A0A087YCW3_POEFO Loading...

Inositol 1,4,5-trisphosphate receptor-interacting protein

Enhances Ca(2+)-mediated inhibition of inositol 1,4,5-triphosphate receptor (ITPR) Ca(2+) release.

AlphaFold DB , UniProt , Accession A0A087YCW3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 526 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	47.6	Very low	50.5	Low	202 Å²	202	114.8 Å²	114.8	100%	0.995	63%	0.63	S	S	*	*				0	-35.2	0	-91.1	176.3	75.6	0	0	115.5
2	Q	45.8	Very low	51	Low	179 Å²	179	111.6 Å²	111.6	84%	0.836	62%	0.616	S	S	*	*	H	α-helix	trans	-73.6	-28.5	179.6	-84.3	173.5	-28.2	0	0	115.2
3	G	45.5	Very low	51.2	Low	49 Å²	49	106.2 Å²	106.2	51%	0.505	60%	0.595	S	S	.	*	H	α-helix	trans	-72.8	-26.9	179	0	0	0	0	0	114.5	R7	G3-R7 WeakPolarHBondContact O-CG 3.45Å; G3-R7 PolarHBondContact O-N 2.71Å
4	T	44.7	Very low	51	Low	93 Å²	93	101.8 Å²	101.8	57%	0.571	58%	0.579	S	S	*	*	H	α-helix	trans	-76.1	-38.4	-177.3	-28.5	0	0	0	0	111.3	R7 V8	T4-R7 PolarHBondContact O-N 2.71Å; T4-V8 WeakPolarHBondContact O-CG2 3.12Å; T4-V8 PolarHBondContact O-N 3.36Å; T4-V8 VanDerWaalsContact O-N 3.07Å
5	I	50.4	Low	50.8	Low	108 Å²	108	99.1 Å²	99.1	55%	0.554	57%	0.574	S	S	*	*	H	α-helix	trans	-64.6	-42.5	177.1	-62.9	170.3	0	0	0	110.7	R7 V8 C9	I5-R7 VanDerWaalsContact C-N 3.29Å; I5-R7 PolarHBondContact O-N 3.23Å; I5-V8 PolarHBondContact O-N 3.46Å; I5-C9 PolarHBondContact O-N 2.96Å; I5-C9 PolarHBondContact O-SG 3.01Å
6	A	48.9	Very low	50.9	Low	56 Å²	56	101 Å²	101	46%	0.463	58%	0.58	S	S	.	*	H	α-helix	trans	-63.3	-33.9	177	0	0	0	0	0	112.8	M10	A6-M10 WeakPolarHBondContact O-CB 3.25Å; A6-M10 VanDerWaalsContact O-CG 3.28Å; A6-M10 WeakPolarHBondContact O-CG 3.43Å; A6-M10 PolarHBondContact O-N 2.99Å; A6-M10 VanDerWaalsContact O-N 3.11Å
7	R	49.3	Very low	50.9	Low	165 Å²	165	103.3 Å²	103.3	62%	0.623	59%	0.589	S	S	*	*	H	α-helix	trans	-71.6	-41.6	176.2	-72.7	177.1	-178.8	-176.4	0.3	112.2	G3 T4 I5 M10 V11	G3-R7 WeakPolarHBondContact O-CG 3.45Å; G3-R7 PolarHBondContact O-N 2.71Å; T4-R7 PolarHBondContact O-N 2.71Å; I5-R7 VanDerWaalsContact C-N 3.29Å; I5-R7 PolarHBondContact O-N 3.23Å; R7-M10 PolarHBondContact O-N 3.17Å; R7-V11 WeakPolarHBondContact O-CG2 3.16Å; R7-V11 PolarHBondContact O-N 2.69Å
8	V	54.6	Low	50.6	Low	88 Å²	88	104.5 Å²	104.5	53%	0.533	59%	0.593	S	S	.	*	H	α-helix	trans	-63.3	-44.4	175.4	176.1	0	0	0	0	110.4	T4 I5 M10 V11 V12	T4-V8 WeakPolarHBondContact O-CG2 3.12Å; T4-V8 PolarHBondContact O-N 3.36Å; T4-V8 VanDerWaalsContact O-N 3.07Å; I5-V8 PolarHBondContact O-N 3.46Å; V8-M10 VanDerWaalsContact C-N 3.32Å; V8-M10 PolarHBondContact O-N 3.06Å; V8-V11 PolarHBondContact O-N 2.97Å; V8-V12 HydrophobicContact CG1-CG2 4.17Å; V8-V12 WeakPolarHBondContact O-CB 3.45Å; V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 3.31Å
9	C	52.7	Low	50	Low	79 Å²	79	107.7 Å²	107.7	53%	0.534	60%	0.602	S	S	.	*	H	α-helix	trans	-61.7	-37.5	176.5	-67.1	0	0	0	0	113	I5 A13	I5-C9 PolarHBondContact O-N 2.96Å; I5-C9 PolarHBondContact O-SG 3.01Å; C9-A13 WeakPolarHBondContact O-CB 3.46Å; C9-A13 PolarHBondContact O-N 3.31Å
10	M	55.9	Low	49.5	Very low	141 Å²	141	107.4 Å²	107.4	70%	0.695	61%	0.605	S	S	*	*	H	α-helix	trans	-71.3	-37	177.6	-76.6	-68.2	-69.6	0	0	112.9	A6 R7 V8 A14	A6-M10 WeakPolarHBondContact O-CB 3.25Å; A6-M10 VanDerWaalsContact O-CG 3.28Å; A6-M10 WeakPolarHBondContact O-CG 3.43Å; A6-M10 PolarHBondContact O-N 2.99Å; A6-M10 VanDerWaalsContact O-N 3.11Å; R7-M10 PolarHBondContact O-N 3.17Å; V8-M10 VanDerWaalsContact C-N 3.32Å; V8-M10 PolarHBondContact O-N 3.06Å; M10-A14 VanDerWaalsContact O-CB 3.26Å; M10-A14 WeakPolarHBondContact O-CB 3.33Å; M10-A14 PolarHBondContact O-N 3.39Å
11	V	60.3	Low	49.1	Very low	103 Å²	103	109.8 Å²	109.8	62%	0.624	62%	0.616	S	S	*	*	H	α-helix	trans	-72.5	-40.1	177.1	174.6	0	0	0	0	110.9	R7 V8 A14 A15	R7-V11 WeakPolarHBondContact O-CG2 3.16Å; R7-V11 PolarHBondContact O-N 2.69Å; V8-V11 PolarHBondContact O-N 2.97Å; V11-A14 PolarHBondContact O-N 3.47Å; V11-A15 WeakPolarHBondContact O-CB 3.29Å; V11-A15 PolarHBondContact O-N 2.83Å
12	V	56.1	Low	48.6	Very low	76 Å²	76	107.9 Å²	107.9	46%	0.461	61%	0.609	S	S	.	*	H	α-helix	trans	-64	-43.2	174	174.1	0	0	0	0	110.8	V8 A14 A15 I16	V8-V12 HydrophobicContact CG1-CG2 4.17Å; V8-V12 WeakPolarHBondContact O-CB 3.45Å; V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 3.31Å; V12-A14 PolarHBondContact O-N 3.26Å; V12-A15 PolarHBondContact O-N 2.05Å; V12-I16 HydrophobicContact CG1-CD1 3.91Å; V12-I16 VanDerWaalsContact O-CG1 3.31Å; V12-I16 WeakPolarHBondContact O-CG1 3.5Å; V12-I16 PolarHBondContact O-N 2.64Å
13	A	53.9	Low	48.1	Very low	41 Å²	41	109 Å²	109	34%	0.339	61%	0.611	S	S	.	*	H	α-helix	trans	-63.2	-40.6	174.5	0	0	0	0	0	112.1	C9 L17	C9-A13 WeakPolarHBondContact O-CB 3.46Å; C9-A13 PolarHBondContact O-N 3.31Å; A13-L17 VanDerWaalsContact O-CB 3.31Å; A13-L17 WeakPolarHBondContact O-CB 3.46Å; A13-L17 WeakPolarHBondContact O-CD1 3.44Å; A13-L17 WeakPolarHBondContact O-CG 3.45Å; A13-L17 PolarHBondContact O-N 3.45Å
14	A	48.8	Very low	47.6	Very low	45 Å²	45	112.9 Å²	112.9	37%	0.372	63%	0.627	S	S	.	*	H	α-helix	trans	-68.8	-31.7	177.3	0	0	0	0	0	113.1	M10 V11 V12 N18	M10-A14 VanDerWaalsContact O-CB 3.26Å; M10-A14 WeakPolarHBondContact O-CB 3.33Å; M10-A14 PolarHBondContact O-N 3.39Å; V11-A14 PolarHBondContact O-N 3.47Å; V12-A14 PolarHBondContact O-N 3.26Å; A14-N18 WeakPolarHBondContact O-CB 3.46Å; A14-N18 PolarHBondContact O-N 3.15Å; A14-N18 PolarHBondContact O-ND2 3.33Å
15	A	47	Very low	47.1	Very low	62 Å²	62	115.6 Å²	115.6	51%	0.512	63%	0.633	S	S	.	*	H	α-helix	trans	-72.4	-42.5	176.1	0	0	0	0	0	112	V11 V12 L17 N18 H19	V11-A15 WeakPolarHBondContact O-CB 3.29Å; V11-A15 PolarHBondContact O-N 2.83Å; V12-A15 PolarHBondContact O-N 2.05Å; A15-L17 VanDerWaalsContact C-N 3.32Å; A15-L17 PolarHBondContact O-N 3.45Å; A15-N18 PolarHBondContact O-N 3.12Å; A15-H19 PolarHBondContact O-N 2.82Å
16	I	53.6	Low	46.2	Very low	129 Å²	129	119.5 Å²	119.5	66%	0.662	65%	0.649	S	S	*	*	H	α-helix	trans	-65.3	-36.8	175.8	-65.7	167.8	0	0	0	111.2	V12	V12-I16 HydrophobicContact CG1-CD1 3.91Å; V12-I16 VanDerWaalsContact O-CG1 3.31Å; V12-I16 WeakPolarHBondContact O-CG1 3.5Å; V12-I16 PolarHBondContact O-N 2.64Å
17	L	50.7	Low	45.5	Very low	140 Å²	140	122.6 Å²	122.6	73%	0.733	66%	0.658	S	S	*	*	H	α-helix	trans	-77.9	-22.4	-178.3	-73.7	166.9	0	0	0	114.1	A13 A15	A13-L17 VanDerWaalsContact O-CB 3.31Å; A13-L17 WeakPolarHBondContact O-CB 3.46Å; A13-L17 WeakPolarHBondContact O-CD1 3.44Å; A13-L17 WeakPolarHBondContact O-CG 3.45Å; A13-L17 PolarHBondContact O-N 3.45Å; A15-L17 VanDerWaalsContact C-N 3.32Å; A15-L17 PolarHBondContact O-N 3.45Å
18	N	44.3	Very low	44.7	Very low	125 Å²	125	120.8 Å²	120.8	67%	0.668	67%	0.665	S	S	*	*	H	α-helix	trans	-102.3	-9.1	-175.6	-77.3	-53	0	0	0	115.4	A14 A15	A14-N18 WeakPolarHBondContact O-CB 3.46Å; A14-N18 PolarHBondContact O-N 3.15Å; A14-N18 PolarHBondContact O-ND2 3.33Å; A15-N18 PolarHBondContact O-N 3.12Å
19	H	39.9	Very low	43.9	Very low	165 Å²	165	122.4 Å²	122.4	76%	0.764	68%	0.676	S	S	*	*			trans	-127.3	84	173.7	-97.9	-77.4	0	0	0	111.8	A15	A15-H19 PolarHBondContact O-N 2.82Å
20	P	39.2	Very low	43.3	Very low	101 Å²	101	126.5 Å²	126.5	66%	0.656	69%	0.692	S	S	*	*			trans	-79.1	131.3	164.8	32.3	-26.5	0	0	0	107.5
21	L	41.5	Very low	43.1	Very low	159 Å²	159	125 Å²	125	83%	0.832	69%	0.693	S	S	*	*			trans	99.1	84.2	174.3	-51.4	163.8	0	0	0	115.7
22	L	36.9	Very low	42.6	Very low	161 Å²	161	129.2 Å²	129.2	84%	0.843	71%	0.705	S	S	*	*			trans	-138.6	68.6	141.1	-80.2	178.2	0	0	0	109.5
23	F	35.9	Very low	42.6	Very low	202 Å²	202	133 Å²	133	89%	0.886	72%	0.718	S	S	*	*			trans	-145	106.1	153.6	-73.2	-69.7	0	0	0	107.8
24	P	35.1	Very low	42.8	Very low	131 Å²	131	137.4 Å²	137.4	85%	0.851	74%	0.736	S	S	*	*			trans	-78.6	121.3	159.5	15.3	-0.1	0	0	0	107.9
25	H	33.3	Very low	43.7	Very low	150 Å²	150	143.7 Å²	143.7	69%	0.694	76%	0.757	S	S	*	*			trans	-95.9	112	165.8	-172.9	31.9	0	0	0	107.7	N27	H25-N27 PolarHBondContact CE1-OD1 3.12Å; H25-N27 VanDerWaalsContact CE1-OD1 3.3Å
26	E	33	Very low	44.8	Very low	191 Å²	191	144.8 Å²	144.8	89%	0.893	76%	0.755	S	S	*	*			trans	-135.6	121.1	157.9	-94.4	-177.6	169.6	0	0	109.2
27	N	34.3	Very low	45.5	Very low	120 Å²	120	143 Å²	143	64%	0.642	75%	0.746	S	S	*	*			trans	-76.9	135.2	169.2	-67.1	-45.8	0	0	0	108.9	H25	H25-N27 PolarHBondContact CE1-OD1 3.12Å; H25-N27 VanDerWaalsContact CE1-OD1 3.3Å
28	T	32.8	Very low	46.6	Very low	127 Å²	127	140 Å²	140	78%	0.779	73%	0.733	S	S	*	*				159.7	128.4	122.8	38.8	0	0	0	0	113.6
29	T	35.9	Very low	48.3	Very low	123 Å²	123	136.8 Å²	136.8	76%	0.755	72%	0.724	S	S	*	*			trans	72.5	118.4	144.9	53.4	0	0	0	0	123.2
30	L	42.1	Very low	50.1	Low	165 Å²	165	135.6 Å²	135.6	86%	0.864	71%	0.713	S	S	*	*			trans	82.1	145.8	145.9	-66.5	171.3	0	0	0	120.6
31	P	51	Low	51.6	Low	110 Å²	110	136.6 Å²	136.6	71%	0.714	71%	0.71	S	S	*	*			trans	-107.1	106.6	-155.5	35.1	-20	0	0	0	111.5
32	E	49	Very low	53.5	Low	190 Å²	190	136.9 Å²	136.9	89%	0.888	70%	0.7	S	S	*	*			trans	-170.6	62	165.6	-115.6	173.6	-155.6	0	0	110.6
33	Q	56.1	Low	55.7	Low	155 Å²	155	135.7 Å²	135.7	72%	0.724	69%	0.691	S	S	*	*			trans	-165.8	28.5	167.1	-116.1	166.7	32.3	0	0	116.3
34	D	59.3	Low	57.8	Low	135 Å²	135	131.1 Å²	131.1	72%	0.722	67%	0.672	S	S	*	*	H	α-helix	trans	-71.5	-31	-179.7	-95.4	-15.5	0	0	0	113.5	V38	D34-V38 WeakPolarHBondContact O-CB 3.41Å; D34-V38 WeakPolarHBondContact O-CG2 3.38Å; D34-V38 PolarHBondContact O-N 3.43Å
35	E	66.7	Low	60	Low	176 Å²	176	130.2 Å²	130.2	82%	0.822	66%	0.656	S	S	*	*	H	α-helix	trans	-73.2	-37.8	-174.2	-70.6	-165.9	163.7	0	0	113.9	A39	E35-A39 WeakPolarHBondContact O-CB 3.44Å; E35-A39 PolarHBondContact O-N 3.28Å
36	D	71.1	Confident	62.5	Low	86 Å²	86	128.4 Å²	128.4	46%	0.46	65%	0.648	S	S	.	*	H	α-helix	trans	-73.5	-32	179.6	-176.6	73.2	0	0	0	112.2	R40	D36-R40 WeakPolarHBondContact O-CG 3.33Å; D36-R40 PolarHBondContact O-N 3.22Å; D36-R40 VanDerWaalsContact O-N 3.14Å; D36-R40 PolarHBondContact O-NE 2.83Å; D36-R40 IonicContact OD2-CZ 3.8Å; D36-R40 IonicContact OD2-NE 3.34Å; D36-R40 PolarHBondContact OD2-NE 2.76Å; D36-R40 IonicContact OD2-NH2 3.85Å; D36-R40 PolarHBondContact OD2-NH2 3.06Å
37	L	68.4	Low	65	Low	91 Å²	91	124.6 Å²	124.6	48%	0.476	63%	0.632	S	S	.	*	H	α-helix	trans	-73.2	-41.2	176	-159.8	126.5	0	0	0	111	R40 M41	L37-R40 PolarHBondContact O-N 2.82Å; L37-M41 HydrophobicContact CD2-SD 3.9Å; L37-M41 WeakPolarHBondContact O-CG 3.1Å; L37-M41 PolarHBondContact O-N 2.68Å
38	V	73.8	Confident	67.2	Low	77 Å²	77	123.5 Å²	123.5	47%	0.467	63%	0.625	S	S	.	*	H	α-helix	trans	-65.6	-37.4	174.3	172.3	0	0	0	0	111.5	D34 M41 R42	D34-V38 WeakPolarHBondContact O-CB 3.41Å; D34-V38 WeakPolarHBondContact O-CG2 3.38Å; D34-V38 PolarHBondContact O-N 3.43Å; V38-M41 PolarHBondContact O-N 3.17Å; V38-R42 PolarHBondContact O-N 2.9Å
39	A	79.3	Confident	69.6	Low	57 Å²	57	123.5 Å²	123.5	47%	0.471	62%	0.616	S	S	.	*	H	α-helix	trans	-62.7	-46.2	175.3	0	0	0	0	0	111.9	E35 M41 R42 E43	E35-A39 WeakPolarHBondContact O-CB 3.44Å; E35-A39 PolarHBondContact O-N 3.28Å; A39-M41 VanDerWaalsContact C-N 3.34Å; A39-M41 PolarHBondContact O-N 3.03Å; A39-R42 PolarHBondContact O-N 2.76Å; A39-E43 PolarHBondContact O-N 2.89Å
40	R	77.3	Confident	72	Confident	140 Å²	140	124.1 Å²	124.1	53%	0.528	61%	0.612	S	S	.	*	H	α-helix	trans	-66.5	-34	176.4	-73.6	-174.9	-71	175.3	-4.4	113.1	D36 L37 H44	D36-R40 WeakPolarHBondContact O-CG 3.33Å; D36-R40 PolarHBondContact O-N 3.22Å; D36-R40 VanDerWaalsContact O-N 3.14Å; D36-R40 PolarHBondContact O-NE 2.83Å; D36-R40 IonicContact OD2-CZ 3.8Å; D36-R40 IonicContact OD2-NE 3.34Å; D36-R40 PolarHBondContact OD2-NE 2.76Å; D36-R40 IonicContact OD2-NH2 3.85Å; D36-R40 PolarHBondContact OD2-NH2 3.06Å; L37-R40 PolarHBondContact O-N 2.82Å; R40-H44 WeakPolarHBondContact O-CB 3.46Å; R40-H44 PolarHBondContact O-N 2.99Å; R40-H44 VanDerWaalsContact O-N 3.1Å
41	M	70.6	Confident	73.7	Confident	123 Å²	123	121.5 Å²	121.5	61%	0.606	60%	0.595	S	S	*	*	H	α-helix	trans	-64.2	-42.6	173.6	-77	179.6	67.4	0	0	111.8	L37 V38 A39 H44 E45	L37-M41 HydrophobicContact CD2-SD 3.9Å; L37-M41 WeakPolarHBondContact O-CG 3.1Å; L37-M41 PolarHBondContact O-N 2.68Å; V38-M41 PolarHBondContact O-N 3.17Å; A39-M41 VanDerWaalsContact C-N 3.34Å; A39-M41 PolarHBondContact O-N 3.03Å; M41-H44 PolarHBondContact O-N 3.37Å; M41-E45 PolarHBondContact O-N 3.5Å
42	R	81	Confident	74.6	Confident	164 Å²	164	121.7 Å²	121.7	62%	0.619	59%	0.587	S	S	*	*	H	α-helix	trans	-69.3	-38	179.7	-166.7	179.8	-89.2	163.5	-7.7	112.2	V38 A39 H44 E45 E46	V38-R42 PolarHBondContact O-N 2.9Å; A39-R42 PolarHBondContact O-N 2.76Å; R42-H44 VanDerWaalsContact C-N 3.29Å; R42-H44 PolarHBondContact O-N 3.1Å; R42-E45 WeakPolarHBondContact O-CB 3.4Å; R42-E45 PolarHBondContact O-N 2.81Å; R42-E46 PolarHBondContact O-N 2.79Å; R42-E46 VanDerWaalsContact O-N 3.09Å
43	E	84.3	Confident	76.4	Confident	137 Å²	137	115.3 Å²	115.3	64%	0.64	57%	0.566	S	S	*	*	H	α-helix	trans	-66.1	-33.3	175.3	-157.6	174.6	-153.4	0	0	112	A39 M47	A39-E43 PolarHBondContact O-N 2.89Å; E43-M47 PolarHBondContact O-N 2.93Å
44	H	78.8	Confident	77.7	Confident	106 Å²	106	115.4 Å²	115.4	49%	0.491	56%	0.56	S	S	.	*	H	α-helix	trans	-72.8	-35.4	173.8	-165	55.4	0	0	0	112.9	R40 M41 R42 M47 L48	R40-H44 WeakPolarHBondContact O-CB 3.46Å; R40-H44 PolarHBondContact O-N 2.99Å; R40-H44 VanDerWaalsContact O-N 3.1Å; M41-H44 PolarHBondContact O-N 3.37Å; R42-H44 VanDerWaalsContact C-N 3.29Å; R42-H44 PolarHBondContact O-N 3.1Å; H44-M47 PolarHBondContact O-N 2.79Å; H44-L48 WeakPolarHBondContact O-CG 3.31Å; H44-L48 PolarHBondContact O-N 3.15Å
45	E	81.4	Confident	78.6	Confident	112 Å²	112	113 Å²	113	52%	0.523	55%	0.547	S	S	.	.	H	α-helix	trans	-62.1	-47.1	174.8	-171.5	172.2	-155.3	0	0	111.1	M41 R42 M47 L48 E49	M41-E45 PolarHBondContact O-N 3.5Å; R42-E45 WeakPolarHBondContact O-CB 3.4Å; R42-E45 PolarHBondContact O-N 2.81Å; E45-M47 VanDerWaalsContact C-N 3.3Å; E45-M47 PolarHBondContact O-N 2.97Å; E45-L48 PolarHBondContact O-N 2.8Å; E45-E49 WeakPolarHBondContact O-CG 3.44Å; E45-E49 PolarHBondContact O-N 2.8Å
46	E	87.3	Confident	79.1	Confident	112 Å²	112	110.1 Å²	110.1	52%	0.523	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-35.7	176.4	-70.4	-178.9	-178	0	0	112.6	R42 M50	R42-E46 PolarHBondContact O-N 2.79Å; R42-E46 VanDerWaalsContact O-N 3.09Å; E46-M50 PolarHBondContact O-N 3.45Å; E46-M50 VanDerWaalsContact O-N 3.1Å
