContact O-N 2.88Å; K304-L306 PolarHBondContact O-N 3.46Å; K304-A308 HydrophobicContact CB-CB 4.26Å
305	D	63.8	Low	78.5	Confident	136 Å²	136	51.5 Å²	51.5	73%	0.727	28%	0.276	S	S	*	.			trans	-51.8	137.1	166.3	-69.1	-35.5	0	0	0	111	A307 A308	D305-A307 PolarHBondContact O-N 3.33Å; D305-A307 VanDerWaalsContact O-N 3.1Å; D305-A308 WeakPolarHBondContact O-CB 3.27Å; D305-A308 PolarHBondContact O-N 3.09Å
306	L	62.7	Low	78.4	Confident	42 Å²	42	51.8 Å²	51.8	22%	0.22	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-62.9	-25.1	-172	-58.4	108	0	0	0	114	I214 I244 W297 K304 A308 G309	I214-L306 HydrophobicContact CD1-CD2 4.22Å; I214-L306 HydrophobicContact CG2-CB 4.24Å; I244-L306 HydrophobicContact CB-CD1 4.47Å; I244-L306 HydrophobicContact CB-CD2 4.36Å; I244-L306 HydrophobicContact CD1-CD1 3.13Å; I244-L306 HydrophobicContact CD1-CD2 4.48Å; I244-L306 HydrophobicContact CD1-CG 4.41Å; I244-L306 HydrophobicContact CG1-CD1 3.52Å; I244-L306 HydrophobicContact CG1-CD2 4.08Å; I244-L306 HydrophobicContact CG1-CG 4.43Å; I244-L306 HydrophobicContact CG2-CD2 4.23Å; W297-L306 HydrophobicContact CH2-CD2 3.57Å; W297-L306 HydrophobicContact CZ2-CD2 3.3Å; K304-L306 PolarHBondContact O-N 3.46Å; L306-A308 PolarHBondContact O-N 3.16Å; L306-G309 PolarHBondContact O-N 3.44Å
307	A	61.3	Low	78.4	Confident	38 Å²	38	51 Å²	51	31%	0.314	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-62.1	-26.8	174	0	0	0	0	0	112.1	L217 D305 G309	L217-A307 HydrophobicContact CD1-CB 4.01Å; D305-A307 PolarHBondContact O-N 3.33Å; D305-A307 VanDerWaalsContact O-N 3.1Å; A307-G309 VanDerWaalsContact C-N 3.27Å; A307-G309 PolarHBondContact O-N 3.25Å
308	A	61.3	Low	78.6	Confident	68 Å²	68	54.3 Å²	54.3	56%	0.562	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-75.6	-11.5	179.8	0	0	0	0	0	113.6	K304 D305 L306	K304-A308 HydrophobicContact CB-CB 4.26Å; D305-A308 WeakPolarHBondContact O-CB 3.27Å; D305-A308 PolarHBondContact O-N 3.09Å; L306-A308 PolarHBondContact O-N 3.16Å
309	G	69.1	Low	78.9	Confident	5 Å²	5	56.9 Å²	56.9	5%	0.052	30%	0.299	C	S	.	.			trans	77.2	-173.8	-179.7	0	0	0	0	0	114	Y302 L306 A307	Y302-G309 VanDerWaalsContact CD1-C 3.47Å; L306-G309 PolarHBondContact O-N 3.44Å; A307-G309 VanDerWaalsContact C-N 3.27Å; A307-G309 PolarHBondContact O-N 3.25Å
310	P	76.3	Confident	79.5	Confident	19 Å²	19	53.7 Å²	53.7	12%	0.123	28%	0.28	C	S	.	.	S	Bend	trans	-69.8	156.6	-175.8	29.4	-34	0	0	0	112	L301 Y302 T312 V401	L301-P310 HydrophobicContact CB-CB 4.44Å; L301-P310 CarbonylContact O-C 3.59Å; L301-P310 WeakPolarHBondContact O-CA 3.45Å; Y302-P310 HydrophobicContact CD1-CB 4.45Å; Y302-P310 HydrophobicContact CE1-CB 4.11Å; Y302-P310 HydrophobicContact CE1-CG 4.48Å; P310-T312 PolarHBondContact O-N 3.45Å; P310-V401 HydrophobicContact CB-CG1 4.04Å; P310-V401 HydrophobicContact CB-CG2 4.14Å; P310-V401 HydrophobicContact CG-CG2 4.06Å
311	A	79.1	Confident	80.1	Confident	19 Å²	19	54.5 Å²	54.5	16%	0.157	28%	0.281	C	S	.	.			trans	-64.1	107.5	173	0	0	0	0	0	110.4	L301 P303 V401 H402	L301-A311 PolarHBondContact O-N 3.35Å; P303-A311 HydrophobicContact CG-CB 3.79Å; A311-V401 WeakPolarHBondContact O-CA 3.39Å; A311-H402 PolarHBondContact O-N 3.36Å
312	T	83.5	Confident	80.5	Confident	66 Å²	66	57.9 Å²	57.9	41%	0.405	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-104.6	137.5	178.9	53.6	0	0	0	0	112.1	P310 R314 I400 V401	P310-T312 PolarHBondContact O-N 3.45Å; T312-R314 PolarHBondContact O-N 2.94Å; T312-I400 CarbonylContact C-O 3.24Å; T312-I400 WeakPolarHBondContact CA-O 3.44Å; T312-V401 HydrophobicContact CG2-CG2 3.97Å
313	V	86.6	Confident	81.2	Confident	22 Å²	22	56.4 Å²	56.4	13%	0.133	29%	0.293	C	S	.	.			trans	-71.8	120.6	167.6	-173.2	0	0	0	0	107.9	M315 I344 I400 H402	V313-M315 HydrophobicContact CG1-CB 4.47Å; V313-M315 HydrophobicContact CG1-CG 4.44Å; V313-M315 HydrophobicContact CG1-SD 4.12Å; V313-I344 HydrophobicContact CG2-CD1 4.25Å; V313-I344 HydrophobicContact CG2-CG1 4.32Å; V313-I400 HydrophobicContact CB-CB 4.2Å; V313-I400 HydrophobicContact CB-CG2 3.78Å; V313-I400 HydrophobicContact CG2-CG2 3.86Å; V313-I400 PolarHBondContact N-O 3.09Å; V313-H402 VanDerWaalsContact CG2-CD2 3.47Å; V313-H402 WeakPolarHBondContact CG2-CD2 3.33Å
314	R	89.3	Confident	82.6	Confident	222 Å²	222	54.2 Å²	54.2	84%	0.838	28%	0.279	S	S	*	.			trans	-86.5	112.7	170.9	-66.7	-174	176.8	-169.5	-3.6	108.5	T312	T312-R314 PolarHBondContact O-N 2.94Å
315	M	92.1	Very high	83.8	Confident	7 Å²	7	50.6 Å²	50.6	3%	0.034	27%	0.27	C	S	.	.			trans	-153.1	151	174.3	71.1	-169.8	-40.7	0	0	111.4	V313 E319 W349 Q396 L397	V313-M315 HydrophobicContact CG1-CB 4.47Å; V313-M315 HydrophobicContact CG1-CG 4.44Å; V313-M315 HydrophobicContact CG1-SD 4.12Å; M315-E319 VanDerWaalsContact CA-OE2 3.29Å; M315-E319 WeakPolarHBondContact CA-OE2 3.43Å; M315-E319 HydrophobicContact CB-CB 4.25Å; M315-E319 HydrophobicContact CE-CB 4.25Å; M315-W349 HydrophobicContact CE-CZ2 4.15Å; M315-W349 HydrophobicContact SD-CH2 3.44Å; M315-W349 WeakPolarHBondContact SD-CH2 3.39Å; M315-W349 HydrophobicContact SD-CZ2 3.57Å; M315-W349 VanDerWaalsContact SD-CZ2 3.57Å; M315-Q396 PolarHBondContact O-OE1 2.71Å; M315-L397 HydrophobicContact CG-CB 4.29Å; M315-L397 HydrophobicContact CG-CD1 3.78Å; M315-L397 HydrophobicContact CG-CG 4.05Å; M315-L397 PolarHBondContact O-N 2.94Å; M315-L397 HydrophobicContact SD-CD1 4.13Å
316	T	93.6	Very high	85.1	Confident	15 Å²	15	49.3 Å²	49.3	9%	0.092	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-84.8	162.6	174.3	57.8	0	0	0	0	111.9	K318 E319 Y320 E393 I395	T316-K318 PolarHBondContact O-N 2.74Å; T316-E319 PolarHBondContact N-OE2 3.38Å; T316-E319 PolarHBondContact O-N 3.19Å; T316-E319 VanDerWaalsContact OG1-CG 3.27Å; T316-E319 WeakPolarHBondContact OG1-CG 3.47Å; T316-E319 PolarHBondContact OG1-N 3.36Å; T316-E319 PolarHBondContact OG1-OE2 3.06Å; T316-Y320 PolarHBondContact O-N 3.45Å; T316-E393 WeakPolarHBondContact CB-O 3.28Å; T316-I395 CarbonylContact C-O 3.53Å; T316-I395 VanDerWaalsContact CA-O 3.3Å; T316-I395 WeakPolarHBondContact CA-O 3.48Å
317	W	93.9	Very high	86.4	Confident	17 Å²	17	51.5 Å²	51.5	6%	0.064	27%	0.265	C	S	.	.	H	α-helix	trans	-52.9	-41.6	169.7	-177.9	-108.3	0	0	0	111.9	Y320 Q321 L365 Q392 I395 L397 R429 E432	W317-Y320 HydrophobicContact CD2-CD1 4.41Å; W317-Y320 AromaticContact CE3-CD1 3.86Å; W317-Y320 HydrophobicContact CE3-CD1 3.86Å; W317-Y320 HydrophobicContact CE3-CE1 4.28Å; W317-Y320 HydrophobicContact CH2-CD1 4.25Å; W317-Y320 AromaticContact CH2-CE1 3.92Å; W317-Y320 HydrophobicContact CH2-CE1 3.92Å; W317-Y320 AromaticContact CZ3-CD1 3.77Å; W317-Y320 HydrophobicContact CZ3-CD1 3.77Å; W317-Y320 AromaticContact CZ3-CE1 3.69Å; W317-Y320 HydrophobicContact CZ3-CE1 3.69Å; W317-Y320 WeakPolarHBondContact O-CB 3.18Å; W317-Y320 PolarHBondContact O-N 2.81Å; W317-Q321 HydrophobicContact CD2-CG 4.36Å; W317-Q321 HydrophobicContact CZ2-CG 4.16Å; W317-Q321 WeakPolarHBondContact O-CG 3.29Å; W317-Q321 PolarHBondContact O-N 2.9Å; W317-L365 HydrophobicContact CZ3-CB 4.24Å; W317-L365 WeakPolarHBondContact CZ3-O 3.24Å; W317-Q392 VanDerWaalsContact CB-O 3.27Å; W317-Q392 WeakPolarHBondContact CB-O 3.36Å; W317-I395 PolarHBondContact N-O 2.89Å; W317-L397 HydrophobicContact CE3-CD2 4.05Å; W317-R429 HydrophobicContact CH2-CG 3.77Å; W317-R429 WeakPolarHBondContact CH2-O 3.36Å; W317-R429 HydrophobicContact CZ2-CG 3.9Å; W317-R429 HydrophobicContact CZ3-CG 4.48Å; W317-E432 HydrophobicContact CH2-CB 4.31Å; W317-E432 HydrophobicContact CZ2-CB 4.05Å; W317-E432 WeakPolarHBondContact CZ2-OE2 3.42Å
318	K	93.1	Very high	87.8	Confident	93 Å²	93	49.7 Å²	49.7	40%	0.404	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-47.5	176.2	-175.9	-179.3	-166.7	149.1	0	112.6	T316 Y320 Q321 N322 E393	T316-K318 PolarHBondContact O-N 2.74Å; K318-Y320 VanDerWaalsContact C-N 3.3Å; K318-Y320 PolarHBondContact O-N 3.19Å; K318-Q321 PolarHBondContact O-N 2.72Å; K318-N322 WeakPolarHBondContact O-CB 3.28Å; K318-N322 PolarHBondContact O-N 3.49Å; K318-N322 PolarHBondContact O-ND2 2.82Å; K318-E393 HydrophobicContact CB-CB 4.07Å; K318-E393 WeakPolarHBondContact CB-O 3.31Å; K318-E393 HydrophobicContact CD-CB 4.34Å; K318-E393 WeakPolarHBondContact CD-OE2 3.33Å; K318-E393 WeakPolarHBondContact CE-OE2 3.24Å; K318-E393 PolarHBondContact N-O 3.37Å; K318-E393 IonicContact NZ-OE2 2.79Å; K318-E393 PolarHBondContact NZ-OE2 3.34Å
319	E	93.4	Very high	89	Confident	88 Å²	88	48.6 Å²	48.6	41%	0.411	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-37.9	177.9	-72.5	163.5	149.5	0	0	111.8	M315 T316 N322 S323	M315-E319 VanDerWaalsContact CA-OE2 3.29Å; M315-E319 WeakPolarHBondContact CA-OE2 3.43Å; M315-E319 HydrophobicContact CB-CB 4.25Å; M315-E319 HydrophobicContact CE-CB 4.25Å; T316-E319 PolarHBondContact N-OE2 3.38Å; T316-E319 PolarHBondContact O-N 3.19Å; T316-E319 VanDerWaalsContact OG1-CG 3.27Å; T316-E319 WeakPolarHBondContact OG1-CG 3.47Å; T316-E319 PolarHBondContact OG1-N 3.36Å; T316-E319 PolarHBondContact OG1-OE2 3.06Å; E319-N322 PolarHBondContact O-N 2.79Å; E319-S323 WeakPolarHBondContact O-CB 3.4Å; E319-S323 PolarHBondContact O-N 2.79Å
320	Y	94.9	Very high	89.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-51.2	173.1	164.5	-112.4	0	0	0	112	T316 W317 K318 N322 S323 L324 W349 L365 L397	T316-Y320 PolarHBondContact O-N 3.45Å; W317-Y320 HydrophobicContact CD2-CD1 4.41Å; W317-Y320 AromaticContact CE3-CD1 3.86Å; W317-Y320 HydrophobicContact CE3-CD1 3.86Å; W317-Y320 HydrophobicContact CE3-CE1 4.28Å; W317-Y320 HydrophobicContact CH2-CD1 4.25Å; W317-Y320 AromaticContact CH2-CE1 3.92Å; W317-Y320 HydrophobicContact CH2-CE1 3.92Å; W317-Y320 AromaticContact CZ3-CD1 3.77Å; W317-Y320 HydrophobicContact CZ3-CD1 3.77Å; W317-Y320 AromaticContact CZ3-CE1 3.69Å; W317-Y320 HydrophobicContact CZ3-CE1 3.69Å; W317-Y320 WeakPolarHBondContact O-CB 3.18Å; W317-Y320 PolarHBondContact O-N 2.81Å; K318-Y320 VanDerWaalsContact C-N 3.3Å; K318-Y320 PolarHBondContact O-N 3.19Å; Y320-N322 VanDerWaalsContact C-N 3.28Å; Y320-N322 PolarHBondContact O-N 2.95Å; Y320-S323 WeakPolarHBondContact O-CA 3.33Å; Y320-S323 WeakPolarHBondContact O-CB 3.17Å; Y320-S323 PolarHBondContact O-N 2.87Å; Y320-L324 HydrophobicContact CD2-CG 4.4Å; Y320-L324 HydrophobicContact CE1-CD1 3.89Å; Y320-L324 HydrophobicContact CE2-CD1 3.97Å; Y320-L324 HydrophobicContact CE2-CD2 4.03Å; Y320-L324 HydrophobicContact CE2-CG 3.95Å; Y320-L324 PolarHBondContact O-N 2.98Å; Y320-W349 AromaticContact CD2-CD2 3.83Å; Y320-W349 HydrophobicContact CD2-CD2 3.83Å; Y320-W349 AromaticContact CD2-CE3 3.73Å; Y320-W349 HydrophobicContact CD2-CE3 3.73Å; Y320-W349 HydrophobicContact CD2-CG 4.42Å; Y320-W349 HydrophobicContact CD2-CH2 4.19Å; Y320-W349 HydrophobicContact CD2-CZ2 4.31Å; Y320-W349 AromaticContact CD2-CZ3 3.91Å; Y320-W349 HydrophobicContact CD2-CZ3 3.91Å; Y320-W349 HydrophobicContact CE2-CB 4.12Å; Y320-W349 AromaticContact CE2-CD2 3.57Å; Y320-W349 HydrophobicContact CE2-CD2 3.57Å; Y320-W349 AromaticContact CE2-CE3 3.38Å; Y320-W349 HydrophobicContact CE2-CE3 3.38Å; Y320-W349 AromaticContact CE2-CG 3.9Å; Y320-W349 HydrophobicContact CE2-CG 3.9Å; Y320-W349 AromaticContact CE2-CZ3 3.97Å; Y320-W349 HydrophobicContact CE2-CZ3 3.97Å; Y320-L365 HydrophobicContact CE1-CD2 4.38Å; Y320-L365 HydrophobicContact CE2-CD2 4.33Å; Y320-L397 HydrophobicContact CD2-CD1 4.37Å; Y320-L397 HydrophobicContact CG-CD1 3.97Å
321	Q	94.5	Very high	90	Very high	36 Å²	36	58.8 Å²	58.8	17%	0.168	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-35.7	177.7	-70.7	-62.4	-31.4	0	0	112.3	W317 K318 L324 T325 E432	W317-Q321 HydrophobicContact CD2-CG 4.36Å; W317-Q321 HydrophobicContact CZ2-CG 4.16Å; W317-Q321 WeakPolarHBondContact O-CG 3.29Å; W317-Q321 PolarHBondContact O-N 2.9Å; K318-Q321 PolarHBondContact O-N 2.72Å; Q321-L324 PolarHBondContact O-N 3.19Å; Q321-T325 WeakPolarHBondContact O-CB 3.37Å; Q321-T325 PolarHBondContact O-N 2.74Å; Q321-T325 PolarHBondContact O-OG1 3.16Å; Q321-E432 PolarHBondContact NE2-O 2.74Å
322	N	92.5	Very high	90.1	Very high	73 Å²	73	62.9 Å²	62.9	39%	0.39	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-43.7	171.4	-73.6	-19.5	0	0	0	111.4	K318 E319 Y320 L324 T325 Q326	K318-N322 WeakPolarHBondContact O-CB 3.28Å; K318-N322 PolarHBondContact O-N 3.49Å; K318-N322 PolarHBondContact O-ND2 2.82Å; E319-N322 PolarHBondContact O-N 2.79Å; Y320-N322 VanDerWaalsContact C-N 3.28Å; Y320-N322 PolarHBondContact O-N 2.95Å; N322-L324 VanDerWaalsContact C-N 3.32Å; N322-L324 PolarHBondContact O-N 2.86Å; N322-T325 PolarHBondContact O-N 2.71Å; N322-T325 VanDerWaalsContact O-N 3.13Å; N322-Q326 WeakPolarHBondContact O-CB 3.38Å; N322-Q326 WeakPolarHBondContact O-CG 3.49Å; N322-Q326 PolarHBondContact O-N 3.41Å
323	S	92.9	Very high	90	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-41.2	177.1	-175.1	0	0	0	0	112.4	E319 Y320 R327 C328	E319-S323 WeakPolarHBondContact O-CB 3.4Å; E319-S323 PolarHBondContact O-N 2.79Å; Y320-S323 WeakPolarHBondContact O-CA 3.33Å; Y320-S323 WeakPolarHBondContact O-CB 3.17Å; Y320-S323 PolarHBondContact O-N 2.87Å; S323-R327 PolarHBondContact O-N 2.85Å; S323-C328 VanDerWaalsContact CA-SG 3.57Å; S323-C328 PolarHBondContact O-N 2.71Å; S323-C328 PolarHBondContact O-SG 2.94Å; S323-C328 PolarHBondContact OG-SG 3.27Å; S323-C328 VanDerWaalsContact OG-SG 3.37Å
324	L	94.1	Very high	89.8	Confident	7 Å²	7	69 Å²	69	4%	0.037	33%	0.326	C	S	.	.	H	α-helix	trans	-62.8	-44.2	172.9	-65.4	-177.2	0	0	0	112.2	Y320 Q321 N322 R327 H346 W349 I434	Y320-L324 HydrophobicContact CD2-CG 4.4Å; Y320-L324 HydrophobicContact CE1-CD1 3.89Å; Y320-L324 HydrophobicContact CE2-CD1 3.97Å; Y320-L324 HydrophobicContact CE2-CD2 4.03Å; Y320-L324 HydrophobicContact CE2-CG 3.95Å; Y320-L324 PolarHBondContact O-N 2.98Å; Q321-L324 PolarHBondContact O-N 3.19Å; N322-L324 VanDerWaalsContact C-N 3.32Å; N322-L324 PolarHBondContact O-N 2.86Å; L324-R327 PolarHBondContact O-N 2.82Å; L324-H346 PolarHBondContact O-CE1 3.14Å; L324-W349 HydrophobicContact CD2-CB 3.6Å; L324-W349 HydrophobicContact CD2-CG 3.99Å; L324-I434 HydrophobicContact CD1-CD1 3.96Å; L324-I434 HydrophobicContact CD2-CD1 3.89Å
325	T	92.7	Very high	89.4	Confident	89 Å²	89	60.2 Å²	60.2	55%	0.546	30%	0.298	S	S	.	.	H	α-helix	trans	-66.1	-42	-178.8	-61	0	0	0	0	111.8	Q321 N322 R327	Q321-T325 WeakPolarHBondContact O-CB 3.37Å; Q321-T325 PolarHBondContact O-N 2.74Å; Q321-T325 PolarHBondContact O-OG1 3.16Å; N322-T325 PolarHBondContact O-N 2.71Å; N322-T325 VanDerWaalsContact O-N 3.13Å; T325-R327 VanDerWaalsContact C-N 3.27Å; T325-R327 PolarHBondContact O-N 3.45Å
326	Q	90.1	Very high	88.9	Confident	109 Å²	109	68.4 Å²	68.4	51%	0.509	33%	0.333	S	S	.	.	H	α-helix	trans	-78.1	-9.5	178.5	-63.3	-57.4	-46.1	0	0	113.5	N322 C328	N322-Q326 WeakPolarHBondContact O-CB 3.38Å; N322-Q326 WeakPolarHBondContact O-CG 3.49Å; N322-Q326 PolarHBondContact O-N 3.41Å; Q326-C328 VanDerWaalsContact C-N 3.31Å; Q326-C328 PolarHBondContact O-N 3.3Å
327	R	91.1	Very high	87.8	Confident	88 Å²	88	73.3 Å²	73.3	33%	0.332	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	49.7	-179.6	-62.4	168.2	154.9	-117.6	-12.7	111.5	S323 L324 T325 W329 Q330 E436	S323-R327 PolarHBondContact O-N 2.85Å; L324-R327 PolarHBondContact O-N 2.82Å; T325-R327 VanDerWaalsContact C-N 3.27Å; T325-R327 PolarHBondContact O-N 3.45Å; R327-W329 PolarHBondContact O-N 2.92Å; R327-Q330 HydrophobicContact CB-CB 4.17Å; R327-Q330 VanDerWaalsContact O-CB 3.22Å; R327-Q330 WeakPolarHBondContact O-CB 3.42Å; R327-Q330 PolarHBondContact O-N 3Å; R327-Q330 VanDerWaalsContact O-N 3.08Å; R327-E436 IonicContact CZ-OE2 2.65Å; R327-E436 IonicContact NH1-OE2 3.74Å; R327-E436 IonicContact NH2-OE2 3.94Å; R327-E436 PolarHBondContact NH2-OE2 3.48Å
328	C	89.4	Confident	86.8	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.007	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	129.7	-171.2	-61	0	0	0	0	112.5	S323 Q326 Q330 C341 H346	S323-C328 VanDerWaalsContact CA-SG 3.57Å; S323-C328 PolarHBondContact O-N 2.71Å; S323-C328 PolarHBondContact O-SG 2.94Å; S323-C328 PolarHBondContact OG-SG 3.27Å; S323-C328 VanDerWaalsContact OG-SG 3.37Å; Q326-C328 VanDerWaalsContact C-N 3.31Å; Q326-C328 PolarHBondContact O-N 3.3Å; C328-Q330 PolarHBondContact O-N 3.36Å; C328-Q330 VanDerWaalsContact O-N 3.08Å; C328-C341 VanDerWaalsContact CA-SG 3.55Å; C328-C341 HydrophobicContact CB-CB 3.67Å; C328-C341 WeakPolarHBondContact CB-SG 3.38Å; C328-C341 WeakPolarHBondContact SG-CA 2.93Å; C328-C341 WeakPolarHBondContact SG-CB 3.4Å; C328-C341 CovalentContact SG-SG 2.03Å; C328-C341 PolarHBondContact SG-SG 3Å; C328-H346 WeakPolarHBondContact O-CB 3.27Å; C328-H346 PolarHBondContact O-N 2.68Å
329	W	87.1	Confident	86	Confident	44 Å²	44	76.6 Å²	76.6	17%	0.167	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	59	17.6	178.2	-49.4	96.5	0	0	0	115.3	R327 K331 N332 V333 N334 P335 S342 Y345 R408	R327-W329 PolarHBondContact O-N 2.92Å; W329-K331 PolarHBondContact O-N 3.04Å; W329-N332 PolarHBondContact O-N 3.25Å; W329-N332 VanDerWaalsContact O-N 3.1Å; W329-V333 WeakPolarHBondContact CA-O 3.25Å; W329-N334 HydrophobicContact CZ3-CB 4.44Å; W329-N334 WeakPolarHBondContact CZ3-OD1 3.28Å; W329-P335 HydrophobicContact CD2-CG 4.05Å; W329-P335 HydrophobicContact CH2-CG 4.31Å; W329-P335 HydrophobicContact CZ2-CG 3.78Å; W329-S342 PolarHBondContact NE1-O 3.47Å; W329-Y345 HydrophobicContact CB-CD1 3.29Å; W329-Y345 HydrophobicContact CB-CE1 3.54Å; W329-Y345 HydrophobicContact CB-CG 4.39Å; W329-Y345 HydrophobicContact CG-CD1 4.35Å; W329-Y345 HydrophobicContact CG-CE1 4.47Å; W329-Y345 VanDerWaalsContact O-CD1 3.23Å; W329-Y345 WeakPolarHBondContact O-CD1 3.17Å; W329-Y345 WeakPolarHBondContact O-CE1 3.12Å; W329-R408 VanDerWaalsContact CE3-NH1 3.26Å; W329-R408 VanDerWaalsContact CZ3-NH2 3.33Å
330	Q	85.6	Confident	85.3	Confident	48 Å²	48	75 Å²	75	22%	0.224	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-57.8	126.9	176.4	-175.7	167.6	49.9	0	0	110.1	R327 C328 N332 V333 E436	R327-Q330 HydrophobicContact CB-CB 4.17Å; R327-Q330 VanDerWaalsContact O-CB 3.22Å; R327-Q330 WeakPolarHBondContact O-CB 3.42Å; R327-Q330 PolarHBondContact O-N 3Å; R327-Q330 VanDerWaalsContact O-N 3.08Å; C328-Q330 PolarHBondContact O-N 3.36Å; C328-Q330 VanDerWaalsContact O-N 3.08Å; Q330-N332 VanDerWaalsContact C-N 3.26Å; Q330-N332 PolarHBondContact O-N 3.03Å; Q330-V333 WeakPolarHBondContact O-CB 3.4Å; Q330-V333 WeakPolarHBondContact O-CG2 3.19Å; Q330-V333 PolarHBondContact O-N 3.13Å; Q330-E436 PolarHBondContact NE2-OE1 3.34Å; Q330-E436 PolarHBondContact NE2-OE2 2.87Å
331	K	81.4	Confident	84.8	Confident	190 Å²	190	76.6 Å²	76.6	83%	0.826	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	55.1	36.6	-176.8	-58.9	178.6	178.6	-176.1	0	113.8	W329 V333	W329-K331 PolarHBondContact O-N 3.04Å; K331-V333 PolarHBondContact O-N 3Å; K331-V333 VanDerWaalsContact O-N 3.15Å
332	N	80.3	Confident	84.4	Confident	105 Å²	105	75.9 Å²	75.9	56%	0.561	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	60.5	20	180	-58.9	-33.8	0	0	0	114.5	W329 Q330 N334 Y345	W329-N332 PolarHBondContact O-N 3.25Å; W329-N332 VanDerWaalsContact O-N 3.1Å; Q330-N332 VanDerWaalsContact C-N 3.26Å; Q330-N332 PolarHBondContact O-N 3.03Å; N332-N334 PolarHBondContact O-N 2.97Å; N332-Y345 VanDerWaalsContact OD1-CE1 3.26Å; N332-Y345 WeakPolarHBondContact OD1-CE1 3.48Å; N332-Y345 VanDerWaalsContact OD1-CZ 3.23Å; N332-Y345 PolarHBondContact OD1-OH 2.99Å
333	V	81.3	Confident	84.1	Confident	98 Å²	98	74.6 Å²	74.6	59%	0.594	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-79.9	121.7	175.3	-179.6	0	0	0	0	109	W329 Q330 K331	W329-V333 WeakPolarHBondContact CA-O 3.25Å; Q330-V333 WeakPolarHBondContact O-CB 3.4Å; Q330-V333 WeakPolarHBondContact O-CG2 3.19Å; Q330-V333 PolarHBondContact O-N 3.13Å; K331-V333 PolarHBondContact O-N 3Å; K331-V333 VanDerWaalsContact O-N 3.15Å
334	N	81.6	Confident	84.1	Confident	118 Å²	118	74.6 Å²	74.6	63%	0.631	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-63.2	126.1	178.3	-70.5	-16	0	0	0	110.3	W329 N332	W329-N334 HydrophobicContact CZ3-CB 4.44Å; W329-N334 WeakPolarHBondContact CZ3-OD1 3.28Å; N332-N334 PolarHBondContact O-N 2.97Å
335	P	82.4	Confident	84	Confident	39 Å²	39	75.6 Å²	75.6	25%	0.253	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-68.3	153.5	176.6	28.4	-32.8	0	0	0	110.8	W329 C341	W329-P335 HydrophobicContact CD2-CG 4.05Å; W329-P335 HydrophobicContact CH2-CG 4.31Å; W329-P335 HydrophobicContact CZ2-CG 3.78Å; P335-C341 HydrophobicContact CB-CB 3.68Å; P335-C341 WeakPolarHBondContact CB-SG 3.34Å; P335-C341 HydrophobicContact CG-CB 3.66Å
336	K	80.1	Confident	84.1	Confident	178 Å²	178	71.5 Å²	71.5	77%	0.774	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-61.8	144.2	175	-64.4	-179.7	179.7	178.6	0	109.6	N338 S339	K336-N338 PolarHBondContact O-N 3.11Å; K336-S339 VanDerWaalsContact O-CB 3.25Å; K336-S339 WeakPolarHBondContact O-CB 3.12Å; K336-S339 PolarHBondContact O-N 3.27Å; K336-S339 PolarHBondContact O-OG 3.06Å
337	S	71.9	Confident	84.3	Confident	118 Å²	118	67.3 Å²	67.3	83%	0.825	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-30.8	-176.7	57.9	0	0	0	0	114.3
338	N	72.9	Confident	84.5	Confident	155 Å²	155	63.1 Å²	63.1	83%	0.829	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	13.8	-176.6	-57.8	0.4	0	0	0	113.3	K336 G340	K336-N338 PolarHBondContact O-N 3.11Å; N338-G340 VanDerWaalsContact C-N 3.33Å; N338-G340 PolarHBondContact O-N 2.84Å
339	S	74.9	Confident	84.8	Confident	24 Å²	24	63.1 Å²	63.1	17%	0.168	35%	0.352	C	S	.	.	S	Bend	trans	-79.1	-11.5	-174.7	58.9	0	0	0	0	114.6	K336 C341	K336-S339 VanDerWaalsContact O-CB 3.25Å; K336-S339 WeakPolarHBondContact O-CB 3.12Å; K336-S339 PolarHBondContact O-N 3.27Å; K336-S339 PolarHBondContact O-OG 3.06Å; S339-C341 PolarHBondContact O-N 3.2Å; S339-C341 PolarHBondContact OG-SG 3.33Å
340	G	78.8	Confident	85.3	Confident	56 Å²	56	61 Å²	61	58%	0.577	34%	0.344	S	S	*	.			trans	69.3	19.6	-174.4	0	0	0	0	0	113.8	N338	N338-G340 VanDerWaalsContact C-N 3.33Å; N338-G340 PolarHBondContact O-N 2.84Å
341	C	85.5	Confident	85.9	Confident	32 Å²	32	59 Å²	59	22%	0.216	34%	0.335	C	S	.	.			trans	-70.5	131.7	178.2	-82.3	0	0	0	0	112.6	C328 P335 S339	C328-C341 VanDerWaalsContact CA-SG 3.55Å; C328-C341 HydrophobicContact CB-CB 3.67Å; C328-C341 WeakPolarHBondContact CB-SG 3.38Å; C328-C341 WeakPolarHBondContact SG-CA 2.93Å; C328-C341 WeakPolarHBondContact SG-CB 3.4Å; C328-C341 CovalentContact SG-SG 2.03Å; C328-C341 PolarHBondContact SG-SG 3Å; P335-C341 HydrophobicContact CB-CB 3.68Å; P335-C341 WeakPolarHBondContact CB-SG 3.34Å; P335-C341 HydrophobicContact CG-CB 3.66Å; S339-C341 PolarHBondContact O-N 3.2Å; S339-C341 PolarHBondContact OG-SG 3.33Å
342	S	84.9	Confident	86.7	Confident	22 Å²	22	50.1 Å²	50.1	15%	0.154	30%	0.296	C	S	.	.			trans	-72.4	171.3	165	65.6	0	0	0	0	110.9	W329 I344	W329-S342 PolarHBondContact NE1-O 3.47Å; S342-I344 PolarHBondContact O-N 3.35Å
343	S	86.8	Confident	87.5	Confident	46 Å²	46	45.1 Å²	45.1	32%	0.322	27%	0.269	S	S	.	.	S	Bend	trans	-71.2	-9.4	177.8	58.6	0	0	0	0	114.4	L407 R408	S343-L407 WeakPolarHBondContact CB-O 3.32Å; S343-L407 PolarHBondContact OG-O 3.3Å; S343-R408 WeakPolarHBondContact O-CA 3.38Å
344	I	92.1	Very high	88.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.241	C	C	.	.	S	Bend	trans	-83.3	136.8	-169.9	-56.8	-61.1	0	0	0	111.2	V313 S342 E348 W349 L407 R408 L410	V313-I344 HydrophobicContact CG2-CD1 4.25Å; V313-I344 HydrophobicContact CG2-CG1 4.32Å; S342-I344 PolarHBondContact O-N 3.35Å; I344-E348 HydrophobicContact CG2-CB 3.79Å; I344-E348 HydrophobicContact CG2-CG 4.33Å; I344-W349 HydrophobicContact CB-CZ2 4.1Å; I344-W349 HydrophobicContact CG1-CZ2 4.22Å; I344-W349 HydrophobicContact CG2-CZ2 4.06Å; I344-L407 WeakPolarHBondContact CD1-O 3.46Å; I344-R408 WeakPolarHBondContact CA-O 3.24Å; I344-L410 HydrophobicContact CD1-CD2 3.68Å; I344-L410 HydrophobicContact CD1-CG 4.37Å; I344-L410 HydrophobicContact CG1-CD2 4.09Å; I344-L410 HydrophobicContact CG2-CD1 4.12Å; I344-L410 HydrophobicContact CG2-CD2 4.08Å; I344-L410 HydrophobicContact CG2-CG 3.83Å
345	Y	93.3	Very high	89.2	Confident	27 Å²	27	34.8 Å²	34.8	11%	0.106	21%	0.211	C	C	.	.			trans	-63.3	138.8	173.9	-78.2	-55.3	0	0	0	111.8	W329 N332 S347 E348 R408 H409	W329-Y345 HydrophobicContact CB-CD1 3.29Å; W329-Y345 HydrophobicContact CB-CE1 3.54Å; W329-Y345 HydrophobicContact CB-CG 4.39Å; W329-Y345 HydrophobicContact CG-CD1 4.35Å; W329-Y345 HydrophobicContact CG-CE1 4.47Å; W329-Y345 VanDerWaalsContact O-CD1 3.23Å; W329-Y345 WeakPolarHBondContact O-CD1 3.17Å; W329-Y345 WeakPolarHBondContact O-CE1 3.12Å; N332-Y345 VanDerWaalsContact OD1-CE1 3.26Å; N332-Y345 WeakPolarHBondContact OD1-CE1 3.48Å; N332-Y345 VanDerWaalsContact OD1-CZ 3.23Å; N332-Y345 PolarHBondContact OD1-OH 2.99Å; Y345-S347 PolarHBondContact O-N 3.29Å; Y345-E348 WeakPolarHBondContact O-CB 3.45Å; Y345-E348 PolarHBondContact O-N 2.79Å; Y345-R408 HydrophobicContact CD2-CB 3.7Å; Y345-R408 HydrophobicContact CE2-CB 3.61Å; Y345-R408 HydrophobicContact CE2-CG 4.27Å; Y345-R408 HydrophobicContact CG-CB 4.45Å; Y345-R408 VanDerWaalsContact CZ-CD 3.43Å; Y345-R408 PolarHBondContact N-O 3.28Å; Y345-R408 VanDerWaalsContact N-O 3.07Å; Y345-R408 VanDerWaalsContact OH-CD 3.24Å; Y345-R408 WeakPolarHBondContact OH-CD 3.45Å; Y345-R408 PolarHBondContact OH-NH1 2.78Å; Y345-H409 AromaticContact CD2-CD2 3.92Å; Y345-H409 AromaticContact CD2-NE2 3.46Å; Y345-H409 WeakPolarHBondContact CD2-NE2 3.17Å; Y345-H409 AromaticContact CE2-CE1 3.79Å; Y345-H409 AromaticContact CE2-NE2 3.63Å
346	H	93.7	Very high	89.9	Confident	4 Å²	4	33 Å²	33	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-52.8	-39.1	176.5	-178.1	61.9	0	0	0	113.4	L324 C328 E348 W349 E436	L324-H346 PolarHBondContact O-CE1 3.14Å; C328-H346 WeakPolarHBondContact O-CB 3.27Å; C328-H346 PolarHBondContact O-N 2.68Å; H346-E348 PolarHBondContact O-N 2.86Å; H346-W349 PolarHBondContact O-N 3.16Å; H346-E436 IonicContact CD2-OE1 2.71Å; H346-E436 PolarHBondContact CD2-OE1 2.75Å; H346-E436 IonicContact NE2-OE1 3.47Å
347	S	94.3	Very high	90.8	Very high	21 Å²	21	24.5 Å²	24.5	15%	0.147	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-28.5	178.5	50.5	0	0	0	0	113.4	Y345 W349 S350 K351	Y345-S347 PolarHBondContact O-N 3.29Å; S347-W349 VanDerWaalsContact C-N 3.33Å; S347-W349 PolarHBondContact O-N 2.96Å; S347-S350 WeakPolarHBondContact O-CB 3.47Å; S347-S350 PolarHBondContact O-N 3.36Å; S347-K351 WeakPolarHBondContact O-CG 3.35Å; S347-K351 PolarHBondContact O-N 3.28Å
348	E	96.1	Very high	92	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-69.1	-35.2	-178.7	-62.2	-67	108.3	0	0	111.4	R274 I344 Y345 H346 K351 L352 H409 L410	R274-E348 IonicContact CZ-OE1 2.89Å; R274-E348 IonicContact CZ-OE2 3.55Å; R274-E348 IonicContact NE-OE1 2.65Å; R274-E348 PolarHBondContact NE-OE1 3.32Å; R274-E348 IonicContact NE-OE2 3.33Å; R274-E348 PolarHBondContact NE-OE2 2.85Å; R274-E348 IonicContact NH2-OE1 2.68Å; R274-E348 PolarHBondContact NH2-OE1 2.71Å; R274-E348 IonicContact NH2-OE2 3.4Å; I344-E348 HydrophobicContact CG2-CB 3.79Å; I344-E348 HydrophobicContact CG2-CG 4.33Å; Y345-E348 WeakPolarHBondContact O-CB 3.45Å; Y345-E348 PolarHBondContact O-N 2.79Å; H346-E348 PolarHBondContact O-N 2.86Å; E348-K351 PolarHBondContact O-N 3.33Å; E348-K351 IonicContact OE1-NZ 3.13Å; E348-K351 PolarHBondContact OE1-NZ 2.77Å; E348-L352 VanDerWaalsContact O-CB 3.29Å; E348-L352 WeakPolarHBondContact O-CB 3.27Å; E348-L352 PolarHBondContact O-N 3.38Å; E348-H409 IonicContact OE1-CD2 3.67Å; E348-H409 IonicContact OE2-CD2 3.51Å; E348-L410 HydrophobicContact CB-CB 4.37Å; E348-L410 HydrophobicContact CB-CD1 3.9Å; E348-L410 HydrophobicContact CB-CG 3.92Å; E348-L410 PolarHBondContact OE2-N 2.8Å
349	W	96.4	Very high	93.2	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65.5	-39.9	173.3	-61.4	117.1	0	0	0	112.1	M315 Y320 L324 I344 H346 S347 L352 A353 L365 I400 L410	M315-W349 HydrophobicContact CE-CZ2 4.15Å; M315-W349 HydrophobicContact SD-CH2 3.44Å; M315-W349 WeakPolarHBondContact SD-CH2 3.39Å; M315-W349 HydrophobicContact SD-CZ2 3.57Å; M315-W349 VanDerWaalsContact SD-CZ2 3.57Å; Y320-W349 AromaticContact CD2-CD2 3.83Å; Y320-W349 HydrophobicContact CD2-CD2 3.83Å; Y320-W349 AromaticContact CD2-CE3 3.73Å; Y320-W349 HydrophobicContact CD2-CE3 3.73Å; Y320-W349 HydrophobicContact CD2-CG 4.42Å; Y320-W349 HydrophobicContact CD2-CH2 4.19Å; Y320-W349 HydrophobicContact CD2-CZ2 4.31Å; Y320-W349 AromaticContact CD2-CZ3 3.91Å; Y320-W349 HydrophobicContact CD2-CZ3 3.91Å; Y320-W349 HydrophobicContact CE2-CB 4.12Å; Y320-W349 AromaticContact CE2-CD2 3.57Å; Y320-W349 HydrophobicContact CE2-CD2 3.57Å; Y320-W349 AromaticContact CE2-CE3 3.38Å; Y320-W349 HydrophobicContact CE2-CE3 3.38Å; Y320-W349 AromaticContact CE2-CG 3.9Å; Y320-W349 HydrophobicContact CE2-CG 3.9Å; Y320-W349 AromaticContact CE2-CZ3 3.97Å; Y320-W349 HydrophobicContact CE2-CZ3 3.97Å; L324-W349 HydrophobicContact CD2-CB 3.6Å; L324-W349 HydrophobicContact CD2-CG 3.99Å; I344-W349 HydrophobicContact CB-CZ2 4.1Å; I344-W349 HydrophobicContact CG1-CZ2 4.22Å; I344-W349 HydrophobicContact CG2-CZ2 4.06Å; H346-W349 PolarHBondContact O-N 3.16Å; S347-W349 VanDerWaalsContact C-N 3.33Å; S347-W349 PolarHBondContact O-N 2.96Å; W349-L352 HydrophobicContact CE3-CD2 3.85Å; W349-L352 HydrophobicContact CZ3-CD2 3.87Å; W349-L352 PolarHBondContact O-N 3.42Å; W349-A353 VanDerWaalsContact O-CB 3.3Å; W349-A353 WeakPolarHBondContact O-CB 3.46Å; W349-A353 PolarHBondContact O-N 3.17Å; W349-L365 HydrophobicContact CZ3-CD2 4.33Å; W349-I400 HydrophobicContact CH2-CG2 3.76Å; W349-I400 HydrophobicContact CZ3-CD1 4.13Å; W349-I400 HydrophobicContact CZ3-CG2 4.25Å; W349-L410 HydrophobicContact CD2-CD1 4.44Å; W349-L410 HydrophobicContact CE3-CD1 4.04Å; W349-L410 HydrophobicContact CH2-CD1 4.49Å; W349-L410 HydrophobicContact CZ3-CD1 4.08Å
350	S	97.2	Very high	94.2	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.007	8%	0.077	C	C	.	.	H	α-helix	trans	-63.4	-41.1	174.2	-66.4	0	0	0	0	112.8	S347 L354 E436 L437	S347-S350 WeakPolarHBondContact O-CB 3.47Å; S347-S350 PolarHBondContact O-N 3.36Å; S350-L354 WeakPolarHBondContact O-CB 3.48Å; S350-L354 PolarHBondContact O-N 3.36Å; S350-E436 WeakPolarHBondContact CB-O 3.41Å; S350-E436 PolarHBondContact OG-O 2.75Å; S350-L437 WeakPolarHBondContact O-CD2 3.38Å
351	K	97.8	Very high	95	Very high	5 Å²	5	8 Å²	8	2%	0.022	5%	0.05	C	C	.	.	H	α-helix	trans	-64.7	-45.6	175.1	-68.5	173.6	-170.6	165.5	0	110.8	L272 S347 E348 F355 F412 P438 D504	L272-K351 HydrophobicContact CD2-CB 4.09Å; L272-K351 HydrophobicContact CD2-CG 3.95Å; S347-K351 WeakPolarHBondContact O-CG 3.35Å; S347-K351 PolarHBondContact O-N 3.28Å; E348-K351 PolarHBondContact O-N 3.33Å; E348-K351 IonicContact OE1-NZ 3.13Å; E348-K351 PolarHBondContact OE1-NZ 2.77Å; K351-F355 WeakPolarHBondContact O-CB 3.48Å; K351-F355 PolarHBondContact O-N 2.97Å; K351-F355 VanDerWaalsContact O-N 3.1Å; K351-F412 HydrophobicContact CB-CZ 4.11Å; K351-P438 HydrophobicContact CG-CG 4.3Å; K351-D504 IonicContact NZ-OD1 3.21Å; K351-D504 PolarHBondContact NZ-OD1 3.42Å
352	L	97.8	Very high	95.3	Very high	3 Å²	3	7 Å²	7	2%	0.016	4%	0.042	C	C	.	.	H	α-helix	trans	-61	-53.1	179.8	-176.3	75	0	0	0	111	E348 W349 L354 F355 D356 L365 I400 L410 F412	E348-L352 VanDerWaalsContact O-CB 3.29Å; E348-L352 WeakPolarHBondContact O-CB 3.27Å; E348-L352 PolarHBondContact O-N 3.38Å; W349-L352 HydrophobicContact CE3-CD2 3.85Å; W349-L352 HydrophobicContact CZ3-CD2 3.87Å; W349-L352 PolarHBondContact O-N 3.42Å; L352-L354 VanDerWaalsContact C-N 3.34Å; L352-L354 PolarHBondContact O-N 3.4Å; L352-F355 PolarHBondContact O-N 3.14Å; L352-F355 VanDerWaalsContact O-N 3.14Å; L352-D356 WeakPolarHBondContact CD1-OD2 3.45Å; L352-D356 WeakPolarHBondContact CG-OD2 3.11Å; L352-D356 WeakPolarHBondContact O-CB 3.5Å; L352-D356 PolarHBondContact O-N 3.26Å; L352-L365 HydrophobicContact CD2-CD1 4.37Å; L352-L365 HydrophobicContact CD2-CD2 4.06Å; L352-L365 HydrophobicContact CD2-CG 4.3Å; L352-I400 HydrophobicContact CD2-CD1 4.18Å; L352-L410 HydrophobicContact CB-CD1 4.34Å; L352-L410 HydrophobicContact CD2-CD1 4.12Å; L352-F412 VanDerWaalsContact CA-CZ 3.42Å; L352-F412 HydrophobicContact CB-CE1 3.91Å; L352-F412 HydrophobicContact CB-CZ 3.88Å; L352-F412 HydrophobicContact CD1-CD1 3.6Å; L352-F412 HydrophobicContact CD1-CE1 3.39Å; L352-F412 HydrophobicContact CD1-CE2 4.5Å; L352-F412 HydrophobicContact CD1-CG 4.29Å; L352-F412 HydrophobicContact CD1-CZ 3.9Å; L352-F412 HydrophobicContact CG-CE1 4.28Å
353	A	98.2	Very high	95.5	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-59.4	-42.3	-178.2	0	0	0	0	0	112.6	W349 F357 L430 L431 I434	W349-A353 VanDerWaalsContact O-CB 3.3Å; W349-A353 WeakPolarHBondContact O-CB 3.46Å; W349-A353 PolarHBondContact O-N 3.17Å; A353-F357 WeakPolarHBondContact O-CB 3.38Å; A353-F357 PolarHBondContact O-N 3.29Å; A353-L430 VanDerWaalsContact CB-O 3.31Å; A353-L430 WeakPolarHBondContact CB-O 3.2Å; A353-L431 HydrophobicContact CB-CD2 4.41Å; A353-I434 HydrophobicContact CB-CD1 3.85Å; A353-I434 HydrophobicContact CB-CG1 3.71Å
354	L	98.5	Very high	95.9	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-61.5	-47	175.5	-178.1	149.6	0	0	0	111.6	L270 L272 S350 L352 L358 L437 P438 A441 V442 L488	L270-L354 HydrophobicContact CD1-CD2 3.86Å; L272-L354 HydrophobicContact CD1-CD2 4.42Å; S350-L354 WeakPolarHBondContact O-CB 3.48Å; S350-L354 PolarHBondContact O-N 3.36Å; L352-L354 VanDerWaalsContact C-N 3.34Å; L352-L354 PolarHBondContact O-N 3.4Å; L354-L358 HydrophobicContact CD2-CD1 3.88Å; L354-L358 WeakPolarHBondContact O-CG 3.38Å; L354-L358 PolarHBondContact O-N 3.3Å; L354-L437 HydrophobicContact CB-CD2 3.99Å; L354-L437 HydrophobicContact CD1-CD1 4.44Å; L354-L437 HydrophobicContact CD1-CD2 4.29Å; L354-P438 HydrophobicContact CD1-CG 4.14Å; L354-A441 HydrophobicContact CD1-CB 4.03Å; L354-A441 HydrophobicContact CD2-CB 4.15Å; L354-V442 HydrophobicContact CD1-CG2 3.99Å; L354-L488 HydrophobicContact CD1-CD2 4.35Å; L354-L488 HydrophobicContact CG-CD2 4Å
355	F	98.6	Very high	96	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-65.9	-50	-177.6	-175.3	-102.6	0	0	0	111.9	A263 L266 D267 L272 T275 K351 L352 F357 L358 L359 I361 F412 N415	A263-F355 HydrophobicContact CB-CE1 4.44Å; A263-F355 HydrophobicContact CB-CZ 3.79Å; A263-F355 WeakPolarHBondContact O-CE2 3.44Å; A263-F355 WeakPolarHBondContact O-CZ 3.4Å; L266-F355 HydrophobicContact CB-CE2 4.42Å; L266-F355 HydrophobicContact CD2-CD2 4.45Å; L266-F355 HydrophobicContact CD2-CE2 4.2Å; L266-F355 HydrophobicContact CG-CE2 4.32Å; D267-F355 HydrophobicContact CB-CD2 4.41Å; D267-F355 HydrophobicContact CB-CE2 3.72Å; D267-F355 HydrophobicContact CB-CZ 4.26Å; L272-F355 HydrophobicContact CD1-CB 3.83Å; L272-F355 HydrophobicContact CD1-CD2 3.75Å; L272-F355 HydrophobicContact CD1-CG 4.17Å; T275-F355 HydrophobicContact CG2-CE1 4.15Å; T275-F355 HydrophobicContact CG2-CE2 4.31Å; T275-F355 HydrophobicContact CG2-CZ 3.64Å; K351-F355 WeakPolarHBondContact O-CB 3.48Å; K351-F355 PolarHBondContact O-N 2.97Å; K351-F355 VanDerWaalsContact O-N 3.1Å; L352-F355 PolarHBondContact O-N 3.14Å; L352-F355 VanDerWaalsContact O-N 3.14Å; F355-F357 VanDerWaalsContact C-N 3.33Å; F355-F357 PolarHBondContact O-N 3.18Å; F355-L358 PolarHBondContact O-N 2.51Å; F355-L359 HydrophobicContact CD1-CD1 4.23Å; F355-L359 HydrophobicContact CD2-CD1 4.45Å; F355-L359 HydrophobicContact CE1-CD1 3.61Å; F355-L359 HydrophobicContact CE2-CD1 3.86Å; F355-L359 HydrophobicContact CZ-CD1 3.42Å; F355-L359 VanDerWaalsContact CZ-CD1 3.42Å; F355-L359 PolarHBondContact O-N 3.21Å; F355-L359 VanDerWaalsContact O-N 3.16Å; F355-I361 HydrophobicContact CD1-CD1 4.21Å; F355-I361 HydrophobicContact CE1-CD1 3.91Å; F355-F412 HydrophobicContact CB-CD2 4.24Å; F355-F412 HydrophobicContact CB-CE2 3.81Å; F355-F412 AromaticContact CD1-CD2 3.56Å; F355-F412 HydrophobicContact CD1-CD2 3.56Å; F355-F412 HydrophobicContact CD1-CE2 4.01Å; F355-F412 HydrophobicContact CD1-CG 4.42Å; F355-F412 HydrophobicContact CD2-CD2 4.48Å; F355-F412 HydrophobicContact CE1-CB 4.47Å; F355-F412 AromaticContact CE1-CD2 3.91Å; F355-F412 HydrophobicContact CE1-CD2 3.91Å; F355-F412 AromaticContact CG-CD2 3.84Å; F355-F412 HydrophobicContact CG-CD2 3.84Å; F355-F412 AromaticContact CG-CE2 3.9Å; F355-F412 HydrophobicContact CG-CE2 3.9Å; F355-F412 HydrophobicContact CZ-CD2 4.49Å; F355-N415 WeakPolarHBondContact CE1-OD1 3.25Å