47	M	84.4	Confident	79.5	Confident	111 Å²	111	113.2 Å²	113.2	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-65.2	-43.2	174.7	-175.7	-174.7	-63	0	0	111.8	E43 H44 E45 M50 E51	E43-M47 PolarHBondContact O-N 2.93Å; H44-M47 PolarHBondContact O-N 2.79Å; E45-M47 VanDerWaalsContact C-N 3.3Å; E45-M47 PolarHBondContact O-N 2.97Å; M47-M50 PolarHBondContact O-N 2.76Å; M47-E51 PolarHBondContact O-N 3.33Å
48	L	80.2	Confident	79.9	Confident	97 Å²	97	112.6 Å²	112.6	51%	0.508	54%	0.537	S	S	.	.	H	α-helix	trans	-66.1	-39.8	178.3	-78.2	165.2	0	0	0	111.7	H44 E45 E51 H52	H44-L48 WeakPolarHBondContact O-CG 3.31Å; H44-L48 PolarHBondContact O-N 3.15Å; E45-L48 PolarHBondContact O-N 2.8Å; L48-E51 PolarHBondContact O-N 3.08Å; L48-H52 WeakPolarHBondContact O-CB 3.37Å; L48-H52 PolarHBondContact O-N 3.19Å
49	E	83.9	Confident	79.9	Confident	127 Å²	127	114.1 Å²	114.1	59%	0.593	54%	0.542	S	S	*	.	H	α-helix	trans	-64.5	-39.4	176.1	-72.3	-172.2	164.7	0	0	112.1	E45 H52 A53	E45-E49 WeakPolarHBondContact O-CG 3.44Å; E45-E49 PolarHBondContact O-N 2.8Å; E49-H52 PolarHBondContact O-N 3.42Å; E49-A53 WeakPolarHBondContact O-CB 3.02Å; E49-A53 PolarHBondContact O-N 2.81Å
50	M	85.6	Confident	79.6	Confident	136 Å²	136	114.4 Å²	114.4	67%	0.67	55%	0.545	S	S	*	.	H	α-helix	trans	-66.2	-41.9	174.7	-84.4	-169.6	-80.1	0	0	112.9	E46 M47 R54	E46-M50 PolarHBondContact O-N 3.45Å; E46-M50 VanDerWaalsContact O-N 3.1Å; M47-M50 PolarHBondContact O-N 2.76Å; M50-R54 WeakPolarHBondContact O-CB 3.47Å; M50-R54 PolarHBondContact O-N 3.08Å
51	E	77.6	Confident	79.2	Confident	109 Å²	109	113.7 Å²	113.7	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-62.4	-43.3	173.7	-99.4	-118.7	141.5	0	0	111.5	M47 L48 A53 R54 L55	M47-E51 PolarHBondContact O-N 3.33Å; L48-E51 PolarHBondContact O-N 3.08Å; E51-A53 PolarHBondContact O-N 3.04Å; E51-R54 WeakPolarHBondContact O-CB 3.18Å; E51-R54 PolarHBondContact O-N 3.41Å; E51-L55 WeakPolarHBondContact O-CG 3.27Å; E51-L55 PolarHBondContact O-N 2.94Å
52	H	71.6	Confident	79	Confident	115 Å²	115	112.4 Å²	112.4	53%	0.532	54%	0.542	S	S	.	.	H	α-helix	trans	-60.3	-47.5	178	-172.3	-86.4	0	0	0	111.5	L48 E49 R54 L55 E56	L48-H52 WeakPolarHBondContact O-CB 3.37Å; L48-H52 PolarHBondContact O-N 3.19Å; E49-H52 PolarHBondContact O-N 3.42Å; H52-R54 VanDerWaalsContact C-N 3.28Å; H52-R54 PolarHBondContact O-N 2.87Å; H52-L55 PolarHBondContact O-N 2.81Å; H52-E56 VanDerWaalsContact CE1-CD 3.49Å; H52-E56 IonicContact CE1-OE1 3.15Å; H52-E56 PolarHBondContact CE1-OE1 2.87Å; H52-E56 IonicContact CE1-OE2 2.79Å; H52-E56 IonicContact ND1-OE1 3.32Å; H52-E56 IonicContact ND1-OE2 3.25Å; H52-E56 PolarHBondContact O-N 3.08Å
53	A	84.9	Confident	78	Confident	56 Å²	56	110.1 Å²	110.1	46%	0.463	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-33.5	177	0	0	0	0	0	112.8	E49 E51 K57	E49-A53 WeakPolarHBondContact O-CB 3.02Å; E49-A53 PolarHBondContact O-N 2.81Å; E51-A53 PolarHBondContact O-N 3.04Å; A53-K57 PolarHBondContact O-N 3.16Å
54	R	84.8	Confident	76.8	Confident	157 Å²	157	107.3 Å²	107.3	59%	0.592	54%	0.538	S	S	*	.	H	α-helix	trans	-67	-47.1	174.1	-179.1	-176.4	173.3	172.8	1.1	111.3	M50 E51 H52 K57 E58	M50-R54 WeakPolarHBondContact O-CB 3.47Å; M50-R54 PolarHBondContact O-N 3.08Å; E51-R54 WeakPolarHBondContact O-CB 3.18Å; E51-R54 PolarHBondContact O-N 3.41Å; H52-R54 VanDerWaalsContact C-N 3.28Å; H52-R54 PolarHBondContact O-N 2.87Å; R54-K57 WeakPolarHBondContact O-CB 3.38Å; R54-K57 PolarHBondContact O-N 3.43Å; R54-K57 VanDerWaalsContact O-N 3.16Å; R54-E58 IonicContact CZ-OE1 2.92Å; R54-E58 IonicContact NE-OE1 2.72Å; R54-E58 PolarHBondContact NE-OE1 3.23Å; R54-E58 IonicContact NH2-OE1 2.65Å; R54-E58 PolarHBondContact O-N 2.93Å
55	L	76.7	Confident	75.6	Confident	84 Å²	84	109 Å²	109	44%	0.44	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-38	-180	-72.4	170	0	0	0	112	E51 H52 K57 E58 L59	E51-L55 WeakPolarHBondContact O-CG 3.27Å; E51-L55 PolarHBondContact O-N 2.94Å; H52-L55 PolarHBondContact O-N 2.81Å; L55-K57 VanDerWaalsContact C-N 3.26Å; L55-K57 PolarHBondContact O-N 3.42Å; L55-E58 PolarHBondContact O-N 2.67Å; L55-L59 WeakPolarHBondContact O-CB 3.24Å; L55-L59 WeakPolarHBondContact O-CG 3.41Å; L55-L59 PolarHBondContact O-N 3.02Å
56	E	79.1	Confident	74.2	Confident	115 Å²	115	110 Å²	110	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-60.7	-37.3	172.7	-81.7	-172.8	148.2	0	0	112.1	H52 L59 A60	H52-E56 VanDerWaalsContact CE1-CD 3.49Å; H52-E56 IonicContact CE1-OE1 3.15Å; H52-E56 PolarHBondContact CE1-OE1 2.87Å; H52-E56 IonicContact CE1-OE2 2.79Å; H52-E56 IonicContact ND1-OE1 3.32Å; H52-E56 IonicContact ND1-OE2 3.25Å; H52-E56 PolarHBondContact O-N 3.08Å; E56-L59 PolarHBondContact O-N 3.38Å; E56-A60 WeakPolarHBondContact O-CB 3.35Å; E56-A60 PolarHBondContact O-N 3.26Å
57	K	78.1	Confident	72.5	Confident	151 Å²	151	113.1 Å²	113.1	66%	0.657	57%	0.569	S	S	*	*	H	α-helix	trans	-71.8	-37.1	177.6	-159.3	176	-176	178.1	0	112.4	A53 R54 L55 Q61	A53-K57 PolarHBondContact O-N 3.16Å; R54-K57 WeakPolarHBondContact O-CB 3.38Å; R54-K57 PolarHBondContact O-N 3.43Å; R54-K57 VanDerWaalsContact O-N 3.16Å; L55-K57 VanDerWaalsContact C-N 3.26Å; L55-K57 PolarHBondContact O-N 3.42Å; K57-Q61 WeakPolarHBondContact O-CG 3.29Å; K57-Q61 PolarHBondContact O-N 3.47Å; K57-Q61 VanDerWaalsContact O-N 3.13Å
58	E	76.4	Confident	70.9	Confident	79 Å²	79	116.1 Å²	116.1	37%	0.369	58%	0.582	S	S	.	*	H	α-helix	trans	-66.9	-39.1	173.6	-73	179.1	-170.7	0	0	111.2	R54 L55 Q61 L62	R54-E58 IonicContact CZ-OE1 2.92Å; R54-E58 IonicContact NE-OE1 2.72Å; R54-E58 PolarHBondContact NE-OE1 3.23Å; R54-E58 IonicContact NH2-OE1 2.65Å; R54-E58 PolarHBondContact O-N 2.93Å; L55-E58 PolarHBondContact O-N 2.67Å; E58-Q61 PolarHBondContact O-N 3.4Å; E58-L62 PolarHBondContact O-N 3.19Å
59	L	73.7	Confident	69	Low	108 Å²	108	117 Å²	117	57%	0.565	59%	0.591	S	S	*	*	H	α-helix	trans	-64.6	-42.6	173.8	-80	167.2	0	0	0	112.5	L55 E56 Q61 L62 D63	L55-L59 WeakPolarHBondContact O-CB 3.24Å; L55-L59 WeakPolarHBondContact O-CG 3.41Å; L55-L59 PolarHBondContact O-N 3.02Å; E56-L59 PolarHBondContact O-N 3.38Å; L59-Q61 VanDerWaalsContact C-N 3.27Å; L59-Q61 PolarHBondContact O-N 3.14Å; L59-L62 PolarHBondContact O-N 2.89Å; L59-D63 PolarHBondContact O-N 2.85Å
60	A	73.4	Confident	67.2	Low	63 Å²	63	116.4 Å²	116.4	52%	0.521	60%	0.598	S	S	.	*	H	α-helix	trans	-65.2	-30.4	176.5	0	0	0	0	0	112.7	E56 S64	E56-A60 WeakPolarHBondContact O-CB 3.35Å; E56-A60 PolarHBondContact O-N 3.26Å; A60-S64 PolarHBondContact O-N 3.2Å
61	Q	70	Confident	65.5	Low	126 Å²	126	115.6 Å²	115.6	59%	0.589	61%	0.606	S	S	*	*	H	α-helix	trans	-71.7	-40.7	172.4	-78.1	-179.2	-21	0	0	112.1	K57 E58 L59 S64 E65	K57-Q61 WeakPolarHBondContact O-CG 3.29Å; K57-Q61 PolarHBondContact O-N 3.47Å; K57-Q61 VanDerWaalsContact O-N 3.13Å; E58-Q61 PolarHBondContact O-N 3.4Å; L59-Q61 VanDerWaalsContact C-N 3.27Å; L59-Q61 PolarHBondContact O-N 3.14Å; Q61-S64 PolarHBondContact O-N 3.02Å; Q61-E65 PolarHBondContact O-N 3.38Å
62	L	65.7	Low	64.1	Low	96 Å²	96	117.4 Å²	117.4	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-65.2	-39.3	176.6	-100.8	144.9	0	0	0	112.9	E58 L59 S64 E65 L66	E58-L62 PolarHBondContact O-N 3.19Å; L59-L62 PolarHBondContact O-N 2.89Å; L62-S64 VanDerWaalsContact C-N 3.3Å; L62-S64 PolarHBondContact O-N 2.74Å; L62-E65 PolarHBondContact O-N 3.01Å; L62-L66 PolarHBondContact O-N 3Å
63	D	60.8	Low	63	Low	115 Å²	115	120.1 Å²	120.1	62%	0.615	63%	0.632	S	S	*	*	H	α-helix	trans	-66.4	-33	175.5	-85.7	-13.1	0	0	0	111.7	L59 L66	L59-D63 PolarHBondContact O-N 2.85Å; D63-L66 PolarHBondContact O-N 2.91Å
64	S	59	Low	61.5	Low	78 Å²	78	119.5 Å²	119.5	55%	0.545	63%	0.631	S	S	.	*	H	α-helix	trans	-71.5	-34	173.4	-178.7	0	0	0	0	113	A60 Q61 L62 L66	A60-S64 PolarHBondContact O-N 3.2Å; Q61-S64 PolarHBondContact O-N 3.02Å; L62-S64 VanDerWaalsContact C-N 3.3Å; L62-S64 PolarHBondContact O-N 2.74Å; S64-L66 VanDerWaalsContact C-N 3.34Å
65	E	53.5	Low	59.9	Low	143 Å²	143	120.8 Å²	120.8	67%	0.668	64%	0.641	S	S	*	*	H	α-helix	trans	-72.6	-27.8	175.4	-80.1	-174.2	155.4	0	0	112.2	Q61 L62 E67	Q61-E65 PolarHBondContact O-N 3.38Å; L62-E65 PolarHBondContact O-N 3.01Å; E65-E67 VanDerWaalsContact C-N 3.34Å; E65-E67 PolarHBondContact O-N 3.12Å
66	L	52.3	Low	59	Low	131 Å²	131	119.8 Å²	119.8	69%	0.686	64%	0.641	S	S	*	*	H	α-helix	trans	-73.2	-22.8	179.4	-136.1	93.8	0	0	0	113.4	L62 D63 S64 E68	L62-L66 PolarHBondContact O-N 3Å; D63-L66 PolarHBondContact O-N 2.91Å; S64-L66 VanDerWaalsContact C-N 3.34Å; L66-E68 VanDerWaalsContact C-N 3.35Å
67	E	50.8	Low	58	Low	178 Å²	178	122.3 Å²	122.3	83%	0.832	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-13.1	178.5	-77.3	-163.8	155.4	0	0	113.9	E65	E65-E67 VanDerWaalsContact C-N 3.34Å; E65-E67 PolarHBondContact O-N 3.12Å
68	E	51.7	Low	57.4	Low	175 Å²	175	123.3 Å²	123.3	82%	0.818	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	3.6	-175.1	-70.6	-158.3	161.7	0	0	116.3	L66	L66-E68 VanDerWaalsContact C-N 3.35Å
69	T	39.3	Very low	57.2	Low	115 Å²	115	125.6 Å²	125.6	71%	0.706	66%	0.656	S	S	*	*	S	Bend	trans	-115.1	119.9	179.5	14.6	0	0	0	0	114.2
70	P	46	Very low	57.1	Low	115 Å²	115	128.3 Å²	128.3	75%	0.747	66%	0.659	S	S	*	*			trans	-85.5	125.8	-175.7	33.1	-32.9	0	0	0	114	D72	P70-D72 PolarHBondContact O-N 3.44Å
71	S	50.5	Low	57	Low	119 Å²	119	127.8 Å²	127.8	83%	0.832	65%	0.652	S	S	*	*	S	Bend		62.6	30.5	128.7	81.6	0	0	0	0	123.5
72	D	48.3	Very low	57.3	Low	146 Å²	146	124.4 Å²	124.4	78%	0.781	65%	0.645	S	S	*	*	S	Bend	trans	-126.5	-3.3	170.1	-140	9.9	0	0	0	115.7	P70	P70-D72 PolarHBondContact O-N 3.44Å
73	Q	48.5	Very low	57.9	Low	172 Å²	172	122.1 Å²	122.1	80%	0.804	64%	0.635	S	S	*	*	S	Bend	trans	-92.8	-13.8	-177.5	-111	168.9	4	0	0	115.1
74	G	52.6	Low	58.6	Low	44 Å²	44	120.2 Å²	120.2	45%	0.454	63%	0.63	S	S	.	*	H	α-helix	trans	-67.7	-39.4	-178.8	0	0	0	0	0	113.1	W77 Y78	G74-W77 PolarHBondContact O-N 3.42Å; G74-Y78 WeakPolarHBondContact O-CD2 3.37Å; G74-Y78 PolarHBondContact O-N 2.98Å
75	F	51.6	Low	59.6	Low	183 Å²	183	123 Å²	123	80%	0.803	63%	0.633	S	S	*	*	H	α-helix	trans	-72.3	-34.9	-173.5	-129.6	-93.7	0	0	0	112.9	F79	F75-F79 PolarHBondContact O-N 3.49Å
76	S	57.3	Low	60.9	Low	63 Å²	63	120.8 Å²	120.8	44%	0.441	63%	0.629	S	S	.	*	H	α-helix	trans	-67	-38.1	177.4	-170.8	0	0	0	0	111.7	F79 W80	S76-F79 PolarHBondContact O-N 3.05Å; S76-W80 PolarHBondContact O-N 3.32Å
77	W	59	Low	62.2	Low	168 Å²	168	119 Å²	119	64%	0.636	62%	0.619	S	S	*	*	H	α-helix	trans	-69.1	-42.8	-177.3	-172.5	-94.7	0	0	0	113.5	G74 F79 S81	G74-W77 PolarHBondContact O-N 3.42Å; W77-F79 VanDerWaalsContact C-N 3.29Å; W77-F79 PolarHBondContact O-N 2.85Å; W77-S81 PolarHBondContact O-N 2.89Å; W77-S81 VanDerWaalsContact O-N 3.14Å; W77-S81 PolarHBondContact O-OG 2.89Å
78	Y	64.5	Low	63.5	Low	173 Å²	173	117 Å²	117	68%	0.678	61%	0.608	S	S	*	*	H	α-helix	trans	-66.8	-32.5	176.5	-71.5	-68.2	0	0	0	112.3	G74 S81 A82	G74-Y78 WeakPolarHBondContact O-CD2 3.37Å; G74-Y78 PolarHBondContact O-N 2.98Å; Y78-S81 VanDerWaalsContact CA-OG 3.31Å; Y78-S81 WeakPolarHBondContact CA-OG 3.1Å; Y78-S81 PolarHBondContact O-OG 3.18Å; Y78-A82 VanDerWaalsContact O-CB 3.26Å; Y78-A82 WeakPolarHBondContact O-CB 3.25Å; Y78-A82 PolarHBondContact O-N 3.27Å
79	F	72.7	Confident	64.4	Low	126 Å²	126	113 Å²	113	55%	0.553	59%	0.592	S	S	*	*	H	α-helix	trans	-64.5	-50.6	176.1	-178.2	-100.2	0	0	0	111.8	F75 S76 W77 S81 A82 V83	F75-F79 PolarHBondContact O-N 3.49Å; S76-F79 PolarHBondContact O-N 3.05Å; W77-F79 VanDerWaalsContact C-N 3.29Å; W77-F79 PolarHBondContact O-N 2.85Å; F79-S81 PolarHBondContact O-N 2.82Å; F79-A82 PolarHBondContact O-N 3.07Å; F79-V83 HydrophobicContact CD1-CG2 4.32Å; F79-V83 HydrophobicContact CE1-CG2 4.02Å; F79-V83 HydrophobicContact CE2-CG2 4.37Å; F79-V83 HydrophobicContact CZ-CG2 4.05Å; F79-V83 WeakPolarHBondContact O-CB 3.47Å; F79-V83 VanDerWaalsContact O-CG2 3.24Å; F79-V83 WeakPolarHBondContact O-CG2 3.42Å; F79-V83 PolarHBondContact O-N 3.4Å
80	W	71.4	Confident	65.9	Low	165 Å²	165	109.9 Å²	109.9	63%	0.625	58%	0.578	S	S	*	*	H	α-helix	trans	-68.6	-33.3	-179.3	-68.8	114.3	0	0	0	113.5	S76 S84	S76-W80 PolarHBondContact O-N 3.32Å; W80-S84 WeakPolarHBondContact O-CB 3.22Å; W80-S84 PolarHBondContact O-N 3.49Å
81	S	71.9	Confident	67	Low	53 Å²	53	108.8 Å²	108.8	37%	0.371	57%	0.565	S	S	.	*	H	α-helix	trans	-71	-38.3	175	43.7	0	0	0	0	112.3	W77 Y78 F79 S84 F85	W77-S81 PolarHBondContact O-N 2.89Å; W77-S81 VanDerWaalsContact O-N 3.14Å; W77-S81 PolarHBondContact O-OG 2.89Å; Y78-S81 VanDerWaalsContact CA-OG 3.31Å; Y78-S81 WeakPolarHBondContact CA-OG 3.1Å; Y78-S81 PolarHBondContact O-OG 3.18Å; F79-S81 PolarHBondContact O-N 2.82Å; S81-S84 PolarHBondContact O-N 3.43Å; S81-F85 PolarHBondContact O-N 2.9Å
82	A	75.4	Confident	67.6	Low	54 Å²	54	107.1 Å²	107.1	45%	0.446	54%	0.544	S	S	.	.	H	α-helix	trans	-65.1	-43	171.6	0	0	0	0	0	112.1	Y78 F79 S84 F85 V86	Y78-A82 VanDerWaalsContact O-CB 3.26Å; Y78-A82 WeakPolarHBondContact O-CB 3.25Å; Y78-A82 PolarHBondContact O-N 3.27Å; F79-A82 PolarHBondContact O-N 3.07Å; A82-S84 VanDerWaalsContact C-N 3.34Å; A82-S84 PolarHBondContact O-N 3.04Å; A82-F85 PolarHBondContact O-N 2.71Å; A82-V86 WeakPolarHBondContact O-CG2 3.5Å; A82-V86 PolarHBondContact O-N 3.32Å
83	V	78.2	Confident	68.1	Low	48 Å²	48	106 Å²	106	29%	0.291	54%	0.535	S	S	.	.	H	α-helix	trans	-60.9	-43.6	176	168.8	0	0	0	0	111	F79 F85 V86 I87	F79-V83 HydrophobicContact CD1-CG2 4.32Å; F79-V83 HydrophobicContact CE1-CG2 4.02Å; F79-V83 HydrophobicContact CE2-CG2 4.37Å; F79-V83 HydrophobicContact CZ-CG2 4.05Å; F79-V83 WeakPolarHBondContact O-CB 3.47Å; F79-V83 VanDerWaalsContact O-CG2 3.24Å; F79-V83 WeakPolarHBondContact O-CG2 3.42Å; F79-V83 PolarHBondContact O-N 3.4Å; V83-F85 VanDerWaalsContact C-N 3.34Å; V83-F85 PolarHBondContact O-N 3.21Å; V83-V86 PolarHBondContact O-N 2.76Å; V83-I87 HydrophobicContact CG1-CD1 3.77Å; V83-I87 HydrophobicContact CG1-CG1 4.46Å; V83-I87 VanDerWaalsContact O-CG1 3.26Å; V83-I87 WeakPolarHBondContact O-CG1 2.96Å; V83-I87 PolarHBondContact O-N 2.96Å
84	S	77.2	Confident	68.3	Low	75 Å²	75	101.3 Å²	101.3	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-40.3	176.8	-167.2	0	0	0	0	112.2	W80 S81 A82 I87 F88	W80-S84 WeakPolarHBondContact O-CB 3.22Å; W80-S84 PolarHBondContact O-N 3.49Å; S81-S84 PolarHBondContact O-N 3.43Å; A82-S84 VanDerWaalsContact C-N 3.34Å; A82-S84 PolarHBondContact O-N 3.04Å; S84-I87 PolarHBondContact O-N 3.31Å; S84-F88 WeakPolarHBondContact O-CB 3.21Å; S84-F88 PolarHBondContact O-N 3.28Å