356	D	98.2	Very high	96	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-64.5	-37.7	-179.9	-73.8	-4	0	0	0	110.9	L352 L359 Q360 I361 R364 L430	L352-D356 WeakPolarHBondContact CD1-OD2 3.45Å; L352-D356 WeakPolarHBondContact CG-OD2 3.11Å; L352-D356 WeakPolarHBondContact O-CB 3.5Å; L352-D356 PolarHBondContact O-N 3.26Å; D356-L359 CarbonylContact O-C 3.57Å; D356-L359 PolarHBondContact O-N 3.34Å; D356-Q360 CarbonylContact O-C 3.47Å; D356-Q360 WeakPolarHBondContact O-CA 3.5Å; D356-Q360 PolarHBondContact O-N 2.91Å; D356-I361 HydrophobicContact CB-CB 4.14Å; D356-I361 PolarHBondContact O-N 2.71Å; D356-R364 IonicContact OD1-CZ 2.74Å; D356-R364 IonicContact OD1-NH1 3.32Å; D356-R364 PolarHBondContact OD1-NH1 3.2Å; D356-R364 WeakPolarHBondContact OD2-CD 3.4Å; D356-R364 IonicContact OD2-NH1 3.53Å; D356-L430 HydrophobicContact CB-CD1 4.31Å
357	F	98.4	Very high	95.8	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-63.6	-43.3	174.5	-177.8	-92.9	0	0	0	112.5	A353 F355 L359 Q360 L426 D427 F428 L431 I487 L488	A353-F357 WeakPolarHBondContact O-CB 3.38Å; A353-F357 PolarHBondContact O-N 3.29Å; F355-F357 VanDerWaalsContact C-N 3.33Å; F355-F357 PolarHBondContact O-N 3.18Å; F357-L359 VanDerWaalsContact C-N 3.34Å; F357-L359 PolarHBondContact O-N 3.38Å; F357-Q360 PolarHBondContact O-N 3.07Å; F357-Q360 PolarHBondContact O-NE2 2.87Å; F357-L426 HydrophobicContact CE2-CB 4.41Å; F357-L426 HydrophobicContact CZ-CD1 4.04Å; F357-D427 WeakPolarHBondContact CD2-O 3.21Å; F357-F428 AromaticContact CE2-CD1 3.83Å; F357-F428 HydrophobicContact CE2-CD1 3.83Å; F357-F428 AromaticContact CE2-CE1 3.89Å; F357-F428 HydrophobicContact CE2-CE1 3.89Å; F357-F428 HydrophobicContact CE2-CG 4.26Å; F357-F428 HydrophobicContact CE2-CZ 4.36Å; F357-F428 HydrophobicContact CZ-CD1 4.24Å; F357-F428 AromaticContact CZ-CE1 3.82Å; F357-F428 HydrophobicContact CZ-CE1 3.82Å; F357-F428 HydrophobicContact CZ-CZ 4.15Å; F357-L431 HydrophobicContact CB-CD2 3.97Å; F357-L431 HydrophobicContact CB-CG 4.35Å; F357-L431 HydrophobicContact CD1-CD1 4.42Å; F357-L431 HydrophobicContact CD2-CD1 3.61Å; F357-L431 HydrophobicContact CD2-CD2 4.32Å; F357-L431 HydrophobicContact CD2-CG 3.79Å; F357-L431 HydrophobicContact CE2-CD1 3.75Å; F357-L431 HydrophobicContact CE2-CG 4.37Å; F357-L431 HydrophobicContact CG-CD1 3.96Å; F357-L431 HydrophobicContact CG-CD2 4.16Å; F357-L431 HydrophobicContact CG-CG 4.13Å; F357-L431 HydrophobicContact CZ-CD1 4.22Å; F357-I487 HydrophobicContact CZ-CG2 4.16Å; F357-L488 HydrophobicContact CD1-CB 3.93Å; F357-L488 HydrophobicContact CD1-CD1 3.95Å; F357-L488 HydrophobicContact CD1-CD2 4.29Å; F357-L488 HydrophobicContact CD1-CG 4.27Å; F357-L488 HydrophobicContact CE1-CB 3.71Å; F357-L488 HydrophobicContact CE1-CD1 4.24Å; F357-L488 HydrophobicContact CE1-CG 4.46Å; F357-L488 HydrophobicContact CG-CD1 4.48Å
358	L	98.2	Very high	95.6	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-63.6	-41.8	179.5	-71	175.3	0	0	0	111.8	L266 L270 L354 F355 L445 I481 R484 A485 L488	L266-L358 HydrophobicContact CD2-CB 4.43Å; L270-L358 HydrophobicContact CD1-CD1 3.77Å; L354-L358 HydrophobicContact CD2-CD1 3.88Å; L354-L358 WeakPolarHBondContact O-CG 3.38Å; L354-L358 PolarHBondContact O-N 3.3Å; F355-L358 PolarHBondContact O-N 2.51Å; L358-L445 HydrophobicContact CD1-CD1 4.41Å; L358-L445 HydrophobicContact CD1-CD2 4.46Å; L358-I481 HydrophobicContact CB-CG2 4.44Å; L358-I481 HydrophobicContact CD2-CG2 4.44Å; L358-I481 VanDerWaalsContact O-CD1 3.25Å; L358-I481 WeakPolarHBondContact O-CD1 3.36Å; L358-R484 HydrophobicContact CD2-CB 4.35Å; L358-R484 WeakPolarHBondContact O-CD 3.06Å; L358-R484 PolarHBondContact O-NH1 3.44Å; L358-R484 VanDerWaalsContact O-NH1 3.14Å; L358-A485 HydrophobicContact CD2-CB 3.99Å; L358-L488 HydrophobicContact CD2-CD2 4.27Å; L358-L488 HydrophobicContact CG-CD2 4.45Å
359	L	97.3	Very high	95.3	Very high	2 Å²	2	3.8 Å²	3.8	1%	0.01	2%	0.023	C	C	.	.	H	α-helix	trans	-87.7	-9.3	-179.5	-66.2	176.6	0	0	0	113.8	F262 A263 L266 F355 D356 F357 I361 G417 F418 F419 I481	F262-L359 HydrophobicContact CD1-CD2 3.92Å; F262-L359 HydrophobicContact CE1-CD2 4.12Å; A263-L359 HydrophobicContact CB-CD1 3.79Å; L266-L359 HydrophobicContact CD2-CD1 4.12Å; L266-L359 HydrophobicContact CD2-CD2 3.77Å; L266-L359 HydrophobicContact CD2-CG 3.81Å; F355-L359 HydrophobicContact CD1-CD1 4.23Å; F355-L359 HydrophobicContact CD2-CD1 4.45Å; F355-L359 HydrophobicContact CE1-CD1 3.61Å; F355-L359 HydrophobicContact CE2-CD1 3.86Å; F355-L359 HydrophobicContact CZ-CD1 3.42Å; F355-L359 VanDerWaalsContact CZ-CD1 3.42Å; F355-L359 PolarHBondContact O-N 3.21Å; F355-L359 VanDerWaalsContact O-N 3.16Å; D356-L359 CarbonylContact O-C 3.57Å; D356-L359 PolarHBondContact O-N 3.34Å; F357-L359 VanDerWaalsContact C-N 3.34Å; F357-L359 PolarHBondContact O-N 3.38Å; L359-I361 VanDerWaalsContact C-N 3.32Å; L359-I361 HydrophobicContact CB-CD1 3.72Å; L359-I361 HydrophobicContact CB-CG1 3.71Å; L359-I361 HydrophobicContact CD1-CD1 3.69Å; L359-I361 HydrophobicContact CG-CD1 4.36Å; L359-G417 CarbonylContact O-C 3.44Å; L359-G417 VanDerWaalsContact O-CA 3.28Å; L359-G417 WeakPolarHBondContact O-CA 3.38Å; L359-F418 PolarHBondContact O-N 2.97Å; L359-F419 HydrophobicContact CD2-CE1 4.48Å; L359-F419 HydrophobicContact CD2-CZ 3.94Å; L359-I481 HydrophobicContact CD2-CD1 3.9Å
360	Q	96	Very high	95	Very high	5 Å²	5	5.2 Å²	5.2	2%	0.023	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	43.5	-171.1	-64.2	-71.6	-64.3	0	0	112.5	D356 F357 H362 F418 L426 R484	D356-Q360 CarbonylContact O-C 3.47Å; D356-Q360 WeakPolarHBondContact O-CA 3.5Å; D356-Q360 PolarHBondContact O-N 2.91Å; F357-Q360 PolarHBondContact O-N 3.07Å; F357-Q360 PolarHBondContact O-NE2 2.87Å; Q360-H362 PolarHBondContact O-N 3.49Å; Q360-H362 VanDerWaalsContact O-N 3.09Å; Q360-F418 HydrophobicContact CB-CB 4.45Å; Q360-F418 VanDerWaalsContact O-CD2 3.32Å; Q360-F418 WeakPolarHBondContact O-CD2 3.24Å; Q360-L426 HydrophobicContact CG-CD2 3.76Å; Q360-L426 VanDerWaalsContact OE1-CA 3.31Å; Q360-R484 VanDerWaalsContact CG-NH1 3.34Å
361	I	94.9	Very high	94.6	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	5%	0.045	C	C	.	.			trans	-81.3	85	175.4	-58.4	163.4	0	0	0	108.2	F355 D356 L359 R364 N415	F355-I361 HydrophobicContact CD1-CD1 4.21Å; F355-I361 HydrophobicContact CE1-CD1 3.91Å; D356-I361 HydrophobicContact CB-CB 4.14Å; D356-I361 PolarHBondContact O-N 2.71Å; L359-I361 VanDerWaalsContact C-N 3.32Å; L359-I361 HydrophobicContact CB-CD1 3.72Å; L359-I361 HydrophobicContact CB-CG1 3.71Å; L359-I361 HydrophobicContact CD1-CD1 3.69Å; L359-I361 HydrophobicContact CG-CD1 4.36Å; I361-R364 HydrophobicContact CG2-CG 4.49Å; I361-N415 HydrophobicContact CD1-CB 4.05Å
362	H	92.1	Very high	94.3	Very high	12 Å²	12	7.1 Å²	7.1	6%	0.056	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-23.1	-177.8	68	87.7	0	0	0	113.1	Q360 R364 L365 D366 C369 F372 F418 D427	Q360-H362 PolarHBondContact O-N 3.49Å; Q360-H362 VanDerWaalsContact O-N 3.09Å; H362-R364 PolarHBondContact O-N 2.87Å; H362-L365 PolarHBondContact O-N 3.49Å; H362-D366 HydrophobicContact CB-CB 4.44Å; H362-D366 PolarHBondContact ND1-O 3.26Å; H362-D366 CarbonylContact O-C 3.48Å; H362-D366 VanDerWaalsContact O-CA 3.32Å; H362-D366 WeakPolarHBondContact O-CA 3.32Å; H362-D366 PolarHBondContact O-N 3.37Å; H362-C369 PolarHBondContact CE1-SG 2.85Å; H362-C369 PolarHBondContact ND1-SG 2.87Å; H362-F372 HydrophobicContact CB-CE1 3.82Å; H362-F372 HydrophobicContact CB-CZ 4.48Å; H362-F372 AromaticContact CD2-CZ 3.82Å; H362-F372 AromaticContact CG-CE1 3.68Å; H362-F372 AromaticContact CG-CZ 3.88Å; H362-F418 AromaticContact CD2-CE2 3.71Å; H362-F418 AromaticContact NE2-CE2 3.58Å; H362-F418 AromaticContact NE2-CZ 3.7Å; H362-D427 WeakPolarHBondContact CB-OD2 2.98Å
363	S	90.4	Very high	93.8	Very high	29 Å²	29	16.5 Å²	16.5	20%	0.203	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-2.4	-172.2	61.2	0	0	0	0	115.6	E398	S363-E398 WeakPolarHBondContact O-CB 3.13Å
364	R	93.5	Very high	93.3	Very high	1 Å²	1	18.5 Å²	18.5	0%	0.004	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-60.3	175.5	-71	177.2	-175.6	157	0.3	112.1	D356 I361 H362 E398 N399 I400 F412 T413 N415	D356-R364 IonicContact OD1-CZ 2.74Å; D356-R364 IonicContact OD1-NH1 3.32Å; D356-R364 PolarHBondContact OD1-NH1 3.2Å; D356-R364 WeakPolarHBondContact OD2-CD 3.4Å; D356-R364 IonicContact OD2-NH1 3.53Å; I361-R364 HydrophobicContact CG2-CG 4.49Å; H362-R364 PolarHBondContact O-N 2.87Å; R364-E398 VanDerWaalsContact CA-O 3.24Å; R364-E398 WeakPolarHBondContact CA-O 3.05Å; R364-E398 PolarHBondContact O-N 2.91Å; R364-E398 VanDerWaalsContact O-N 3.13Å; R364-N399 HydrophobicContact CG-CB 4.04Å; R364-I400 HydrophobicContact CB-CD1 4.1Å; R364-F412 VanDerWaalsContact NH2-C 3.33Å; R364-T413 VanDerWaalsContact NH2-N 3.12Å; R364-T413 PolarHBondContact NH2-O 3.47Å; R364-N415 PolarHBondContact NH2-OD1 3.04Å
365	L	94.8	Very high	92.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-24.8	-173	-62.3	-176.1	0	0	0	113.1	W317 Y320 W349 L352 H362 P367 L397 I400 L430	W317-L365 HydrophobicContact CZ3-CB 4.24Å; W317-L365 WeakPolarHBondContact CZ3-O 3.24Å; Y320-L365 HydrophobicContact CE1-CD2 4.38Å; Y320-L365 HydrophobicContact CE2-CD2 4.33Å; W349-L365 HydrophobicContact CZ3-CD2 4.33Å; L352-L365 HydrophobicContact CD2-CD1 4.37Å; L352-L365 HydrophobicContact CD2-CD2 4.06Å; L352-L365 HydrophobicContact CD2-CG 4.3Å; H362-L365 PolarHBondContact O-N 3.49Å; L365-P367 VanDerWaalsContact C-CD 3.49Å; L365-L397 HydrophobicContact CD2-CD1 3.9Å; L365-I400 HydrophobicContact CD2-CD1 4.36Å; L365-L430 HydrophobicContact CB-CD2 3.76Å; L365-L430 HydrophobicContact CD1-CD2 4.45Å
366	D	92.9	Very high	91.9	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.152	C	C	.	.			trans	-131.4	63.2	178.2	-171.1	31.3	0	0	0	112	H362 S368 C369 C370 G371 D427 R429 L430	H362-D366 HydrophobicContact CB-CB 4.44Å; H362-D366 PolarHBondContact ND1-O 3.26Å; H362-D366 CarbonylContact O-C 3.48Å; H362-D366 VanDerWaalsContact O-CA 3.32Å; H362-D366 WeakPolarHBondContact O-CA 3.32Å; H362-D366 PolarHBondContact O-N 3.37Å; D366-S368 PolarHBondContact O-N 2.94Å; D366-S368 VanDerWaalsContact O-N 3.16Å; D366-C369 PolarHBondContact O-N 3.23Å; D366-C369 VanDerWaalsContact O-N 3.12Å; D366-C369 PolarHBondContact OD1-N 3.43Å; D366-C369 VanDerWaalsContact OD2-C 3.27Å; D366-C369 WeakPolarHBondContact OD2-CA 3.5Å; D366-C370 VanDerWaalsContact CG-N 3.27Å; D366-C370 PolarHBondContact OD1-N 3.5Å; D366-C370 PolarHBondContact OD2-N 3.28Å; D366-G371 PolarHBondContact OD2-N 3.48Å; D366-D427 WeakPolarHBondContact CB-OD2 3.25Å; D366-R429 IonicContact OD1-CZ 3.34Å; D366-R429 IonicContact OD1-NH1 3.06Å; D366-R429 PolarHBondContact OD1-NH1 2.91Å; D366-L430 HydrophobicContact CB-CD2 4.38Å
367	P	90.6	Very high	91.2	Very high	11 Å²	11	37.7 Å²	37.7	7%	0.071	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.7	-177.5	25.6	-32.5	0	0	0	113.4	L365 C380 I395 Q396 E398	L365-P367 VanDerWaalsContact C-CD 3.49Å; P367-C380 WeakPolarHBondContact O-CB 3.28Å; P367-I395 HydrophobicContact CG-CG2 3.95Å; P367-Q396 VanDerWaalsContact CG-O 3.28Å; P367-Q396 WeakPolarHBondContact CG-O 3.14Å; P367-E398 HydrophobicContact CB-CB 4.48Å; P367-E398 HydrophobicContact CB-CG 4.07Å; P367-E398 HydrophobicContact CG-CG 4.32Å
368	S	89	Confident	90.5	Very high	11 Å²	11	38 Å²	38	8%	0.077	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	2.5	177.3	-58.7	0	0	0	0	114.2	D366 C370	D366-S368 PolarHBondContact O-N 2.94Å; D366-S368 VanDerWaalsContact O-N 3.16Å; S368-C370 PolarHBondContact O-N 2.88Å
369	C	89.9	Confident	89.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.			trans	53.2	48.8	-179.4	-58.5	0	0	0	0	113.8	H362 D366 F372 C380	H362-C369 PolarHBondContact CE1-SG 2.85Å; H362-C369 PolarHBondContact ND1-SG 2.87Å; D366-C369 PolarHBondContact O-N 3.23Å; D366-C369 VanDerWaalsContact O-N 3.12Å; D366-C369 PolarHBondContact OD1-N 3.43Å; D366-C369 VanDerWaalsContact OD2-C 3.27Å; D366-C369 WeakPolarHBondContact OD2-CA 3.5Å; C369-F372 HydrophobicContact CB-CD1 4.45Å; C369-F372 HydrophobicContact CB-CE1 3.73Å; C369-F372 HydrophobicContact CB-CE2 4.48Å; C369-F372 HydrophobicContact CB-CZ 3.76Å; C369-F372 WeakPolarHBondContact SG-CZ 3.37Å; C369-C380 HydrophobicContact CB-CB 3.79Å; C369-C380 WeakPolarHBondContact CB-SG 3.3Å; C369-C380 WeakPolarHBondContact SG-CB 3.41Å; C369-C380 CovalentContact SG-SG 1.99Å; C369-C380 PolarHBondContact SG-SG 3.44Å
370	C	89.9	Confident	88.7	Confident	29 Å²	29	42.5 Å²	42.5	20%	0.196	21%	0.213	C	C	.	.			trans	-83.2	-21.1	176.8	-51	0	0	0	0	112.7	D366 S368 C389 R429	D366-C370 VanDerWaalsContact CG-N 3.27Å; D366-C370 PolarHBondContact OD1-N 3.5Å; D366-C370 PolarHBondContact OD2-N 3.28Å; S368-C370 PolarHBondContact O-N 2.88Å; C370-C389 WeakPolarHBondContact CA-SG 3.22Å; C370-C389 HydrophobicContact CB-CB 3.74Å; C370-C389 WeakPolarHBondContact CB-SG 3.1Å; C370-C389 WeakPolarHBondContact SG-CA 3.1Å; C370-C389 WeakPolarHBondContact SG-CB 3.32Å; C370-C389 CovalentContact SG-SG 2.04Å; C370-C389 PolarHBondContact SG-SG 1.99Å; C370-R429 VanDerWaalsContact CB-NH1 3.28Å; C370-R429 PolarHBondContact SG-NH1 2.75Å
371	G	90.2	Very high	87.5	Confident	26 Å²	26	45.3 Å²	45.3	27%	0.268	23%	0.23	S	C	.	.	S	Bend	trans	-87.6	-5.1	-173.7	0	0	0	0	0	115.5	D366 D427	D366-G371 PolarHBondContact OD2-N 3.48Å; G371-D427 WeakPolarHBondContact CA-OD1 3.46Å
372	F	90.5	Very high	86.2	Confident	20 Å²	20	51.4 Å²	51.4	9%	0.088	26%	0.258	C	S	.	.	S	Bend	trans	-153.1	168	-179.4	67.7	-79.8	0	0	0	111.9	H362 C369 S374 D427	H362-F372 HydrophobicContact CB-CE1 3.82Å; H362-F372 HydrophobicContact CB-CZ 4.48Å; H362-F372 AromaticContact CD2-CZ 3.82Å; H362-F372 AromaticContact CG-CE1 3.68Å; H362-F372 AromaticContact CG-CZ 3.88Å; C369-F372 HydrophobicContact CB-CD1 4.45Å; C369-F372 HydrophobicContact CB-CE1 3.73Å; C369-F372 HydrophobicContact CB-CE2 4.48Å; C369-F372 HydrophobicContact CB-CZ 3.76Å; C369-F372 WeakPolarHBondContact SG-CZ 3.37Å; F372-S374 PolarHBondContact O-N 3.29Å; F372-D427 HydrophobicContact CB-CB 4.34Å; F372-D427 HydrophobicContact CD1-CB 3.71Å; F372-D427 HydrophobicContact CE1-CB 4.43Å; F372-D427 HydrophobicContact CG-CB 4.34Å
373	R	88.5	Confident	84.6	Confident	201 Å²	201	57.3 Å²	57.3	76%	0.758	30%	0.298	S	S	*	.			trans	-78.8	104.9	174.5	-55.4	176.2	-175.9	171.2	2.2	108.9	N425	R373-N425 VanDerWaalsContact CB-OD1 3.28Å; R373-N425 WeakPolarHBondContact CB-OD1 3.49Å; R373-N425 WeakPolarHBondContact CG-OD1 3.49Å; R373-N425 PolarHBondContact N-OD1 3.31Å; R373-N425 PolarHBondContact O-ND2 3.28Å
374	S	86.8	Confident	83.2	Confident	42 Å²	42	57.9 Å²	57.9	29%	0.294	31%	0.309	S	S	.	.			trans	-68	150.3	179.5	57.2	0	0	0	0	112.2	F372 D378 V381	F372-S374 PolarHBondContact O-N 3.29Å; S374-D378 WeakPolarHBondContact CA-OD2 3.31Å; S374-V381 VanDerWaalsContact CB-CG2 3.44Å; S374-V381 VanDerWaalsContact OG-CG2 3.3Å; S374-V381 WeakPolarHBondContact OG-CG2 2.85Å
375	R	86.1	Confident	81.9	Confident	82 Å²	82	61.6 Å²	61.6	31%	0.309	32%	0.323	S	S	.	.			trans	-102	161.2	172.9	-57.2	-177.5	-178.6	164.5	7.9	109.8	E377 D378 V381 D420	R375-E377 WeakPolarHBondContact CB-OE2 3.48Å; R375-E377 PolarHBondContact O-N 2.93Å; R375-E377 VanDerWaalsContact O-N 3.09Å; R375-D378 PolarHBondContact N-OD2 3.24Å; R375-D378 VanDerWaalsContact O-CB 3.32Å; R375-D378 WeakPolarHBondContact O-CB 3.47Å; R375-D378 PolarHBondContact O-N 3.09Å; R375-V381 VanDerWaalsContact O-CG2 3.25Å; R375-V381 WeakPolarHBondContact O-CG2 3.31Å; R375-D420 IonicContact CZ-OD2 3.84Å; R375-D420 IonicContact NH1-OD2 2.78Å; R375-D420 PolarHBondContact NH1-OD2 3.02Å; R375-D420 PolarHBondContact NH2-O 3.48Å
376	Q	82.6	Confident	80.6	Confident	179 Å²	179	66.6 Å²	66.6	84%	0.836	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.5	-179.4	-68.8	-176.5	-13	0	0	113.2	D378	Q376-D378 VanDerWaalsContact C-N 3.28Å; Q376-D378 PolarHBondContact O-N 3.24Å
377	E	82.3	Confident	79.6	Confident	142 Å²	142	71.4 Å²	71.4	66%	0.664	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.8	178	-46.6	80.6	-162.1	0	0	113.3	R375	R375-E377 WeakPolarHBondContact CB-OE2 3.48Å; R375-E377 PolarHBondContact O-N 2.93Å; R375-E377 VanDerWaalsContact O-N 3.09Å
378	D	83.4	Confident	79	Confident	7 Å²	7	73.9 Å²	73.9	4%	0.037	39%	0.386	C	S	.	.	S	Bend	trans	-75.3	132	-179.8	-67.4	-35.4	0	0	0	111.1	S374 R375 Q376 C380 V381 R421	S374-D378 WeakPolarHBondContact CA-OD2 3.31Å; R375-D378 PolarHBondContact N-OD2 3.24Å; R375-D378 VanDerWaalsContact O-CB 3.32Å; R375-D378 WeakPolarHBondContact O-CB 3.47Å; R375-D378 PolarHBondContact O-N 3.09Å; Q376-D378 VanDerWaalsContact C-N 3.28Å; Q376-D378 PolarHBondContact O-N 3.24Å; D378-C380 PolarHBondContact O-N 2.91Å; D378-V381 HydrophobicContact CB-CG2 4Å; D378-V381 WeakPolarHBondContact O-CB 3.25Å; D378-V381 PolarHBondContact O-N 2.92Å; D378-R421 IonicContact OD1-CZ 3.76Å; D378-R421 VanDerWaalsContact OD1-CZ 3.31Å; D378-R421 IonicContact OD1-NH1 3.46Å; D378-R421 PolarHBondContact OD1-NH1 3.13Å; D378-R421 IonicContact OD1-NH2 3.39Å; D378-R421 PolarHBondContact OD1-NH2 2.75Å; D378-R421 IonicContact OD2-CZ 2.94Å; D378-R421 IonicContact OD2-NH1 3.25Å; D378-R421 PolarHBondContact OD2-NH1 3.29Å; D378-R421 IonicContact OD2-NH2 2.71Å
379	V	78.3	Confident	78.8	Confident	91 Å²	91	74.3 Å²	74.3	55%	0.552	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.4	-174.8	-180	0	0	0	0	112.7	V381 R385	V379-V381 VanDerWaalsContact C-N 3.33Å; V379-R385 PolarHBondContact O-NH1 3.46Å; V379-R385 VanDerWaalsContact O-NH1 3.13Å
380	C	79.4	Confident	78.3	Confident	4 Å²	4	83 Å²	83	3%	0.027	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-8.5	178.8	56.2	0	0	0	0	114.3	P367 C369 D378 Q382 R385	P367-C380 WeakPolarHBondContact O-CB 3.28Å; C369-C380 HydrophobicContact CB-CB 3.79Å; C369-C380 WeakPolarHBondContact CB-SG 3.3Å; C369-C380 WeakPolarHBondContact SG-CB 3.41Å; C369-C380 CovalentContact SG-SG 1.99Å; C369-C380 PolarHBondContact SG-SG 3.44Å; D378-C380 PolarHBondContact O-N 2.91Å; C380-Q382 PolarHBondContact O-N 3.32Å; C380-R385 WeakPolarHBondContact O-CB 3.49Å
381	V	72.1	Confident	78	Confident	64 Å²	64	85.6 Å²	85.6	39%	0.388	44%	0.439	S	S	.	.			trans	-85.6	19.6	-173.5	-178.2	0	0	0	0	113.4	S374 R375 D378 V379	S374-V381 VanDerWaalsContact CB-CG2 3.44Å; S374-V381 VanDerWaalsContact OG-CG2 3.3Å; S374-V381 WeakPolarHBondContact OG-CG2 2.85Å; R375-V381 VanDerWaalsContact O-CG2 3.25Å; R375-V381 WeakPolarHBondContact O-CG2 3.31Å; D378-V381 HydrophobicContact CB-CG2 4Å; D378-V381 WeakPolarHBondContact O-CB 3.25Å; D378-V381 PolarHBondContact O-N 2.92Å; V379-V381 VanDerWaalsContact C-N 3.33Å
382	Q	66.9	Low	77.7	Confident	128 Å²	128	87.7 Å²	87.7	60%	0.598	44%	0.442	S	S	*	.	S	Bend	trans	-68.5	149.2	171.2	-64.7	-160.1	-8.9	0	0	111.7	C380 G384 R385	C380-Q382 PolarHBondContact O-N 3.32Å; Q382-G384 PolarHBondContact O-N 2.75Å; Q382-R385 PolarHBondContact O-N 3.38Å; Q382-R385 VanDerWaalsContact O-N 3.14Å
383	P	59.2	Low	77.6	Confident	136 Å²	136	91.3 Å²	91.3	88%	0.883	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	127.2	-178.9	-23.7	31.8	0	0	0	111.6	R385	P383-R385 PolarHBondContact O-N 2.72Å
384	G	60	Low	77.7	Confident	42 Å²	42	86.4 Å²	86.4	43%	0.433	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-12.8	177.4	0	0	0	0	0	116.6	Q382 H386 V388	Q382-G384 PolarHBondContact O-N 2.75Å; G384-H386 PolarHBondContact O-N 3.15Å; G384-V388 WeakPolarHBondContact O-CG2 3.22Å
385	R	66.1	Low	77.8	Confident	78 Å²	78	84.8 Å²	84.8	29%	0.294	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-30.9	178.1	-107.9	-177.7	170.6	168.5	-6.4	113.5	V379 C380 Q382 P383 V388 E398	V379-R385 PolarHBondContact O-NH1 3.46Å; V379-R385 VanDerWaalsContact O-NH1 3.13Å; C380-R385 WeakPolarHBondContact O-CB 3.49Å; Q382-R385 PolarHBondContact O-N 3.38Å; Q382-R385 VanDerWaalsContact O-N 3.14Å; P383-R385 PolarHBondContact O-N 2.72Å; R385-V388 WeakPolarHBondContact O-CB 2.97Å; R385-V388 WeakPolarHBondContact O-CG2 3.46Å; R385-E398 IonicContact NH2-OE1 2.67Å
386	H	68.1	Low	78.1	Confident	106 Å²	106	85.7 Å²	85.7	49%	0.491	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-25.1	178.9	-161.5	64.6	0	0	0	113.1	G384 V388 C389	G384-H386 PolarHBondContact O-N 3.15Å; H386-V388 PolarHBondContact O-N 3.38Å; H386-C389 VanDerWaalsContact O-CB 3.25Å; H386-C389 WeakPolarHBondContact O-CB 3.28Å; H386-C389 PolarHBondContact O-N 3.48Å; H386-C389 PolarHBondContact O-SG 3.12Å
387	D	72	Confident	78.6	Confident	101 Å²	101	77.7 Å²	77.7	54%	0.54	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-63.4	-25.3	174.6	-73.2	-55.7	0	0	0	112.4	C389 K390	D387-C389 PolarHBondContact O-N 3.4Å; D387-K390 PolarHBondContact O-N 3.16Å; D387-K390 IonicContact OD1-NZ 2.74Å
388	V	78.2	Confident	79.1	Confident	62 Å²	62	74.6 Å²	74.6	38%	0.376	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-62.9	-22.3	174.1	-167.9	0	0	0	0	111.8	G384 R385 H386 K390 D391 I395	G384-V388 WeakPolarHBondContact O-CG2 3.22Å; R385-V388 WeakPolarHBondContact O-CB 2.97Å; R385-V388 WeakPolarHBondContact O-CG2 3.46Å; H386-V388 PolarHBondContact O-N 3.38Å; V388-K390 PolarHBondContact O-N 2.04Å; V388-D391 CarbonylContact O-C 3.58Å; V388-D391 VanDerWaalsContact O-C 3.32Å; V388-D391 PolarHBondContact O-N 3.48Å; V388-D391 VanDerWaalsContact O-O 3.13Å; V388-I395 HydrophobicContact CG1-CD1 4.22Å; V388-I395 HydrophobicContact CG1-CG1 3.72Å
389	C	83.3	Confident	79.3	Confident	20 Å²	20	76.2 Å²	76.2	14%	0.135	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-66.1	-5.7	177.6	-62	0	0	0	0	114.1	C370 H386 D387 Q392	C370-C389 WeakPolarHBondContact CA-SG 3.22Å; C370-C389 HydrophobicContact CB-CB 3.74Å; C370-C389 WeakPolarHBondContact CB-SG 3.1Å; C370-C389 WeakPolarHBondContact SG-CA 3.1Å; C370-C389 WeakPolarHBondContact SG-CB 3.32Å; C370-C389 CovalentContact SG-SG 2.04Å; C370-C389 PolarHBondContact SG-SG 1.99Å; H386-C389 VanDerWaalsContact O-CB 3.25Å; H386-C389 WeakPolarHBondContact O-CB 3.28Å; H386-C389 PolarHBondContact O-N 3.48Å; H386-C389 PolarHBondContact O-SG 3.12Å; D387-C389 PolarHBondContact O-N 3.4Å; C389-Q392 WeakPolarHBondContact O-CG 3.49Å; C389-Q392 PolarHBondContact O-NE2 2.96Å
390	K	81.3	Confident	80.1	Confident	182 Å²	182	72.1 Å²	72.1	79%	0.791	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-77	-36.1	169.7	-65.7	173.5	-176.3	160	0	112.7	D387 V388	D387-K390 PolarHBondContact O-N 3.16Å; D387-K390 IonicContact OD1-NZ 2.74Å; V388-K390 PolarHBondContact O-N 2.04Å
391	D	82.4	Confident	80.7	Confident	84 Å²	84	72 Å²	72	45%	0.449	37%	0.374	S	S	.	.	S	Bend	trans	-116.9	82.3	175	-179.6	12.2	0	0	0	109.4	V388 E393 N394	V388-D391 CarbonylContact O-C 3.58Å; V388-D391 VanDerWaalsContact O-C 3.32Å; V388-D391 PolarHBondContact O-N 3.48Å; V388-D391 VanDerWaalsContact O-O 3.13Å; D391-E393 VanDerWaalsContact C-N 3.35Å; D391-N394 PolarHBondContact OD1-ND2 3.44Å; D391-N394 PolarHBondContact OD2-ND2 3.07Å
392	Q	84.6	Confident	81.7	Confident	71 Å²	71	70.1 Å²	70.1	33%	0.332	36%	0.361	S	S	.	.			trans	-78.5	-20.6	-171.4	-61.9	-175.7	15.6	0	0	113.5	W317 C389 N394 I395	W317-Q392 VanDerWaalsContact CB-O 3.27Å; W317-Q392 WeakPolarHBondContact CB-O 3.36Å; C389-Q392 WeakPolarHBondContact O-CG 3.49Å; C389-Q392 PolarHBondContact O-NE2 2.96Å; Q392-N394 VanDerWaalsContact C-N 3.28Å; Q392-N394 PolarHBondContact O-N 3.02Å; Q392-I395 HydrophobicContact CB-CD1 4.23Å; Q392-I395 HydrophobicContact CG-CD1 4.37Å; Q392-I395 PolarHBondContact O-N 3.23Å
393	E	87.9	Confident	82.7	Confident	96 Å²	96	67 Å²	67	45%	0.449	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-37.9	-173.4	-71.6	-166.9	-175.6	0	0	111.8	T316 K318 D391	T316-E393 WeakPolarHBondContact CB-O 3.28Å; K318-E393 HydrophobicContact CB-CB 4.07Å; K318-E393 WeakPolarHBondContact CB-O 3.31Å; K318-E393 HydrophobicContact CD-CB 4.34Å; K318-E393 WeakPolarHBondContact CD-OE2 3.33Å; K318-E393 WeakPolarHBondContact CE-OE2 3.24Å; K318-E393 PolarHBondContact N-O 3.37Å; K318-E393 IonicContact NZ-OE2 2.79Å; K318-E393 PolarHBondContact NZ-OE2 3.34Å; D391-E393 VanDerWaalsContact C-N 3.35Å
394	N	89.6	Confident	84	Confident	97 Å²	97	66.2 Å²	66.2	52%	0.519	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	0.4	-173.3	-63.5	-47.1	0	0	0	113.6	D391 Q392 Q396	D391-N394 PolarHBondContact OD1-ND2 3.44Å; D391-N394 PolarHBondContact OD2-ND2 3.07Å; Q392-N394 VanDerWaalsContact C-N 3.28Å; Q392-N394 PolarHBondContact O-N 3.02Å; N394-Q396 PolarHBondContact O-N 3.01Å
395	I	90.8	Very high	85.2	Confident	8 Å²	8	71.2 Å²	71.2	4%	0.041	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-62.1	121.5	176.3	-64.8	175.6	0	0	0	108.6	T316 W317 P367 V388 Q392	T316-I395 CarbonylContact C-O 3.53Å; T316-I395 VanDerWaalsContact CA-O 3.3Å; T316-I395 WeakPolarHBondContact CA-O 3.48Å; W317-I395 PolarHBondContact N-O 2.89Å; P367-I395 HydrophobicContact CG-CG2 3.95Å; V388-I395 HydrophobicContact CG1-CD1 4.22Å; V388-I395 HydrophobicContact CG1-CG1 3.72Å; Q392-I395 HydrophobicContact CB-CD1 4.23Å; Q392-I395 HydrophobicContact CG-CD1 4.37Å; Q392-I395 PolarHBondContact O-N 3.23Å
396	Q	91.8	Very high	86.4	Confident	102 Å²	102	69.7 Å²	69.7	48%	0.477	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-73.5	132.7	175.2	-67.7	-67.2	-34	0	0	109.9	M315 P367 N394	M315-Q396 PolarHBondContact O-OE1 2.71Å; P367-Q396 VanDerWaalsContact CG-O 3.28Å; P367-Q396 WeakPolarHBondContact CG-O 3.14Å; N394-Q396 PolarHBondContact O-N 3.01Å
397	L	93.4	Very high	87.4	Confident	10 Å²	10	68.8 Å²	68.8	5%	0.052	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-72.9	151.2	170.4	-55.8	-164.9	0	0	0	110	M315 W317 Y320 L365 I400	M315-L397 HydrophobicContact CG-CB 4.29Å; M315-L397 HydrophobicContact CG-CD1 3.78Å; M315-L397 HydrophobicContact CG-CG 4.05Å; M315-L397 PolarHBondContact O-N 2.94Å; M315-L397 HydrophobicContact SD-CD1 4.13Å; W317-L397 HydrophobicContact CE3-CD2 4.05Å; Y320-L397 HydrophobicContact CD2-CD1 4.37Å; Y320-L397 HydrophobicContact CG-CD1 3.97Å; L365-L397 HydrophobicContact CD2-CD1 3.9Å; L397-I400 HydrophobicContact CB-CG1 3.95Å; L397-I400 HydrophobicContact CD1-CG1 4.4Å
398	E	91.3	Very high	88.4	Confident	78 Å²	78	67.9 Å²	67.9	36%	0.364	33%	0.325	S	S	.	.			trans	-122	156.5	-179.1	-67.5	-173.7	-166.6	0	0	111.2	S363 R364 P367 R385 I400	S363-E398 WeakPolarHBondContact O-CB 3.13Å; R364-E398 VanDerWaalsContact CA-O 3.24Å; R364-E398 WeakPolarHBondContact CA-O 3.05Å; R364-E398 PolarHBondContact O-N 2.91Å; R364-E398 VanDerWaalsContact O-N 3.13Å; P367-E398 HydrophobicContact CB-CB 4.48Å; P367-E398 HydrophobicContact CB-CG 4.07Å; P367-E398 HydrophobicContact CG-CG 4.32Å; R385-E398 IonicContact NH2-OE1 2.67Å; E398-I400 PolarHBondContact O-N 3.25Å
399	N	89.1	Confident	89.1	Confident	41 Å²	41	66.4 Å²	66.4	22%	0.219	31%	0.314	C	S	.	.			trans	54.4	28.8	172.8	-55.7	-68.9	0	0	0	115.2	R364 V401 N414	R364-N399 HydrophobicContact CG-CB 4.04Å; N399-V401 PolarHBondContact O-N 3.07Å; N399-N414 PolarHBondContact OD1-ND2 3.13Å
400	I	93.7	Very high	89.7	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.021	31%	0.309	C	S	.	.			trans	-84.8	99.7	171	-53.6	-52.8	0	0	0	108.1	T312 V313 W349 L352 R364 L365 L397 E398 L410	T312-I400 CarbonylContact C-O 3.24Å; T312-I400 WeakPolarHBondContact CA-O 3.44Å; V313-I400 HydrophobicContact CB-CB 4.2Å; V313-I400 HydrophobicContact CB-CG2 3.78Å; V313-I400 HydrophobicContact CG2-CG2 3.86Å; V313-I400 PolarHBondContact N-O 3.09Å; W349-I400 HydrophobicContact CH2-CG2 3.76Å; W349-I400 HydrophobicContact CZ3-CD1 4.13Å; W349-I400 HydrophobicContact CZ3-CG2 4.25Å; L352-I400 HydrophobicContact CD2-CD1 4.18Å; R364-I400 HydrophobicContact CB-CD1 4.1Å; L365-I400 HydrophobicContact CD2-CD1 4.36Å; L397-I400 HydrophobicContact CB-CG1 3.95Å; L397-I400 HydrophobicContact CD1-CG1 4.4Å; E398-I400 PolarHBondContact O-N 3.25Å; I400-L410 HydrophobicContact CG2-CD2 3.61Å
401	V	92.9	Very high	90.4	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	143.4	-169.2	177.9	0	0	0	0	111.4	L301 P310 A311 T312 N399 L410 V411 T413	L301-V401 HydrophobicContact CD2-CG1 3.85Å; P310-V401 HydrophobicContact CB-CG1 4.04Å; P310-V401 HydrophobicContact CB-CG2 4.14Å; P310-V401 HydrophobicContact CG-CG2 4.06Å; A311-V401 WeakPolarHBondContact O-CA 3.39Å; T312-V401 HydrophobicContact CG2-CG2 3.97Å; N399-V401 PolarHBondContact O-N 3.07Å; V401-L410 CarbonylContact O-C 3.49Å; V401-L410 WeakPolarHBondContact O-CA 3.48Å; V401-V411 HydrophobicContact CG1-CB 4.4Å; V401-V411 PolarHBondContact O-N 3.21Å; V401-T413 WeakPolarHBondContact CG2-OG1 2.96Å
402	H	92.2	Very high	91.1	Very high	25 Å²	25	53.1 Å²	53.1	12%	0.116	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	171.6	168.6	64.1	79.1	0	0	0	110.1	A311 V313 L407 H409	A311-H402 PolarHBondContact O-N 3.36Å; V313-H402 VanDerWaalsContact CG2-CD2 3.47Å; V313-H402 WeakPolarHBondContact CG2-CD2 3.33Å; H402-L407 WeakPolarHBondContact CE1-CD2 3.32Å; H402-L407 VanDerWaalsContact ND1-CD2 3.31Å; H402-L407 WeakPolarHBondContact ND1-CD2 3.37Å; H402-H409 WeakPolarHBondContact CB-O 3.19Å
403	R	89.9	Confident	91.4	Very high	64 Å²	64	50.5 Å²	50.5	24%	0.242	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	156.2	174.7	-66.8	-177.3	173	85.6	6.7	110.4	D298 S300 L301 H405 D406 V411	D298-R403 IonicContact OD2-CZ 3.68Å; D298-R403 IonicContact OD2-NE 2.77Å; D298-R403 PolarHBondContact OD2-NE 2.02Å; D298-R403 IonicContact OD2-NH2 3.85Å; D298-R403 PolarHBondContact OD2-NH2 2.98Å; D298-R403 VanDerWaalsContact OD2-NH2 3.11Å; S300-R403 WeakPolarHBondContact OG-CD 2.94Å; S300-R403 WeakPolarHBondContact OG-CG 3.43Å; L301-R403 HydrophobicContact CD2-CG 3.75Å; R403-H405 VanDerWaalsContact C-N 3.31Å; R403-H405 PolarHBondContact O-N 3.23Å; R403-D406 HydrophobicContact CB-CB 4.29Å; R403-D406 PolarHBondContact N-O 3.44Å; R403-D406 CarbonylContact O-C 3.42Å; R403-D406 VanDerWaalsContact O-C 3.24Å; R403-D406 PolarHBondContact O-N 3.31Å; R403-V411 HydrophobicContact CG-CG2 3.99Å; R403-V411 VanDerWaalsContact NH1-CG2 3.29Å
404	E	84.8	Confident	91.4	Very high	119 Å²	119	48.7 Å²	48.7	56%	0.556	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-41.7	175.8	-172	179.5	-171.5	0	0	112.7	S300 P303 L407	S300-E404 PolarHBondContact O-N 2.97Å; P303-E404 HydrophobicContact CB-CB 4.02Å; P303-E404 VanDerWaalsContact CB-CD 3.46Å; P303-E404 HydrophobicContact CB-CG 3.83Å; E404-L407 WeakPolarHBondContact O-CD2 3.42Å
405	H	86.7	Confident	91.6	Very high	147 Å²	147	44.1 Å²	44.1	68%	0.681	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-5	-179.2	60.9	-89.3	0	0	0	113.6	R403	R403-H405 VanDerWaalsContact C-N 3.31Å; R403-H405 PolarHBondContact O-N 3.23Å
406	D	90.4	Very high	91.6	Very high	46 Å²	46	48.8 Å²	48.8	25%	0.246	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	88.5	178.1	-173.7	-4.2	0	0	0	109.8	R403 R408 H409	R403-D406 HydrophobicContact CB-CB 4.29Å; R403-D406 PolarHBondContact N-O 3.44Å; R403-D406 CarbonylContact O-C 3.42Å; R403-D406 VanDerWaalsContact O-C 3.24Å; R403-D406 PolarHBondContact O-N 3.31Å; D406-R408 VanDerWaalsContact C-N 3.26Å; D406-R408 PolarHBondContact O-N 3.1Å; D406-R408 PolarHBondContact OD1-N 2.88Å; D406-H409 VanDerWaalsContact CG-ND1 3.29Å; D406-H409 IonicContact OD1-CG 3.91Å; D406-H409 PolarHBondContact OD1-N 3.41Å; D406-H409 IonicContact OD1-ND1 3.69Å; D406-H409 PolarHBondContact OD1-ND1 3.33Å; D406-H409 IonicContact OD2-CE1 3.28Å; D406-H409 IonicContact OD2-CG 2.88Å; D406-H409 IonicContact OD2-ND1 3.58Å; D406-H409 PolarHBondContact OD2-ND1 3.17Å
407	L	90.1	Very high	91.5	Very high	87 Å²	87	44.3 Å²	44.3	46%	0.455	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-1	-177.9	-51.6	179.4	0	0	0	113.3	S343 I344 H402 E404	S343-L407 WeakPolarHBondContact CB-O 3.32Å; S343-L407 PolarHBondContact OG-O 3.3Å; I344-L407 WeakPolarHBondContact CD1-O 3.46Å; H402-L407 WeakPolarHBondContact CE1-CD2 3.32Å; H402-L407 VanDerWaalsContact ND1-CD2 3.31Å; H402-L407 WeakPolarHBondContact ND1-CD2 3.37Å; E404-L407 WeakPolarHBondContact O-CD2 3.42Å
408	R	91.3	Very high	91.5	Very high	81 Å²	81	45.1 Å²	45.1	31%	0.306	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-28.1	-172	-58.8	-167.3	178	-140.5	-8.1	113	W329 S343 I344 Y345 D406	W329-R408 VanDerWaalsContact CE3-NH1 3.26Å; W329-R408 VanDerWaalsContact CZ3-NH2 3.33Å; S343-R408 WeakPolarHBondContact O-CA 3.38Å; I344-R408 WeakPolarHBondContact CA-O 3.24Å; Y345-R408 HydrophobicContact CD2-CB 3.7Å; Y345-R408 HydrophobicContact CE2-CB 3.61Å; Y345-R408 HydrophobicContact CE2-CG 4.27Å; Y345-R408 HydrophobicContact CG-CB 4.45Å; Y345-R408 VanDerWaalsContact CZ-CD 3.43Å; Y345-R408 PolarHBondContact N-O 3.28Å; Y345-R408 VanDerWaalsContact N-O 3.07Å; Y345-R408 VanDerWaalsContact OH-CD 3.24Å; Y345-R408 WeakPolarHBondContact OH-CD 3.45Å; Y345-R408 PolarHBondContact OH-NH1 2.78Å; D406-R408 VanDerWaalsContact C-N 3.26Å; D406-R408 PolarHBondContact O-N 3.1Å; D406-R408 PolarHBondContact OD1-N 2.88Å
409	H	93.8	Very high	91.5	Very high	31 Å²	31	43 Å²	43	14%	0.144	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139.5	179	-59	103.4	0	0	0	111.9	R274 Y345 E348 H402 D406	R274-H409 PolarHBondContact NH2-CD2 3.17Å; R274-H409 VanDerWaalsContact NH2-CD2 3.28Å; Y345-H409 AromaticContact CD2-CD2 3.92Å; Y345-H409 AromaticContact CD2-NE2 3.46Å; Y345-H409 WeakPolarHBondContact CD2-NE2 3.17Å; Y345-H409 AromaticContact CE2-CE1 3.79Å; Y345-H409 AromaticContact CE2-NE2 3.63Å; E348-H409 IonicContact OE1-CD2 3.67Å; E348-H409 IonicContact OE2-CD2 3.51Å; H402-H409 WeakPolarHBondContact CB-O 3.19Å; D406-H409 VanDerWaalsContact CG-ND1 3.29Å; D406-H409 IonicContact OD1-CG 3.91Å; D406-H409 PolarHBondContact OD1-N 3.41Å; D406-H409 IonicContact OD1-ND1 3.69Å; D406-H409 PolarHBondContact OD1-ND1 3.33Å; D406-H409 IonicContact OD2-CE1 3.28Å; D406-H409 IonicContact OD2-CG 2.88Å; D406-H409 IonicContact OD2-ND1 3.58Å; D406-H409 PolarHBondContact OD2-ND1 3.17Å
410	L	95.6	Very high	91.5	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	148.5	177.4	-67.1	177.5	0	0	0	110.3	R274 I344 E348 W349 L352 I400 V401 F412	R274-L410 WeakPolarHBondContact CD-O 3.16Å; I344-L410 HydrophobicContact CD1-CD2 3.68Å; I344-L410 HydrophobicContact CD1-CG 4.37Å; I344-L410 HydrophobicContact CG1-CD2 4.09Å; I344-L410 HydrophobicContact CG2-CD1 4.12Å; I344-L410 HydrophobicContact CG2-CD2 4.08Å; I344-L410 HydrophobicContact CG2-CG 3.83Å; E348-L410 HydrophobicContact CB-CB 4.37Å; E348-L410 HydrophobicContact CB-CD1 3.9Å; E348-L410 HydrophobicContact CB-CG 3.92Å; E348-L410 PolarHBondContact OE2-N 2.8Å; W349-L410 HydrophobicContact CD2-CD1 4.44Å; W349-L410 HydrophobicContact CE3-CD1 4.04Å; W349-L410 HydrophobicContact CH2-CD1 4.49Å; W349-L410 HydrophobicContact CZ3-CD1 4.08Å; L352-L410 HydrophobicContact CB-CD1 4.34Å; L352-L410 HydrophobicContact CD2-CD1 4.12Å; I400-L410 HydrophobicContact CG2-CD2 3.61Å; V401-L410 CarbonylContact O-C 3.49Å; V401-L410 WeakPolarHBondContact O-CA 3.48Å; L410-F412 HydrophobicContact CB-CD1 4.33Å; L410-F412 HydrophobicContact CB-CE1 3.95Å
411	V	96.4	Very high	91.3	Very high	3 Å²	3	45 Å²	45	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.8	169.8	-172.9	0	0	0	0	108.3	I276 L301 V401 R403 T413	I276-V411 HydrophobicContact CD1-CG1 4.17Å; I276-V411 HydrophobicContact CG1-CG1 3.84Å; L301-V411 HydrophobicContact CD1-CG1 4.46Å; L301-V411 HydrophobicContact CD2-CB 4.1Å; L301-V411 HydrophobicContact CD2-CG1 4.13Å; L301-V411 HydrophobicContact CD2-CG2 3.92Å; V401-V411 HydrophobicContact CG1-CB 4.4Å; V401-V411 PolarHBondContact O-N 3.21Å; R403-V411 HydrophobicContact CG-CG2 3.99Å; R403-V411 VanDerWaalsContact NH1-CG2 3.29Å; V411-T413 HydrophobicContact CB-CG2 4.5Å; V411-T413 HydrophobicContact CG1-CG2 3.87Å; V411-T413 PolarHBondContact O-N 3.22Å; V411-T413 VanDerWaalsContact O-N 3.16Å
412	F	96.3	Very high	91.1	Very high	1 Å²	1	49 Å²	49	0%	0.004	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-85.1	96.6	-177.2	-63.7	-1.6	0	0	0	108.9	L272 R274 T275 K351 L352 F355 R364 L410 N415	L272-F412 HydrophobicContact CD1-CE2 4.4Å; R274-F412 HydrophobicContact CB-CB 4.36Å; R274-F412 HydrophobicContact CB-CD1 3.77Å; R274-F412 HydrophobicContact CB-CD2 3.67Å; R274-F412 HydrophobicContact CB-CE1 3.81Å; R274-F412 HydrophobicContact CB-CE2 3.73Å; R274-F412 HydrophobicContact CB-CG 3.67Å; R274-F412 HydrophobicContact CB-CZ 3.78Å; R274-F412 HydrophobicContact CG-CE1 4.07Å; R274-F412 HydrophobicContact CG-CE2 4.19Å; R274-F412 HydrophobicContact CG-CZ 3.88Å; R274-F412 PolarHBondContact O-N 3.2Å; T275-F412 HydrophobicContact CG2-CB 3.79Å; T275-F412 HydrophobicContact CG2-CD2 4.34Å; K351-F412 HydrophobicContact CB-CZ 4.11Å; L352-F412 VanDerWaalsContact CA-CZ 3.42Å; L352-F412 HydrophobicContact CB-CE1 3.91Å; L352-F412 HydrophobicContact CB-CZ 3.88Å; L352-F412 HydrophobicContact CD1-CD1 3.6Å; L352-F412 HydrophobicContact CD1-CE1 3.39Å; L352-F412 HydrophobicContact CD1-CE2 4.5Å; L352-F412 HydrophobicContact CD1-CG 4.29Å; L352-F412 HydrophobicContact CD1-CZ 3.9Å; L352-F412 HydrophobicContact CG-CE1 4.28Å; F355-F412 HydrophobicContact CB-CD2 4.24Å; F355-F412 HydrophobicContact CB-CE2 3.81Å; F355-F412 AromaticContact CD1-CD2 3.56Å; F355-F412 HydrophobicContact CD1-CD2 3.56Å; F355-F412 HydrophobicContact CD1-CE2 4.01Å; F355-F412 HydrophobicContact CD1-CG 4.42Å; F355-F412 HydrophobicContact CD2-CD2 4.48Å; F355-F412 HydrophobicContact CE1-CB 4.47Å; F355-F412 AromaticContact CE1-CD2 3.91Å; F355-F412 HydrophobicContact CE1-CD2 3.91Å; F355-F412 AromaticContact CG-CD2 3.84Å; F355-F412 HydrophobicContact CG-CD2 3.84Å; F355-F412 AromaticContact CG-CE2 3.9Å; F355-F412 HydrophobicContact CG-CE2 3.9Å; F355-F412 HydrophobicContact CZ-CD2 4.49Å; R364-F412 VanDerWaalsContact NH2-C 3.33Å; L410-F412 HydrophobicContact CB-CD1 4.33Å; L410-F412 HydrophobicContact CB-CE1 3.95Å; F412-N415 PolarHBondContact O-ND2 3.05Å; F412-N415 PolarHBondContact O-OD1 3.36Å