85	F	78.6	Confident	68.4	Low	137 Å²	137	107.1 Å²	107.1	60%	0.601	53%	0.529	S	S	*	.	H	α-helix	trans	-67	-39.8	176.9	-165.2	-105.6	0	0	0	112.5	S81 A82 V83 F88 L89	S81-F85 PolarHBondContact O-N 2.9Å; A82-F85 PolarHBondContact O-N 2.71Å; V83-F85 VanDerWaalsContact C-N 3.34Å; V83-F85 PolarHBondContact O-N 3.21Å; F85-F88 PolarHBondContact O-N 3.3Å; F85-L89 HydrophobicContact CD1-CD1 3.7Å; F85-L89 HydrophobicContact CD1-CG 4.35Å; F85-L89 HydrophobicContact CE1-CD1 3.5Å; F85-L89 VanDerWaalsContact CE1-CD1 3.5Å; F85-L89 HydrophobicContact CE1-CG 4.16Å; F85-L89 HydrophobicContact CZ-CD1 4.3Å; F85-L89 WeakPolarHBondContact O-CG 3.34Å; F85-L89 PolarHBondContact O-N 3.41Å
86	V	81.3	Confident	68.1	Low	96 Å²	96	101.4 Å²	101.4	58%	0.582	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-39.5	175	172.5	0	0	0	0	111.4	A82 V83 F88 L89 A90	A82-V86 WeakPolarHBondContact O-CG2 3.5Å; A82-V86 PolarHBondContact O-N 3.32Å; V83-V86 PolarHBondContact O-N 2.76Å; V86-F88 VanDerWaalsContact C-N 3.34Å; V86-L89 PolarHBondContact O-N 2.84Å; V86-A90 VanDerWaalsContact O-CB 3.31Å; V86-A90 WeakPolarHBondContact O-CB 3.41Å; V86-A90 PolarHBondContact O-N 3.29Å
87	I	80.6	Confident	67.2	Low	93 Å²	93	104.5 Å²	104.5	48%	0.477	53%	0.528	S	S	.	.	H	α-helix	trans	-62.8	-43.5	173.7	-70.1	166.2	0	0	0	110.4	V83 S84 A90 I91	V83-I87 HydrophobicContact CG1-CD1 3.77Å; V83-I87 HydrophobicContact CG1-CG1 4.46Å; V83-I87 VanDerWaalsContact O-CG1 3.26Å; V83-I87 WeakPolarHBondContact O-CG1 2.96Å; V83-I87 PolarHBondContact O-N 2.96Å; S84-I87 PolarHBondContact O-N 3.31Å; I87-A90 PolarHBondContact O-N 3.42Å; I87-I91 HydrophobicContact CG2-CD1 3.85Å; I87-I91 HydrophobicContact CG2-CG1 4.49Å; I87-I91 VanDerWaalsContact O-CG1 3.28Å; I87-I91 WeakPolarHBondContact O-CG1 3.48Å; I87-I91 PolarHBondContact O-N 3.09Å
88	F	78.1	Confident	66.5	Low	137 Å²	137	102.8 Å²	102.8	60%	0.601	53%	0.53	S	S	*	.	H	α-helix	trans	-64.4	-42.3	179.1	-151.8	-87.4	0	0	0	112.1	S84 F85 V86 I91 E92	S84-F88 WeakPolarHBondContact O-CB 3.21Å; S84-F88 PolarHBondContact O-N 3.28Å; F85-F88 PolarHBondContact O-N 3.3Å; V86-F88 VanDerWaalsContact C-N 3.34Å; F88-I91 PolarHBondContact O-N 2.88Å; F88-E92 PolarHBondContact O-N 2.69Å
89	L	70.2	Confident	65.4	Low	90 Å²	90	98.7 Å²	98.7	47%	0.471	53%	0.531	S	S	.	.	H	α-helix	trans	-65.4	-39.5	173.9	-75.5	172.1	0	0	0	112.1	F85 V86 I91 E92 M93	F85-L89 HydrophobicContact CD1-CD1 3.7Å; F85-L89 HydrophobicContact CD1-CG 4.35Å; F85-L89 HydrophobicContact CE1-CD1 3.5Å; F85-L89 VanDerWaalsContact CE1-CD1 3.5Å; F85-L89 HydrophobicContact CE1-CG 4.16Å; F85-L89 HydrophobicContact CZ-CD1 4.3Å; F85-L89 WeakPolarHBondContact O-CG 3.34Å; F85-L89 PolarHBondContact O-N 3.41Å; V86-L89 PolarHBondContact O-N 2.84Å; L89-I91 VanDerWaalsContact C-N 3.34Å; L89-E92 PolarHBondContact O-N 3.28Å; L89-M93 WeakPolarHBondContact O-CB 3.28Å; L89-M93 VanDerWaalsContact O-CG 3.24Å; L89-M93 WeakPolarHBondContact O-CG 3.47Å; L89-M93 PolarHBondContact O-N 3.15Å
90	A	69.7	Low	63.9	Low	51 Å²	51	101.6 Å²	101.6	42%	0.421	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-39.5	175.4	0	0	0	0	0	111.5	V86 I87 M93 C94	V86-A90 VanDerWaalsContact O-CB 3.31Å; V86-A90 WeakPolarHBondContact O-CB 3.41Å; V86-A90 PolarHBondContact O-N 3.29Å; I87-A90 PolarHBondContact O-N 3.42Å; A90-M93 PolarHBondContact O-N 3.02Å; A90-C94 VanDerWaalsContact O-CB 3.26Å; A90-C94 WeakPolarHBondContact O-CB 3.45Å; A90-C94 PolarHBondContact O-N 3.4Å; A90-C94 PolarHBondContact O-SG 2.7Å
91	I	70.1	Confident	62	Low	92 Å²	92	100.7 Å²	100.7	47%	0.472	55%	0.554	S	S	.	*	H	α-helix	trans	-63.4	-44.7	174.7	-68.5	165	0	0	0	110.8	I87 F88 L89 C94 R95	I87-I91 HydrophobicContact CG2-CD1 3.85Å; I87-I91 HydrophobicContact CG2-CG1 4.49Å; I87-I91 VanDerWaalsContact O-CG1 3.28Å; I87-I91 WeakPolarHBondContact O-CG1 3.48Å; I87-I91 PolarHBondContact O-N 3.09Å; F88-I91 PolarHBondContact O-N 2.88Å; L89-I91 VanDerWaalsContact C-N 3.34Å; I91-C94 PolarHBondContact O-N 3.11Å; I91-R95 VanDerWaalsContact O-CG 3.26Å; I91-R95 WeakPolarHBondContact O-CG 3.38Å; I91-R95 PolarHBondContact O-N 3.38Å
92	E	62.8	Low	60.3	Low	84 Å²	84	106.3 Å²	106.3	39%	0.393	57%	0.574	S	S	.	*	H	α-helix	trans	-69.5	-36.1	178.5	-80.7	-60.1	140.7	0	0	113.2	F88 L89 R95 A96	F88-E92 PolarHBondContact O-N 2.69Å; L89-E92 PolarHBondContact O-N 3.28Å; E92-R95 WeakPolarHBondContact O-CB 3.04Å; E92-R95 PolarHBondContact O-N 2.91Å; E92-R95 IonicContact OE1-CZ 3.19Å; E92-R95 IonicContact OE1-NE 3.67Å; E92-R95 IonicContact OE1-NH1 3.57Å; E92-R95 PolarHBondContact OE1-NH1 3.34Å; E92-A96 PolarHBondContact O-N 3.01Å; E92-A96 VanDerWaalsContact O-N 3.08Å
93	M	58.3	Low	58.8	Low	122 Å²	122	111 Å²	111	60%	0.601	59%	0.59	S	S	*	*	H	α-helix	trans	-68	-40.1	173.2	-69.7	-62.8	-61	0	0	111.7	L89 A90 R95 A96 D97	L89-M93 WeakPolarHBondContact O-CB 3.28Å; L89-M93 VanDerWaalsContact O-CG 3.24Å; L89-M93 WeakPolarHBondContact O-CG 3.47Å; L89-M93 PolarHBondContact O-N 3.15Å; A90-M93 PolarHBondContact O-N 3.02Å; M93-R95 VanDerWaalsContact C-N 3.28Å; M93-R95 PolarHBondContact O-N 3.41Å; M93-A96 PolarHBondContact O-N 2.79Å; M93-A96 VanDerWaalsContact O-N 3.16Å; M93-D97 PolarHBondContact O-N 2.81Å; M93-D97 VanDerWaalsContact O-N 3.09Å
94	C	53.8	Low	56.6	Low	74 Å²	74	119.9 Å²	119.9	50%	0.5	62%	0.618	S	S	.	*	H	α-helix	trans	-63.2	-34	171.2	-71.9	0	0	0	0	111.9	A90 I91 A96 I98	A90-C94 VanDerWaalsContact O-CB 3.26Å; A90-C94 WeakPolarHBondContact O-CB 3.45Å; A90-C94 PolarHBondContact O-N 3.4Å; A90-C94 PolarHBondContact O-SG 2.7Å; I91-C94 PolarHBondContact O-N 3.11Å; C94-A96 VanDerWaalsContact C-N 3.31Å; C94-A96 PolarHBondContact O-N 3.1Å; C94-I98 WeakPolarHBondContact O-CB 3.26Å; C94-I98 WeakPolarHBondContact O-CD1 3.5Å; C94-I98 WeakPolarHBondContact O-CG1 3.46Å; C94-I98 PolarHBondContact O-N 2.93Å; C94-I98 VanDerWaalsContact O-N 3.12Å
95	R	54.6	Low	54.8	Low	165 Å²	165	122.1 Å²	122.1	62%	0.623	63%	0.631	S	S	*	*	H	α-helix	trans	-69.3	-27.6	174.4	-74.9	178.2	74.1	-174.9	5.5	113.2	I91 E92 M93	I91-R95 VanDerWaalsContact O-CG 3.26Å; I91-R95 WeakPolarHBondContact O-CG 3.38Å; I91-R95 PolarHBondContact O-N 3.38Å; E92-R95 WeakPolarHBondContact O-CB 3.04Å; E92-R95 PolarHBondContact O-N 2.91Å; E92-R95 IonicContact OE1-CZ 3.19Å; E92-R95 IonicContact OE1-NE 3.67Å; E92-R95 IonicContact OE1-NH1 3.57Å; E92-R95 PolarHBondContact OE1-NH1 3.34Å; M93-R95 VanDerWaalsContact C-N 3.28Å; M93-R95 PolarHBondContact O-N 3.41Å
96	A	44.5	Very low	52.5	Low	64 Å²	64	122.3 Å²	122.3	53%	0.529	64%	0.643	S	S	.	*	H	α-helix	trans	-76.4	-40.6	175.1	0	0	0	0	0	112.4	E92 M93 C94	E92-A96 PolarHBondContact O-N 3.01Å; E92-A96 VanDerWaalsContact O-N 3.08Å; M93-A96 PolarHBondContact O-N 2.79Å; M93-A96 VanDerWaalsContact O-N 3.16Å; C94-A96 VanDerWaalsContact C-N 3.31Å; C94-A96 PolarHBondContact O-N 3.1Å
97	D	38.2	Very low	50.7	Low	128 Å²	128	126.2 Å²	126.2	68%	0.684	66%	0.655	S	S	*	*	H	α-helix	trans	-77.9	-24.4	-179.5	-83.6	-21.3	0	0	0	113.9	M93 A99	M93-D97 PolarHBondContact O-N 2.81Å; M93-D97 VanDerWaalsContact O-N 3.09Å; D97-A99 PolarHBondContact O-N 3.03Å
98	I	43.9	Very low	48.5	Very low	132 Å²	132	129.8 Å²	129.8	68%	0.677	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-7.7	175.6	-69.3	165.6	0	0	0	112.5	C94 E100	C94-I98 WeakPolarHBondContact O-CB 3.26Å; C94-I98 WeakPolarHBondContact O-CD1 3.5Å; C94-I98 WeakPolarHBondContact O-CG1 3.46Å; C94-I98 PolarHBondContact O-N 2.93Å; C94-I98 VanDerWaalsContact O-N 3.12Å; I98-E100 VanDerWaalsContact C-N 3.34Å; I98-E100 PolarHBondContact O-N 3.17Å
99	A	42.7	Very low	46.9	Very low	86 Å²	86	131.5 Å²	131.5	71%	0.711	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-15.9	178.2	0	0	0	0	0	114.3	D97	D97-A99 PolarHBondContact O-N 3.03Å
100	E	40.5	Very low	45.5	Very low	188 Å²	188	134.1 Å²	134.1	88%	0.879	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-11.7	-173.6	-100.6	-177.6	173.6	0	0	117.2	I98	I98-E100 VanDerWaalsContact C-N 3.34Å; I98-E100 PolarHBondContact O-N 3.17Å
101	D	31.6	Very low	44	Very low	146 Å²	146	137.6 Å²	137.6	78%	0.781	72%	0.716	S	S	*	*	S	Bend	trans	-128.4	145.5	-176.9	-132.2	3.5	0	0	0	115.2
102	E	35.8	Very low	42.5	Very low	170 Å²	170	140.6 Å²	140.6	79%	0.794	73%	0.731	S	S	*	*			trans	-60.1	135.5	-160.7	-76.3	179.7	133.5	0	0	118.1
103	I	44.8	Very low	41.2	Very low	153 Å²	153	141.7 Å²	141.7	79%	0.785	75%	0.748	S	S	*	*				21.8	101.2	130	-48.8	166.4	0	0	0	117.3
104	R	31.8	Very low	40.1	Very low	234 Å²	234	142.9 Å²	142.9	88%	0.883	75%	0.752	S	S	*	*			trans	-153.2	138.2	136.3	-77.6	-164.3	176.7	160.8	0.7	110.4
105	P	38.3	Very low	39.3	Very low	122 Å²	122	144.5 Å²	144.5	79%	0.792	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-84.3	132.3	176.6	33.2	-29.1	0	0	0	110.3
106	V	31.4	Very low	38.7	Very low	141 Å²	141	140.1 Å²	140.1	86%	0.855	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-98.8	126.4	161.1	172.4	0	0	0	0	106.5
107	E	43	Very low	38.7	Very low	179 Å²	179	141.6 Å²	141.6	84%	0.836	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-72	133.1	177.6	-64.1	174.8	154.7	0	0	109.8
108	D	34	Very low	39	Very low	167 Å²	167	138 Å²	138	89%	0.893	74%	0.738	S	S	*	*			trans	-139.8	133.4	152.6	-103.9	-25.6	0	0	0	108.5
109	E	45.8	Very low	39.1	Very low	174 Å²	174	135.8 Å²	135.8	81%	0.813	73%	0.732	S	S	*	*			trans	-77	164.8	-167.5	-72.7	-138.3	139.9	0	0	114.2
110	D	40.3	Very low	39.2	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	74%	0.74	S	S	*	*			trans	75.3	70.9	167.3	-66.3	-25.3	0	0	0	118.6
111	V	37.5	Very low	39.9	Very low	124 Å²	124	140.2 Å²	140.2	75%	0.752	74%	0.74	S	S	*	*	S	Bend		-159.9	104.4	124.6	175.1	0	0	0	0	109	S113	V111-S113 PolarHBondContact O-N 3.38Å
112	I	38.6	Very low	41.2	Very low	154 Å²	154	134.6 Å²	134.6	79%	0.79	71%	0.709	S	S	*	*			trans	46.8	64.1	167.4	-43.4	175.4	0	0	0	113.7	E114	I112-E114 PolarHBondContact O-N 3.18Å
113	S	35.3	Very low	42.8	Very low	107 Å²	107	127.2 Å²	127.2	75%	0.748	68%	0.675	S	S	*	*			trans	-76.5	74.3	160.7	-83.7	0	0	0	0	110.1	V111 T115	V111-S113 PolarHBondContact O-N 3.38Å; S113-T115 PolarHBondContact O-N 3.15Å
114	E	35.6	Very low	44.5	Very low	148 Å²	148	123.3 Å²	123.3	69%	0.692	66%	0.656	S	S	*	*			trans	-82.3	74.5	138.8	-82.7	-171.1	174.7	0	0	106.6	I112 V116	I112-E114 PolarHBondContact O-N 3.18Å; E114-V116 PolarHBondContact O-N 3Å
115	T	38	Very low	46.9	Very low	107 Å²	107	118.9 Å²	118.9	66%	0.656	64%	0.643	S	S	*	*			trans	-67	81.7	162.2	-51.2	0	0	0	0	106.2	S113 S117	S113-T115 PolarHBondContact O-N 3.15Å; T115-S117 PolarHBondContact O-N 3.09Å
116	V	40.9	Very low	49	Very low	74 Å²	74	118 Å²	118	45%	0.448	63%	0.631	S	S	.	*			trans	-65	86.1	155.7	179.4	0	0	0	0	104.9	E114 I118	E114-V116 PolarHBondContact O-N 3Å; V116-I118 PolarHBondContact O-N 2.74Å; V116-I118 VanDerWaalsContact O-N 3.16Å
117	S	44.1	Very low	51.6	Low	95 Å²	95	111.7 Å²	111.7	66%	0.664	59%	0.594	S	S	*	*			trans	-46.7	119.7	149.3	53.4	0	0	0	0	105.7	T115 P119	T115-S117 PolarHBondContact O-N 3.09Å; S117-P119 VanDerWaalsContact O-CD 3.29Å; S117-P119 WeakPolarHBondContact O-CD 3.16Å
118	I	44.9	Very low	53.7	Low	53 Å²	53	103.3 Å²	103.3	27%	0.272	56%	0.555	S	S	.	*			trans	-46	118.5	178.9	-62.8	166.5	0	0	0	107.3	V116 M122	V116-I118 PolarHBondContact O-N 2.74Å; V116-I118 VanDerWaalsContact O-N 3.16Å; I118-M122 HydrophobicContact CG2-CG 4.36Å; I118-M122 HydrophobicContact CG2-SD 3.54Å; I118-M122 VanDerWaalsContact CG2-SD 3.54Å
119	P	45.6	Very low	56.2	Low	85 Å²	85	103.3 Å²	103.3	55%	0.552	54%	0.543	S	S	*	.			trans	-60.5	131.2	173.2	-19.4	30.6	0	0	0	108.1	S117 R121	S117-P119 VanDerWaalsContact O-CD 3.29Å; S117-P119 WeakPolarHBondContact O-CD 3.16Å; P119-R121 PolarHBondContact O-N 2.89Å
120	P	45.2	Very low	58.1	Low	136 Å²	136	98.9 Å²	98.9	88%	0.883	52%	0.524	S	S	*	.	S	Bend	trans	-78.2	39.8	-170.3	34.2	-39	0	0	0	113.1
121	R	55.8	Low	60.4	Low	230 Å²	230	92 Å²	92	87%	0.868	49%	0.487	S	S	*	.			trans	-141.1	51.1	-178.7	-123.6	-176.1	-172.8	-168.7	1.6	110.4	P119 M123	P119-R121 PolarHBondContact O-N 2.89Å; R121-M123 PolarHBondContact O-N 3.32Å
122	M	59	Low	62.7	Low	29 Å²	29	86.3 Å²	86.3	14%	0.143	45%	0.453	C	S	.	.			trans	-76.4	-19.2	-157.3	-130.2	176.2	81.7	0	0	114.6	I118 F446 L508	I118-M122 HydrophobicContact CG2-CG 4.36Å; I118-M122 HydrophobicContact CG2-SD 3.54Å; I118-M122 VanDerWaalsContact CG2-SD 3.54Å; M122-F446 HydrophobicContact CE-CB 4.41Å; M122-F446 HydrophobicContact CE-CD2 3.37Å; M122-F446 HydrophobicContact CE-CE2 3.95Å; M122-F446 HydrophobicContact CE-CG 4.26Å; M122-L508 HydrophobicContact CE-CD2 4.26Å
123	M	69.5	Low	65	Low	14 Å²	14	83.1 Å²	83.1	7%	0.069	44%	0.438	C	S	.	.			trans	-172.6	140.7	173	-101.7	151.9	-78.2	0	0	110.6	R121 K125 L128 V395 L442 F446 A511 L515	R121-M123 PolarHBondContact O-N 3.32Å; M123-K125 PolarHBondContact O-N 3.19Å; M123-L128 HydrophobicContact CB-CD1 3.54Å; M123-L128 HydrophobicContact CB-CD2 4.47Å; M123-L128 HydrophobicContact CB-CG 3.8Å; M123-L128 HydrophobicContact CG-CD1 4.21Å; M123-L128 HydrophobicContact CG-CD2 4.27Å; M123-L128 HydrophobicContact CG-CG 4.07Å; M123-L128 HydrophobicContact SD-CD1 4.14Å; M123-L128 HydrophobicContact SD-CD2 3.64Å; M123-L128 HydrophobicContact SD-CG 4.05Å; M123-V395 HydrophobicContact SD-CG1 4.45Å; M123-L442 HydrophobicContact CE-CD2 3.93Å; M123-L442 HydrophobicContact SD-CD2 3.78Å; M123-F446 HydrophobicContact CE-CE2 4.14Å; M123-A511 HydrophobicContact CE-CB 4.22Å; M123-L515 HydrophobicContact CG-CD1 3.39Å; M123-L515 HydrophobicContact SD-CD1 3.2Å; M123-L515 WeakPolarHBondContact SD-CD1 3.49Å
124	D	79	Confident	67.3	Low	72 Å²	72	81.9 Å²	81.9	39%	0.385	42%	0.419	S	S	.	.			trans	-64.8	130.4	169.5	173.1	43.1	0	0	0	110.3	N126 A127 L128	D124-N126 PolarHBondContact O-N 3.36Å; D124-N126 PolarHBondContact OD1-N 3.31Å; D124-N126 VanDerWaalsContact OD2-CB 3.3Å; D124-N126 WeakPolarHBondContact OD2-CB 3.42Å; D124-N126 PolarHBondContact OD2-N 3.36Å; D124-A127 HydrophobicContact CB-CB 4.01Å; D124-A127 PolarHBondContact O-N 3.26Å; D124-A127 PolarHBondContact OD2-N 3.46Å; D124-L128 PolarHBondContact O-N 3.34Å