413	T	91.8	Very high	91.2	Very high	16 Å²	16	51.2 Å²	51.2	10%	0.098	24%	0.244	C	C	.	.			trans	-115.1	158.4	177	61.4	0	0	0	0	111.9	I276 L301 R364 V401 V411	I276-T413 HydrophobicContact CD1-CG2 3.65Å; I276-T413 HydrophobicContact CG1-CG2 4.37Å; L301-T413 HydrophobicContact CD1-CG2 4.29Å; R364-T413 VanDerWaalsContact NH2-N 3.12Å; R364-T413 PolarHBondContact NH2-O 3.47Å; V401-T413 WeakPolarHBondContact CG2-OG1 2.96Å; V411-T413 HydrophobicContact CB-CG2 4.5Å; V411-T413 HydrophobicContact CG1-CG2 3.87Å; V411-T413 PolarHBondContact O-N 3.22Å; V411-T413 VanDerWaalsContact O-N 3.16Å
414	N	87.8	Confident	91.2	Very high	57 Å²	57	54.5 Å²	54.5	31%	0.305	27%	0.266	S	S	.	.			trans	60.6	48	-177.2	-54.8	-29.9	0	0	0	111.3	E260 N399 K416	E260-N414 WeakPolarHBondContact OE1-CA 3.33Å; E260-N414 PolarHBondContact OE1-N 2.88Å; E260-N414 VanDerWaalsContact OE1-N 3.15Å; N399-N414 PolarHBondContact OD1-ND2 3.13Å; N414-K416 PolarHBondContact O-N 3.44Å
415	N	94	Very high	91.6	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	25%	0.247	C	C	.	.			trans	-77.6	56	-176.6	-55.2	-66.1	0	0	0	112.2	T259 E260 A263 F355 I361 R364 F412 G417	T259-N415 WeakPolarHBondContact CB-O 3.49Å; T259-N415 PolarHBondContact OG1-O 3.29Å; E260-N415 PolarHBondContact OE1-N 3.17Å; E260-N415 WeakPolarHBondContact OE2-CB 3.03Å; E260-N415 PolarHBondContact OE2-ND2 3.34Å; A263-N415 HydrophobicContact CB-CB 3.42Å; A263-N415 VanDerWaalsContact CB-CB 3.42Å; F355-N415 WeakPolarHBondContact CE1-OD1 3.25Å; I361-N415 HydrophobicContact CD1-CB 4.05Å; R364-N415 PolarHBondContact NH2-OD1 3.04Å; F412-N415 PolarHBondContact O-ND2 3.05Å; F412-N415 PolarHBondContact O-OD1 3.36Å; N415-G417 PolarHBondContact O-N 2.94Å
416	K	90.4	Very high	92	Very high	107 Å²	107	43.4 Å²	43.4	47%	0.465	22%	0.216	S	C	.	.			trans	-73.5	87.2	177	-172.4	-178.7	176.3	-176.3	0	110.4	N414 F418	N414-K416 PolarHBondContact O-N 3.44Å; K416-F418 HydrophobicContact CD-CZ 4.18Å; K416-F418 HydrophobicContact CG-CE2 4.35Å; K416-F418 HydrophobicContact CG-CZ 4.37Å; K416-F418 WeakPolarHBondContact O-CD2 3.16Å; K416-F418 WeakPolarHBondContact O-CE2 3.32Å
417	G	90.9	Very high	92.3	Very high	7 Å²	7	41.2 Å²	41.2	7%	0.072	20%	0.204	C	C	.	.			trans	-78.1	147.2	176.5	0	0	0	0	0	113.4	T259 L359 N415	T259-G417 VanDerWaalsContact CG2-O 3.32Å; T259-G417 WeakPolarHBondContact CG2-O 3.49Å; L359-G417 CarbonylContact O-C 3.44Å; L359-G417 VanDerWaalsContact O-CA 3.28Å; L359-G417 WeakPolarHBondContact O-CA 3.38Å; N415-G417 PolarHBondContact O-N 2.94Å
418	F	91.8	Very high	92.5	Very high	28 Å²	28	40.4 Å²	40.4	12%	0.123	20%	0.197	C	C	.	.			trans	-115.3	97.8	-179.5	-65.2	-96.6	0	0	0	110.5	L359 Q360 H362 K416 D420 R421 R484	L359-F418 PolarHBondContact O-N 2.97Å; Q360-F418 HydrophobicContact CB-CB 4.45Å; Q360-F418 VanDerWaalsContact O-CD2 3.32Å; Q360-F418 WeakPolarHBondContact O-CD2 3.24Å; H362-F418 AromaticContact CD2-CE2 3.71Å; H362-F418 AromaticContact NE2-CE2 3.58Å; H362-F418 AromaticContact NE2-CZ 3.7Å; K416-F418 HydrophobicContact CD-CZ 4.18Å; K416-F418 HydrophobicContact CG-CE2 4.35Å; K416-F418 HydrophobicContact CG-CZ 4.37Å; K416-F418 WeakPolarHBondContact O-CD2 3.16Å; K416-F418 WeakPolarHBondContact O-CE2 3.32Å; F418-D420 VanDerWaalsContact C-N 3.34Å; F418-R421 HydrophobicContact CB-CG 3.61Å; F418-R484 VanDerWaalsContact O-CZ 3.27Å; F418-R484 PolarHBondContact O-NH1 2.98Å; F418-R484 PolarHBondContact O-NH2 3.17Å
419	F	92.1	Very high	92.7	Very high	33 Å²	33	36.9 Å²	36.9	15%	0.145	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.2	-177	-68	-94.1	0	0	0	114	T259 F262 L359 L477 V480 I481	T259-F419 HydrophobicContact CG2-CE2 4.17Å; F262-F419 HydrophobicContact CB-CZ 4.26Å; F262-F419 HydrophobicContact CD1-CE1 4.08Å; F262-F419 AromaticContact CD1-CZ 3.57Å; F262-F419 HydrophobicContact CD1-CZ 3.57Å; F262-F419 HydrophobicContact CD2-CE1 4.49Å; F262-F419 HydrophobicContact CD2-CZ 4.22Å; F262-F419 AromaticContact CE1-CE1 3.91Å; F262-F419 HydrophobicContact CE1-CE1 3.91Å; F262-F419 AromaticContact CE1-CZ 3.89Å; F262-F419 HydrophobicContact CE1-CZ 3.89Å; F262-F419 HydrophobicContact CE2-CE1 4.33Å; F262-F419 HydrophobicContact CE2-CZ 4.49Å; F262-F419 HydrophobicContact CG-CE1 4.36Å; F262-F419 AromaticContact CG-CZ 3.75Å; F262-F419 HydrophobicContact CG-CZ 3.75Å; F262-F419 HydrophobicContact CZ-CE1 4.04Å; F262-F419 HydrophobicContact CZ-CZ 4.33Å; L359-F419 HydrophobicContact CD2-CE1 4.48Å; L359-F419 HydrophobicContact CD2-CZ 3.94Å; F419-L477 HydrophobicContact CB-CD2 4.12Å; F419-L477 HydrophobicContact CD1-CB 4.25Å; F419-L477 HydrophobicContact CD1-CD2 3.74Å; F419-L477 HydrophobicContact CD2-CD2 4.25Å; F419-L477 HydrophobicContact CE1-CB 4.16Å; F419-L477 HydrophobicContact CE1-CD2 4.17Å; F419-L477 HydrophobicContact CG-CD2 3.77Å; F419-V480 HydrophobicContact CD1-CB 4.4Å; F419-V480 HydrophobicContact CD1-CG1 4.35Å; F419-I481 HydrophobicContact CD1-CD1 4.17Å; F419-I481 HydrophobicContact CD1-CG1 4.46Å; F419-I481 HydrophobicContact CE1-CD1 3.66Å; F419-I481 HydrophobicContact CE1-CG1 3.84Å; F419-I481 HydrophobicContact CZ-CD1 4.44Å
420	D	89.8	Confident	92.9	Very high	73 Å²	73	35.4 Å²	35.4	39%	0.39	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-1.6	-179.2	69.8	-43	0	0	0	113.3	R375 F418 N422	R375-D420 IonicContact CZ-OD2 3.84Å; R375-D420 IonicContact NH1-OD2 2.78Å; R375-D420 PolarHBondContact NH1-OD2 3.02Å; R375-D420 PolarHBondContact NH2-O 3.48Å; F418-D420 VanDerWaalsContact C-N 3.34Å; D420-N422 PolarHBondContact O-N 3.47Å
421	R	89.4	Confident	93	Very high	13 Å²	13	35.2 Å²	35.2	5%	0.049	18%	0.176	C	C	.	.			trans	-76.3	121.3	175.6	-55.5	-70.1	145.5	156.3	3.6	109.8	D378 F418 R484	D378-R421 IonicContact OD1-CZ 3.76Å; D378-R421 VanDerWaalsContact OD1-CZ 3.31Å; D378-R421 IonicContact OD1-NH1 3.46Å; D378-R421 PolarHBondContact OD1-NH1 3.13Å; D378-R421 IonicContact OD1-NH2 3.39Å; D378-R421 PolarHBondContact OD1-NH2 2.75Å; D378-R421 IonicContact OD2-CZ 2.94Å; D378-R421 IonicContact OD2-NH1 3.25Å; D378-R421 PolarHBondContact OD2-NH1 3.29Å; D378-R421 IonicContact OD2-NH2 2.71Å; F418-R421 HydrophobicContact CB-CG 3.61Å; R421-R484 PolarHBondContact O-NH2 3.29Å
422	N	88.9	Confident	93	Very high	87 Å²	87	39.1 Å²	39.1	47%	0.465	19%	0.194	S	C	.	.			trans	-68.7	156.1	176.3	-61.8	-14.8	0	0	0	111	D420 D424 N425	D420-N422 PolarHBondContact O-N 3.47Å; N422-D424 WeakPolarHBondContact CB-OD1 3.13Å; N422-D424 PolarHBondContact O-N 2.97Å; N422-N425 PolarHBondContact O-N 2.75Å
423	E	92.9	Very high	92.9	Very high	71 Å²	71	40.8 Å²	40.8	33%	0.332	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-66.1	-23.4	-176.6	-62.4	87.9	167.3	0	0	113.8	N425 R483 I487	E423-N425 VanDerWaalsContact C-N 3.31Å; E423-R483 HydrophobicContact CG-CB 4.26Å; E423-R483 WeakPolarHBondContact OE1-CD 3.46Å; E423-R483 IonicContact OE1-CZ 3.23Å; E423-R483 IonicContact OE1-NE 3.5Å; E423-R483 IonicContact OE1-NH1 3.81Å; E423-R483 PolarHBondContact OE1-NH1 3.27Å; E423-I487 HydrophobicContact CB-CD1 3.63Å; E423-I487 HydrophobicContact CG-CD1 3.78Å
424	D	90.8	Very high	93.2	Very high	132 Å²	132	40.4 Å²	40.4	71%	0.706	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-83	-6.2	178.4	65.8	-38.4	0	0	0	113.7	N422	N422-D424 WeakPolarHBondContact CB-OD1 3.13Å; N422-D424 PolarHBondContact O-N 2.97Å
425	N	91.9	Very high	93.7	Very high	28 Å²	28	44 Å²	44	15%	0.15	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-135.3	37.9	-177	-164.8	44.2	0	0	0	111.7	R373 N422 E423	R373-N425 VanDerWaalsContact CB-OD1 3.28Å; R373-N425 WeakPolarHBondContact CB-OD1 3.49Å; R373-N425 WeakPolarHBondContact CG-OD1 3.49Å; R373-N425 PolarHBondContact N-OD1 3.31Å; R373-N425 PolarHBondContact O-ND2 3.28Å; N422-N425 PolarHBondContact O-N 2.75Å; E423-N425 VanDerWaalsContact C-N 3.31Å
426	L	95.9	Very high	93.8	Very high	6 Å²	6	44.4 Å²	44.4	3%	0.031	22%	0.223	C	C	.	.			trans	-77.8	145.6	172.6	-59.6	176.1	0	0	0	110.4	F357 Q360 F428 R484 I487	F357-L426 HydrophobicContact CE2-CB 4.41Å; F357-L426 HydrophobicContact CZ-CD1 4.04Å; Q360-L426 HydrophobicContact CG-CD2 3.76Å; Q360-L426 VanDerWaalsContact OE1-CA 3.31Å; L426-F428 HydrophobicContact CB-CD2 4.39Å; L426-F428 HydrophobicContact CB-CE2 4.04Å; L426-F428 WeakPolarHBondContact O-CD2 3Å; L426-F428 PolarHBondContact O-N 2.65Å; L426-R484 HydrophobicContact CD1-CG 4.08Å; L426-R484 HydrophobicContact CD2-CG 4.07Å; L426-I487 HydrophobicContact CD1-CB 4.49Å; L426-I487 HydrophobicContact CD1-CD1 3.65Å; L426-I487 HydrophobicContact CD1-CG2 4.14Å
427	D	95.8	Very high	94.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.			trans	-79.2	96.3	175.3	-174.5	-2.6	0	0	0	110.6	F357 H362 D366 G371 F372 R429 L430	F357-D427 WeakPolarHBondContact CD2-O 3.21Å; H362-D427 WeakPolarHBondContact CB-OD2 2.98Å; D366-D427 WeakPolarHBondContact CB-OD2 3.25Å; G371-D427 WeakPolarHBondContact CA-OD1 3.46Å; F372-D427 HydrophobicContact CB-CB 4.34Å; F372-D427 HydrophobicContact CD1-CB 3.71Å; F372-D427 HydrophobicContact CE1-CB 4.43Å; F372-D427 HydrophobicContact CG-CB 4.34Å; D427-R429 VanDerWaalsContact C-N 3.3Å; D427-R429 WeakPolarHBondContact OD1-CA 3.02Å; D427-R429 WeakPolarHBondContact OD1-CB 3.28Å; D427-R429 PolarHBondContact OD1-N 2.85Å; D427-L430 HydrophobicContact CB-CD1 4.12Å; D427-L430 HydrophobicContact CB-CG 4.11Å; D427-L430 WeakPolarHBondContact OD2-CD2 3.18Å; D427-L430 WeakPolarHBondContact OD2-CG 3.39Å
428	F	95.9	Very high	94.4	Very high	70 Å²	70	39.3 Å²	39.3	31%	0.307	20%	0.2	S	C	.	.			trans	-80.8	-11.3	174.8	-76	-87	0	0	0	113.1	F357 L426 L430 L431 I487 Y491	F357-F428 AromaticContact CE2-CD1 3.83Å; F357-F428 HydrophobicContact CE2-CD1 3.83Å; F357-F428 AromaticContact CE2-CE1 3.89Å; F357-F428 HydrophobicContact CE2-CE1 3.89Å; F357-F428 HydrophobicContact CE2-CG 4.26Å; F357-F428 HydrophobicContact CE2-CZ 4.36Å; F357-F428 HydrophobicContact CZ-CD1 4.24Å; F357-F428 AromaticContact CZ-CE1 3.82Å; F357-F428 HydrophobicContact CZ-CE1 3.82Å; F357-F428 HydrophobicContact CZ-CZ 4.15Å; L426-F428 HydrophobicContact CB-CD2 4.39Å; L426-F428 HydrophobicContact CB-CE2 4.04Å; L426-F428 WeakPolarHBondContact O-CD2 3Å; L426-F428 PolarHBondContact O-N 2.65Å; F428-L430 PolarHBondContact O-N 2.82Å; F428-L431 HydrophobicContact CD1-CD1 4.19Å; F428-L431 PolarHBondContact O-N 3.12Å; F428-I487 HydrophobicContact CE1-CG2 3.98Å; F428-I487 HydrophobicContact CZ-CG2 3.52Å; F428-Y491 AromaticContact CD1-CD2 3.6Å; F428-Y491 HydrophobicContact CD1-CD2 3.6Å; F428-Y491 AromaticContact CD1-CE2 3.76Å; F428-Y491 HydrophobicContact CD1-CE2 3.76Å; F428-Y491 HydrophobicContact CD1-CG 4.37Å; F428-Y491 AromaticContact CE1-CD2 3.69Å; F428-Y491 HydrophobicContact CE1-CD2 3.69Å; F428-Y491 HydrophobicContact CE1-CE2 4.32Å; F428-Y491 HydrophobicContact CE1-CG 4.28Å
429	R	94.8	Very high	94.7	Very high	6 Å²	6	42.6 Å²	42.6	2%	0.023	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-60.3	-31.9	175.9	-168.6	-177.2	176.8	-170.5	1.6	110.7	W317 D366 C370 D427 L431 E432	W317-R429 HydrophobicContact CH2-CG 3.77Å; W317-R429 WeakPolarHBondContact CH2-O 3.36Å; W317-R429 HydrophobicContact CZ2-CG 3.9Å; W317-R429 HydrophobicContact CZ3-CG 4.48Å; D366-R429 IonicContact OD1-CZ 3.34Å; D366-R429 IonicContact OD1-NH1 3.06Å; D366-R429 PolarHBondContact OD1-NH1 2.91Å; C370-R429 VanDerWaalsContact CB-NH1 3.28Å; C370-R429 PolarHBondContact SG-NH1 2.75Å; D427-R429 VanDerWaalsContact C-N 3.3Å; D427-R429 WeakPolarHBondContact OD1-CA 3.02Å; D427-R429 WeakPolarHBondContact OD1-CB 3.28Å; D427-R429 PolarHBondContact OD1-N 2.85Å; R429-L431 PolarHBondContact O-N 2.63Å; R429-E432 WeakPolarHBondContact O-CB 3.34Å; R429-E432 PolarHBondContact O-N 2.83Å
430	L	97	Very high	94.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-54.9	-24.8	174.2	-53.7	-179.7	0	0	0	113.8	A353 D356 L365 D366 D427 F428	A353-L430 VanDerWaalsContact CB-O 3.31Å; A353-L430 WeakPolarHBondContact CB-O 3.2Å; D356-L430 HydrophobicContact CB-CD1 4.31Å; L365-L430 HydrophobicContact CB-CD2 3.76Å; L365-L430 HydrophobicContact CD1-CD2 4.45Å; D366-L430 HydrophobicContact CB-CD2 4.38Å; D427-L430 HydrophobicContact CB-CD1 4.12Å; D427-L430 HydrophobicContact CB-CG 4.11Å; D427-L430 WeakPolarHBondContact OD2-CD2 3.18Å; D427-L430 WeakPolarHBondContact OD2-CG 3.39Å; F428-L430 PolarHBondContact O-N 2.82Å
431	L	97.9	Very high	95.2	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-99.2	-4.7	-179.5	-58.8	177	0	0	0	113.1	A353 F357 F428 R429 G433 I434 L488 Y491	A353-L431 HydrophobicContact CB-CD2 4.41Å; F357-L431 HydrophobicContact CB-CD2 3.97Å; F357-L431 HydrophobicContact CB-CG 4.35Å; F357-L431 HydrophobicContact CD1-CD1 4.42Å; F357-L431 HydrophobicContact CD2-CD1 3.61Å; F357-L431 HydrophobicContact CD2-CD2 4.32Å; F357-L431 HydrophobicContact CD2-CG 3.79Å; F357-L431 HydrophobicContact CE2-CD1 3.75Å; F357-L431 HydrophobicContact CE2-CG 4.37Å; F357-L431 HydrophobicContact CG-CD1 3.96Å; F357-L431 HydrophobicContact CG-CD2 4.16Å; F357-L431 HydrophobicContact CG-CG 4.13Å; F357-L431 HydrophobicContact CZ-CD1 4.22Å; F428-L431 HydrophobicContact CD1-CD1 4.19Å; F428-L431 PolarHBondContact O-N 3.12Å; R429-L431 PolarHBondContact O-N 2.63Å; L431-G433 PolarHBondContact O-N 3.32Å; L431-I434 WeakPolarHBondContact O-CB 3.24Å; L431-I434 PolarHBondContact O-N 3.4Å; L431-I434 VanDerWaalsContact O-N 3.13Å; L431-L488 HydrophobicContact CD1-CD1 3.66Å; L431-L488 HydrophobicContact CD2-CD1 3.95Å; L431-L488 HydrophobicContact CG-CD1 4.49Å; L431-Y491 HydrophobicContact CB-CD1 4.44Å; L431-Y491 HydrophobicContact CB-CE1 3.7Å; L431-Y491 HydrophobicContact CD1-CD1 3.6Å; L431-Y491 HydrophobicContact CD1-CD2 4.46Å; L431-Y491 HydrophobicContact CD1-CE1 3.72Å; L431-Y491 HydrophobicContact CD1-CG 4Å; L431-Y491 HydrophobicContact CG-CE1 4.34Å
432	E	96.1	Very high	95.6	Very high	84 Å²	84	42.8 Å²	42.8	39%	0.393	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	131.3	-177.9	-76.9	-179.8	-178.3	0	0	111.9	W317 Q321 R429 I434	W317-E432 HydrophobicContact CH2-CB 4.31Å; W317-E432 HydrophobicContact CZ2-CB 4.05Å; W317-E432 WeakPolarHBondContact CZ2-OE2 3.42Å; Q321-E432 PolarHBondContact NE2-O 2.74Å; R429-E432 WeakPolarHBondContact O-CB 3.34Å; R429-E432 PolarHBondContact O-N 2.83Å; E432-I434 PolarHBondContact O-N 2.77Å
433	G	95.7	Very high	96	Very high	36 Å²	36	40.7 Å²	40.7	37%	0.371	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	-12.6	-177.8	0	0	0	0	0	114.6	L431 K435	L431-G433 PolarHBondContact O-N 3.32Å; G433-K435 PolarHBondContact O-N 3.29Å
434	I	97.9	Very high	96.2	Very high	9 Å²	9	37.8 Å²	37.8	5%	0.046	19%	0.194	C	C	.	.			trans	-73.5	118.7	179.6	-57.1	-62.4	0	0	0	110.3	L324 A353 L431 E432 E436 L437	L324-I434 HydrophobicContact CD1-CD1 3.96Å; L324-I434 HydrophobicContact CD2-CD1 3.89Å; A353-I434 HydrophobicContact CB-CD1 3.85Å; A353-I434 HydrophobicContact CB-CG1 3.71Å; L431-I434 WeakPolarHBondContact O-CB 3.24Å; L431-I434 PolarHBondContact O-N 3.4Å; L431-I434 VanDerWaalsContact O-N 3.13Å; E432-I434 PolarHBondContact O-N 2.77Å; I434-E436 WeakPolarHBondContact CG2-O 3.24Å; I434-L437 HydrophobicContact CG2-CD2 3.74Å; I434-L437 HydrophobicContact CG2-CG 4.14Å
435	K	96.9	Very high	96.5	Very high	132 Å²	132	31.9 Å²	31.9	57%	0.574	16%	0.163	S	C	*	.			trans	-113.6	-9.5	-178.8	-66.9	178.7	-178.4	175.6	0	113.8	G433 K498	G433-K435 PolarHBondContact O-N 3.29Å; K435-K498 PolarHBondContact O-N 3.4Å
436	E	96.5	Very high	96.7	Very high	9 Å²	9	36 Å²	36	4%	0.042	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	144.4	179.2	53.8	-170.1	-125.2	0	0	111.3	R327 Q330 H346 S350 I434 K498 I500 M502	R327-E436 IonicContact CZ-OE2 2.65Å; R327-E436 IonicContact NH1-OE2 3.74Å; R327-E436 IonicContact NH2-OE2 3.94Å; R327-E436 PolarHBondContact NH2-OE2 3.48Å; Q330-E436 PolarHBondContact NE2-OE1 3.34Å; Q330-E436 PolarHBondContact NE2-OE2 2.87Å; H346-E436 IonicContact CD2-OE1 2.71Å; H346-E436 PolarHBondContact CD2-OE1 2.75Å; H346-E436 IonicContact NE2-OE1 3.47Å; S350-E436 WeakPolarHBondContact CB-O 3.41Å; S350-E436 PolarHBondContact OG-O 2.75Å; I434-E436 WeakPolarHBondContact CG2-O 3.24Å; E436-K498 CarbonylContact C-O 3.47Å; E436-K498 WeakPolarHBondContact CA-O 3.49Å; E436-K498 HydrophobicContact CB-CB 4.5Å; E436-I500 HydrophobicContact CB-CD1 3.97Å; E436-I500 HydrophobicContact CB-CG1 4.23Å; E436-I500 HydrophobicContact CG-CD1 4.18Å; E436-I500 WeakPolarHBondContact OE1-CD1 3.5Å; E436-M502 HydrophobicContact CB-CE 3.89Å; E436-M502 HydrophobicContact CG-CE 3.77Å
437	L	97.9	Very high	96.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153	179.3	-73.4	178.5	0	0	0	111.7	S350 L354 I434 E439 V442 L488 I492 I497 K498 V499 I500 M502	S350-L437 WeakPolarHBondContact O-CD2 3.38Å; L354-L437 HydrophobicContact CB-CD2 3.99Å; L354-L437 HydrophobicContact CD1-CD1 4.44Å; L354-L437 HydrophobicContact CD1-CD2 4.29Å; I434-L437 HydrophobicContact CG2-CD2 3.74Å; I434-L437 HydrophobicContact CG2-CG 4.14Å; L437-E439 PolarHBondContact O-N 3.46Å; L437-V442 HydrophobicContact CB-CG2 3.97Å; L437-L488 HydrophobicContact CD1-CD1 4.48Å; L437-I492 HydrophobicContact CD1-CD1 3.49Å; L437-I492 VanDerWaalsContact CD1-CD1 3.49Å; L437-I492 HydrophobicContact CD1-CG1 3.61Å; L437-I497 HydrophobicContact CB-CG2 4.29Å; L437-I497 HydrophobicContact CD1-CG2 3.94Å; L437-I497 HydrophobicContact CG-CG2 3.8Å; L437-K498 PolarHBondContact N-O 2.95Å; L437-V499 WeakPolarHBondContact O-CA 3.34Å; L437-I500 PolarHBondContact O-N 3.18Å; L437-I500 VanDerWaalsContact O-N 3.07Å; L437-M502 VanDerWaalsContact C-CE 3.49Å
438	P	97.1	Very high	96.2	Very high	8 Å²	8	50.3 Å²	50.3	5%	0.052	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	124.4	-174.2	23.6	-31	0	0	0	112.3	L272 K351 L354 Q440 A441 V442 M502	L272-P438 HydrophobicContact CD2-CG 3.97Å; K351-P438 HydrophobicContact CG-CG 4.3Å; L354-P438 HydrophobicContact CD1-CG 4.14Å; P438-Q440 PolarHBondContact O-N 3.28Å; P438-A441 HydrophobicContact CB-CB 4.45Å; P438-A441 HydrophobicContact CG-CB 3.97Å; P438-A441 PolarHBondContact O-N 2.86Å; P438-V442 WeakPolarHBondContact O-CG2 3.48Å; P438-V442 PolarHBondContact O-N 2.95Å; P438-M502 HydrophobicContact CB-CB 4.38Å; P438-M502 HydrophobicContact CB-CG 4.33Å; P438-M502 HydrophobicContact CB-SD 3.84Å; P438-M502 HydrophobicContact CG-SD 4.31Å
439	E	97.1	Very high	96.2	Very high	97 Å²	97	52.1 Å²	52.1	45%	0.453	25%	0.245	S	C	.	.	H	α-helix	trans	-57.2	-44.2	-178.4	180	176.2	-156.2	0	0	113.3	L437 A441 V442 S443 V499 I500 P501	L437-E439 PolarHBondContact O-N 3.46Å; E439-A441 PolarHBondContact O-N 2.88Å; E439-V442 PolarHBondContact O-N 3.13Å; E439-S443 VanDerWaalsContact O-CB 3.22Å; E439-S443 WeakPolarHBondContact O-CB 3.38Å; E439-S443 PolarHBondContact O-N 2.79Å; E439-S443 PolarHBondContact O-OG 3.02Å; E439-V499 VanDerWaalsContact CA-CG1 3.44Å; E439-V499 HydrophobicContact CB-CG1 3.86Å; E439-V499 HydrophobicContact CG-CG1 4.15Å; E439-I500 WeakPolarHBondContact CB-O 3.46Å; E439-I500 PolarHBondContact N-O 3.46Å; E439-P501 WeakPolarHBondContact OE2-CD 3.12Å
440	Q	95.4	Very high	96.3	Very high	122 Å²	122	52 Å²	52	57%	0.57	25%	0.245	S	C	*	.	H	α-helix	trans	-57.9	-51	180	-175.4	173	3.1	0	0	111.5	P438 S443 V444	P438-Q440 PolarHBondContact O-N 3.28Å; Q440-S443 PolarHBondContact O-N 2.97Å; Q440-S443 PolarHBondContact O-OG 3.13Å; Q440-V444 PolarHBondContact O-N 3.11Å
441	A	97.4	Very high	96.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-49.7	179	0	0	0	0	0	111.4	L270 L272 L354 P438 E439 S443 V444 L445	L270-A441 HydrophobicContact CB-CB 3.96Å; L270-A441 HydrophobicContact CD2-CB 4.23Å; L270-A441 WeakPolarHBondContact O-CA 3.35Å; L270-A441 WeakPolarHBondContact O-CB 3.5Å; L270-A441 PolarHBondContact O-N 2.92Å; L272-A441 HydrophobicContact CD2-CB 4.14Å; L354-A441 HydrophobicContact CD1-CB 4.03Å; L354-A441 HydrophobicContact CD2-CB 4.15Å; P438-A441 HydrophobicContact CB-CB 4.45Å; P438-A441 HydrophobicContact CG-CB 3.97Å; P438-A441 PolarHBondContact O-N 2.86Å; E439-A441 PolarHBondContact O-N 2.88Å; A441-S443 VanDerWaalsContact C-N 3.25Å; A441-S443 PolarHBondContact O-N 3.2Å; A441-V444 WeakPolarHBondContact O-CB 3.42Å; A441-V444 PolarHBondContact O-N 3.28Å; A441-V444 VanDerWaalsContact O-N 3.09Å; A441-L445 WeakPolarHBondContact O-CG 3.38Å; A441-L445 PolarHBondContact O-N 2.9Å
442	V	97.9	Very high	96.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-33.9	-179	176.7	0	0	0	0	111.5	L354 L437 P438 E439 L445 R446 L489 I492 V499	L354-V442 HydrophobicContact CD1-CG2 3.99Å; L437-V442 HydrophobicContact CB-CG2 3.97Å; P438-V442 WeakPolarHBondContact O-CG2 3.48Å; P438-V442 PolarHBondContact O-N 2.95Å; E439-V442 PolarHBondContact O-N 3.13Å; V442-L445 PolarHBondContact O-N 3.02Å; V442-R446 HydrophobicContact CG1-CG 4.17Å; V442-R446 WeakPolarHBondContact O-CG 3.47Å; V442-R446 PolarHBondContact O-N 2.77Å; V442-L489 HydrophobicContact CG1-CD2 3.99Å; V442-I492 HydrophobicContact CG1-CD1 4.42Å; V442-I492 HydrophobicContact CG2-CD1 4.22Å; V442-V499 HydrophobicContact CB-CG1 3.89Å; V442-V499 HydrophobicContact CB-CG2 4.37Å; V442-V499 HydrophobicContact CG1-CG1 4.05Å; V442-V499 HydrophobicContact CG1-CG2 3.89Å; V442-V499 HydrophobicContact CG2-CG1 4.3Å; V442-V499 HydrophobicContact CG2-CG2 4.33Å
443	S	97	Very high	96.3	Very high	43 Å²	43	57.7 Å²	57.7	30%	0.301	27%	0.269	S	S	.	.	H	α-helix	trans	-64.8	-37.8	175.8	80.3	0	0	0	0	112.5	E439 Q440 A441 L445 R446 N447	E439-S443 VanDerWaalsContact O-CB 3.22Å; E439-S443 WeakPolarHBondContact O-CB 3.38Å; E439-S443 PolarHBondContact O-N 2.79Å; E439-S443 PolarHBondContact O-OG 3.02Å; Q440-S443 PolarHBondContact O-N 2.97Å; Q440-S443 PolarHBondContact O-OG 3.13Å; A441-S443 VanDerWaalsContact C-N 3.25Å; A441-S443 PolarHBondContact O-N 3.2Å; S443-L445 VanDerWaalsContact C-N 3.3Å; S443-L445 PolarHBondContact O-N 2.83Å; S443-R446 PolarHBondContact O-N 3.5Å; S443-N447 VanDerWaalsContact O-CB 3.24Å; S443-N447 WeakPolarHBondContact O-CB 3.18Å; S443-N447 VanDerWaalsContact O-CG 3.26Å; S443-N447 PolarHBondContact O-N 3.47Å; S443-N447 PolarHBondContact O-ND2 2.75Å; S443-N447 VanDerWaalsContact O-ND2 3.1Å
444	V	97.2	Very high	96.4	Very high	10 Å²	10	56 Å²	56	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-40.5	175.6	172.2	0	0	0	0	110.4	V269 L270 Q440 A441 K449 L450 K453	V269-V444 HydrophobicContact CG1-CG1 4.21Å; L270-V444 HydrophobicContact CD2-CB 4.38Å; L270-V444 HydrophobicContact CD2-CG1 4.32Å; Q440-V444 PolarHBondContact O-N 3.11Å; A441-V444 WeakPolarHBondContact O-CB 3.42Å; A441-V444 PolarHBondContact O-N 3.28Å; A441-V444 VanDerWaalsContact O-N 3.09Å; V444-K449 PolarHBondContact O-N 2.81Å; V444-L450 HydrophobicContact CG1-CB 4.21Å; V444-L450 HydrophobicContact CG1-CD1 4.24Å; V444-L450 PolarHBondContact O-N 3.37Å; V444-K453 HydrophobicContact CG1-CD 4.02Å; V444-K453 HydrophobicContact CG2-CD 4.28Å
445	L	97.2	Very high	96.4	Very high	8 Å²	8	56.4 Å²	56.4	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-50.8	176.8	-54.6	-174.9	0	0	0	111.5	L270 L358 A441 V442 S443 N447 R448 L450 A485 L488 L489	L270-L445 HydrophobicContact CD2-CD2 3.91Å; L270-L445 HydrophobicContact CD2-CG 4.43Å; L358-L445 HydrophobicContact CD1-CD1 4.41Å; L358-L445 HydrophobicContact CD1-CD2 4.46Å; A441-L445 WeakPolarHBondContact O-CG 3.38Å; A441-L445 PolarHBondContact O-N 2.9Å; V442-L445 PolarHBondContact O-N 3.02Å; S443-L445 VanDerWaalsContact C-N 3.3Å; S443-L445 PolarHBondContact O-N 2.83Å; L445-N447 PolarHBondContact O-N 3.14Å; L445-R448 PolarHBondContact O-N 3.01Å; L445-L450 HydrophobicContact CD2-CD1 4.24Å; L445-L450 HydrophobicContact CD2-CD2 3.88Å; L445-L450 HydrophobicContact CD2-CG 4.43Å; L445-A485 HydrophobicContact CB-CB 4.43Å; L445-A485 HydrophobicContact CD1-CB 4.18Å; L445-A485 HydrophobicContact CD2-CB 3.84Å; L445-A485 HydrophobicContact CG-CB 4.35Å; L445-L488 HydrophobicContact CD1-CD2 4.09Å; L445-L489 HydrophobicContact CB-CD1 4.16Å; L445-L489 HydrophobicContact CB-CD2 4.32Å; L445-L489 HydrophobicContact CB-CG 4.4Å
446	R	95.9	Very high	96.4	Very high	115 Å²	115	54.3 Å²	54.3	43%	0.434	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-42.5	-178.2	-75.9	-178.9	177.5	162.4	-2.4	112.9	V442 S443 R448 L489	V442-R446 HydrophobicContact CG1-CG 4.17Å; V442-R446 WeakPolarHBondContact O-CG 3.47Å; V442-R446 PolarHBondContact O-N 2.77Å; S443-R446 PolarHBondContact O-N 3.5Å; R446-R448 PolarHBondContact O-N 3.41Å; R446-L489 HydrophobicContact CG-CD1 4.21Å; R446-L489 HydrophobicContact CG-CD2 3.54Å
447	N	93.4	Very high	96.4	Very high	102 Å²	102	53.9 Å²	53.9	55%	0.545	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	6.7	-175.4	-65.7	-31.4	0	0	0	113.3	S443 L445 K449	S443-N447 VanDerWaalsContact O-CB 3.24Å; S443-N447 WeakPolarHBondContact O-CB 3.18Å; S443-N447 VanDerWaalsContact O-CG 3.26Å; S443-N447 PolarHBondContact O-N 3.47Å; S443-N447 PolarHBondContact O-ND2 2.75Å; S443-N447 VanDerWaalsContact O-ND2 3.1Å; L445-N447 PolarHBondContact O-N 3.14Å; N447-K449 HydrophobicContact CB-CD 4.41Å; N447-K449 HydrophobicContact CB-CG 4.1Å; N447-K449 PolarHBondContact O-N 3.06Å
448	R	88.5	Confident	96.4	Very high	205 Å²	205	53.9 Å²	53.9	77%	0.774	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	27.5	-178.8	-55.7	-176.3	178.4	-175.9	-0.9	113.4	L445 R446 L450	L445-R448 PolarHBondContact O-N 3.01Å; R446-R448 PolarHBondContact O-N 3.41Å; R448-L450 VanDerWaalsContact C-N 3.35Å
449	K	95.1	Very high	96.3	Very high	107 Å²	107	56.7 Å²	56.7	47%	0.465	26%	0.255	S	S	.	.			trans	-86.5	-9.9	177.4	-68.6	-170.1	176.7	-177.1	0	112.6	V444 N447 R451 E452 K453	V444-K449 PolarHBondContact O-N 2.81Å; N447-K449 HydrophobicContact CB-CD 4.41Å; N447-K449 HydrophobicContact CB-CG 4.1Å; N447-K449 PolarHBondContact O-N 3.06Å; K449-R451 VanDerWaalsContact C-N 3.34Å; K449-R451 PolarHBondContact O-N 2.79Å; K449-E452 PolarHBondContact O-N 2.89Å; K449-K453 HydrophobicContact CB-CD 4.18Å; K449-K453 WeakPolarHBondContact O-CB 3.32Å; K449-K453 WeakPolarHBondContact O-CG 3.5Å; K449-K453 PolarHBondContact O-N 3.13Å
450	L	96.8	Very high	96.3	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-53.9	-48.7	-178.4	-178.2	66	0	0	0	111.9	L266 V269 L270 V444 L445 R448 E452 K453 L454 I481 E482 A485	L266-L450 HydrophobicContact CD1-CD1 3.95Å; V269-L450 HydrophobicContact CG1-CD1 4.1Å; L270-L450 HydrophobicContact CD2-CD1 4.3Å; V444-L450 HydrophobicContact CG1-CB 4.21Å; V444-L450 HydrophobicContact CG1-CD1 4.24Å; V444-L450 PolarHBondContact O-N 3.37Å; L445-L450 HydrophobicContact CD2-CD1 4.24Å; L445-L450 HydrophobicContact CD2-CD2 3.88Å; L445-L450 HydrophobicContact CD2-CG 4.43Å; R448-L450 VanDerWaalsContact C-N 3.35Å; L450-E452 PolarHBondContact O-N 3.44Å; L450-K453 PolarHBondContact O-N 3.39Å; L450-L454 HydrophobicContact CD1-CD1 3.65Å; L450-L454 HydrophobicContact CD1-CG 4Å; L450-L454 HydrophobicContact CD2-CD1 4.45Å; L450-L454 HydrophobicContact CG-CD1 3.81Å; L450-L454 HydrophobicContact CG-CG 4.46Å; L450-L454 WeakPolarHBondContact O-CB 3.35Å; L450-L454 PolarHBondContact O-N 2.89Å; L450-I481 HydrophobicContact CD2-CG2 3.88Å; L450-E482 HydrophobicContact CD2-CG 3.99Å; L450-A485 HydrophobicContact CD2-CB 4.46Å
451	R	97.5	Very high	96.3	Very high	52 Å²	52	46.8 Å²	46.8	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-52.3	-59.7	178.3	-166.8	156.4	-94.5	44.5	-11.6	112.1	K449 K453 L454 L455 I478 D479 E482	K449-R451 VanDerWaalsContact C-N 3.34Å; K449-R451 PolarHBondContact O-N 2.79Å; R451-K453 VanDerWaalsContact C-N 3.33Å; R451-K453 PolarHBondContact O-N 2.89Å; R451-L454 PolarHBondContact O-N 3.26Å; R451-L455 HydrophobicContact CG-CD1 3.54Å; R451-L455 HydrophobicContact CG-CG 4.42Å; R451-L455 WeakPolarHBondContact O-CB 3.45Å; R451-L455 VanDerWaalsContact O-CD1 3.28Å; R451-L455 WeakPolarHBondContact O-CD1 3.32Å; R451-L455 WeakPolarHBondContact O-CG 3.28Å; R451-L455 PolarHBondContact O-N 3.02Å; R451-I478 HydrophobicContact CG-CG2 4.46Å; R451-D479 IonicContact CZ-OD1 3.06Å; R451-D479 IonicContact NH2-OD1 3.87Å; R451-D479 PolarHBondContact NH2-OD1 3.17Å; R451-E482 IonicContact CZ-OE1 3.31Å; R451-E482 IonicContact CZ-OE2 2.86Å; R451-E482 IonicContact NE-OE2 3.72Å; R451-E482 IonicContact NH1-OE1 3.55Å; R451-E482 PolarHBondContact NH1-OE1 3.44Å; R451-E482 IonicContact NH1-OE2 3.8Å; R451-E482 PolarHBondContact NH1-OE2 2.92Å; R451-E482 IonicContact NH2-OE1 2.63Å; R451-E482 IonicContact NH2-OE2 3.56Å; R451-E482 PolarHBondContact NH2-OE2 3.35Å
452	E	96.6	Very high	96.2	Very high	108 Å²	108	48.8 Å²	48.8	51%	0.505	22%	0.219	S	C	.	.	H	α-helix	trans	-58.6	-48.5	-173.5	-176.6	-167.1	156	0	0	110.3	K449 L450 L455 Q456	K449-E452 PolarHBondContact O-N 2.89Å; L450-E452 PolarHBondContact O-N 3.44Å; E452-L455 PolarHBondContact O-N 3.37Å; E452-Q456 WeakPolarHBondContact O-CG 3.3Å; E452-Q456 PolarHBondContact O-N 3.29Å; E452-Q456 PolarHBondContact OE1-NE2 3.44Å
453	K	97.7	Very high	96	Very high	46 Å²	46	50.3 Å²	50.3	20%	0.2	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-44.9	-179.7	-72.2	174.9	157.7	-84.3	0	112.4	W191 V269 V444 K449 L450 R451 Q456 S457	W191-K453 HydrophobicContact CE3-CG 4.45Å; W191-K453 HydrophobicContact CH2-CB 3.94Å; W191-K453 HydrophobicContact CH2-CG 3.93Å; W191-K453 HydrophobicContact CZ2-CB 4.36Å; W191-K453 VanDerWaalsContact CZ2-O 3.24Å; W191-K453 WeakPolarHBondContact CZ2-O 3.36Å; W191-K453 HydrophobicContact CZ3-CB 4.21Å; W191-K453 HydrophobicContact CZ3-CD 4.42Å; W191-K453 HydrophobicContact CZ3-CG 3.77Å; V269-K453 HydrophobicContact CB-CB 4.4Å; V269-K453 HydrophobicContact CG1-CB 3.56Å; V269-K453 HydrophobicContact CG1-CD 4.19Å; V269-K453 HydrophobicContact CG2-CB 3.98Å; V444-K453 HydrophobicContact CG1-CD 4.02Å; V444-K453 HydrophobicContact CG2-CD 4.28Å; K449-K453 HydrophobicContact CB-CD 4.18Å; K449-K453 WeakPolarHBondContact O-CB 3.32Å; K449-K453 WeakPolarHBondContact O-CG 3.5Å; K449-K453 PolarHBondContact O-N 3.13Å; L450-K453 PolarHBondContact O-N 3.39Å; R451-K453 VanDerWaalsContact C-N 3.33Å; R451-K453 PolarHBondContact O-N 2.89Å; K453-Q456 PolarHBondContact O-N 3.43Å; K453-S457 WeakPolarHBondContact O-CB 2.95Å; K453-S457 PolarHBondContact O-N 3.3Å
454	L	98.1	Very high	95.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-40.3	177.5	-80.6	174.4	0	0	0	112	F262 L266 V269 L450 R451 S457 L458 I478	F262-L454 HydrophobicContact CZ-CD1 4.11Å; L266-L454 HydrophobicContact CB-CD2 4.23Å; L266-L454 HydrophobicContact CD1-CD1 4.14Å; L266-L454 HydrophobicContact CD1-CD2 4.1Å; V269-L454 HydrophobicContact CB-CD2 4.31Å; V269-L454 HydrophobicContact CG1-CD2 4.47Å; V269-L454 HydrophobicContact CG1-CG 4.3Å; V269-L454 HydrophobicContact CG2-CD2 4.16Å; L450-L454 HydrophobicContact CD1-CD1 3.65Å; L450-L454 HydrophobicContact CD1-CG 4Å; L450-L454 HydrophobicContact CD2-CD1 4.45Å; L450-L454 HydrophobicContact CG-CD1 3.81Å; L450-L454 HydrophobicContact CG-CG 4.46Å; L450-L454 WeakPolarHBondContact O-CB 3.35Å; L450-L454 PolarHBondContact O-N 2.89Å; R451-L454 PolarHBondContact O-N 3.26Å; L454-S457 PolarHBondContact O-N 3.37Å; L454-L458 HydrophobicContact CB-CD1 4.35Å; L454-L458 VanDerWaalsContact O-CB 3.28Å; L454-L458 WeakPolarHBondContact O-CB 3.29Å; L454-L458 VanDerWaalsContact O-CG 3.25Å; L454-L458 WeakPolarHBondContact O-CG 3.34Å; L454-L458 PolarHBondContact O-N 2.93Å; L454-I478 HydrophobicContact CB-CD1 3.76Å; L454-I478 HydrophobicContact CB-CG1 4.18Å; L454-I478 HydrophobicContact CD1-CG1 4.13Å; L454-I478 HydrophobicContact CD1-CG2 4.13Å
455	L	97.5	Very high	95.8	Very high	18 Å²	18	49.3 Å²	49.3	9%	0.094	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-44.3	176.4	-71	161.1	0	0	0	111.6	R451 E452 F459 W465 R471 I474 I478	R451-L455 HydrophobicContact CG-CD1 3.54Å; R451-L455 HydrophobicContact CG-CG 4.42Å; R451-L455 WeakPolarHBondContact O-CB 3.45Å; R451-L455 VanDerWaalsContact O-CD1 3.28Å; R451-L455 WeakPolarHBondContact O-CD1 3.32Å; R451-L455 WeakPolarHBondContact O-CG 3.28Å; R451-L455 PolarHBondContact O-N 3.02Å; E452-L455 PolarHBondContact O-N 3.37Å; L455-F459 WeakPolarHBondContact O-CB 3.3Å; L455-F459 PolarHBondContact O-N 3.49Å; L455-F459 VanDerWaalsContact O-N 3.16Å; L455-W465 HydrophobicContact CD2-CH2 4.03Å; L455-W465 HydrophobicContact CD2-CZ3 4.21Å; L455-R471 VanDerWaalsContact CD1-CZ 3.43Å; L455-R471 VanDerWaalsContact CD1-NH1 3.28Å; L455-R471 VanDerWaalsContact CD2-NH1 3.32Å; L455-I474 HydrophobicContact CD2-CG2 3.92Å; L455-I478 HydrophobicContact CD2-CD1 3.66Å; L455-I478 HydrophobicContact CG-CD1 3.7Å
456	Q	96.1	Very high	95.6	Very high	87 Å²	87	53.5 Å²	53.5	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-60.4	-48.6	173.9	-73.1	174	16.9	0	0	110	W191 E452 K453 L460	W191-Q456 HydrophobicContact CH2-CB 3.94Å; W191-Q456 HydrophobicContact CZ2-CB 3.97Å; E452-Q456 WeakPolarHBondContact O-CG 3.3Å; E452-Q456 PolarHBondContact O-N 3.29Å; E452-Q456 PolarHBondContact OE1-NE2 3.44Å; K453-Q456 PolarHBondContact O-N 3.43Å; Q456-L460 WeakPolarHBondContact O-CD1 3.36Å
457	S	97.3	Very high	95.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-54.8	-177.2	-164.2	0	0	0	0	112.5	W191 F192 H265 K453 L454 F459 L460	W191-S457 PolarHBondContact NE1-OG 3.24Å; F192-S457 WeakPolarHBondContact CE2-OG 3.28Å; F192-S457 WeakPolarHBondContact CZ-OG 3.14Å; H265-S457 PolarHBondContact CE1-O 2.98Å; H265-S457 VanDerWaalsContact ND1-C 3.26Å; H265-S457 PolarHBondContact ND1-O 2.67Å; H265-S457 PolarHBondContact ND1-OG 2.85Å; K453-S457 WeakPolarHBondContact O-CB 2.95Å; K453-S457 PolarHBondContact O-N 3.3Å; L454-S457 PolarHBondContact O-N 3.37Å; S457-F459 VanDerWaalsContact C-N 3.28Å; S457-F459 PolarHBondContact O-N 2.62Å; S457-L460 WeakPolarHBondContact O-CB 3.27Å; S457-L460 PolarHBondContact O-N 2.84Å
458	L	97.1	Very high	95.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70.5	-23.8	-175.3	-65.8	167.6	0	0	0	112.8	F262 H265 L454 L460 D461 Y464 W465 I474 I478	F262-L458 HydrophobicContact CD2-CD1 3.9Å; F262-L458 HydrophobicContact CD2-CD2 4.25Å; F262-L458 HydrophobicContact CE2-CD1 3.7Å; H265-L458 HydrophobicContact CB-CD2 3.5Å; H265-L458 HydrophobicContact CB-CG 4.19Å; L454-L458 HydrophobicContact CB-CD1 4.35Å; L454-L458 VanDerWaalsContact O-CB 3.28Å; L454-L458 WeakPolarHBondContact O-CB 3.29Å; L454-L458 VanDerWaalsContact O-CG 3.25Å; L454-L458 WeakPolarHBondContact O-CG 3.34Å; L454-L458 PolarHBondContact O-N 2.93Å; L458-L460 PolarHBondContact O-N 2.89Å; L458-D461 PolarHBondContact O-N 3.49Å; L458-Y464 HydrophobicContact CD2-CD1 3.97Å; L458-Y464 HydrophobicContact CD2-CE1 3.67Å; L458-W465 HydrophobicContact CB-CE3 4.43Å; L458-I474 HydrophobicContact CD1-CD1 4.41Å; L458-I474 HydrophobicContact CD1-CG2 3.89Å; L458-I478 HydrophobicContact CD1-CD1 4.41Å
459	F	96.2	Very high	95.5	Very high	68 Å²	68	40.8 Å²	40.8	30%	0.298	21%	0.206	S	C	.	.	H	α-helix	trans	-70.6	-18.8	176.8	-172.4	-114.8	0	0	0	113.1	Y184 L455 S457 D461 W465	Y184-F459 AromaticContact CD2-CD1 3.77Å; Y184-F459 HydrophobicContact CD2-CD1 3.77Å; Y184-F459 AromaticContact CD2-CE1 3.61Å; Y184-F459 HydrophobicContact CD2-CE1 3.61Å; Y184-F459 HydrophobicContact CE1-CE1 4.26Å; Y184-F459 AromaticContact CE2-CD1 3.37Å; Y184-F459 HydrophobicContact CE2-CD1 3.37Å; Y184-F459 AromaticContact CE2-CE1 3.03Å; Y184-F459 HydrophobicContact CE2-CE1 3.03Å; Y184-F459 HydrophobicContact CE2-CG 4.46Å; Y184-F459 AromaticContact CE2-CZ 3.89Å; Y184-F459 HydrophobicContact CE2-CZ 3.89Å; Y184-F459 HydrophobicContact CG-CE1 4.38Å; Y184-F459 AromaticContact CZ-CE1 3.39Å; Y184-F459 AromaticContact CZ-CZ 3.85Å; L455-F459 WeakPolarHBondContact O-CB 3.3Å; L455-F459 PolarHBondContact O-N 3.49Å; L455-F459 VanDerWaalsContact O-N 3.16Å; S457-F459 VanDerWaalsContact C-N 3.28Å; S457-F459 PolarHBondContact O-N 2.62Å; F459-D461 VanDerWaalsContact C-N 3.32Å; F459-W465 HydrophobicContact CB-CE3 4.01Å; F459-W465 HydrophobicContact CB-CZ3 3.98Å; F459-W465 AromaticContact CD2-CD2 3.76Å; F459-W465 HydrophobicContact CD2-CD2 3.76Å; F459-W465 AromaticContact CD2-CE2 3.74Å; F459-W465 AromaticContact CD2-CE3 3.95Å; F459-W465 HydrophobicContact CD2-CE3 3.95Å; F459-W465 HydrophobicContact CD2-CG 4.25Å; F459-W465 HydrophobicContact CD2-CH2 4.14Å; F459-W465 AromaticContact CD2-CZ2 3.94Å; F459-W465 HydrophobicContact CD2-CZ2 3.94Å; F459-W465 HydrophobicContact CD2-CZ3 4.14Å; F459-W465 HydrophobicContact CE2-CZ2 4.43Å