125	K	82.9	Confident	69.4	Low	140 Å²	140	75.2 Å²	75.2	61%	0.609	39%	0.389	S	S	*	.	H	α-helix	trans	-59.5	-35.5	-179.6	-73.1	179.1	177.2	174.1	0	111.6	M123 R129 E439	M123-K125 PolarHBondContact O-N 3.19Å; K125-R129 WeakPolarHBondContact O-CB 3.32Å; K125-R129 PolarHBondContact O-N 3.5Å; K125-E439 WeakPolarHBondContact CE-OE2 3.37Å; K125-E439 WeakPolarHBondContact CG-OE2 3.4Å; K125-E439 IonicContact NZ-OE2 2.77Å
126	N	82.4	Confident	71.3	Confident	103 Å²	103	73 Å²	73	55%	0.551	38%	0.375	S	S	*	.	H	α-helix	trans	-73.8	-43.5	-179.5	-55.1	-40.5	0	0	0	110.7	D124 L128 R129 N130	D124-N126 PolarHBondContact O-N 3.36Å; D124-N126 PolarHBondContact OD1-N 3.31Å; D124-N126 VanDerWaalsContact OD2-CB 3.3Å; D124-N126 WeakPolarHBondContact OD2-CB 3.42Å; D124-N126 PolarHBondContact OD2-N 3.36Å; N126-L128 VanDerWaalsContact C-N 3.34Å; N126-L128 PolarHBondContact O-N 2.99Å; N126-R129 PolarHBondContact O-N 3.29Å; N126-N130 WeakPolarHBondContact O-CB 3.47Å; N126-N130 PolarHBondContact O-N 3.07Å; N126-N130 PolarHBondContact O-ND2 3.29Å
127	A	85.1	Confident	72.9	Confident	9 Å²	9	77.8 Å²	77.8	7%	0.074	39%	0.386	C	S	.	.	H	α-helix	trans	-56	-46.7	172.8	0	0	0	0	0	112.3	D124 R129 N130 F131	D124-A127 HydrophobicContact CB-CB 4.01Å; D124-A127 PolarHBondContact O-N 3.26Å; D124-A127 PolarHBondContact OD2-N 3.46Å; A127-R129 PolarHBondContact O-N 3.35Å; A127-N130 PolarHBondContact O-N 2.81Å; A127-F131 WeakPolarHBondContact O-CB 3.49Å; A127-F131 PolarHBondContact O-N 3.03Å
128	L	87.8	Confident	74.2	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-60.6	-44.8	176	-85.7	174.7	0	0	0	112.6	M123 D124 N126 F131 C132 V395 L438 E439 L442 L515	M123-L128 HydrophobicContact CB-CD1 3.54Å; M123-L128 HydrophobicContact CB-CD2 4.47Å; M123-L128 HydrophobicContact CB-CG 3.8Å; M123-L128 HydrophobicContact CG-CD1 4.21Å; M123-L128 HydrophobicContact CG-CD2 4.27Å; M123-L128 HydrophobicContact CG-CG 4.07Å; M123-L128 HydrophobicContact SD-CD1 4.14Å; M123-L128 HydrophobicContact SD-CD2 3.64Å; M123-L128 HydrophobicContact SD-CG 4.05Å; D124-L128 PolarHBondContact O-N 3.34Å; N126-L128 VanDerWaalsContact C-N 3.34Å; N126-L128 PolarHBondContact O-N 2.99Å; L128-F131 PolarHBondContact O-N 3.17Å; L128-C132 WeakPolarHBondContact O-CB 3.46Å; L128-C132 PolarHBondContact O-N 3.47Å; L128-C132 PolarHBondContact O-SG 2.88Å; L128-V395 HydrophobicContact CD2-CG1 4.05Å; L128-V395 HydrophobicContact CD2-CG2 3.98Å; L128-L438 HydrophobicContact CB-CD2 4.27Å; L128-E439 HydrophobicContact CD1-CB 4.38Å; L128-E439 HydrophobicContact CD1-CG 4.49Å; L128-L442 HydrophobicContact CD1-CD2 4.42Å; L128-L442 HydrophobicContact CD2-CD2 3.91Å; L128-L515 HydrophobicContact CD2-CD1 3.94Å
129	R	86	Confident	75.2	Confident	168 Å²	168	74.1 Å²	74.1	63%	0.634	36%	0.363	S	S	*	.	H	α-helix	trans	-64.8	-47.2	179.3	-169.6	176.2	-171.4	-173.4	3	111.4	K125 N126 A127 F131 C132 D133	K125-R129 WeakPolarHBondContact O-CB 3.32Å; K125-R129 PolarHBondContact O-N 3.5Å; N126-R129 PolarHBondContact O-N 3.29Å; A127-R129 PolarHBondContact O-N 3.35Å; R129-F131 VanDerWaalsContact C-N 3.27Å; R129-F131 PolarHBondContact O-N 3.5Å; R129-C132 WeakPolarHBondContact O-CB 3.06Å; R129-C132 PolarHBondContact O-N 3.07Å; R129-C132 VanDerWaalsContact O-N 3.08Å; R129-D133 WeakPolarHBondContact O-CB 3.46Å; R129-D133 VanDerWaalsContact O-CG 3.27Å; R129-D133 PolarHBondContact O-N 2.73Å
130	N	85.9	Confident	76.3	Confident	80 Å²	80	73.5 Å²	73.5	43%	0.428	36%	0.362	S	S	.	.	H	α-helix	trans	-58.5	-40.9	176.9	-70.2	-15.2	0	0	0	111.6	N126 A127 K134 T519	N126-N130 WeakPolarHBondContact O-CB 3.47Å; N126-N130 PolarHBondContact O-N 3.07Å; N126-N130 PolarHBondContact O-ND2 3.29Å; A127-N130 PolarHBondContact O-N 2.81Å; N130-K134 WeakPolarHBondContact O-CB 3.45Å; N130-K134 PolarHBondContact O-N 3.28Å; N130-T519 HydrophobicContact CB-CG2 3.98Å
131	F	88.5	Confident	77.7	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.9	-47.2	174.9	176.5	-87.6	0	0	0	111.2	A127 L128 R129 K134 C135 V188 V395 F398 L515 Y518 T519	A127-F131 WeakPolarHBondContact O-CB 3.49Å; A127-F131 PolarHBondContact O-N 3.03Å; L128-F131 PolarHBondContact O-N 3.17Å; R129-F131 VanDerWaalsContact C-N 3.27Å; R129-F131 PolarHBondContact O-N 3.5Å; F131-K134 PolarHBondContact O-N 3.36Å; F131-C135 WeakPolarHBondContact CE1-SG 3.11Å; F131-C135 VanDerWaalsContact CZ-SG 3.58Å; F131-C135 WeakPolarHBondContact O-CB 3.25Å; F131-C135 PolarHBondContact O-N 3.05Å; F131-C135 PolarHBondContact O-SG 3.2Å; F131-V188 HydrophobicContact CE2-CG1 4.45Å; F131-V188 HydrophobicContact CZ-CG1 3.84Å; F131-V395 HydrophobicContact CD1-CG2 3.54Å; F131-V395 HydrophobicContact CE1-CB 4.25Å; F131-V395 HydrophobicContact CE1-CG2 3.5Å; F131-V395 VanDerWaalsContact CE1-CG2 3.5Å; F131-F398 HydrophobicContact CE2-CB 4.26Å; F131-F398 AromaticContact CE2-CD1 3.61Å; F131-F398 HydrophobicContact CE2-CD1 3.61Å; F131-F398 AromaticContact CE2-CD2 3.86Å; F131-F398 HydrophobicContact CE2-CD2 3.86Å; F131-F398 AromaticContact CE2-CE1 3.87Å; F131-F398 HydrophobicContact CE2-CE1 3.87Å; F131-F398 HydrophobicContact CE2-CE2 4.09Å; F131-F398 AromaticContact CE2-CG 3.62Å; F131-F398 HydrophobicContact CE2-CG 3.62Å; F131-F398 HydrophobicContact CE2-CZ 4.1Å; F131-F398 HydrophobicContact CZ-CB 3.68Å; F131-F398 AromaticContact CZ-CD1 3.83Å; F131-F398 HydrophobicContact CZ-CD1 3.83Å; F131-F398 HydrophobicContact CZ-CD2 4.06Å; F131-F398 AromaticContact CZ-CG 3.57Å; F131-F398 HydrophobicContact CZ-CG 3.57Å; F131-L515 HydrophobicContact CB-CD2 4.25Å; F131-L515 HydrophobicContact CD1-CD2 4.36Å; F131-L515 HydrophobicContact CD2-CD2 3.6Å; F131-L515 HydrophobicContact CE2-CD2 3.97Å; F131-L515 HydrophobicContact CG-CD2 3.81Å; F131-L515 HydrophobicContact CZ-CD2 4.47Å; F131-Y518 AromaticContact CD2-CD1 3.65Å; F131-Y518 HydrophobicContact CD2-CD1 3.65Å; F131-Y518 HydrophobicContact CD2-CE1 4.28Å; F131-Y518 HydrophobicContact CD2-CG 4.49Å; F131-Y518 AromaticContact CE2-CD1 3.66Å; F131-Y518 HydrophobicContact CE2-CD1 3.66Å; F131-Y518 HydrophobicContact CE2-CE1 4.03Å; F131-Y518 HydrophobicContact CE2-CG 4.4Å; F131-T519 HydrophobicContact CB-CG2 3.8Å
132	C	86.9	Confident	78.9	Confident	5 Å²	5	64 Å²	64	3%	0.034	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-40.2	179.9	-68.2	0	0	0	0	112.3	L128 R129 C135 T136 H391 L438	L128-C132 WeakPolarHBondContact O-CB 3.46Å; L128-C132 PolarHBondContact O-N 3.47Å; L128-C132 PolarHBondContact O-SG 2.88Å; R129-C132 WeakPolarHBondContact O-CB 3.06Å; R129-C132 PolarHBondContact O-N 3.07Å; R129-C132 VanDerWaalsContact O-N 3.08Å; C132-C135 PolarHBondContact O-N 3.47Å; C132-T136 WeakPolarHBondContact O-CB 3.45Å; C132-T136 PolarHBondContact O-N 3.21Å; C132-T136 PolarHBondContact O-OG1 3.3Å; C132-H391 HydrophobicContact CB-CB 4.47Å; C132-H391 VanDerWaalsContact CB-CD2 3.43Å; C132-H391 WeakPolarHBondContact CB-CD2 3.45Å; C132-L438 VanDerWaalsContact SG-CD2 3.56Å
133	D	85.8	Confident	80.1	Confident	87 Å²	87	63 Å²	63	47%	0.465	31%	0.31	S	S	.	.	H	α-helix	trans	-64.5	-44.8	177	-69.2	-18.8	0	0	0	110.3	R129 C135 T136 Y137	R129-D133 WeakPolarHBondContact O-CB 3.46Å; R129-D133 VanDerWaalsContact O-CG 3.27Å; R129-D133 PolarHBondContact O-N 2.73Å; D133-C135 PolarHBondContact O-N 2.87Å; D133-T136 PolarHBondContact O-N 2.84Å; D133-Y137 PolarHBondContact O-N 3.42Å
134	K	83.7	Confident	81	Confident	82 Å²	82	67.7 Å²	67.7	36%	0.357	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-44.7	173.3	-175.5	172.4	177.8	176.2	0	112	N130 F131 T136 Y137 T138 Y518	N130-K134 WeakPolarHBondContact O-CB 3.45Å; N130-K134 PolarHBondContact O-N 3.28Å; F131-K134 PolarHBondContact O-N 3.36Å; K134-T136 VanDerWaalsContact C-N 3.32Å; K134-T136 PolarHBondContact O-N 3.49Å; K134-Y137 PolarHBondContact O-N 3.33Å; K134-T138 PolarHBondContact O-N 3.43Å; K134-T138 PolarHBondContact O-OG1 2.99Å; K134-Y518 HydrophobicContact CD-CD1 4.34Å; K134-Y518 HydrophobicContact CD-CE1 4.06Å; K134-Y518 PolarHBondContact NZ-O 3.32Å
135	C	80.7	Confident	81.5	Confident	8 Å²	8	68.8 Å²	68.8	5%	0.054	33%	0.328	C	S	.	.	H	α-helix	trans	-62.9	-39.4	176.2	-70	0	0	0	0	111.9	F131 C132 D133 S139	F131-C135 WeakPolarHBondContact CE1-SG 3.11Å; F131-C135 VanDerWaalsContact CZ-SG 3.58Å; F131-C135 WeakPolarHBondContact O-CB 3.25Å; F131-C135 PolarHBondContact O-N 3.05Å; F131-C135 PolarHBondContact O-SG 3.2Å; C132-C135 PolarHBondContact O-N 3.47Å; D133-C135 PolarHBondContact O-N 2.87Å; C135-S139 WeakPolarHBondContact O-CB 3.42Å; C135-S139 PolarHBondContact O-N 2.98Å; C135-S139 PolarHBondContact O-OG 2.79Å
136	T	78.5	Confident	81.8	Confident	61 Å²	61	63 Å²	63	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-66	-41.6	178.2	-54	0	0	0	0	110.9	C132 D133 K134 S139 S140 H391	C132-T136 WeakPolarHBondContact O-CB 3.45Å; C132-T136 PolarHBondContact O-N 3.21Å; C132-T136 PolarHBondContact O-OG1 3.3Å; D133-T136 PolarHBondContact O-N 2.84Å; K134-T136 VanDerWaalsContact C-N 3.32Å; K134-T136 PolarHBondContact O-N 3.49Å; T136-S139 WeakPolarHBondContact CA-OG 3.26Å; T136-S139 PolarHBondContact O-OG 2.8Å; T136-S140 VanDerWaalsContact O-CB 3.27Å; T136-S140 WeakPolarHBondContact O-CB 3.31Å; T136-S140 PolarHBondContact O-N 2.89Å; T136-S140 PolarHBondContact O-OG 3.42Å; T136-H391 PolarHBondContact OG1-NE2 2.94Å
137	Y	74.2	Confident	82.3	Confident	173 Å²	173	61.2 Å²	61.2	68%	0.678	29%	0.291	S	S	*	.	H	α-helix	trans	-63.5	-50.9	175.5	-177.1	-97.7	0	0	0	112.3	D133 K134 S139 S140 H141	D133-Y137 PolarHBondContact O-N 3.42Å; K134-Y137 PolarHBondContact O-N 3.33Å; Y137-S139 PolarHBondContact O-N 2.92Å; Y137-S140 PolarHBondContact O-N 2.9Å; Y137-S140 PolarHBondContact O-OG 3.31Å; Y137-S140 VanDerWaalsContact O-OG 3.08Å; Y137-H141 PolarHBondContact O-N 3.42Å
138	T	70.7	Confident	82.6	Confident	43 Å²	43	66.2 Å²	66.2	26%	0.264	31%	0.312	S	S	.	.	H	α-helix	trans	-64.5	-42	179.1	-56	0	0	0	0	111.9	K134 E142	K134-T138 PolarHBondContact O-N 3.43Å; K134-T138 PolarHBondContact O-OG1 2.99Å; T138-E142 PolarHBondContact O-N 3.46Å
139	S	66.9	Low	82.9	Confident	28 Å²	28	68.6 Å²	68.6	20%	0.196	32%	0.323	C	S	.	.	H	α-helix	trans	-69.4	-32.6	-178.8	61.7	0	0	0	0	113.8	C135 T136 Y137 N143	C135-S139 WeakPolarHBondContact O-CB 3.42Å; C135-S139 PolarHBondContact O-N 2.98Å; C135-S139 PolarHBondContact O-OG 2.79Å; T136-S139 WeakPolarHBondContact CA-OG 3.26Å; T136-S139 PolarHBondContact O-OG 2.8Å; Y137-S139 PolarHBondContact O-N 2.92Å; S139-N143 WeakPolarHBondContact CA-ND2 3.43Å; S139-N143 WeakPolarHBondContact O-CB 3.11Å
140	S	68	Low	83.3	Confident	73 Å²	73	60.6 Å²	60.6	51%	0.51	29%	0.292	S	S	.	.	H	α-helix	trans	-77.7	-32.2	-178.6	55.3	0	0	0	0	113.6	T136 Y137	T136-S140 VanDerWaalsContact O-CB 3.27Å; T136-S140 WeakPolarHBondContact O-CB 3.31Å; T136-S140 PolarHBondContact O-N 2.89Å; T136-S140 PolarHBondContact O-OG 3.42Å; Y137-S140 PolarHBondContact O-N 2.9Å; Y137-S140 PolarHBondContact O-OG 3.31Å; Y137-S140 VanDerWaalsContact O-OG 3.08Å
141	H	74.3	Confident	83.8	Confident	94 Å²	94	59.9 Å²	59.9	44%	0.435	29%	0.287	S	S	.	.	H	α-helix	trans	-109.1	-33.5	-175	-173.4	-96.8	0	0	0	115.4	Y137 W144 K145	Y137-H141 PolarHBondContact O-N 3.42Å; H141-W144 VanDerWaalsContact CA-CD1 3.41Å; H141-W144 PolarHBondContact O-NE1 3.46Å; H141-K145 VanDerWaalsContact CE1-CE 3.48Å; H141-K145 WeakPolarHBondContact CE1-CE 3.35Å; H141-K145 PolarHBondContact CE1-NZ 3.16Å; H141-K145 VanDerWaalsContact NE2-CE 3.28Å; H141-K145 WeakPolarHBondContact NE2-CE 3.41Å; H141-K145 PolarHBondContact NE2-NZ 3.27Å; H141-K145 WeakPolarHBondContact O-CG 3.29Å
142	E	81.3	Confident	84.1	Confident	72 Å²	72	61.4 Å²	61.4	34%	0.336	30%	0.302	S	S	.	.	H	α-helix	trans	-91.6	-44.7	179.1	-63.4	-160.5	136.4	0	0	112.3	T138 W144 K145 V146	T138-E142 PolarHBondContact O-N 3.46Å; E142-W144 VanDerWaalsContact C-N 3.3Å; E142-W144 PolarHBondContact O-N 3.22Å; E142-K145 PolarHBondContact O-N 3.02Å; E142-V146 VanDerWaalsContact O-CG2 3.31Å; E142-V146 WeakPolarHBondContact O-CG2 3.45Å; E142-V146 PolarHBondContact O-N 3.36Å; E142-V146 VanDerWaalsContact O-N 3.09Å
143	N	85.1	Confident	84.6	Confident	9 Å²	9	61.3 Å²	61.3	5%	0.048	30%	0.301	C	S	.	.	H	α-helix	trans	-66.6	-32	-176	-65.6	-12.6	0	0	0	112.5	S139 R147 M182 L192	S139-N143 WeakPolarHBondContact CA-ND2 3.43Å; S139-N143 WeakPolarHBondContact O-CB 3.11Å; N143-R147 WeakPolarHBondContact O-CB 3.48Å; N143-R147 PolarHBondContact O-N 2.89Å; N143-M182 HydrophobicContact CB-CE 3.9Å; N143-L192 WeakPolarHBondContact OD1-CD2 3.42Å
144	W	86.9	Confident	85	Confident	112 Å²	112	57.1 Å²	57.1	42%	0.424	28%	0.279	S	S	.	.	H	α-helix	trans	-68.3	-44.8	177.4	87	-83.4	0	0	0	111.9	H141 E142 V146 R147 E148	H141-W144 VanDerWaalsContact CA-CD1 3.41Å; H141-W144 PolarHBondContact O-NE1 3.46Å; E142-W144 VanDerWaalsContact C-N 3.3Å; E142-W144 PolarHBondContact O-N 3.22Å; W144-V146 VanDerWaalsContact C-N 3.26Å; W144-V146 PolarHBondContact O-N 2.89Å; W144-R147 WeakPolarHBondContact O-CB 3.3Å; W144-R147 PolarHBondContact O-N 3.4Å; W144-R147 VanDerWaalsContact O-N 3.14Å; W144-E148 WeakPolarHBondContact CZ3-OE2 3.02Å; W144-E148 WeakPolarHBondContact O-CB 3.4Å; W144-E148 PolarHBondContact O-N 2.94Å
145	K	89.6	Confident	85.7	Confident	94 Å²	94	56.6 Å²	56.6	41%	0.409	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-40.1	176.8	-65.2	-173.2	-174.6	-170.7	0	111.2	H141 E142 F149	H141-K145 VanDerWaalsContact CE1-CE 3.48Å; H141-K145 WeakPolarHBondContact CE1-CE 3.35Å; H141-K145 PolarHBondContact CE1-NZ 3.16Å; H141-K145 VanDerWaalsContact NE2-CE 3.28Å; H141-K145 WeakPolarHBondContact NE2-CE 3.41Å; H141-K145 PolarHBondContact NE2-NZ 3.27Å; H141-K145 WeakPolarHBondContact O-CG 3.29Å; E142-K145 PolarHBondContact O-N 3.02Å; K145-F149 WeakPolarHBondContact O-CB 3.47Å; K145-F149 PolarHBondContact O-N 3.41Å
146	V	90.1	Very high	86.4	Confident	20 Å²	20	58.6 Å²	58.6	12%	0.121	29%	0.29	C	S	.	.	H	α-helix	trans	-67.2	-40	177.4	167.3	0	0	0	0	110.6	E142 W144 V150 M182 L192 I331	E142-V146 VanDerWaalsContact O-CG2 3.31Å; E142-V146 WeakPolarHBondContact O-CG2 3.45Å; E142-V146 PolarHBondContact O-N 3.36Å; E142-V146 VanDerWaalsContact O-N 3.09Å; W144-V146 VanDerWaalsContact C-N 3.26Å; W144-V146 PolarHBondContact O-N 2.89Å; V146-V150 HydrophobicContact CG1-CG2 4.4Å; V146-V150 VanDerWaalsContact O-CB 3.29Å; V146-V150 WeakPolarHBondContact O-CB 3.46Å; V146-V150 WeakPolarHBondContact O-CG2 3.33Å; V146-V150 PolarHBondContact O-N 3.5Å; V146-M182 HydrophobicContact CB-CE 4.41Å; V146-M182 HydrophobicContact CG1-CE 3.94Å; V146-L192 HydrophobicContact CB-CD1 3.96Å; V146-L192 HydrophobicContact CG1-CB 4.18Å; V146-L192 HydrophobicContact CG1-CD1 3.82Å; V146-L192 HydrophobicContact CG2-CD1 3.52Å; V146-I331 HydrophobicContact CB-CD1 4.48Å; V146-I331 HydrophobicContact CG1-CD1 4.01Å; V146-I331 HydrophobicContact CG1-CG1 4.33Å; V146-I331 HydrophobicContact CG1-CG2 4.23Å; V146-I331 HydrophobicContact CG2-CD1 4.08Å