460	L	95.9	Very high	95.5	Very high	10 Å²	10	36.3 Å²	36.3	5%	0.052	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-39.2	173.8	-85.2	62	0	0	0	111.1	I181 R182 P189 F192 M200 Q456 S457 L458 Q462	I181-L460 CarbonylContact C-O 3.46Å; I181-L460 VanDerWaalsContact CA-O 3.31Å; I181-L460 WeakPolarHBondContact CA-O 3.48Å; R182-L460 PolarHBondContact N-O 3.06Å; R182-L460 WeakPolarHBondContact O-CA 3.46Å; R182-L460 WeakPolarHBondContact O-CG 3.19Å; P189-L460 HydrophobicContact CG-CD1 3.96Å; P189-L460 HydrophobicContact CG-CD2 4.11Å; F192-L460 HydrophobicContact CD2-CD2 4.07Å; F192-L460 HydrophobicContact CE2-CD2 3.8Å; M200-L460 HydrophobicContact CE-CB 4.48Å; Q456-L460 WeakPolarHBondContact O-CD1 3.36Å; S457-L460 WeakPolarHBondContact O-CB 3.27Å; S457-L460 PolarHBondContact O-N 2.84Å; L458-L460 PolarHBondContact O-N 2.89Å; L460-Q462 PolarHBondContact O-N 3.07Å
461	D	96.1	Very high	95.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-85.8	96.5	177.5	-174.1	-26.2	0	0	0	109.5	I181 V279 S280 L458 F459 M463 Y464 W465	I181-D461 HydrophobicContact CD1-CB 4.42Å; V279-D461 WeakPolarHBondContact CA-OD2 3.24Å; V279-D461 WeakPolarHBondContact CB-OD2 3.34Å; S280-D461 PolarHBondContact N-OD2 2.79Å; L458-D461 PolarHBondContact O-N 3.49Å; F459-D461 VanDerWaalsContact C-N 3.32Å; D461-M463 VanDerWaalsContact C-N 3.29Å; D461-M463 PolarHBondContact O-N 2.93Å; D461-M463 PolarHBondContact OD1-N 3.43Å; D461-M463 VanDerWaalsContact OD1-N 3.12Å; D461-Y464 PolarHBondContact O-N 3.09Å; D461-Y464 WeakPolarHBondContact OD1-CB 3.34Å; D461-Y464 PolarHBondContact OD1-N 3.23Å; D461-W465 WeakPolarHBondContact O-CB 3.2Å; D461-W465 PolarHBondContact O-N 2.04Å
462	Q	94.9	Very high	95.4	Very high	43 Å²	43	46 Å²	46	20%	0.201	23%	0.233	C	C	.	.	H	α-helix	trans	-53.9	-48.9	179.7	178.7	172.8	-19.5	0	0	111.9	S180 R182 L460 Y464 W465 E466	S180-Q462 WeakPolarHBondContact O-CB 3.23Å; S180-Q462 PolarHBondContact O-N 2.9Å; R182-Q462 HydrophobicContact CG-CB 4.49Å; R182-Q462 VanDerWaalsContact NH2-CG 3.3Å; L460-Q462 PolarHBondContact O-N 3.07Å; Q462-Y464 VanDerWaalsContact C-N 3.32Å; Q462-W465 PolarHBondContact O-N 3.2Å; Q462-E466 HydrophobicContact CG-CG 4.39Å; Q462-E466 VanDerWaalsContact CG-OE1 3.24Å; Q462-E466 WeakPolarHBondContact CG-OE1 3.17Å; Q462-E466 PolarHBondContact NE2-OE1 2.8Å; Q462-E466 WeakPolarHBondContact O-CB 3.2Å; Q462-E466 WeakPolarHBondContact O-CG 3.35Å; Q462-E466 PolarHBondContact O-N 2.79Å
463	M	93.2	Very high	95.4	Very high	32 Å²	32	41.6 Å²	41.6	16%	0.158	22%	0.216	C	C	.	.	H	α-helix	trans	-68.6	-40.1	-169.9	-65.8	-51.5	-59.9	0	0	109.8	S280 K282 D461 S467	S280-M463 VanDerWaalsContact O-CB 3.27Å; S280-M463 WeakPolarHBondContact O-CB 3.27Å; K282-M463 HydrophobicContact CB-CE 4.13Å; K282-M463 HydrophobicContact CD-CE 3.41Å; K282-M463 VanDerWaalsContact CD-CE 3.41Å; K282-M463 VanDerWaalsContact CE-CE 3.47Å; K282-M463 HydrophobicContact CG-CE 3.5Å; K282-M463 VanDerWaalsContact CG-CE 3.5Å; D461-M463 VanDerWaalsContact C-N 3.29Å; D461-M463 PolarHBondContact O-N 2.93Å; D461-M463 PolarHBondContact OD1-N 3.43Å; D461-M463 VanDerWaalsContact OD1-N 3.12Å; M463-S467 WeakPolarHBondContact O-CB 3.09Å; M463-S467 PolarHBondContact O-N 3.38Å; M463-S467 PolarHBondContact O-OG 3.44Å
464	Y	94.6	Very high	95.3	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-53.4	174.1	-177.2	-99.7	0	0	0	110.2	N258 V261 F262 L458 D461 Q462 E466 S467 Q468 I474	N258-Y464 HydrophobicContact CB-CD2 4.04Å; N258-Y464 HydrophobicContact CB-CE2 3.63Å; N258-Y464 VanDerWaalsContact O-CE2 3.28Å; N258-Y464 WeakPolarHBondContact O-CE2 3.36Å; V261-Y464 HydrophobicContact CB-CD2 3.61Å; V261-Y464 HydrophobicContact CB-CE2 3.84Å; V261-Y464 HydrophobicContact CB-CG 4.25Å; V261-Y464 HydrophobicContact CG1-CD1 4.3Å; V261-Y464 HydrophobicContact CG1-CD2 3.53Å; V261-Y464 HydrophobicContact CG1-CE2 4.1Å; V261-Y464 HydrophobicContact CG1-CG 3.65Å; V261-Y464 HydrophobicContact CG2-CD2 4.13Å; F262-Y464 WeakPolarHBondContact CB-OH 3.41Å; F262-Y464 WeakPolarHBondContact CD2-OH 3.41Å; L458-Y464 HydrophobicContact CD2-CD1 3.97Å; L458-Y464 HydrophobicContact CD2-CE1 3.67Å; D461-Y464 PolarHBondContact O-N 3.09Å; D461-Y464 WeakPolarHBondContact OD1-CB 3.34Å; D461-Y464 PolarHBondContact OD1-N 3.23Å; Q462-Y464 VanDerWaalsContact C-N 3.32Å; Y464-E466 VanDerWaalsContact C-N 3.32Å; Y464-E466 PolarHBondContact O-N 2.96Å; Y464-S467 PolarHBondContact O-N 2.86Å; Y464-S467 VanDerWaalsContact O-N 3.13Å; Y464-S467 PolarHBondContact O-OG 2.78Å; Y464-Q468 HydrophobicContact CD1-CG 4.2Å; Y464-Q468 HydrophobicContact CD2-CG 4.25Å; Y464-Q468 HydrophobicContact CE1-CG 3.72Å; Y464-Q468 HydrophobicContact CE2-CG 3.79Å; Y464-Q468 HydrophobicContact CG-CG 4.44Å; Y464-Q468 VanDerWaalsContact CZ-CG 3.5Å; Y464-Q468 WeakPolarHBondContact O-CG 3.19Å; Y464-Q468 PolarHBondContact O-N 3.47Å; Y464-I474 HydrophobicContact CD1-CD1 3.99Å; Y464-I474 HydrophobicContact CE1-CD1 3.49Å; Y464-I474 VanDerWaalsContact CE1-CD1 3.49Å
465	W	95.3	Very high	95.3	Very high	30 Å²	30	41.2 Å²	41.2	11%	0.114	22%	0.216	C	C	.	.	H	α-helix	trans	-52.7	-49.2	-179.3	-176.8	-89.3	0	0	0	112.4	L455 L458 F459 D461 Q462 Q468 G470 R471 I474	L455-W465 HydrophobicContact CD2-CH2 4.03Å; L455-W465 HydrophobicContact CD2-CZ3 4.21Å; L458-W465 HydrophobicContact CB-CE3 4.43Å; F459-W465 HydrophobicContact CB-CE3 4.01Å; F459-W465 HydrophobicContact CB-CZ3 3.98Å; F459-W465 AromaticContact CD2-CD2 3.76Å; F459-W465 HydrophobicContact CD2-CD2 3.76Å; F459-W465 AromaticContact CD2-CE2 3.74Å; F459-W465 AromaticContact CD2-CE3 3.95Å; F459-W465 HydrophobicContact CD2-CE3 3.95Å; F459-W465 HydrophobicContact CD2-CG 4.25Å; F459-W465 HydrophobicContact CD2-CH2 4.14Å; F459-W465 AromaticContact CD2-CZ2 3.94Å; F459-W465 HydrophobicContact CD2-CZ2 3.94Å; F459-W465 HydrophobicContact CD2-CZ3 4.14Å; F459-W465 HydrophobicContact CE2-CZ2 4.43Å; D461-W465 WeakPolarHBondContact O-CB 3.2Å; D461-W465 PolarHBondContact O-N 2.04Å; Q462-W465 PolarHBondContact O-N 3.2Å; W465-Q468 PolarHBondContact O-N 3.49Å; W465-G470 WeakPolarHBondContact O-CA 3.14Å; W465-G470 PolarHBondContact O-N 3.17Å; W465-R471 HydrophobicContact CH2-CB 4.43Å; W465-R471 VanDerWaalsContact CZ2-CA 3.46Å; W465-R471 HydrophobicContact CZ2-CB 3.74Å; W465-R471 HydrophobicContact CZ2-CG 4.42Å; W465-I474 HydrophobicContact CD2-CG1 4.08Å; W465-I474 HydrophobicContact CE3-CB 4.36Å; W465-I474 HydrophobicContact CE3-CD1 4.4Å; W465-I474 HydrophobicContact CE3-CG1 3.71Å; W465-I474 HydrophobicContact CE3-CG2 4.32Å; W465-I474 HydrophobicContact CH2-CB 4.48Å; W465-I474 HydrophobicContact CH2-CG2 4.43Å; W465-I474 HydrophobicContact CZ3-CB 4.12Å; W465-I474 HydrophobicContact CZ3-CG1 4Å; W465-I474 HydrophobicContact CZ3-CG2 3.83Å
466	E	93.1	Very high	95.3	Very high	95 Å²	95	44.5 Å²	44.5	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-67.9	-42	179.5	-69.9	173.5	-170.7	0	0	111.8	R182 Q462 Y464 Q468 G469	R182-E466 IonicContact NH2-OE1 3.77Å; Q462-E466 HydrophobicContact CG-CG 4.39Å; Q462-E466 VanDerWaalsContact CG-OE1 3.24Å; Q462-E466 WeakPolarHBondContact CG-OE1 3.17Å; Q462-E466 PolarHBondContact NE2-OE1 2.8Å; Q462-E466 WeakPolarHBondContact O-CB 3.2Å; Q462-E466 WeakPolarHBondContact O-CG 3.35Å; Q462-E466 PolarHBondContact O-N 2.79Å; Y464-E466 VanDerWaalsContact C-N 3.32Å; Y464-E466 PolarHBondContact O-N 2.96Å; E466-Q468 PolarHBondContact O-N 3.24Å; E466-G469 PolarHBondContact O-N 3Å
467	S	91.2	Very high	95.3	Very high	47 Å²	47	41.6 Å²	41.6	33%	0.329	22%	0.217	S	C	.	.	H	α-helix	trans	-61.4	-30.5	178.6	76	0	0	0	0	113.2	N258 M463 Y464 G469	N258-S467 PolarHBondContact ND2-OG 3.19Å; M463-S467 WeakPolarHBondContact O-CB 3.09Å; M463-S467 PolarHBondContact O-N 3.38Å; M463-S467 PolarHBondContact O-OG 3.44Å; Y464-S467 PolarHBondContact O-N 2.86Å; Y464-S467 VanDerWaalsContact O-N 3.13Å; Y464-S467 PolarHBondContact O-OG 2.78Å; S467-G469 PolarHBondContact O-N 3.42Å
468	Q	92.3	Very high	95.3	Very high	50 Å²	50	41.6 Å²	41.6	23%	0.234	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	9.7	177.9	-60.5	-46.4	-68.9	0	0	112.8	N258 Y464 W465 E466 G473 I474 L477	N258-Q468 PolarHBondContact ND2-NE2 3.19Å; Y464-Q468 HydrophobicContact CD1-CG 4.2Å; Y464-Q468 HydrophobicContact CD2-CG 4.25Å; Y464-Q468 HydrophobicContact CE1-CG 3.72Å; Y464-Q468 HydrophobicContact CE2-CG 3.79Å; Y464-Q468 HydrophobicContact CG-CG 4.44Å; Y464-Q468 VanDerWaalsContact CZ-CG 3.5Å; Y464-Q468 WeakPolarHBondContact O-CG 3.19Å; Y464-Q468 PolarHBondContact O-N 3.47Å; W465-Q468 PolarHBondContact O-N 3.49Å; E466-Q468 PolarHBondContact O-N 3.24Å; Q468-G473 VanDerWaalsContact O-CA 3.24Å; Q468-G473 WeakPolarHBondContact O-CA 3.25Å; Q468-I474 HydrophobicContact CB-CD1 3.67Å; Q468-I474 HydrophobicContact CB-CG1 4.22Å; Q468-I474 HydrophobicContact CG-CD1 3.88Å; Q468-L477 HydrophobicContact CG-CD1 4.2Å
469	G	92.8	Very high	95.3	Very high	58 Å²	58	44.7 Å²	44.7	60%	0.598	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.6	25.6	-177.4	0	0	0	0	0	113.4	E466 S467	E466-G469 PolarHBondContact O-N 3Å; S467-G469 PolarHBondContact O-N 3.42Å
470	G	95.1	Very high	95.3	Very high	14 Å²	14	42.9 Å²	42.9	14%	0.144	23%	0.228	C	C	.	.	H	α-helix	trans	65.1	-149	177.2	0	0	0	0	0	113.1	W465 Q472 G473 I474	W465-G470 WeakPolarHBondContact O-CA 3.14Å; W465-G470 PolarHBondContact O-N 3.17Å; G470-Q472 VanDerWaalsContact C-N 3.28Å; G470-Q472 PolarHBondContact O-N 2.75Å; G470-G473 PolarHBondContact O-N 3.14Å; G470-I474 WeakPolarHBondContact O-CG1 3.07Å; G470-I474 PolarHBondContact O-N 3.41Å
471	R	96.3	Very high	95.4	Very high	117 Å²	117	42.4 Å²	42.4	44%	0.442	23%	0.225	S	C	.	.	H	α-helix	trans	-52.8	-44.8	-173.2	179.5	59.1	-167.9	-143.8	11.5	113.3	L455 W465 D475	L455-R471 VanDerWaalsContact CD1-CZ 3.43Å; L455-R471 VanDerWaalsContact CD1-NH1 3.28Å; L455-R471 VanDerWaalsContact CD2-NH1 3.32Å; W465-R471 HydrophobicContact CH2-CB 4.43Å; W465-R471 VanDerWaalsContact CZ2-CA 3.46Å; W465-R471 HydrophobicContact CZ2-CB 3.74Å; W465-R471 HydrophobicContact CZ2-CG 4.42Å; R471-D475 IonicContact CZ-OD1 3.38Å; R471-D475 IonicContact CZ-OD2 3.62Å; R471-D475 IonicContact NE-OD1 2.71Å; R471-D475 PolarHBondContact NE-OD1 2.86Å; R471-D475 IonicContact NE-OD2 3.54Å; R471-D475 PolarHBondContact NE-OD2 2.98Å; R471-D475 IonicContact NH2-OD1 2.75Å; R471-D475 PolarHBondContact NH2-OD1 3.32Å; R471-D475 IonicContact NH2-OD2 2.8Å; R471-D475 WeakPolarHBondContact O-CB 3.41Å; R471-D475 PolarHBondContact O-N 3.43Å
472	Q	96.9	Very high	95.5	Very high	141 Å²	141	44.6 Å²	44.6	66%	0.659	24%	0.236	S	C	*	.	H	α-helix	trans	-66.9	-40.4	-174.2	-175.9	-179.6	-1.5	0	0	112.2	G470 K476	G470-Q472 VanDerWaalsContact C-N 3.28Å; G470-Q472 PolarHBondContact O-N 2.75Å; Q472-K476 WeakPolarHBondContact O-CG 3.44Å; Q472-K476 PolarHBondContact O-N 3.18Å
473	G	95.3	Very high	95.6	Very high	15 Å²	15	48.9 Å²	48.9	16%	0.155	25%	0.25	C	C	.	.	H	α-helix	trans	-76.2	-36.9	178.6	0	0	0	0	0	112.4	Q468 G470 D475 K476 L477	Q468-G473 VanDerWaalsContact O-CA 3.24Å; Q468-G473 WeakPolarHBondContact O-CA 3.25Å; G470-G473 PolarHBondContact O-N 3.14Å; G473-D475 PolarHBondContact O-N 3.26Å; G473-K476 WeakPolarHBondContact O-CB 3.07Å; G473-K476 PolarHBondContact O-N 3.03Å; G473-K476 VanDerWaalsContact O-N 3.17Å; G473-L477 PolarHBondContact O-N 3.09Å; G473-L477 VanDerWaalsContact O-N 3.13Å
474	I	97	Very high	95.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-45.1	171.4	-62.9	-67.3	0	0	0	111.2	L455 L458 Y464 W465 Q468 G470 K476 L477 I478	L455-I474 HydrophobicContact CD2-CG2 3.92Å; L458-I474 HydrophobicContact CD1-CD1 4.41Å; L458-I474 HydrophobicContact CD1-CG2 3.89Å; Y464-I474 HydrophobicContact CD1-CD1 3.99Å; Y464-I474 HydrophobicContact CE1-CD1 3.49Å; Y464-I474 VanDerWaalsContact CE1-CD1 3.49Å; W465-I474 HydrophobicContact CD2-CG1 4.08Å; W465-I474 HydrophobicContact CE3-CB 4.36Å; W465-I474 HydrophobicContact CE3-CD1 4.4Å; W465-I474 HydrophobicContact CE3-CG1 3.71Å; W465-I474 HydrophobicContact CE3-CG2 4.32Å; W465-I474 HydrophobicContact CH2-CB 4.48Å; W465-I474 HydrophobicContact CH2-CG2 4.43Å; W465-I474 HydrophobicContact CZ3-CB 4.12Å; W465-I474 HydrophobicContact CZ3-CG1 4Å; W465-I474 HydrophobicContact CZ3-CG2 3.83Å; Q468-I474 HydrophobicContact CB-CD1 3.67Å; Q468-I474 HydrophobicContact CB-CG1 4.22Å; Q468-I474 HydrophobicContact CG-CD1 3.88Å; G470-I474 WeakPolarHBondContact O-CG1 3.07Å; G470-I474 PolarHBondContact O-N 3.41Å; I474-K476 VanDerWaalsContact C-N 3.26Å; I474-K476 PolarHBondContact O-N 2.6Å; I474-L477 PolarHBondContact O-N 3.13Å; I474-L477 VanDerWaalsContact O-N 3.14Å; I474-I478 HydrophobicContact CG2-CD1 3.69Å; I474-I478 HydrophobicContact CG2-CG1 4.21Å; I474-I478 WeakPolarHBondContact O-CG1 3.46Å; I474-I478 PolarHBondContact O-N 3.01Å
475	D	97.6	Very high	96	Very high	39 Å²	39	47.5 Å²	47.5	21%	0.209	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-39.7	175.9	-81.4	-32.7	0	0	0	111.6	R471 G473 I478 D479	R471-D475 IonicContact CZ-OD1 3.38Å; R471-D475 IonicContact CZ-OD2 3.62Å; R471-D475 IonicContact NE-OD1 2.71Å; R471-D475 PolarHBondContact NE-OD1 2.86Å; R471-D475 IonicContact NE-OD2 3.54Å; R471-D475 PolarHBondContact NE-OD2 2.98Å; R471-D475 IonicContact NH2-OD1 2.75Å; R471-D475 PolarHBondContact NH2-OD1 3.32Å; R471-D475 IonicContact NH2-OD2 2.8Å; R471-D475 WeakPolarHBondContact O-CB 3.41Å; R471-D475 PolarHBondContact O-N 3.43Å; G473-D475 PolarHBondContact O-N 3.26Å; D475-I478 PolarHBondContact O-N 3.07Å; D475-D479 WeakPolarHBondContact O-CB 3.45Å; D475-D479 PolarHBondContact O-N 3.28Å
476	K	96.1	Very high	96.1	Very high	87 Å²	87	50.2 Å²	50.2	38%	0.378	26%	0.261	S	S	.	.	H	α-helix	trans	-63	-43.1	176.3	-70.6	174.3	-177.9	-179.2	0	112.5	Q472 G473 I474 D479 V480	Q472-K476 WeakPolarHBondContact O-CG 3.44Å; Q472-K476 PolarHBondContact O-N 3.18Å; G473-K476 WeakPolarHBondContact O-CB 3.07Å; G473-K476 PolarHBondContact O-N 3.03Å; G473-K476 VanDerWaalsContact O-N 3.17Å; I474-K476 VanDerWaalsContact C-N 3.26Å; I474-K476 PolarHBondContact O-N 2.6Å; K476-D479 PolarHBondContact O-N 3.44Å; K476-V480 PolarHBondContact O-N 3.45Å
477	L	96.2	Very high	96.4	Very high	25 Å²	25	47.7 Å²	47.7	13%	0.131	25%	0.25	C	C	.	.	H	α-helix	trans	-63.1	-44.9	177.1	-63.9	176	0	0	0	110.6	F262 F419 Q468 G473 I474 V480 I481	F262-L477 HydrophobicContact CD2-CB 4.39Å; F262-L477 HydrophobicContact CD2-CD1 4.23Å; F262-L477 HydrophobicContact CE2-CB 3.85Å; F262-L477 HydrophobicContact CE2-CD1 4.47Å; F419-L477 HydrophobicContact CB-CD2 4.12Å; F419-L477 HydrophobicContact CD1-CB 4.25Å; F419-L477 HydrophobicContact CD1-CD2 3.74Å; F419-L477 HydrophobicContact CD2-CD2 4.25Å; F419-L477 HydrophobicContact CE1-CB 4.16Å; F419-L477 HydrophobicContact CE1-CD2 4.17Å; F419-L477 HydrophobicContact CG-CD2 3.77Å; Q468-L477 HydrophobicContact CG-CD1 4.2Å; G473-L477 PolarHBondContact O-N 3.09Å; G473-L477 VanDerWaalsContact O-N 3.13Å; I474-L477 PolarHBondContact O-N 3.13Å; I474-L477 VanDerWaalsContact O-N 3.14Å; L477-V480 PolarHBondContact O-N 2.92Å; L477-I481 PolarHBondContact O-N 3.29Å
478	I	97.5	Very high	96.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-37.1	178.9	-59.7	174.6	0	0	0	111.3	F262 R451 L454 L455 L458 I474 D475 V480 I481 E482	F262-I478 HydrophobicContact CE2-CG1 4.35Å; F262-I478 HydrophobicContact CZ-CG1 4.48Å; R451-I478 HydrophobicContact CG-CG2 4.46Å; L454-I478 HydrophobicContact CB-CD1 3.76Å; L454-I478 HydrophobicContact CB-CG1 4.18Å; L454-I478 HydrophobicContact CD1-CG1 4.13Å; L454-I478 HydrophobicContact CD1-CG2 4.13Å; L455-I478 HydrophobicContact CD2-CD1 3.66Å; L455-I478 HydrophobicContact CG-CD1 3.7Å; L458-I478 HydrophobicContact CD1-CD1 4.41Å; I474-I478 HydrophobicContact CG2-CD1 3.69Å; I474-I478 HydrophobicContact CG2-CG1 4.21Å; I474-I478 WeakPolarHBondContact O-CG1 3.46Å; I474-I478 PolarHBondContact O-N 3.01Å; D475-I478 PolarHBondContact O-N 3.07Å; I478-V480 VanDerWaalsContact C-N 3.27Å; I478-V480 PolarHBondContact O-N 2.84Å; I478-I481 PolarHBondContact O-N 3Å; I478-E482 PolarHBondContact O-N 3.31Å
479	D	97.3	Very high	97	Very high	65 Å²	65	44.1 Å²	44.1	35%	0.348	23%	0.228	S	C	.	.	H	α-helix	trans	-56.5	-42.4	175.8	-77.9	-16.2	0	0	0	111.1	R451 D475 K476 E482 R483	R451-D479 IonicContact CZ-OD1 3.06Å; R451-D479 IonicContact NH2-OD1 3.87Å; R451-D479 PolarHBondContact NH2-OD1 3.17Å; D475-D479 WeakPolarHBondContact O-CB 3.45Å; D475-D479 PolarHBondContact O-N 3.28Å; K476-D479 PolarHBondContact O-N 3.44Å; D479-E482 PolarHBondContact O-N 3.47Å; D479-R483 VanDerWaalsContact O-CG 3.31Å; D479-R483 WeakPolarHBondContact O-CG 3.47Å; D479-R483 PolarHBondContact O-N 3.47Å; D479-R483 VanDerWaalsContact O-N 3.12Å
480	V	97.2	Very high	97.2	Very high	30 Å²	30	45.8 Å²	45.8	18%	0.182	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-49	175.7	173	0	0	0	0	110.9	F419 K476 L477 I478 E482 R483 R484	F419-V480 HydrophobicContact CD1-CB 4.4Å; F419-V480 HydrophobicContact CD1-CG1 4.35Å; K476-V480 PolarHBondContact O-N 3.45Å; L477-V480 PolarHBondContact O-N 2.92Å; I478-V480 VanDerWaalsContact C-N 3.27Å; I478-V480 PolarHBondContact O-N 2.84Å; V480-E482 VanDerWaalsContact C-N 3.34Å; V480-E482 PolarHBondContact O-N 2.98Å; V480-R483 PolarHBondContact O-N 3.45Å; V480-R484 WeakPolarHBondContact O-CG 3.32Å; V480-R484 PolarHBondContact O-N 2.95Å; V480-R484 VanDerWaalsContact O-N 3.11Å
481	I	97.6	Very high	97.4	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-37.9	-178.6	-57.3	-57.4	0	0	0	111.6	F262 L266 L358 L359 F419 L450 L477 I478 R484 A485	F262-I481 HydrophobicContact CE1-CD1 4.31Å; F262-I481 HydrophobicContact CE1-CG1 3.77Å; F262-I481 HydrophobicContact CZ-CG1 3.8Å; L266-I481 HydrophobicContact CD1-CG2 4.43Å; L358-I481 HydrophobicContact CB-CG2 4.44Å; L358-I481 HydrophobicContact CD2-CG2 4.44Å; L358-I481 VanDerWaalsContact O-CD1 3.25Å; L358-I481 WeakPolarHBondContact O-CD1 3.36Å; L359-I481 HydrophobicContact CD2-CD1 3.9Å; F419-I481 HydrophobicContact CD1-CD1 4.17Å; F419-I481 HydrophobicContact CD1-CG1 4.46Å; F419-I481 HydrophobicContact CE1-CD1 3.66Å; F419-I481 HydrophobicContact CE1-CG1 3.84Å; F419-I481 HydrophobicContact CZ-CD1 4.44Å; L450-I481 HydrophobicContact CD2-CG2 3.88Å; L477-I481 PolarHBondContact O-N 3.29Å; I478-I481 PolarHBondContact O-N 3Å; I481-R484 PolarHBondContact O-N 3.35Å; I481-A485 WeakPolarHBondContact O-CB 3.25Å; I481-A485 PolarHBondContact O-N 3.5Å
482	E	97.4	Very high	97.5	Very high	46 Å²	46	41.5 Å²	41.5	22%	0.215	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-38.8	176.3	-92.9	-164	173.1	0	0	113.4	L450 R451 I478 D479 V480 R484 A485 N486	L450-E482 HydrophobicContact CD2-CG 3.99Å; R451-E482 IonicContact CZ-OE1 3.31Å; R451-E482 IonicContact CZ-OE2 2.86Å; R451-E482 IonicContact NE-OE2 3.72Å; R451-E482 IonicContact NH1-OE1 3.55Å; R451-E482 PolarHBondContact NH1-OE1 3.44Å; R451-E482 IonicContact NH1-OE2 3.8Å; R451-E482 PolarHBondContact NH1-OE2 2.92Å; R451-E482 IonicContact NH2-OE1 2.63Å; R451-E482 IonicContact NH2-OE2 3.56Å; R451-E482 PolarHBondContact NH2-OE2 3.35Å; I478-E482 PolarHBondContact O-N 3.31Å; D479-E482 PolarHBondContact O-N 3.47Å; V480-E482 VanDerWaalsContact C-N 3.34Å; V480-E482 PolarHBondContact O-N 2.98Å; E482-R484 VanDerWaalsContact C-N 3.34Å; E482-A485 WeakPolarHBondContact O-CB 3.43Å; E482-A485 PolarHBondContact O-N 3.44Å; E482-N486 PolarHBondContact O-N 3.24Å; E482-N486 PolarHBondContact O-ND2 3.37Å
483	R	97.7	Very high	97.5	Very high	133 Å²	133	40.3 Å²	40.3	50%	0.502	21%	0.205	S	C	.	.	H	α-helix	trans	-63.1	-44.3	175.5	-69.5	178.4	-166.2	-178.5	2.8	110.8	E423 D479 V480 A485 N486 I487	E423-R483 HydrophobicContact CG-CB 4.26Å; E423-R483 WeakPolarHBondContact OE1-CD 3.46Å; E423-R483 IonicContact OE1-CZ 3.23Å; E423-R483 IonicContact OE1-NE 3.5Å; E423-R483 IonicContact OE1-NH1 3.81Å; E423-R483 PolarHBondContact OE1-NH1 3.27Å; D479-R483 VanDerWaalsContact O-CG 3.31Å; D479-R483 WeakPolarHBondContact O-CG 3.47Å; D479-R483 PolarHBondContact O-N 3.47Å; D479-R483 VanDerWaalsContact O-N 3.12Å; V480-R483 PolarHBondContact O-N 3.45Å; R483-A485 VanDerWaalsContact C-N 3.34Å; R483-A485 PolarHBondContact O-N 2.93Å; R483-N486 PolarHBondContact O-N 3.03Å; R483-I487 WeakPolarHBondContact O-CG1 3.36Å; R483-I487 PolarHBondContact O-N 3.08Å; R483-I487 VanDerWaalsContact O-N 3.08Å
484	R	98	Very high	97.7	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-63.5	-38.6	174.1	-67.4	176	-173.5	174.7	2	112.4	L358 Q360 F418 R421 L426 V480 I481 E482 N486 I487 L488	L358-R484 HydrophobicContact CD2-CB 4.35Å; L358-R484 WeakPolarHBondContact O-CD 3.06Å; L358-R484 PolarHBondContact O-NH1 3.44Å; L358-R484 VanDerWaalsContact O-NH1 3.14Å; Q360-R484 VanDerWaalsContact CG-NH1 3.34Å; F418-R484 VanDerWaalsContact O-CZ 3.27Å; F418-R484 PolarHBondContact O-NH1 2.98Å; F418-R484 PolarHBondContact O-NH2 3.17Å; R421-R484 PolarHBondContact O-NH2 3.29Å; L426-R484 HydrophobicContact CD1-CG 4.08Å; L426-R484 HydrophobicContact CD2-CG 4.07Å; V480-R484 WeakPolarHBondContact O-CG 3.32Å; V480-R484 PolarHBondContact O-N 2.95Å; V480-R484 VanDerWaalsContact O-N 3.11Å; I481-R484 PolarHBondContact O-N 3.35Å; E482-R484 VanDerWaalsContact C-N 3.34Å; R484-N486 VanDerWaalsContact C-N 3.34Å; R484-N486 PolarHBondContact O-N 3.48Å; R484-I487 PolarHBondContact O-N 3.27Å; R484-L488 WeakPolarHBondContact O-CB 3.41Å; R484-L488 PolarHBondContact O-N 3.24Å
485	A	98	Very high	97.7	Very high	4 Å²	4	48.9 Å²	48.9	3%	0.033	26%	0.255	C	S	.	.	H	α-helix	trans	-61.2	-41.9	174.2	0	0	0	0	0	111.8	L358 L445 L450 I481 E482 R483 I487 L488 L489	L358-A485 HydrophobicContact CD2-CB 3.99Å; L445-A485 HydrophobicContact CB-CB 4.43Å; L445-A485 HydrophobicContact CD1-CB 4.18Å; L445-A485 HydrophobicContact CD2-CB 3.84Å; L445-A485 HydrophobicContact CG-CB 4.35Å; L450-A485 HydrophobicContact CD2-CB 4.46Å; I481-A485 WeakPolarHBondContact O-CB 3.25Å; I481-A485 PolarHBondContact O-N 3.5Å; E482-A485 WeakPolarHBondContact O-CB 3.43Å; E482-A485 PolarHBondContact O-N 3.44Å; R483-A485 VanDerWaalsContact C-N 3.34Å; R483-A485 PolarHBondContact O-N 2.93Å; A485-I487 VanDerWaalsContact C-N 3.32Å; A485-I487 PolarHBondContact O-N 3.07Å; A485-L488 PolarHBondContact O-N 2.96Å; A485-L489 WeakPolarHBondContact O-CB 3.38Å; A485-L489 VanDerWaalsContact O-CG 3.23Å; A485-L489 WeakPolarHBondContact O-CG 3.38Å; A485-L489 PolarHBondContact O-N 3.32Å
486	N	97.9	Very high	97.7	Very high	88 Å²	88	49.8 Å²	49.8	47%	0.471	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-38.8	175.3	-69.4	-37	0	0	0	112.1	E482 R483 R484 L489 T490	E482-N486 PolarHBondContact O-N 3.24Å; E482-N486 PolarHBondContact O-ND2 3.37Å; R483-N486 PolarHBondContact O-N 3.03Å; R484-N486 VanDerWaalsContact C-N 3.34Å; R484-N486 PolarHBondContact O-N 3.48Å; N486-L489 PolarHBondContact O-N 3.21Å; N486-T490 PolarHBondContact O-N 3.46Å; N486-T490 PolarHBondContact O-OG1 3.25Å
487	I	98.2	Very high	97.8	Very high	41 Å²	41	46.3 Å²	46.3	21%	0.21	26%	0.259	C	S	.	.	H	α-helix	trans	-65.4	-46.1	175.3	-66.6	164.3	0	0	0	110.4	F357 E423 L426 F428 R483 R484 A485 L489 T490 Y491	F357-I487 HydrophobicContact CZ-CG2 4.16Å; E423-I487 HydrophobicContact CB-CD1 3.63Å; E423-I487 HydrophobicContact CG-CD1 3.78Å; L426-I487 HydrophobicContact CD1-CB 4.49Å; L426-I487 HydrophobicContact CD1-CD1 3.65Å; L426-I487 HydrophobicContact CD1-CG2 4.14Å; F428-I487 HydrophobicContact CE1-CG2 3.98Å; F428-I487 HydrophobicContact CZ-CG2 3.52Å; R483-I487 WeakPolarHBondContact O-CG1 3.36Å; R483-I487 PolarHBondContact O-N 3.08Å; R483-I487 VanDerWaalsContact O-N 3.08Å; R484-I487 PolarHBondContact O-N 3.27Å; A485-I487 VanDerWaalsContact C-N 3.32Å; A485-I487 PolarHBondContact O-N 3.07Å; I487-L489 VanDerWaalsContact C-N 3.34Å; I487-L489 PolarHBondContact O-N 2.89Å; I487-T490 WeakPolarHBondContact O-CB 3.32Å; I487-T490 PolarHBondContact O-N 3.11Å; I487-T490 VanDerWaalsContact O-N 3.14Å; I487-Y491 WeakPolarHBondContact O-CB 3.12Å; I487-Y491 PolarHBondContact O-N 3.15Å
488	L	98.3	Very high	97.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.3	-44.8	175.2	-179.4	60.4	0	0	0	111.4	L354 F357 L358 L431 L437 L445 R484 A485 T490 Y491 I492	L354-L488 HydrophobicContact CD1-CD2 4.35Å; L354-L488 HydrophobicContact CG-CD2 4Å; F357-L488 HydrophobicContact CD1-CB 3.93Å; F357-L488 HydrophobicContact CD1-CD1 3.95Å; F357-L488 HydrophobicContact CD1-CD2 4.29Å; F357-L488 HydrophobicContact CD1-CG 4.27Å; F357-L488 HydrophobicContact CE1-CB 3.71Å; F357-L488 HydrophobicContact CE1-CD1 4.24Å; F357-L488 HydrophobicContact CE1-CG 4.46Å; F357-L488 HydrophobicContact CG-CD1 4.48Å; L358-L488 HydrophobicContact CD2-CD2 4.27Å; L358-L488 HydrophobicContact CG-CD2 4.45Å; L431-L488 HydrophobicContact CD1-CD1 3.66Å; L431-L488 HydrophobicContact CD2-CD1 3.95Å; L431-L488 HydrophobicContact CG-CD1 4.49Å; L437-L488 HydrophobicContact CD1-CD1 4.48Å; L445-L488 HydrophobicContact CD1-CD2 4.09Å; R484-L488 WeakPolarHBondContact O-CB 3.41Å; R484-L488 PolarHBondContact O-N 3.24Å; A485-L488 PolarHBondContact O-N 2.96Å; L488-T490 VanDerWaalsContact C-N 3.3Å; L488-T490 PolarHBondContact O-N 3.03Å; L488-Y491 WeakPolarHBondContact O-CB 3.15Å; L488-Y491 PolarHBondContact O-N 3.03Å; L488-I492 HydrophobicContact CD1-CD1 4.4Å; L488-I492 HydrophobicContact CD1-CG1 4.42Å; L488-I492 HydrophobicContact CG-CD1 3.99Å; L488-I492 HydrophobicContact CG-CG1 4.47Å; L488-I492 WeakPolarHBondContact O-CB 3.28Å; L488-I492 VanDerWaalsContact O-CG1 3.22Å; L488-I492 WeakPolarHBondContact O-CG1 3.48Å; L488-I492 PolarHBondContact O-N 3.38Å
489	L	98.4	Very high	97.8	Very high	22 Å²	22	53.4 Å²	53.4	12%	0.115	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-37.7	177	-71	173.5	0	0	0	112.2	V442 L445 R446 A485 N486 I487 I492 N493	V442-L489 HydrophobicContact CG1-CD2 3.99Å; L445-L489 HydrophobicContact CB-CD1 4.16Å; L445-L489 HydrophobicContact CB-CD2 4.32Å; L445-L489 HydrophobicContact CB-CG 4.4Å; R446-L489 HydrophobicContact CG-CD1 4.21Å; R446-L489 HydrophobicContact CG-CD2 3.54Å; A485-L489 WeakPolarHBondContact O-CB 3.38Å; A485-L489 VanDerWaalsContact O-CG 3.23Å; A485-L489 WeakPolarHBondContact O-CG 3.38Å; A485-L489 PolarHBondContact O-N 3.32Å; N486-L489 PolarHBondContact O-N 3.21Å; I487-L489 VanDerWaalsContact C-N 3.34Å; I487-L489 PolarHBondContact O-N 2.89Å; L489-I492 HydrophobicContact CD2-CD1 4.3Å; L489-N493 VanDerWaalsContact O-CG 3.3Å; L489-N493 PolarHBondContact O-N 3.06Å; L489-N493 PolarHBondContact O-ND2 2.69Å
490	T	98.2	Very high	97.7	Very high	93 Å²	93	52.6 Å²	52.6	57%	0.571	29%	0.286	S	S	*	.	H	α-helix	trans	-65.2	-44.5	174.3	-54.9	0	0	0	0	110.7	N486 I487 L488 N493 A494	N486-T490 PolarHBondContact O-N 3.46Å; N486-T490 PolarHBondContact O-OG1 3.25Å; I487-T490 WeakPolarHBondContact O-CB 3.32Å; I487-T490 PolarHBondContact O-N 3.11Å; I487-T490 VanDerWaalsContact O-N 3.14Å; L488-T490 VanDerWaalsContact C-N 3.3Å; L488-T490 PolarHBondContact O-N 3.03Å; T490-N493 PolarHBondContact O-N 3.27Å; T490-A494 WeakPolarHBondContact O-CB 3.49Å; T490-A494 PolarHBondContact O-N 3.08Å
491	Y	98.1	Very high	97.5	Very high	40 Å²	40	55.3 Å²	55.3	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-46.1	175.7	-174.6	-88.7	0	0	0	111.9	F428 L431 I487 L488 N493 A494 H495 I497	F428-Y491 AromaticContact CD1-CD2 3.6Å; F428-Y491 HydrophobicContact CD1-CD2 3.6Å; F428-Y491 AromaticContact CD1-CE2 3.76Å; F428-Y491 HydrophobicContact CD1-CE2 3.76Å; F428-Y491 HydrophobicContact CD1-CG 4.37Å; F428-Y491 AromaticContact CE1-CD2 3.69Å; F428-Y491 HydrophobicContact CE1-CD2 3.69Å; F428-Y491 HydrophobicContact CE1-CE2 4.32Å; F428-Y491 HydrophobicContact CE1-CG 4.28Å; L431-Y491 HydrophobicContact CB-CD1 4.44Å; L431-Y491 HydrophobicContact CB-CE1 3.7Å; L431-Y491 HydrophobicContact CD1-CD1 3.6Å; L431-Y491 HydrophobicContact CD1-CD2 4.46Å; L431-Y491 HydrophobicContact CD1-CE1 3.72Å; L431-Y491 HydrophobicContact CD1-CG 4Å; L431-Y491 HydrophobicContact CG-CE1 4.34Å; I487-Y491 WeakPolarHBondContact O-CB 3.12Å; I487-Y491 PolarHBondContact O-N 3.15Å; L488-Y491 WeakPolarHBondContact O-CB 3.15Å; L488-Y491 PolarHBondContact O-N 3.03Å; Y491-N493 VanDerWaalsContact C-N 3.28Å; Y491-N493 PolarHBondContact O-N 3.04Å; Y491-A494 PolarHBondContact O-N 3.05Å; Y491-H495 AromaticContact CD2-CD2 3.47Å; Y491-H495 VanDerWaalsContact CD2-CD2 3.47Å; Y491-H495 WeakPolarHBondContact CD2-CD2 3.39Å; Y491-H495 AromaticContact CD2-NE2 3.58Å; Y491-H495 HydrophobicContact CE1-CB 4.4Å; Y491-H495 AromaticContact CE1-CD2 3.92Å; Y491-H495 AromaticContact CE2-CD2 3.38Å; Y491-H495 WeakPolarHBondContact CE2-CD2 3.34Å; Y491-H495 AromaticContact CE2-CE1 3.9Å; Y491-H495 AromaticContact CE2-NE2 3.22Å; Y491-H495 WeakPolarHBondContact CE2-NE2 3.31Å; Y491-H495 AromaticContact CG-CD2 3.79Å; Y491-H495 AromaticContact CZ-CD2 3.61Å; Y491-H495 AromaticContact CZ-CG 3.92Å; Y491-H495 AromaticContact CZ-NE2 3.75Å; Y491-H495 WeakPolarHBondContact O-CB 3.35Å; Y491-H495 PolarHBondContact O-CD2 2.92Å; Y491-H495 VanDerWaalsContact O-CD2 3.31Å; Y491-H495 PolarHBondContact O-N 3.13Å; Y491-I497 HydrophobicContact CD1-CD1 3.76Å; Y491-I497 HydrophobicContact CE1-CD1 3.61Å
492	I	98.3	Very high	97	Very high	2 Å²	2	56.6 Å²	56.6	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-53.3	-47	175.9	-73.4	166.3	0	0	0	111.1	L437 V442 L488 L489 G496 I497 V499	L437-I492 HydrophobicContact CD1-CD1 3.49Å; L437-I492 VanDerWaalsContact CD1-CD1 3.49Å; L437-I492 HydrophobicContact CD1-CG1 3.61Å; V442-I492 HydrophobicContact CG1-CD1 4.42Å; V442-I492 HydrophobicContact CG2-CD1 4.22Å; L488-I492 HydrophobicContact CD1-CD1 4.4Å; L488-I492 HydrophobicContact CD1-CG1 4.42Å; L488-I492 HydrophobicContact CG-CD1 3.99Å; L488-I492 HydrophobicContact CG-CG1 4.47Å; L488-I492 WeakPolarHBondContact O-CB 3.28Å; L488-I492 VanDerWaalsContact O-CG1 3.22Å; L488-I492 WeakPolarHBondContact O-CG1 3.48Å; L488-I492 PolarHBondContact O-N 3.38Å; L489-I492 HydrophobicContact CD2-CD1 4.3Å; I492-G496 PolarHBondContact O-N 3.37Å; I492-G496 VanDerWaalsContact O-N 3.13Å; I492-I497 HydrophobicContact CB-CB 4.41Å; I492-I497 HydrophobicContact CG1-CB 4.39Å; I492-I497 HydrophobicContact CG1-CD1 4.49Å; I492-I497 HydrophobicContact CG1-CG2 4.47Å; I492-I497 HydrophobicContact CG2-CB 4.15Å; I492-I497 PolarHBondContact O-N 3.21Å; I492-V499 HydrophobicContact CG2-CG2 4.28Å
493	N	97.8	Very high	95.4	Very high	115 Å²	115	61 Å²	61	62%	0.615	34%	0.336	S	S	*	.	H	α-helix	trans	-69.9	-43.4	-179.4	-66.3	-23.5	0	0	0	111.8	L489 T490 Y491 H495 G496	L489-N493 VanDerWaalsContact O-CG 3.3Å; L489-N493 PolarHBondContact O-N 3.06Å; L489-N493 PolarHBondContact O-ND2 2.69Å; T490-N493 PolarHBondContact O-N 3.27Å; Y491-N493 VanDerWaalsContact C-N 3.28Å; Y491-N493 PolarHBondContact O-N 3.04Å; N493-H495 VanDerWaalsContact C-N 3.33Å; N493-H495 PolarHBondContact O-N 3.29Å; N493-G496 PolarHBondContact O-N 3.33Å
494	A	98.1	Very high	93.4	Very high	80 Å²	80	60.5 Å²	60.5	66%	0.661	34%	0.343	S	S	*	.	H	α-helix	trans	-65.4	-35.2	-178.7	0	0	0	0	0	112.8	T490 Y491	T490-A494 WeakPolarHBondContact O-CB 3.49Å; T490-A494 PolarHBondContact O-N 3.08Å; Y491-A494 PolarHBondContact O-N 3.05Å
495	H	97.7	Very high	93.1	Very high	116 Å²	116	63.5 Å²	63.5	54%	0.537	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	3.1	-178.3	-69.7	-91.9	0	0	0	113.7	Y491 N493 I497	Y491-H495 AromaticContact CD2-CD2 3.47Å; Y491-H495 VanDerWaalsContact CD2-CD2 3.47Å; Y491-H495 WeakPolarHBondContact CD2-CD2 3.39Å; Y491-H495 AromaticContact CD2-NE2 3.58Å; Y491-H495 HydrophobicContact CE1-CB 4.4Å; Y491-H495 AromaticContact CE1-CD2 3.92Å; Y491-H495 AromaticContact CE2-CD2 3.38Å; Y491-H495 WeakPolarHBondContact CE2-CD2 3.34Å; Y491-H495 AromaticContact CE2-CE1 3.9Å; Y491-H495 AromaticContact CE2-NE2 3.22Å; Y491-H495 WeakPolarHBondContact CE2-NE2 3.31Å; Y491-H495 AromaticContact CG-CD2 3.79Å; Y491-H495 AromaticContact CZ-CD2 3.61Å; Y491-H495 AromaticContact CZ-CG 3.92Å; Y491-H495 AromaticContact CZ-NE2 3.75Å; Y491-H495 WeakPolarHBondContact O-CB 3.35Å; Y491-H495 PolarHBondContact O-CD2 2.92Å; Y491-H495 VanDerWaalsContact O-CD2 3.31Å; Y491-H495 PolarHBondContact O-N 3.13Å; N493-H495 VanDerWaalsContact C-N 3.33Å; N493-H495 PolarHBondContact O-N 3.29Å; H495-I497 VanDerWaalsContact C-N 3.25Å; H495-I497 HydrophobicContact CB-CD1 4.31Å; H495-I497 HydrophobicContact CB-CG1 4.07Å; H495-I497 PolarHBondContact O-N 3.43Å
496	G	97.3	Very high	92.9	Very high	58 Å²	58	66.6 Å²	66.6	60%	0.598	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	32	179.2	0	0	0	0	0	113.7	I492 N493 K498	I492-G496 PolarHBondContact O-N 3.37Å; I492-G496 VanDerWaalsContact O-N 3.13Å; N493-G496 PolarHBondContact O-N 3.33Å; G496-K498 PolarHBondContact O-N 3.28Å
497	I	97.9	Very high	92.6	Very high	14 Å²	14	65.4 Å²	65.4	7%	0.072	37%	0.373	C	S	.	.			trans	-67.7	127.8	-179.2	-66.3	176.9	0	0	0	109.3	L437 Y491 I492 H495	L437-I497 HydrophobicContact CB-CG2 4.29Å; L437-I497 HydrophobicContact CD1-CG2 3.94Å; L437-I497 HydrophobicContact CG-CG2 3.8Å; Y491-I497 HydrophobicContact CD1-CD1 3.76Å; Y491-I497 HydrophobicContact CE1-CD1 3.61Å; I492-I497 HydrophobicContact CB-CB 4.41Å; I492-I497 HydrophobicContact CG1-CB 4.39Å; I492-I497 HydrophobicContact CG1-CD1 4.49Å; I492-I497 HydrophobicContact CG1-CG2 4.47Å; I492-I497 HydrophobicContact CG2-CB 4.15Å; I492-I497 PolarHBondContact O-N 3.21Å; H495-I497 VanDerWaalsContact C-N 3.25Å; H495-I497 HydrophobicContact CB-CD1 4.31Å; H495-I497 HydrophobicContact CB-CG1 4.07Å; H495-I497 PolarHBondContact O-N 3.43Å
498	K	97.6	Very high	92.3	Very high	137 Å²	137	66.9 Å²	66.9	60%	0.596	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	140.9	-179.7	-64	-175.8	-179.1	-178.9	0	110.3	K435 E436 L437 G496 I500	K435-K498 PolarHBondContact O-N 3.4Å; E436-K498 CarbonylContact C-O 3.47Å; E436-K498 WeakPolarHBondContact CA-O 3.49Å; E436-K498 HydrophobicContact CB-CB 4.5Å; L437-K498 PolarHBondContact N-O 2.95Å; G496-K498 PolarHBondContact O-N 3.28Å; K498-I500 HydrophobicContact CB-CG2 4.2Å
499	V	97.3	Very high	91.9	Very high	37 Å²	37	71.1 Å²	71.1	22%	0.224	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.6	173.9	179.4	0	0	0	0	106.6	L437 E439 V442 I492	L437-V499 WeakPolarHBondContact O-CA 3.34Å; E439-V499 VanDerWaalsContact CA-CG1 3.44Å; E439-V499 HydrophobicContact CB-CG1 3.86Å; E439-V499 HydrophobicContact CG-CG1 4.15Å; V442-V499 HydrophobicContact CB-CG1 3.89Å; V442-V499 HydrophobicContact CB-CG2 4.37Å; V442-V499 HydrophobicContact CG1-CG1 4.05Å; V442-V499 HydrophobicContact CG1-CG2 3.89Å; V442-V499 HydrophobicContact CG2-CG1 4.3Å; V442-V499 HydrophobicContact CG2-CG2 4.33Å; I492-V499 HydrophobicContact CG2-CG2 4.28Å
500	I	94.9	Very high	91.5	Very high	47 Å²	47	74.3 Å²	74.3	24%	0.241	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	152.4	-171.5	65.2	172.2	0	0	0	111.3	E436 L437 E439 K498 M502	E436-I500 HydrophobicContact CB-CD1 3.97Å; E436-I500 HydrophobicContact CB-CG1 4.23Å; E436-I500 HydrophobicContact CG-CD1 4.18Å; E436-I500 WeakPolarHBondContact OE1-CD1 3.5Å; L437-I500 PolarHBondContact O-N 3.18Å; L437-I500 VanDerWaalsContact O-N 3.07Å; E439-I500 WeakPolarHBondContact CB-O 3.46Å; E439-I500 PolarHBondContact N-O 3.46Å; K498-I500 HydrophobicContact CB-CG2 4.2Å; I500-M502 HydrophobicContact CD1-CE 4.02Å; I500-M502 HydrophobicContact CD1-CG 4.38Å; I500-M502 HydrophobicContact CG1-CE 3.76Å; I500-M502 HydrophobicContact CG1-CG 3.97Å; I500-M502 PolarHBondContact O-N 3.12Å
501	P	92.6	Very high	91	Very high	87 Å²	87	73 Å²	73	57%	0.565	42%	0.415	S	S	*	.			trans	-64.5	118.4	167.6	27	-33.1	0	0	0	108.6	E439	E439-P501 WeakPolarHBondContact OE2-CD 3.12Å
502	M	87	Confident	90.4	Very high	27 Å²	27	75.5 Å²	75.5	13%	0.133	44%	0.435	C	S	.	.			trans	-105.8	94.7	174.1	-66.2	-178.5	176.2	0	0	106.6	E436 L437 P438 I500	E436-M502 HydrophobicContact CB-CE 3.89Å; E436-M502 HydrophobicContact CG-CE 3.77Å; L437-M502 VanDerWaalsContact C-CE 3.49Å; P438-M502 HydrophobicContact CB-CB 4.38Å; P438-M502 HydrophobicContact CB-CG 4.33Å; P438-M502 HydrophobicContact CB-SD 3.84Å; P438-M502 HydrophobicContact CG-SD 4.31Å; I500-M502 HydrophobicContact CD1-CE 4.02Å; I500-M502 HydrophobicContact CD1-CG 4.38Å; I500-M502 HydrophobicContact CG1-CE 3.76Å; I500-M502 HydrophobicContact CG1-CG 3.97Å; I500-M502 PolarHBondContact O-N 3.12Å
503	N	63.8	Low	89.8	Confident	138 Å²	138	81.7 Å²	81.7	74%	0.738	47%	0.47	S	S	*	.			trans	-72.7	152.2	171.9	-67.1	-8.3	0	0	0	109.5
504	D	55.5	Low	89.1	Confident	124 Å²	124	78.6 Å²	78.6	66%	0.663	46%	0.457	S	S	*	.			trans	-76.9	0	165.5	-72	-12.1	0	0	0	110.5	R274 K351	R274-D504 IonicContact CZ-OD1 3.7Å; R274-D504 IonicContact CZ-OD2 3.65Å; R274-D504 IonicContact NH1-OD1 3.63Å; R274-D504 PolarHBondContact NH1-OD1 2.97Å; R274-D504 IonicContact NH1-OD2 2.79Å; R274-D504 PolarHBondContact NH1-OD2 3.46Å; R274-D504 VanDerWaalsContact NH2-CG 3.29Å; R274-D504 IonicContact NH2-OD1 2.71Å; R274-D504 PolarHBondContact NH2-OD1 3.34Å; R274-D504 IonicContact NH2-OD2 3.77Å; K351-D504 IonicContact NZ-OD1 3.21Å; K351-D504 PolarHBondContact NZ-OD1 3.42Å

Retrieved 504 of 504 residues in 231.1 ms (Link to these results)

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