147	R	91.7	Very high	87.2	Confident	65 Å²	65	55.8 Å²	55.8	25%	0.245	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-52.8	175.1	-173.5	-172.8	-63.5	162.9	-0.3	111.1	N143 W144 F149 V150 E151 M182 F183 S185	N143-R147 WeakPolarHBondContact O-CB 3.48Å; N143-R147 PolarHBondContact O-N 2.89Å; W144-R147 WeakPolarHBondContact O-CB 3.3Å; W144-R147 PolarHBondContact O-N 3.4Å; W144-R147 VanDerWaalsContact O-N 3.14Å; R147-F149 VanDerWaalsContact C-N 3.31Å; R147-F149 PolarHBondContact O-N 3.34Å; R147-V150 PolarHBondContact O-N 2.92Å; R147-V150 VanDerWaalsContact O-N 3.13Å; R147-E151 HydrophobicContact CG-CG 4.25Å; R147-E151 WeakPolarHBondContact CG-OE1 3.36Å; R147-E151 WeakPolarHBondContact O-CB 3.5Å; R147-E151 VanDerWaalsContact O-CG 3.31Å; R147-E151 WeakPolarHBondContact O-CG 3.15Å; R147-E151 PolarHBondContact O-N 3.08Å; R147-M182 PolarHBondContact NH2-O 3.45Å; R147-F183 HydrophobicContact CG-CD1 3.97Å; R147-F183 HydrophobicContact CG-CE1 3.66Å; R147-S185 PolarHBondContact NH2-OG 3.45Å
148	E	93.2	Very high	88.2	Confident	114 Å²	114	47.6 Å²	47.6	53%	0.533	24%	0.241	S	C	.	.	H	α-helix	trans	-57.3	-45.4	178.8	-178.8	-176.6	-143.9	0	0	111.4	W144 E151 G152	W144-E148 WeakPolarHBondContact CZ3-OE2 3.02Å; W144-E148 WeakPolarHBondContact O-CB 3.4Å; W144-E148 PolarHBondContact O-N 2.94Å; E148-E151 PolarHBondContact O-N 3Å; E148-G152 PolarHBondContact O-N 3.16Å
149	F	93.8	Very high	89.3	Confident	52 Å²	52	51.6 Å²	51.6	23%	0.228	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-47.1	174.8	168.8	-97.8	0	0	0	112.4	K145 R147 F153 F308 I323 F325 I331	K145-F149 WeakPolarHBondContact O-CB 3.47Å; K145-F149 PolarHBondContact O-N 3.41Å; R147-F149 VanDerWaalsContact C-N 3.31Å; R147-F149 PolarHBondContact O-N 3.34Å; F149-F153 HydrophobicContact CZ-CB 4.26Å; F149-F153 VanDerWaalsContact O-CB 3.24Å; F149-F153 WeakPolarHBondContact O-CB 3.33Å; F149-F153 PolarHBondContact O-N 3.2Å; F149-F308 HydrophobicContact CE2-CD1 4.31Å; F149-F308 AromaticContact CE2-CE1 3.57Å; F149-F308 HydrophobicContact CE2-CE1 3.57Å; F149-F308 HydrophobicContact CE2-CZ 4.12Å; F149-F308 HydrophobicContact CZ-CD1 4.14Å; F149-F308 AromaticContact CZ-CE1 3.51Å; F149-F308 HydrophobicContact CZ-CE1 3.51Å; F149-F308 AromaticContact CZ-CZ 3.76Å; F149-F308 HydrophobicContact CZ-CZ 3.76Å; F149-I323 HydrophobicContact CE1-CD1 3.85Å; F149-I323 HydrophobicContact CE1-CG2 4.26Å; F149-I323 HydrophobicContact CZ-CD1 4.33Å; F149-I323 HydrophobicContact CZ-CG2 4.19Å; F149-F325 HydrophobicContact CD1-CZ 4.09Å; F149-F325 HydrophobicContact CD2-CZ 4.41Å; F149-F325 HydrophobicContact CE1-CE1 4.49Å; F149-F325 HydrophobicContact CE1-CE2 4.32Å; F149-F325 AromaticContact CE1-CZ 3.57Å; F149-F325 HydrophobicContact CE1-CZ 3.57Å; F149-F325 HydrophobicContact CE2-CE1 4.09Å; F149-F325 AromaticContact CE2-CZ 3.93Å; F149-F325 HydrophobicContact CE2-CZ 3.93Å; F149-F325 HydrophobicContact CG-CZ 4.49Å; F149-F325 AromaticContact CZ-CE1 3.99Å; F149-F325 HydrophobicContact CZ-CE1 3.99Å; F149-F325 AromaticContact CZ-CZ 3.49Å; F149-F325 HydrophobicContact CZ-CZ 3.49Å; F149-F325 VanDerWaalsContact CZ-CZ 3.49Å; F149-I331 HydrophobicContact CD1-CD1 3.64Å; F149-I331 HydrophobicContact CE1-CD1 3.93Å
150	V	94.3	Very high	90.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-40.8	-178.6	162.9	0	0	0	0	111.3	V146 R147 A154 C194 L196 I331 L333	V146-V150 HydrophobicContact CG1-CG2 4.4Å; V146-V150 VanDerWaalsContact O-CB 3.29Å; V146-V150 WeakPolarHBondContact O-CB 3.46Å; V146-V150 WeakPolarHBondContact O-CG2 3.33Å; V146-V150 PolarHBondContact O-N 3.5Å; R147-V150 PolarHBondContact O-N 2.92Å; R147-V150 VanDerWaalsContact O-N 3.13Å; V150-A154 WeakPolarHBondContact O-CB 3.47Å; V150-A154 PolarHBondContact O-N 3.23Å; V150-C194 HydrophobicContact CG1-CB 3.85Å; V150-C194 HydrophobicContact CG2-CB 4.36Å; V150-L196 HydrophobicContact CG1-CD1 4.07Å; V150-I331 HydrophobicContact CG2-CG2 3.76Å; V150-L333 HydrophobicContact CG1-CD1 3.58Å; V150-L333 HydrophobicContact CG1-CD2 4.35Å
151	E	95.6	Very high	91.8	Very high	66 Å²	66	47.5 Å²	47.5	31%	0.308	23%	0.228	S	C	.	.	H	α-helix	trans	-62.3	-52.4	176.5	-72	173	164.4	0	0	109.9	R147 E148 F153 A154 D155 F176 F183	R147-E151 HydrophobicContact CG-CG 4.25Å; R147-E151 WeakPolarHBondContact CG-OE1 3.36Å; R147-E151 WeakPolarHBondContact O-CB 3.5Å; R147-E151 VanDerWaalsContact O-CG 3.31Å; R147-E151 WeakPolarHBondContact O-CG 3.15Å; R147-E151 PolarHBondContact O-N 3.08Å; E148-E151 PolarHBondContact O-N 3Å; E151-F153 PolarHBondContact O-N 3.18Å; E151-A154 PolarHBondContact O-N 3.48Å; E151-D155 PolarHBondContact O-N 2.82Å; E151-F176 HydrophobicContact CB-CE2 4.29Å; E151-F176 HydrophobicContact CB-CZ 3.84Å; E151-F176 HydrophobicContact CG-CE2 3.93Å; E151-F176 HydrophobicContact CG-CZ 4Å; E151-F176 WeakPolarHBondContact O-CE1 3.46Å; E151-F176 WeakPolarHBondContact O-CZ 3.44Å; E151-F183 HydrophobicContact CG-CE1 4.15Å; E151-F183 WeakPolarHBondContact OE1-CE1 3.38Å
152	G	96.1	Very high	92.7	Very high	32 Å²	32	46.8 Å²	46.8	33%	0.33	22%	0.221	S	C	.	.	H	α-helix	trans	-63.2	-40.2	178.4	0	0	0	0	0	114	E148 D155 D156	E148-G152 PolarHBondContact O-N 3.16Å; G152-D155 PolarHBondContact O-N 3.25Å; G152-D156 PolarHBondContact O-N 3.48Å; G152-D156 VanDerWaalsContact O-N 3.07Å
153	F	95.6	Very high	93.1	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-40.8	175.3	172.1	-112	0	0	0	112.2	F149 E151 L157 W299 Y306 F308 V310 L321 I323 L333	F149-F153 HydrophobicContact CZ-CB 4.26Å; F149-F153 VanDerWaalsContact O-CB 3.24Å; F149-F153 WeakPolarHBondContact O-CB 3.33Å; F149-F153 PolarHBondContact O-N 3.2Å; E151-F153 PolarHBondContact O-N 3.18Å; F153-L157 HydrophobicContact CE1-CD2 4.19Å; F153-L157 HydrophobicContact CZ-CD2 4.09Å; F153-L157 VanDerWaalsContact O-CB 3.29Å; F153-L157 WeakPolarHBondContact O-CB 3.47Å; F153-L157 PolarHBondContact O-N 3.5Å; F153-W299 AromaticContact CE2-CE3 3.94Å; F153-W299 HydrophobicContact CE2-CE3 3.94Å; F153-W299 AromaticContact CE2-CZ3 3.68Å; F153-W299 HydrophobicContact CE2-CZ3 3.68Å; F153-W299 HydrophobicContact CZ-CE3 4.16Å; F153-W299 HydrophobicContact CZ-CZ3 4.21Å; F153-Y306 HydrophobicContact CD2-CE1 4.3Å; F153-Y306 HydrophobicContact CD2-CE2 4.2Å; F153-Y306 AromaticContact CD2-CZ 3.95Å; F153-Y306 HydrophobicContact CE2-CE2 4.43Å; F153-F308 HydrophobicContact CD2-CE2 4.17Å; F153-F308 AromaticContact CD2-CZ 3.73Å; F153-F308 HydrophobicContact CD2-CZ 3.73Å; F153-F308 AromaticContact CE2-CE2 3.88Å; F153-F308 HydrophobicContact CE2-CE2 3.88Å; F153-F308 AromaticContact CE2-CZ 3.9Å; F153-F308 HydrophobicContact CE2-CZ 3.9Å; F153-F308 HydrophobicContact CG-CZ 4.4Å; F153-F308 HydrophobicContact CZ-CE2 4.35Å; F153-V310 HydrophobicContact CZ-CG2 4Å; F153-L321 HydrophobicContact CE1-CD1 4.31Å; F153-I323 HydrophobicContact CD1-CD1 3.62Å; F153-I323 HydrophobicContact CE1-CD1 3.65Å; F153-I323 HydrophobicContact CE1-CG1 4.37Å; F153-I323 HydrophobicContact CG-CD1 4.44Å; F153-L333 HydrophobicContact CD1-CD2 3.87Å; F153-L333 HydrophobicContact CE1-CD2 4.01Å
154	A	95.9	Very high	93.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-37.9	177.4	0	0	0	0	0	111.5	V150 E151 L157 L158 F176 L196 L335	V150-A154 WeakPolarHBondContact O-CB 3.47Å; V150-A154 PolarHBondContact O-N 3.23Å; E151-A154 PolarHBondContact O-N 3.48Å; A154-L157 PolarHBondContact O-N 3.34Å; A154-L158 WeakPolarHBondContact O-CB 3.38Å; A154-L158 VanDerWaalsContact O-CG 3.3Å; A154-L158 WeakPolarHBondContact O-CG 3.22Å; A154-L158 PolarHBondContact O-N 2.78Å; A154-F176 HydrophobicContact CB-CD1 3.69Å; A154-F176 HydrophobicContact CB-CE1 3.55Å; A154-F176 HydrophobicContact CB-CG 4.47Å; A154-F176 HydrophobicContact CB-CZ 4.27Å; A154-L196 HydrophobicContact CB-CD1 3.37Å; A154-L335 HydrophobicContact CB-CD2 4.38Å
155	D	96.5	Very high	92.9	Very high	71 Å²	71	48.6 Å²	48.6	38%	0.38	25%	0.249	S	C	.	.	H	α-helix	trans	-60.1	-52.4	174.8	-79.3	-35	0	0	0	110.8	E151 G152 L157 L158 E159 F176	E151-D155 PolarHBondContact O-N 2.82Å; G152-D155 PolarHBondContact O-N 3.25Å; D155-L157 VanDerWaalsContact C-N 3.27Å; D155-L157 PolarHBondContact O-N 2.91Å; D155-L158 PolarHBondContact O-N 3.37Å; D155-E159 VanDerWaalsContact O-CB 3.29Å; D155-E159 WeakPolarHBondContact O-CB 3.42Å; D155-E159 PolarHBondContact O-N 3.3Å; D155-F176 HydrophobicContact CB-CE1 4.33Å; D155-F176 WeakPolarHBondContact OD1-CE1 3.36Å
156	D	95.9	Very high	92.5	Very high	50 Å²	50	48 Å²	48	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-57.5	-40	177.2	-89.5	22.2	0	0	0	112.6	G152 S160 I302 Y306	G152-D156 PolarHBondContact O-N 3.48Å; G152-D156 VanDerWaalsContact O-N 3.07Å; D156-S160 WeakPolarHBondContact O-CB 3.22Å; D156-S160 PolarHBondContact O-N 2.86Å; D156-I302 HydrophobicContact CB-CD1 4.22Å; D156-Y306 VanDerWaalsContact CB-OH 3.3Å; D156-Y306 WeakPolarHBondContact CB-OH 3.38Å; D156-Y306 PolarHBondContact OD2-OH 3.06Å
157	L	95.3	Very high	91.7	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-71.3	-42.7	-179.5	-175.5	63.7	0	0	0	112.1	F153 A154 D155 L161 V295 A298 W299 I302 L321 L335	F153-L157 HydrophobicContact CE1-CD2 4.19Å; F153-L157 HydrophobicContact CZ-CD2 4.09Å; F153-L157 VanDerWaalsContact O-CB 3.29Å; F153-L157 WeakPolarHBondContact O-CB 3.47Å; F153-L157 PolarHBondContact O-N 3.5Å; A154-L157 PolarHBondContact O-N 3.34Å; D155-L157 VanDerWaalsContact C-N 3.27Å; D155-L157 PolarHBondContact O-N 2.91Å; L157-L161 WeakPolarHBondContact O-CB 3.2Å; L157-L161 PolarHBondContact O-N 3.39Å; L157-V295 HydrophobicContact CD2-CG1 4.15Å; L157-A298 HydrophobicContact CD1-CB 3.78Å; L157-W299 HydrophobicContact CD1-CB 4.01Å; L157-I302 HydrophobicContact CB-CD1 4Å; L157-I302 HydrophobicContact CD1-CD1 3.89Å; L157-L321 HydrophobicContact CD2-CD1 4.05Å; L157-L335 HydrophobicContact CD2-CD1 3.72Å
158	L	95.1	Very high	90.5	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-72.4	-33.8	176.7	-67.7	-174.1	0	0	0	111.9	A154 D155 L161 R162 V173 F176 V198	A154-L158 WeakPolarHBondContact O-CB 3.38Å; A154-L158 VanDerWaalsContact O-CG 3.3Å; A154-L158 WeakPolarHBondContact O-CG 3.22Å; A154-L158 PolarHBondContact O-N 2.78Å; D155-L158 PolarHBondContact O-N 3.37Å; L158-L161 HydrophobicContact CD2-CD1 4.49Å; L158-L161 WeakPolarHBondContact O-CB 3.44Å; L158-L161 PolarHBondContact O-N 3.42Å; L158-R162 VanDerWaalsContact O-CG 3.28Å; L158-R162 WeakPolarHBondContact O-CG 3.35Å; L158-R162 PolarHBondContact O-N 3.44Å; L158-V173 HydrophobicContact CD2-CG1 4.1Å; L158-F176 HydrophobicContact CD1-CB 3.99Å; L158-F176 HydrophobicContact CD1-CD1 3.87Å; L158-F176 HydrophobicContact CD1-CG 4.45Å; L158-V198 HydrophobicContact CD1-CG1 4.09Å; L158-V198 HydrophobicContact CD1-CG2 4.28Å; L158-V198 HydrophobicContact CD2-CG1 3.94Å; L158-V198 HydrophobicContact CD2-CG2 4.49Å
159	E	95.2	Very high	89.7	Confident	127 Å²	127	58.3 Å²	58.3	59%	0.593	30%	0.296	S	S	*	.	H	α-helix	trans	-63.1	-45.9	172.3	-173.9	178.2	-166.2	0	0	110.9	D155 L161 R162 S163	D155-E159 VanDerWaalsContact O-CB 3.29Å; D155-E159 WeakPolarHBondContact O-CB 3.42Å; D155-E159 PolarHBondContact O-N 3.3Å; E159-L161 VanDerWaalsContact C-N 3.31Å; E159-L161 PolarHBondContact O-N 2.87Å; E159-R162 PolarHBondContact O-N 2.85Å; E159-S163 PolarHBondContact O-N 3.01Å
160	S	94.6	Very high	89.2	Confident	13 Å²	13	58.6 Å²	58.6	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-56.4	-45.9	172.4	-178	0	0	0	0	111.4	D156 S163 M164 A298	D156-S160 WeakPolarHBondContact O-CB 3.22Å; D156-S160 PolarHBondContact O-N 2.86Å; S160-S163 PolarHBondContact O-N 3.31Å; S160-S163 PolarHBondContact O-OG 2.62Å; S160-M164 WeakPolarHBondContact O-CG 3.3Å; S160-M164 PolarHBondContact O-N 2.66Å; S160-A298 WeakPolarHBondContact OG-CA 3.26Å; S160-A298 PolarHBondContact OG-O 3.49Å
161	L	92.3	Very high	88.9	Confident	3 Å²	3	59 Å²	59	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-58.8	-51	177.2	-170.9	158.4	0	0	0	111.5	L157 L158 E159 S163 M164 C165 V173 A294 V295 A298	L157-L161 WeakPolarHBondContact O-CB 3.2Å; L157-L161 PolarHBondContact O-N 3.39Å; L158-L161 HydrophobicContact CD2-CD1 4.49Å; L158-L161 WeakPolarHBondContact O-CB 3.44Å; L158-L161 PolarHBondContact O-N 3.42Å; E159-L161 VanDerWaalsContact C-N 3.31Å; E159-L161 PolarHBondContact O-N 2.87Å; L161-S163 VanDerWaalsContact C-N 3.26Å; L161-S163 PolarHBondContact O-N 3.36Å; L161-M164 PolarHBondContact O-N 2.66Å; L161-M164 VanDerWaalsContact O-N 3.09Å; L161-C165 PolarHBondContact O-N 2.91Å; L161-V173 HydrophobicContact CD2-CB 3.89Å; L161-V173 HydrophobicContact CD2-CG1 4.46Å; L161-V173 HydrophobicContact CD2-CG2 3.58Å; L161-A294 HydrophobicContact CD1-CB 3.77Å; L161-A294 HydrophobicContact CG-CB 4.09Å; L161-V295 HydrophobicContact CD1-CG2 4.24Å; L161-A298 HydrophobicContact CB-CB 3.88Å
162	R	92.7	Very high	88.7	Confident	79 Å²	79	59.5 Å²	59.5	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-33.3	179.2	-69.8	172.2	-161.6	138.3	-1.9	112.9	L158 E159 M164 C165 V173 G174 D175	L158-R162 VanDerWaalsContact O-CG 3.28Å; L158-R162 WeakPolarHBondContact O-CG 3.35Å; L158-R162 PolarHBondContact O-N 3.44Å; E159-R162 PolarHBondContact O-N 2.85Å; R162-M164 PolarHBondContact O-N 2.83Å; R162-C165 PolarHBondContact O-N 2.94Å; R162-V173 PolarHBondContact NE-O 3.35Å; R162-G174 PolarHBondContact NH2-O 3.48Å; R162-D175 IonicContact CZ-OD1 2.97Å; R162-D175 IonicContact NH1-OD1 3.33Å; R162-D175 PolarHBondContact NH1-OD1 3.49Å; R162-D175 VanDerWaalsContact NH2-CA 3.29Å; R162-D175 IonicContact NH2-OD1 2.8Å; R162-D175 PolarHBondContact NH2-OD1 2.87Å
163	S	90.3	Very high	88.5	Confident	94 Å²	94	58.5 Å²	58.5	66%	0.657	29%	0.292	S	S	*	.	H	α-helix	trans	-67.8	-20.4	178.1	78.2	0	0	0	0	113.6	E159 S160 L161	E159-S163 PolarHBondContact O-N 3.01Å; S160-S163 PolarHBondContact O-N 3.31Å; S160-S163 PolarHBondContact O-OG 2.62Å; L161-S163 VanDerWaalsContact C-N 3.26Å; L161-S163 PolarHBondContact O-N 3.36Å
164	M	85.6	Confident	88.4	Confident	103 Å²	103	59.8 Å²	59.8	51%	0.507	31%	0.305	S	S	.	.	H	α-helix	trans	-96.2	-13.9	-179.9	-64.5	-175.9	63.2	0	0	113.6	S160 L161 R162 K297	S160-M164 WeakPolarHBondContact O-CG 3.3Å; S160-M164 PolarHBondContact O-N 2.66Å; L161-M164 PolarHBondContact O-N 2.66Å; L161-M164 VanDerWaalsContact O-N 3.09Å; R162-M164 PolarHBondContact O-N 2.83Å; M164-K297 HydrophobicContact CE-CB 3.8Å; M164-K297 HydrophobicContact CE-CD 4.12Å; M164-K297 HydrophobicContact CE-CG 4.43Å; M164-K297 HydrophobicContact SD-CB 4.15Å
165	C	82.3	Confident	88.3	Confident	33 Å²	33	64.9 Å²	64.9	22%	0.223	33%	0.333	C	S	.	.	S	Bend	trans	-86.5	137.6	-178.5	-73	0	0	0	0	111.4	L161 R162 D170	L161-C165 PolarHBondContact O-N 2.91Å; R162-C165 PolarHBondContact O-N 2.94Å; C165-D170 HydrophobicContact CB-CB 4.14Å
166	D	80.6	Confident	88.2	Confident	83 Å²	83	63 Å²	63	44%	0.444	32%	0.321	S	S	.	.			trans	-83.9	115.6	167	-171.8	-21.2	0	0	0	109	E168 V169 D170	D166-E168 PolarHBondContact O-N 3.16Å; D166-E168 VanDerWaalsContact O-N 3.17Å; D166-E168 PolarHBondContact OD1-N 3.08Å; D166-V169 HydrophobicContact CB-CB 4.17Å; D166-V169 HydrophobicContact CB-CG2 4.26Å; D166-V169 PolarHBondContact O-N 3.09Å; D166-D170 PolarHBondContact N-OD2 3.35Å; D166-D170 WeakPolarHBondContact O-CB 3.1Å; D166-D170 PolarHBondContact O-N 3.41Å
167	R	72.6	Confident	88.2	Confident	196 Å²	196	61.9 Å²	61.9	74%	0.74	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-26	-176.8	-66.2	-171.9	-175.4	-172.2	-2.2	113.5	E172	R167-E172 WeakPolarHBondContact CB-OE1 3.3Å
168	E	67.9	Low	88.2	Confident	149 Å²	149	62.1 Å²	62.1	70%	0.696	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-21.2	179.9	-62.6	-174.9	178.9	0	0	111.9	D166 R268	D166-E168 PolarHBondContact O-N 3.16Å; D166-E168 VanDerWaalsContact O-N 3.17Å; D166-E168 PolarHBondContact OD1-N 3.08Å; E168-R268 PolarHBondContact O-NH1 3.49Å; E168-R268 PolarHBondContact O-NH2 2.87Å
169	V	74.8	Confident	88	Confident	69 Å²	69	62.4 Å²	62.4	42%	0.418	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-43	-167.3	-169.1	0	0	0	0	112.9	D166 R268	D166-V169 HydrophobicContact CB-CB 4.17Å; D166-V169 HydrophobicContact CB-CG2 4.26Å; D166-V169 PolarHBondContact O-N 3.09Å; V169-R268 PolarHBondContact O-NH1 3.43Å
170	D	83.7	Confident	87.6	Confident	59 Å²	59	57.2 Å²	57.2	32%	0.316	30%	0.299	S	S	.	.	S	Bend	trans	-94.4	158.7	-172	-64.1	-44.2	0	0	0	112.1	C165 D166 E172	C165-D170 HydrophobicContact CB-CB 4.14Å; D166-D170 PolarHBondContact N-OD2 3.35Å; D166-D170 WeakPolarHBondContact O-CB 3.1Å; D166-D170 PolarHBondContact O-N 3.41Å; D170-E172 PolarHBondContact O-N 2.85Å
171	M	89.3	Confident	87.3	Confident	7 Å²	7	57.2 Å²	57.2	3%	0.034	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-60.2	131.2	168.2	-65.2	-75.4	172.4	0	0	110.1	F200 P202 F208 L273 L274 W290	M171-F200 HydrophobicContact CB-CD2 4.41Å; M171-F200 HydrophobicContact CG-CD2 4.49Å; M171-F200 HydrophobicContact SD-CD2 4.15Å; M171-F200 HydrophobicContact SD-CE2 4.38Å; M171-P202 HydrophobicContact SD-CB 4.14Å; M171-F208 HydrophobicContact SD-CZ 4.41Å; M171-L273 HydrophobicContact CE-CB 4.3Å; M171-L273 HydrophobicContact CE-CD2 4.41Å; M171-L273 WeakPolarHBondContact CE-O 3.46Å; M171-L274 HydrophobicContact CE-CB 4.42Å; M171-L274 HydrophobicContact CE-CD1 4.14Å; M171-L274 HydrophobicContact CE-CG 4.08Å; M171-L274 HydrophobicContact CG-CD1 3.71Å; M171-L274 HydrophobicContact CG-CG 4.39Å; M171-W290 HydrophobicContact CB-CH2 3.84Å; M171-W290 HydrophobicContact CB-CZ2 3.58Å; M171-W290 HydrophobicContact CG-CZ2 4.43Å
172	E	89.9	Confident	87.2	Confident	78 Å²	78	57.2 Å²	57.2	36%	0.364	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.7	179.3	-63.6	-164.3	148.4	0	0	110.5	R167 D170 F200 T201	R167-E172 WeakPolarHBondContact CB-OE1 3.3Å; D170-E172 PolarHBondContact O-N 2.85Å; E172-F200 CarbonylContact O-C 3.51Å; E172-F200 WeakPolarHBondContact O-CA 3.08Å; E172-F200 WeakPolarHBondContact O-CB 3.33Å; E172-T201 PolarHBondContact N-O 3.31Å; E172-T201 PolarHBondContact O-N 3.13Å
173	V	92.8	Very high	87	Confident	11 Å²	11	54.3 Å²	54.3	7%	0.067	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123	179.6	176.8	0	0	0	0	110.7	L158 L161 R162 V198 F200 W290	L158-V173 HydrophobicContact CD2-CG1 4.1Å; L161-V173 HydrophobicContact CD2-CB 3.89Å; L161-V173 HydrophobicContact CD2-CG1 4.46Å; L161-V173 HydrophobicContact CD2-CG2 3.58Å; R162-V173 PolarHBondContact NE-O 3.35Å; V173-V198 HydrophobicContact CG1-CG1 3.34Å; V173-F200 HydrophobicContact CG2-CB 4.43Å; V173-W290 HydrophobicContact CG2-CH2 3.6Å; V173-W290 HydrophobicContact CG2-CZ2 4.05Å
174	G	92.4	Very high	87	Confident	28 Å²	28	50.6 Å²	50.6	29%	0.289	26%	0.261	S	S	.	.			trans	-85.1	-176.4	177.9	0	0	0	0	0	113.9	R162 P199	R162-G174 PolarHBondContact NH2-O 3.48Å; G174-P199 PolarHBondContact N-O 3.11Å
175	D	94.7	Very high	87.1	Confident	107 Å²	107	48.3 Å²	48.3	57%	0.572	26%	0.256	S	S	*	.			trans	-71.5	147.5	177.4	-66.6	-32.2	0	0	0	112.3	R162 P199	R162-D175 IonicContact CZ-OD1 2.97Å; R162-D175 IonicContact NH1-OD1 3.33Å; R162-D175 PolarHBondContact NH1-OD1 3.49Å; R162-D175 VanDerWaalsContact NH2-CA 3.29Å; R162-D175 IonicContact NH2-OD1 2.8Å; R162-D175 PolarHBondContact NH2-OD1 2.87Å; D175-P199 WeakPolarHBondContact O-CD 3.44Å
176	F	95.3	Very high	87.3	Confident	32 Å²	32	47.4 Å²	47.4	14%	0.14	25%	0.248	C	C	.	.			trans	-76.4	156.2	-178.7	66.6	-103.9	0	0	0	112.5	E151 A154 D155 L158 L196 L197 V198	E151-F176 HydrophobicContact CB-CE2 4.29Å; E151-F176 HydrophobicContact CB-CZ 3.84Å; E151-F176 HydrophobicContact CG-CE2 3.93Å; E151-F176 HydrophobicContact CG-CZ 4Å; E151-F176 WeakPolarHBondContact O-CE1 3.46Å; E151-F176 WeakPolarHBondContact O-CZ 3.44Å; A154-F176 HydrophobicContact CB-CD1 3.69Å; A154-F176 HydrophobicContact CB-CE1 3.55Å; A154-F176 HydrophobicContact CB-CG 4.47Å; A154-F176 HydrophobicContact CB-CZ 4.27Å; D155-F176 HydrophobicContact CB-CE1 4.33Å; D155-F176 WeakPolarHBondContact OD1-CE1 3.36Å; L158-F176 HydrophobicContact CD1-CB 3.99Å; L158-F176 HydrophobicContact CD1-CD1 3.87Å; L158-F176 HydrophobicContact CD1-CG 4.45Å; F176-L196 HydrophobicContact CB-CB 4.21Å; F176-L196 HydrophobicContact CB-CD1 4.39Å; F176-L196 HydrophobicContact CD1-CD1 4.29Å; F176-L196 HydrophobicContact CD2-CD1 3.9Å; F176-L196 HydrophobicContact CD2-CD2 3.75Å; F176-L196 HydrophobicContact CD2-CG 4.3Å; F176-L196 HydrophobicContact CE2-CD1 4.31Å; F176-L196 HydrophobicContact CE2-CD2 4.18Å; F176-L196 HydrophobicContact CG-CD1 3.93Å; F176-L196 HydrophobicContact CG-CD2 4.47Å; F176-L197 CarbonylContact C-O 3.59Å; F176-L197 WeakPolarHBondContact CA-O 3.47Å; F176-V198 HydrophobicContact CB-CG2 4.21Å
177	I	95.4	Very high	87.6	Confident	27 Å²	27	44.6 Å²	44.6	14%	0.138	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	116.2	169.7	-53	105.5	0	0	0	110.1	V179 L197 P199 Y347 V370	I177-V179 HydrophobicContact CG2-CG1 4.27Å; I177-V179 PolarHBondContact O-N 3.34Å; I177-L197 HydrophobicContact CB-CB 4.5Å; I177-L197 PolarHBondContact N-O 3.04Å; I177-L197 PolarHBondContact O-N 2.77Å; I177-P199 HydrophobicContact CD1-CG 3.52Å; I177-Y347 HydrophobicContact CD1-CE1 4.15Å; I177-V370 HydrophobicContact CG2-CG2 3.79Å
178	G	94.1	Very high	87.8	Confident	5 Å²	5	36.2 Å²	36.2	5%	0.052	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	121.7	174.9	0	0	0	0	0	113.6	F183 L196 R373	G178-F183 VanDerWaalsContact C-CD2 3.48Å; G178-F183 VanDerWaalsContact C-CG 3.44Å; G178-L196 VanDerWaalsContact CA-CD2 3.47Å; G178-R373 PolarHBondContact O-NH1 2.89Å
179	V	91.7	Very high	88	Confident	8 Å²	8	30.2 Å²	30.2	5%	0.048	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.4	-174.8	-69.5	0	0	0	0	112.5	I177 F183 D195 L197 A369 V370	I177-V179 HydrophobicContact CG2-CG1 4.27Å; I177-V179 PolarHBondContact O-N 3.34Å; V179-F183 VanDerWaalsContact O-CD2 3.31Å; V179-F183 WeakPolarHBondContact O-CD2 3.21Å; V179-D195 HydrophobicContact CG2-CB 4.11Å; V179-D195 WeakPolarHBondContact CG2-O 3.3Å; V179-D195 PolarHBondContact N-O 2.99Å; V179-L197 HydrophobicContact CG1-CD1 4Å; V179-L197 HydrophobicContact CG1-CG 4.18Å; V179-L197 HydrophobicContact CG2-CD1 4.26Å; V179-L197 HydrophobicContact CG2-CD2 3.94Å; V179-L197 HydrophobicContact CG2-CG 3.73Å; V179-A369 HydrophobicContact CB-CB 4.01Å; V179-A369 HydrophobicContact CG1-CB 3.97Å; V179-V370 HydrophobicContact CG1-CG2 3.93Å
180	G	87.6	Confident	88	Confident	17 Å²	17	33.5 Å²	33.5	18%	0.175	19%	0.187	C	C	.	.	S	Bend	trans	84.1	-168.9	174.8	0	0	0	0	0	114.5	M182 F183 E184	G180-M182 VanDerWaalsContact C-N 3.27Å; G180-M182 PolarHBondContact O-N 3.28Å; G180-M182 VanDerWaalsContact O-N 3.08Å; G180-F183 PolarHBondContact O-N 2.93Å; G180-E184 WeakPolarHBondContact O-CB 3.15Å; G180-E184 WeakPolarHBondContact O-CG 3Å; G180-E184 PolarHBondContact O-N 3.35Å
181	S	87.9	Confident	87.5	Confident	14 Å²	14	33.5 Å²	33.5	10%	0.098	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-34.1	-164.9	57.8	0	0	0	0	115.9	S185 W186 K187	S181-S185 PolarHBondContact O-N 2.94Å; S181-W186 VanDerWaalsContact CA-CE2 3.49Å; S181-W186 PolarHBondContact O-N 3.32Å; S181-W186 VanDerWaalsContact O-N 3.1Å; S181-K187 PolarHBondContact O-N 2.86Å; S181-K187 VanDerWaalsContact O-N 3.13Å; S181-K187 WeakPolarHBondContact OG-CD 3.14Å
182	M	89	Confident	87.1	Confident	3 Å²	3	34 Å²	34	2%	0.015	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-43.4	177.4	-79.1	-60.4	-66.7	0	0	112.2	N143 V146 R147 G180 K187 L192 M193	N143-M182 HydrophobicContact CB-CE 3.9Å; V146-M182 HydrophobicContact CB-CE 4.41Å; V146-M182 HydrophobicContact CG1-CE 3.94Å; R147-M182 PolarHBondContact NH2-O 3.45Å; G180-M182 VanDerWaalsContact C-N 3.27Å; G180-M182 PolarHBondContact O-N 3.28Å; G180-M182 VanDerWaalsContact O-N 3.08Å; M182-K187 HydrophobicContact CG-CB 4.25Å; M182-K187 HydrophobicContact CG-CD 4.09Å; M182-K187 HydrophobicContact CG-CG 4.21Å; M182-K187 HydrophobicContact SD-CB 3.42Å; M182-K187 WeakPolarHBondContact SD-CB 3.35Å; M182-K187 HydrophobicContact SD-CD 3.94Å; M182-K187 HydrophobicContact SD-CG 3.4Å; M182-K187 WeakPolarHBondContact SD-CG 3.19Å; M182-L192 HydrophobicContact CE-CB 4.36Å; M182-L192 HydrophobicContact CE-CD2 4.28Å; M182-L192 HydrophobicContact SD-CB 4.34Å; M182-L192 HydrophobicContact SD-CD2 3.87Å; M182-M193 WeakPolarHBondContact CG-O 3.2Å
183	F	89.6	Confident	86.9	Confident	18 Å²	18	33 Å²	33	8%	0.079	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.6	-176.9	-63	-86.6	0	0	0	112.9	R147 E151 G178 V179 G180 C194 D195 L196	R147-F183 HydrophobicContact CG-CD1 3.97Å; R147-F183 HydrophobicContact CG-CE1 3.66Å; E151-F183 HydrophobicContact CG-CE1 4.15Å; E151-F183 WeakPolarHBondContact OE1-CE1 3.38Å; G178-F183 VanDerWaalsContact C-CD2 3.48Å; G178-F183 VanDerWaalsContact C-CG 3.44Å; V179-F183 VanDerWaalsContact O-CD2 3.31Å; V179-F183 WeakPolarHBondContact O-CD2 3.21Å; G180-F183 PolarHBondContact O-N 2.93Å; F183-C194 HydrophobicContact CE2-CB 4.04Å; F183-C194 HydrophobicContact CZ-CB 4.32Å; F183-D195 WeakPolarHBondContact CE2-O 3.4Å; F183-L196 HydrophobicContact CE1-CD2 4.1Å; F183-L196 HydrophobicContact CE2-CD2 3.72Å; F183-L196 HydrophobicContact CZ-CD2 3.31Å; F183-L196 HydrophobicContact CZ-CG 4.48Å
184	E	90.3	Very high	86.8	Confident	16 Å²	16	32.6 Å²	32.6	8%	0.075	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	4.1	174.8	-66.2	171.6	-172.6	0	0	113.3	G180 W186 R373 L376 K418	G180-E184 WeakPolarHBondContact O-CB 3.15Å; G180-E184 WeakPolarHBondContact O-CG 3Å; G180-E184 PolarHBondContact O-N 3.35Å; E184-W186 VanDerWaalsContact CB-NE1 3.27Å; E184-W186 PolarHBondContact O-N 2.92Å; E184-W186 PolarHBondContact OE2-NE1 3.05Å; E184-R373 HydrophobicContact CG-CB 4.36Å; E184-R373 HydrophobicContact CG-CG 4.15Å; E184-L376 HydrophobicContact CB-CD1 4.46Å; E184-L376 HydrophobicContact CG-CD1 4.27Å; E184-K418 IonicContact OE1-NZ 3.02Å; E184-K418 PolarHBondContact OE1-NZ 3.38Å; E184-K418 WeakPolarHBondContact OE2-CE 3.21Å; E184-K418 IonicContact OE2-NZ 2.8Å; E184-K418 PolarHBondContact OE2-NZ 3.32Å
185	S	86.9	Confident	86.7	Confident	55 Å²	55	32.6 Å²	32.6	39%	0.385	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	28.8	172.4	-54.2	0	0	0	0	115.8	R147 S181	R147-S185 PolarHBondContact NH2-OG 3.45Å; S181-S185 PolarHBondContact O-N 2.94Å
186	W	87.3	Confident	86.7	Confident	14 Å²	14	27.5 Å²	27.5	5%	0.053	15%	0.153	C	C	.	.			trans	-123	14.4	175.8	59.8	-94.4	0	0	0	114.2	S181 E184 V188 L390 L393 Q394 T397 K418	S181-W186 VanDerWaalsContact CA-CE2 3.49Å; S181-W186 PolarHBondContact O-N 3.32Å; S181-W186 VanDerWaalsContact O-N 3.1Å; E184-W186 VanDerWaalsContact CB-NE1 3.27Å; E184-W186 PolarHBondContact O-N 2.92Å; E184-W186 PolarHBondContact OE2-NE1 3.05Å; W186-V188 PolarHBondContact O-N 2.92Å; W186-L390 HydrophobicContact CB-CD2 4.29Å; W186-L393 HydrophobicContact CB-CD2 4.21Å; W186-L393 HydrophobicContact CB-CG 4.47Å; W186-L393 HydrophobicContact CD2-CD2 3.42Å; W186-L393 VanDerWaalsContact CD2-CD2 3.42Å; W186-L393 HydrophobicContact CD2-CG 3.83Å; W186-L393 HydrophobicContact CE3-CD2 3.92Å; W186-L393 HydrophobicContact CE3-CG 3.8Å; W186-L393 HydrophobicContact CG-CD2 3.56Å; W186-L393 HydrophobicContact CG-CG 4.14Å; W186-L393 HydrophobicContact CZ2-CD2 4.21Å; W186-L393 HydrophobicContact CZ3-CG 4.35Å; W186-Q394 HydrophobicContact CB-CG 4.04Å; W186-Q394 WeakPolarHBondContact O-CG 3.08Å; W186-T397 HydrophobicContact CE3-CG2 4.23Å; W186-T397 HydrophobicContact CZ3-CG2 3.7Å; W186-K418 HydrophobicContact CZ2-CD 4.22Å
187	K	85.9	Confident	86.7	Confident	23 Å²	23	26.2 Å²	26.2	10%	0.1	15%	0.147	C	C	.	.			trans	-65.7	129.5	172.5	-168.1	83.9	175.8	-169.5	0	111.9	S181 M182 C189 L192	S181-K187 PolarHBondContact O-N 2.86Å; S181-K187 VanDerWaalsContact O-N 3.13Å; S181-K187 WeakPolarHBondContact OG-CD 3.14Å; M182-K187 HydrophobicContact CG-CB 4.25Å; M182-K187 HydrophobicContact CG-CD 4.09Å; M182-K187 HydrophobicContact CG-CG 4.21Å; M182-K187 HydrophobicContact SD-CB 3.42Å; M182-K187 WeakPolarHBondContact SD-CB 3.35Å; M182-K187 HydrophobicContact SD-CD 3.94Å; M182-K187 HydrophobicContact SD-CG 3.4Å; M182-K187 WeakPolarHBondContact SD-CG 3.19Å; K187-C189 VanDerWaalsContact CE-O 3.31Å; K187-C189 WeakPolarHBondContact CE-O 3.4Å; K187-L192 HydrophobicContact CG-CD2 4.15Å
188	V	76.9	Confident	86.7	Confident	21 Å²	21	25 Å²	25	13%	0.127	14%	0.141	C	C	.	.			trans	-115.9	-41.3	176.2	-173.9	0	0	0	0	113.9	F131 W186 Q394 F398	F131-V188 HydrophobicContact CE2-CG1 4.45Å; F131-V188 HydrophobicContact CZ-CG1 3.84Å; W186-V188 PolarHBondContact O-N 2.92Å; V188-Q394 HydrophobicContact CG2-CB 3.33Å; V188-Q394 HydrophobicContact CG2-CG 3.44Å; V188-Q394 VanDerWaalsContact CG2-CG 3.44Å; V188-F398 HydrophobicContact CB-CB 4.49Å; V188-F398 HydrophobicContact CG1-CB 4.15Å; V188-F398 HydrophobicContact CG1-CD2 4.02Å; V188-F398 HydrophobicContact CG1-CG 4.44Å
189	C	73.3	Confident	86.8	Confident	22 Å²	22	25.6 Å²	25.6	15%	0.149	14%	0.144	C	C	.	.	S	Bend	trans	-101.9	140.5	-168.6	-59	0	0	0	0	113.7	K187 R401	K187-C189 VanDerWaalsContact CE-O 3.31Å; K187-C189 WeakPolarHBondContact CE-O 3.4Å; C189-R401 VanDerWaalsContact CB-CD 3.48Å; C189-R401 VanDerWaalsContact CB-NH1 3.34Å; C189-R401 PolarHBondContact O-NH1 3.25Å
190	Q	72.9	Confident	86.9	Confident	139 Å²	139	25.4 Å²	25.4	65%	0.65	14%	0.142	S	C	*	.	S	Bend	trans	-78.4	155.5	170.9	-69.8	-175.9	-3.6	0	0	112.3	R401	Q190-R401 PolarHBondContact O-NH2 2.92Å
191	P	74.4	Confident	87.1	Confident	59 Å²	59	28 Å²	28	38%	0.383	16%	0.155	S	C	.	.	S	Bend	cis	-67.7	152.1	-6.2	28.9	-35.2	0	0	0	111.8	M193 V332	P191-M193 PolarHBondContact O-N 3.46Å; P191-V332 HydrophobicContact CB-CG2 4.1Å; P191-V332 HydrophobicContact CG-CG2 4.11Å
192	L	81.4	Confident	87.2	Confident	18 Å²	18	28.1 Å²	28.1	9%	0.094	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	115.8	174.4	-60.2	175	0	0	0	107.4	N143 V146 M182 K187 V332	N143-L192 WeakPolarHBondContact OD1-CD2 3.42Å; V146-L192 HydrophobicContact CB-CD1 3.96Å; V146-L192 HydrophobicContact CG1-CB 4.18Å; V146-L192 HydrophobicContact CG1-CD1 3.82Å; V146-L192 HydrophobicContact CG2-CD1 3.52Å; M182-L192 HydrophobicContact CE-CB 4.36Å; M182-L192 HydrophobicContact CE-CD2 4.28Å; M182-L192 HydrophobicContact SD-CB 4.34Å; M182-L192 HydrophobicContact SD-CD2 3.87Å; K187-L192 HydrophobicContact CG-CD2 4.15Å; L192-V332 PolarHBondContact O-N 2.87Å
193	M	84.6	Confident	87.2	Confident	57 Å²	57	28 Å²	28	28%	0.281	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.5	179.8	176.6	-174.7	-67.2	0	0	107.4	M182 P191 V332	M182-M193 WeakPolarHBondContact CG-O 3.2Å; P191-M193 PolarHBondContact O-N 3.46Å; M193-V332 CarbonylContact C-O 3.58Å; M193-V332 VanDerWaalsContact CA-O 3.31Å; M193-V332 WeakPolarHBondContact CA-O 3.26Å; M193-V332 HydrophobicContact CB-CB 4.28Å; M193-V332 HydrophobicContact CB-CG1 4.17Å; M193-V332 HydrophobicContact CE-CG1 4.25Å; M193-V332 HydrophobicContact CG-CG1 3.92Å
194	C	90.6	Very high	86.7	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.007	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.6	178.7	-56	0	0	0	0	108.8	V150 F183 V332 L333 N334	V150-C194 HydrophobicContact CG1-CB 3.85Å; V150-C194 HydrophobicContact CG2-CB 4.36Å; F183-C194 HydrophobicContact CE2-CB 4.04Å; F183-C194 HydrophobicContact CZ-CB 4.32Å; C194-V332 PolarHBondContact N-O 3.35Å; C194-L333 HydrophobicContact CB-CD1 4.07Å; C194-L333 CarbonylContact O-C 3.52Å; C194-L333 WeakPolarHBondContact O-CA 3.31Å; C194-N334 PolarHBondContact O-N 3.38Å
195	D	91.6	Very high	86.3	Confident	29 Å²	29	34.9 Å²	34.9	16%	0.155	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.7	178.7	-54.8	-54.3	0	0	0	108.4	V179 F183 N334 I336	V179-D195 HydrophobicContact CG2-CB 4.11Å; V179-D195 WeakPolarHBondContact CG2-O 3.3Å; V179-D195 PolarHBondContact N-O 2.99Å; F183-D195 WeakPolarHBondContact CE2-O 3.4Å; D195-N334 PolarHBondContact OD1-ND2 3.44Å; D195-I336 HydrophobicContact CB-CD1 4.38Å
196	L	94.6	Very high	86.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.4	178.7	-62.3	-171.6	0	0	0	108.7	V150 A154 F176 G178 F183 L333 N334 L335 I336	V150-L196 HydrophobicContact CG1-CD1 4.07Å; A154-L196 HydrophobicContact CB-CD1 3.37Å; F176-L196 HydrophobicContact CB-CB 4.21Å; F176-L196 HydrophobicContact CB-CD1 4.39Å; F176-L196 HydrophobicContact CD1-CD1 4.29Å; F176-L196 HydrophobicContact CD2-CD1 3.9Å; F176-L196 HydrophobicContact CD2-CD2 3.75Å; F176-L196 HydrophobicContact CD2-CG 4.3Å; F176-L196 HydrophobicContact CE2-CD1 4.31Å; F176-L196 HydrophobicContact CE2-CD2 4.18Å; F176-L196 HydrophobicContact CG-CD1 3.93Å; F176-L196 HydrophobicContact CG-CD2 4.47Å; G178-L196 VanDerWaalsContact CA-CD2 3.47Å; F183-L196 HydrophobicContact CE1-CD2 4.1Å; F183-L196 HydrophobicContact CE2-CD2 3.72Å; F183-L196 HydrophobicContact CZ-CD2 3.31Å; F183-L196 HydrophobicContact CZ-CG 4.48Å; L196-L333 HydrophobicContact CD1-CD1 3.74Å; L196-L333 HydrophobicContact CG-CD1 3.77Å; L196-N334 PolarHBondContact N-O 3.13Å; L196-L335 HydrophobicContact CB-CD2 3.94Å; L196-L335 HydrophobicContact CD1-CD2 3.77Å; L196-L335 HydrophobicContact CG-CD2 4.32Å; L196-I336 PolarHBondContact O-N 3.45Å
197	L	95.1	Very high	86.3	Confident	5 Å²	5	33.7 Å²	33.7	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	132.9	169.8	-52.5	-175.6	0	0	0	108.5	F176 I177 V179 I336 V338 Y347 V370	F176-L197 CarbonylContact C-O 3.59Å; F176-L197 WeakPolarHBondContact CA-O 3.47Å; I177-L197 HydrophobicContact CB-CB 4.5Å; I177-L197 PolarHBondContact N-O 3.04Å; I177-L197 PolarHBondContact O-N 2.77Å; V179-L197 HydrophobicContact CG1-CD1 4Å; V179-L197 HydrophobicContact CG1-CG 4.18Å; V179-L197 HydrophobicContact CG2-CD1 4.26Å; V179-L197 HydrophobicContact CG2-CD2 3.94Å; V179-L197 HydrophobicContact CG2-CG 3.73Å; L197-I336 HydrophobicContact CD2-CB 4.24Å; L197-I336 HydrophobicContact CD2-CD1 4.14Å; L197-V338 HydrophobicContact CB-CG1 4.07Å; L197-V338 HydrophobicContact CB-CG2 3.92Å; L197-V338 HydrophobicContact CD2-CG1 3.92Å; L197-V338 HydrophobicContact CG-CG1 4.4Å; L197-Y347 HydrophobicContact CD1-CD2 4.18Å; L197-Y347 HydrophobicContact CD1-CG 4.32Å; L197-V370 HydrophobicContact CD1-CG2 4.25Å
198	V	95.4	Very high	86.6	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	96	-178.1	-178.5	0	0	0	0	107.9	L158 V173 F176 F291 L335 I336 P337 V338	L158-V198 HydrophobicContact CD1-CG1 4.09Å; L158-V198 HydrophobicContact CD1-CG2 4.28Å; L158-V198 HydrophobicContact CD2-CG1 3.94Å; L158-V198 HydrophobicContact CD2-CG2 4.49Å; V173-V198 HydrophobicContact CG1-CG1 3.34Å; F176-V198 HydrophobicContact CB-CG2 4.21Å; V198-F291 HydrophobicContact CB-CE2 4.43Å; V198-F291 HydrophobicContact CB-CZ 4.18Å; V198-F291 HydrophobicContact CG1-CE2 4.05Å; V198-F291 HydrophobicContact CG1-CZ 4.18Å; V198-F291 HydrophobicContact CG2-CZ 4.27Å; V198-L335 HydrophobicContact CG2-CB 4.28Å; V198-L335 HydrophobicContact CG2-CD2 4.3Å; V198-I336 PolarHBondContact N-O 2.95Å; V198-P337 WeakPolarHBondContact O-CA 3.32Å; V198-V338 PolarHBondContact O-N 2.93Å
199	P	95.3	Very high	87.3	Confident	17 Å²	17	37.2 Å²	37.2	11%	0.11	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	143.1	178.1	-20	33.6	0	0	0	111.2	G174 D175 I177 V338 Y347	G174-P199 PolarHBondContact N-O 3.11Å; D175-P199 WeakPolarHBondContact O-CD 3.44Å; I177-P199 HydrophobicContact CD1-CG 3.52Å; P199-V338 CarbonylContact C-O 3.57Å; P199-V338 VanDerWaalsContact CA-O 3.26Å; P199-V338 WeakPolarHBondContact CA-O 3.45Å; P199-V338 HydrophobicContact CB-CG2 4.33Å; P199-V338 HydrophobicContact CG-CG2 4.15Å; P199-Y347 HydrophobicContact CG-CE1 4.07Å
200	F	93.9	Very high	88.1	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	153.2	167.3	68.5	-84.9	0	0	0	111.1	M171 E172 V173 F208 L282 I287 W290 P337 V338 V339	M171-F200 HydrophobicContact CB-CD2 4.41Å; M171-F200 HydrophobicContact CG-CD2 4.49Å; M171-F200 HydrophobicContact SD-CD2 4.15Å; M171-F200 HydrophobicContact SD-CE2 4.38Å; E172-F200 CarbonylContact O-C 3.51Å; E172-F200 WeakPolarHBondContact O-CA 3.08Å; E172-F200 WeakPolarHBondContact O-CB 3.33Å; V173-F200 HydrophobicContact CG2-CB 4.43Å; F200-F208 HydrophobicContact CD2-CE2 4.47Å; F200-F208 HydrophobicContact CD2-CZ 4.25Å; F200-F208 HydrophobicContact CE2-CE2 4.29Å; F200-F208 AromaticContact CE2-CZ 3.9Å; F200-F208 HydrophobicContact CE2-CZ 3.9Å; F200-L282 HydrophobicContact CE2-CD1 4.49Å; F200-I287 HydrophobicContact CE1-CG2 4.09Å; F200-I287 HydrophobicContact CE2-CD1 4.33Å; F200-I287 HydrophobicContact CZ-CD1 3.73Å; F200-I287 HydrophobicContact CZ-CG1 4.17Å; F200-I287 HydrophobicContact CZ-CG2 4.04Å; F200-W290 HydrophobicContact CB-CH2 4.32Å; F200-W290 HydrophobicContact CG-CH2 4.49Å; F200-W290 HydrophobicContact CG-CZ3 4.39Å; F200-P337 HydrophobicContact CD1-CB 4.14Å; F200-P337 HydrophobicContact CE1-CB 4.12Å; F200-V338 WeakPolarHBondContact CD1-O 3.33Å; F200-V338 WeakPolarHBondContact CE1-O 3.42Å; F200-V338 PolarHBondContact N-O 3.24Å; F200-V339 HydrophobicContact CD1-CG2 4.45Å; F200-V339 HydrophobicContact CE1-CG2 3.64Å; F200-V339 HydrophobicContact CE2-CG2 3.84Å; F200-V339 HydrophobicContact CZ-CG2 3.26Å
201	T	92.1	Very high	88.9	Confident	73 Å²	73	34.9 Å²	34.9	45%	0.448	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151	-178.8	45.6	0	0	0	0	110.3	E172	E172-T201 PolarHBondContact N-O 3.31Å; E172-T201 PolarHBondContact O-N 3.13Å
202	P	91	Very high	89.7	Confident	15 Å²	15	32.3 Å²	32.3	10%	0.097	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-75.2	153.7	178.5	35.4	-31.2	0	0	0	110.2	M171 H206 F208	M171-P202 HydrophobicContact SD-CB 4.14Å; P202-H206 HydrophobicContact CB-CB 3.94Å; P202-H206 HydrophobicContact CG-CB 4.33Å; P202-H206 WeakPolarHBondContact CG-O 3.21Å; P202-F208 HydrophobicContact CB-CD1 4.33Å; P202-F208 HydrophobicContact CB-CE1 3.68Å; P202-F208 HydrophobicContact CB-CZ 3.84Å; P202-F208 VanDerWaalsContact CD-CE2 3.45Å; P202-F208 HydrophobicContact CG-CD1 3.92Å; P202-F208 HydrophobicContact CG-CD2 4.28Å; P202-F208 HydrophobicContact CG-CE1 3.7Å; P202-F208 HydrophobicContact CG-CE2 4.14Å; P202-F208 HydrophobicContact CG-CG 4.19Å; P202-F208 HydrophobicContact CG-CZ 3.83Å
203	P	87.1	Confident	89.9	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-68.8	146.4	176.8	27.7	-34.1	0	0	0	111.1	H206 L273	P203-H206 VanDerWaalsContact O-CB 3.29Å; P203-H206 WeakPolarHBondContact O-CB 3.29Å; P203-H206 PolarHBondContact O-N 3.36Å; P203-H206 PolarHBondContact O-ND1 2.94Å; P203-L273 HydrophobicContact CG-CD2 4.22Å
204	D	79.6	Confident	89.9	Confident	132 Å²	132	32.3 Å²	32.3	71%	0.706	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	140.1	173.9	-75.3	-34.5	0	0	0	111.2
205	P	81.6	Confident	89.5	Confident	46 Å²	46	34.3 Å²	34.3	30%	0.299	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	cis	-97.6	33.8	4.1	40.4	-36.7	0	0	0	112.9	M234 F235	P205-M234 HydrophobicContact CG-SD 4.37Å; P205-F235 HydrophobicContact CB-CB 4.35Å; P205-F235 WeakPolarHBondContact O-CB 3.44Å; P205-F235 VanDerWaalsContact O-CD2 3.25Å; P205-F235 WeakPolarHBondContact O-CD2 3.34Å; P205-F235 PolarHBondContact O-N 3.27Å
206	H	85.8	Confident	88.5	Confident	14 Å²	14	39.7 Å²	39.7	7%	0.065	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	156	-178.3	-56.2	81.4	0	0	0	111.2	P202 P203 V232 T233 L273	P202-H206 HydrophobicContact CB-CB 3.94Å; P202-H206 HydrophobicContact CG-CB 4.33Å; P202-H206 WeakPolarHBondContact CG-O 3.21Å; P203-H206 VanDerWaalsContact O-CB 3.29Å; P203-H206 WeakPolarHBondContact O-CB 3.29Å; P203-H206 PolarHBondContact O-N 3.36Å; P203-H206 PolarHBondContact O-ND1 2.94Å; H206-V232 HydrophobicContact CB-CG1 3.99Å; H206-T233 CarbonylContact C-O 3.58Å; H206-T233 WeakPolarHBondContact CA-O 3.38Å; H206-L273 VanDerWaalsContact CD2-CD1 3.45Å; H206-L273 WeakPolarHBondContact CD2-CD1 3.43Å; H206-L273 WeakPolarHBondContact NE2-CD1 3.24Å
207	S	88.7	Confident	87.1	Confident	31 Å²	31	43.8 Å²	43.8	22%	0.217	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	160.6	176.3	69.5	0	0	0	0	111.1	V232 T233	S207-V232 WeakPolarHBondContact O-CA 3.39Å; S207-T233 PolarHBondContact N-O 3.2Å; S207-T233 PolarHBondContact O-N 3.4Å; S207-T233 PolarHBondContact OG-OG1 3.35Å
208	F	92.4	Very high	85.8	Confident	24 Å²	24	45 Å²	45	11%	0.105	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	125.7	175.4	-64.6	-34.9	0	0	0	110.9	M171 F200 P202 Y210 I230 V232 L282 V339	M171-F208 HydrophobicContact SD-CZ 4.41Å; F200-F208 HydrophobicContact CD2-CE2 4.47Å; F200-F208 HydrophobicContact CD2-CZ 4.25Å; F200-F208 HydrophobicContact CE2-CE2 4.29Å; F200-F208 AromaticContact CE2-CZ 3.9Å; F200-F208 HydrophobicContact CE2-CZ 3.9Å; P202-F208 HydrophobicContact CB-CD1 4.33Å; P202-F208 HydrophobicContact CB-CE1 3.68Å; P202-F208 HydrophobicContact CB-CZ 3.84Å; P202-F208 VanDerWaalsContact CD-CE2 3.45Å; P202-F208 HydrophobicContact CG-CD1 3.92Å; P202-F208 HydrophobicContact CG-CD2 4.28Å; P202-F208 HydrophobicContact CG-CE1 3.7Å; P202-F208 HydrophobicContact CG-CE2 4.14Å; P202-F208 HydrophobicContact CG-CG 4.19Å; P202-F208 HydrophobicContact CG-CZ 3.83Å; F208-Y210 HydrophobicContact CB-CE1 3.87Å; F208-Y210 WeakPolarHBondContact O-CE2 2.98Å; F208-I230 HydrophobicContact CB-CG2 3.9Å; F208-I230 HydrophobicContact CD1-CG2 3.96Å; F208-I230 HydrophobicContact CG-CG2 3.91Å; F208-V232 HydrophobicContact CD1-CG2 4.04Å; F208-V232 HydrophobicContact CE1-CG2 3.9Å; F208-L282 HydrophobicContact CD1-CD1 4.13Å; F208-L282 HydrophobicContact CE1-CD1 3.66Å; F208-L282 HydrophobicContact CE1-CD2 4.26Å; F208-L282 HydrophobicContact CE1-CG 4.29Å; F208-L282 HydrophobicContact CZ-CD1 3.89Å; F208-V339 HydrophobicContact CD2-CG1 3.37Å; F208-V339 HydrophobicContact CD2-CG2 4.43Å; F208-V339 HydrophobicContact CE2-CB 4.46Å; F208-V339 HydrophobicContact CE2-CG1 3.69Å; F208-V339 HydrophobicContact CE2-CG2 3.96Å; F208-V339 HydrophobicContact CG-CG1 4.22Å; F208-V339 HydrophobicContact CZ-CG2 4.49Å
209	L	91.1	Very high	84.5	Confident	94 Å²	94	52 Å²	52	49%	0.492	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.4	170.5	-174	73.5	0	0	0	109.5	K231 T233	L209-K231 HydrophobicContact CB-CB 4.4Å; L209-K231 PolarHBondContact N-O 2.88Å; L209-K231 PolarHBondContact O-N 3.48Å; L209-T233 HydrophobicContact CB-CG2 4.33Å
210	Y	91.2	Very high	83.6	Confident	52 Å²	52	52.1 Å²	52.1	20%	0.204	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137	-172.6	-46.3	-77.5	0	0	0	111.9	F208 I230 V339 Q340 L341 E342 F348	F208-Y210 HydrophobicContact CB-CE1 3.87Å; F208-Y210 WeakPolarHBondContact O-CE2 2.98Å; Y210-I230 HydrophobicContact CD1-CG1 4.34Å; Y210-I230 HydrophobicContact CD1-CG2 4.37Å; Y210-I230 HydrophobicContact CE1-CG2 4.33Å; Y210-V339 HydrophobicContact CE1-CG1 3.82Å; Y210-Q340 PolarHBondContact OH-O 3.16Å; Y210-L341 HydrophobicContact CD1-CD1 3.98Å; Y210-L341 HydrophobicContact CD2-CD1 3.78Å; Y210-L341 HydrophobicContact CE1-CD1 4.45Å; Y210-L341 HydrophobicContact CE2-CD1 4.31Å; Y210-L341 HydrophobicContact CG-CD1 3.58Å; Y210-E342 HydrophobicContact CD2-CG 3.99Å; Y210-E342 HydrophobicContact CE2-CG 3.8Å; Y210-E342 PolarHBondContact OH-N 3.23Å; Y210-F348 HydrophobicContact CD1-CD2 4.14Å; Y210-F348 AromaticContact CD1-CE2 3.37Å; Y210-F348 HydrophobicContact CD1-CE2 3.37Å; Y210-F348 HydrophobicContact CD1-CZ 4.08Å; Y210-F348 HydrophobicContact CE1-CD2 4.26Å; Y210-F348 AromaticContact CE1-CE2 3.88Å; Y210-F348 HydrophobicContact CE1-CE2 3.88Å; Y210-F348 HydrophobicContact CG-CE2 4.14Å
211	H	89.8	Confident	82.6	Confident	59 Å²	59	54.1 Å²	54.1	27%	0.273	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.5	168.1	-175	84.3	0	0	0	109.8	S217 G228 T229	H211-S217 PolarHBondContact CE1-O 3.35Å; H211-G228 CarbonylContact O-C 3.48Å; H211-G228 WeakPolarHBondContact O-CA 3.31Å; H211-T229 WeakPolarHBondContact CB-OG1 3.47Å; H211-T229 PolarHBondContact N-O 3.02Å; H211-T229 PolarHBondContact O-N 3.46Å
212	L	90.1	Very high	81.5	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	151.8	-170.7	-63.1	169.9	0	0	0	111.8	C214 S215 L341 F348 L366 F478	L212-C214 PolarHBondContact O-N 2.69Å; L212-S215 PolarHBondContact N-OG 2.91Å; L212-S215 VanDerWaalsContact O-CB 3.25Å; L212-S215 WeakPolarHBondContact O-CB 3.26Å; L212-S215 PolarHBondContact O-N 3.49Å; L212-S215 PolarHBondContact O-OG 3.29Å; L212-L341 HydrophobicContact CD1-CD1 4.28Å; L212-L341 HydrophobicContact CD1-CD2 4.25Å; L212-L341 HydrophobicContact CD2-CD1 4.24Å; L212-L341 HydrophobicContact CD2-CD2 4.31Å; L212-F348 HydrophobicContact CD2-CE1 4.04Å; L212-F348 HydrophobicContact CD2-CZ 3.5Å; L212-L366 HydrophobicContact CD2-CD1 4.13Å; L212-L366 HydrophobicContact CD2-CD2 4.12Å; L212-F478 HydrophobicContact CD1-CE1 4.1Å; L212-F478 HydrophobicContact CD1-CZ 4.28Å; L212-F478 HydrophobicContact CD2-CZ 4.48Å
213	W	86.7	Confident	80.5	Confident	30 Å²	30	58.7 Å²	58.7	11%	0.114	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-22.5	176.5	78	98.3	0	0	0	115.3	S218 I220 S227 L366 I463 F478 I484	W213-S218 WeakPolarHBondContact CA-OG 3.44Å; W213-S218 WeakPolarHBondContact O-CB 3.35Å; W213-S218 PolarHBondContact O-OG 3.14Å; W213-I220 HydrophobicContact CB-CB 4.25Å; W213-I220 HydrophobicContact CB-CD1 4.03Å; W213-I220 HydrophobicContact CB-CG2 4.05Å; W213-S227 WeakPolarHBondContact CB-O 3.21Å; W213-S227 PolarHBondContact N-O 3.38Å; W213-S227 VanDerWaalsContact N-O 3.09Å; W213-L366 HydrophobicContact CE3-CD1 3.83Å; W213-L366 HydrophobicContact CH2-CD1 4.36Å; W213-L366 HydrophobicContact CH2-CD2 4.22Å; W213-L366 HydrophobicContact CZ3-CB 4.44Å; W213-L366 HydrophobicContact CZ3-CD1 3.38Å; W213-L366 HydrophobicContact CZ3-CD2 3.71Å; W213-L366 HydrophobicContact CZ3-CG 4.01Å; W213-I463 HydrophobicContact CZ2-CD1 4.19Å; W213-F478 HydrophobicContact CE3-CE1 4.43Å; W213-F478 AromaticContact CH2-CD1 3.45Å; W213-F478 HydrophobicContact CH2-CD1 3.45Å; W213-F478 VanDerWaalsContact CH2-CD1 3.45Å; W213-F478 AromaticContact CH2-CE1 3.16Å; W213-F478 HydrophobicContact CH2-CE1 3.16Å; W213-F478 HydrophobicContact CH2-CE2 4.3Å; W213-F478 HydrophobicContact CH2-CG 4.18Å; W213-F478 AromaticContact CH2-CZ 3.64Å; W213-F478 HydrophobicContact CH2-CZ 3.64Å; W213-F478 AromaticContact CZ2-CD1 3.85Å; W213-F478 HydrophobicContact CZ2-CD1 3.85Å; W213-F478 AromaticContact CZ2-CE1 3.96Å; W213-F478 HydrophobicContact CZ2-CE1 3.96Å; W213-F478 HydrophobicContact CZ3-CD1 4.16Å; W213-F478 AromaticContact CZ3-CE1 3.42Å; W213-F478 HydrophobicContact CZ3-CE1 3.42Å; W213-F478 VanDerWaalsContact CZ3-CE1 3.42Å; W213-F478 AromaticContact CZ3-CZ 3.77Å; W213-F478 HydrophobicContact CZ3-CZ 3.77Å; W213-I484 HydrophobicContact CZ2-CD1 3.84Å
214	C	83.9	Confident	80	Confident	46 Å²	46	60.1 Å²	60.1	31%	0.311	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	10.8	179.8	58.3	0	0	0	0	113.2	L212 A481	L212-C214 PolarHBondContact O-N 2.69Å; C214-A481 HydrophobicContact CB-CB 4.33Å
215	S	82.9	Confident	80	Confident	43 Å²	43	57.3 Å²	57.3	30%	0.301	33%	0.332	S	S	.	.	S	Bend	trans	-69.1	147.5	172.4	-68.5	0	0	0	0	111.1	L212 S217 S218	L212-S215 PolarHBondContact N-OG 2.91Å; L212-S215 VanDerWaalsContact O-CB 3.25Å; L212-S215 WeakPolarHBondContact O-CB 3.26Å; L212-S215 PolarHBondContact O-N 3.49Å; L212-S215 PolarHBondContact O-OG 3.29Å; S215-S217 PolarHBondContact O-N 3.18Å; S215-S217 VanDerWaalsContact O-N 3.08Å; S215-S218 WeakPolarHBondContact O-CB 3.24Å; S215-S218 PolarHBondContact O-N 3Å
216	S	69.5	Low	80.1	Confident	141 Å²	141	56 Å²	56	99%	0.986	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.6	-178.2	-46.1	0	0	0	0	114.1
217	S	65.9	Low	80.3	Confident	86 Å²	86	55.3 Å²	55.3	60%	0.601	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	29.9	178.3	67.5	0	0	0	0	112.1	H211 S215 D219	H211-S217 PolarHBondContact CE1-O 3.35Å; S215-S217 PolarHBondContact O-N 3.18Å; S215-S217 VanDerWaalsContact O-N 3.08Å; S217-D219 PolarHBondContact O-N 3.38Å
218	S	68.3	Low	80.3	Confident	32 Å²	32	53.9 Å²	53.9	22%	0.224	31%	0.311	C	S	.	.			trans	-76.5	116.3	-176.8	169.9	0	0	0	0	111.4	W213 S215 I220	W213-S218 WeakPolarHBondContact CA-OG 3.44Å; W213-S218 WeakPolarHBondContact O-CB 3.35Å; W213-S218 PolarHBondContact O-OG 3.14Å; S215-S218 WeakPolarHBondContact O-CB 3.24Å; S215-S218 PolarHBondContact O-N 3Å; S218-I220 WeakPolarHBondContact OG-CB 3.47Å; S218-I220 PolarHBondContact OG-N 2.96Å
219	D	67.9	Low	80.3	Confident	148 Å²	148	53.2 Å²	53.2	79%	0.791	31%	0.309	S	S	*	.			trans	-85.9	7.9	168.8	-64.5	-35.2	0	0	0	112.4	S217 P221	S217-D219 PolarHBondContact O-N 3.38Å; D219-P221 WeakPolarHBondContact O-CD 3.37Å
220	I	75.4	Confident	80.4	Confident	19 Å²	19	48.8 Å²	48.8	10%	0.097	29%	0.286	C	S	.	.			trans	-67.7	124.9	-177.1	-64.4	172.8	0	0	0	110.1	W213 S218 M224 Y363	W213-I220 HydrophobicContact CB-CB 4.25Å; W213-I220 HydrophobicContact CB-CD1 4.03Å; W213-I220 HydrophobicContact CB-CG2 4.05Å; S218-I220 WeakPolarHBondContact OG-CB 3.47Å; S218-I220 PolarHBondContact OG-N 2.96Å; I220-M224 HydrophobicContact CG2-CB 3.64Å; I220-M224 WeakPolarHBondContact CG2-O 3.41Å; I220-Y363 HydrophobicContact CD1-CD1 4.35Å; I220-Y363 HydrophobicContact CD1-CE1 4.22Å; I220-Y363 HydrophobicContact CG1-CD1 4.26Å; I220-Y363 HydrophobicContact CG1-CE1 3.74Å
221	P	73.3	Confident	80.4	Confident	45 Å²	45	50.1 Å²	50.1	29%	0.292	29%	0.292	S	S	.	.			trans	-56	148.5	179.4	-29.4	37.2	0	0	0	113.6	D219 D223 M224	D219-P221 WeakPolarHBondContact O-CD 3.37Å; P221-D223 WeakPolarHBondContact CB-OD1 3.28Å; P221-D223 PolarHBondContact O-N 2.94Å; P221-D223 VanDerWaalsContact O-N 3.13Å; P221-M224 HydrophobicContact CB-CG 4.3Å; P221-M224 HydrophobicContact CG-SD 4.21Å; P221-M224 WeakPolarHBondContact O-CA 3.48Å; P221-M224 PolarHBondContact O-N 3.07Å
222	P	68.9	Low	80.4	Confident	89 Å²	89	47.5 Å²	47.5	58%	0.578	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-61.9	-20.9	180	-24	33.6	0	0	0	115.2	M224 Q225	P222-M224 VanDerWaalsContact C-N 3.28Å; P222-Q225 WeakPolarHBondContact O-CG 3.34Å; P222-Q225 PolarHBondContact O-NE2 3.47Å
223	D	70.3	Confident	80.2	Confident	96 Å²	96	48.2 Å²	48.2	51%	0.513	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-80.2	-9.8	172.6	60.5	-48.2	0	0	0	113.1	P221	P221-D223 WeakPolarHBondContact CB-OD1 3.28Å; P221-D223 PolarHBondContact O-N 2.94Å; P221-D223 VanDerWaalsContact O-N 3.13Å
224	M	75.8	Confident	79.7	Confident	30 Å²	30	48.9 Å²	48.9	15%	0.148	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-107.7	26.6	177.9	-57.9	-172.6	-174.1	0	0	113.7	I220 P221 P222 S227 F359 P360 Y363	I220-M224 HydrophobicContact CG2-CB 3.64Å; I220-M224 WeakPolarHBondContact CG2-O 3.41Å; P221-M224 HydrophobicContact CB-CG 4.3Å; P221-M224 HydrophobicContact CG-SD 4.21Å; P221-M224 WeakPolarHBondContact O-CA 3.48Å; P221-M224 PolarHBondContact O-N 3.07Å; P222-M224 VanDerWaalsContact C-N 3.28Å; M224-S227 VanDerWaalsContact O-CB 3.29Å; M224-S227 WeakPolarHBondContact O-CB 3.21Å; M224-S227 PolarHBondContact O-N 3.22Å; M224-S227 PolarHBondContact O-OG 3.29Å; M224-F359 HydrophobicContact CB-CD1 4.1Å; M224-F359 HydrophobicContact CB-CE1 3.88Å; M224-F359 HydrophobicContact CG-CD1 3.9Å; M224-F359 HydrophobicContact CG-CE1 3.95Å; M224-F359 HydrophobicContact SD-CD1 4.44Å; M224-P360 HydrophobicContact CE-CG 3.81Å; M224-P360 HydrophobicContact SD-CG 4.49Å; M224-Y363 HydrophobicContact SD-CD2 4.05Å; M224-Y363 HydrophobicContact SD-CE2 4.3Å; M224-Y363 HydrophobicContact SD-CG 4.38Å
225	Q	80.2	Confident	78.6	Confident	73 Å²	73	53.7 Å²	53.7	34%	0.341	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	151.9	171.9	-70.6	175.9	11.6	0	0	111.6	P222 S227 I484	P222-Q225 WeakPolarHBondContact O-CG 3.34Å; P222-Q225 PolarHBondContact O-NE2 3.47Å; Q225-S227 VanDerWaalsContact C-N 3.3Å; Q225-I484 HydrophobicContact CB-CD1 4.22Å; Q225-I484 HydrophobicContact CB-CG1 4.41Å; Q225-I484 HydrophobicContact CB-CG2 4.13Å
226	C	84.7	Confident	77.2	Confident	19 Å²	19	53.6 Å²	53.6	13%	0.128	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	27.9	-168.3	-65.7	0	0	0	0	114.4	L366 I463 I484	C226-L366 WeakPolarHBondContact O-CD1 3.47Å; C226-L366 PolarHBondContact O-N 2.97Å; C226-I463 WeakPolarHBondContact SG-CD1 3.35Å; C226-I484 HydrophobicContact CB-CD1 4.47Å; C226-I484 WeakPolarHBondContact SG-CD1 3.38Å
227	S	88.4	Confident	76.4	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	164.5	173.7	77.6	0	0	0	0	112.8	W213 M224 Q225 W364	W213-S227 WeakPolarHBondContact CB-O 3.21Å; W213-S227 PolarHBondContact N-O 3.38Å; W213-S227 VanDerWaalsContact N-O 3.09Å; M224-S227 VanDerWaalsContact O-CB 3.29Å; M224-S227 WeakPolarHBondContact O-CB 3.21Å; M224-S227 PolarHBondContact O-N 3.22Å; M224-S227 PolarHBondContact O-OG 3.29Å; Q225-S227 VanDerWaalsContact C-N 3.3Å; S227-W364 CarbonylContact C-O 3.36Å; S227-W364 WeakPolarHBondContact CA-O 3.43Å; S227-W364 WeakPolarHBondContact CB-O 3.05Å
228	G	90.3	Very high	75.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	169.5	170	0	0	0	0	0	112.1	H211 W364	H211-G228 CarbonylContact O-C 3.48Å; H211-G228 WeakPolarHBondContact O-CA 3.31Å; G228-W364 PolarHBondContact N-O 3.03Å; G228-W364 WeakPolarHBondContact O-CB 3.24Å; G228-W364 PolarHBondContact O-N 3.35Å
229	T	91.6	Very high	74.3	Confident	11 Å²	11	59 Å²	59	7%	0.067	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	152.2	176.3	67.8	0	0	0	0	110.1	H211 P362 Y363	H211-T229 WeakPolarHBondContact CB-OG1 3.47Å; H211-T229 PolarHBondContact N-O 3.02Å; H211-T229 PolarHBondContact O-N 3.46Å; T229-P362 HydrophobicContact CG2-CB 4.45Å; T229-P362 HydrophobicContact CG2-CG 4Å; T229-Y363 HydrophobicContact CG2-CD1 3.54Å; T229-Y363 HydrophobicContact CG2-CE1 3.63Å; T229-Y363 HydrophobicContact CG2-CG 4.33Å
230	I	93.1	Very high	73.2	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.6	-179.8	-50.6	165.7	0	0	0	107.1	F208 Y210 F281 L282 V339 F348 W364	F208-I230 HydrophobicContact CB-CG2 3.9Å; F208-I230 HydrophobicContact CD1-CG2 3.96Å; F208-I230 HydrophobicContact CG-CG2 3.91Å; Y210-I230 HydrophobicContact CD1-CG1 4.34Å; Y210-I230 HydrophobicContact CD1-CG2 4.37Å; Y210-I230 HydrophobicContact CE1-CG2 4.33Å; I230-F281 CarbonylContact O-C 3.49Å; I230-F281 WeakPolarHBondContact O-CA 3.48Å; I230-L282 HydrophobicContact CB-CB 4.33Å; I230-L282 HydrophobicContact CB-CD1 3.97Å; I230-L282 HydrophobicContact CB-CG 4.31Å; I230-L282 HydrophobicContact CD1-CD1 4.25Å; I230-L282 HydrophobicContact CG2-CD1 3.54Å; I230-L282 HydrophobicContact CG2-CG 4.12Å; I230-L282 PolarHBondContact O-N 3.32Å; I230-V339 HydrophobicContact CD1-CB 3.8Å; I230-V339 HydrophobicContact CD1-CG1 4.15Å; I230-V339 HydrophobicContact CD1-CG2 3.83Å; I230-V339 HydrophobicContact CG2-CG1 4.49Å; I230-F348 HydrophobicContact CD1-CB 3.73Å; I230-F348 HydrophobicContact CD1-CD1 4.4Å; I230-F348 HydrophobicContact CD1-CD2 3.95Å; I230-F348 HydrophobicContact CD1-CG 3.79Å; I230-F348 HydrophobicContact CG1-CD1 4.47Å; I230-F348 HydrophobicContact CG1-CD2 4.12Å; I230-F348 HydrophobicContact CG1-CE2 4.32Å; I230-F348 HydrophobicContact CG1-CG 4.17Å; I230-W364 HydrophobicContact CD1-CB 4.46Å; I230-W364 HydrophobicContact CD1-CD2 3.97Å; I230-W364 HydrophobicContact CD1-CE3 4.35Å; I230-W364 HydrophobicContact CD1-CG 3.97Å; I230-W364 HydrophobicContact CG1-CG 4.5Å
231	K	91.3	Very high	71.6	Confident	79 Å²	79	64.8 Å²	64.8	34%	0.343	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.8	176.5	-171.6	-175	176.5	-169.6	0	109.3	L209 T233 H280 F281	L209-K231 HydrophobicContact CB-CB 4.4Å; L209-K231 PolarHBondContact N-O 2.88Å; L209-K231 PolarHBondContact O-N 3.48Å; K231-T233 HydrophobicContact CD-CG2 4.17Å; K231-T233 HydrophobicContact CG-CG2 4.28Å; K231-H280 CarbonylContact C-O 3.44Å; K231-H280 VanDerWaalsContact CA-O 3.27Å; K231-H280 WeakPolarHBondContact CA-O 3.46Å; K231-H280 HydrophobicContact CD-CB 4.43Å; K231-H280 HydrophobicContact CG-CB 3.79Å; K231-H280 WeakPolarHBondContact CG-O 3.46Å; K231-F281 HydrophobicContact CB-CD1 4.02Å; K231-F281 HydrophobicContact CB-CE1 3.94Å; K231-F281 HydrophobicContact CG-CE1 4.41Å
232	V	89.9	Confident	70.4	Confident	4 Å²	4	64.8 Å²	64.8	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.4	171.8	-170.7	0	0	0	0	108.6	H206 S207 F208 L273 C275 H280 L282	H206-V232 HydrophobicContact CB-CG1 3.99Å; S207-V232 WeakPolarHBondContact O-CA 3.39Å; F208-V232 HydrophobicContact CD1-CG2 4.04Å; F208-V232 HydrophobicContact CE1-CG2 3.9Å; V232-L273 HydrophobicContact CG1-CD1 4.08Å; V232-C275 VanDerWaalsContact CG2-SG 3.51Å; V232-H280 PolarHBondContact N-O 2.93Å; V232-L282 HydrophobicContact CG2-CD2 3.52Å; V232-L282 HydrophobicContact CG2-CG 3.88Å
233	T	85.7	Confident	69.5	Low	21 Å²	21	67.1 Å²	67.1	13%	0.129	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	154.3	177.2	57.4	0	0	0	0	109.9	H206 S207 L209 K231	H206-T233 CarbonylContact C-O 3.58Å; H206-T233 WeakPolarHBondContact CA-O 3.38Å; S207-T233 PolarHBondContact N-O 3.2Å; S207-T233 PolarHBondContact O-N 3.4Å; S207-T233 PolarHBondContact OG-OG1 3.35Å; L209-T233 HydrophobicContact CB-CG2 4.33Å; K231-T233 HydrophobicContact CD-CG2 4.17Å; K231-T233 HydrophobicContact CG-CG2 4.28Å
234	M	77.3	Confident	68.9	Low	43 Å²	43	65.6 Å²	65.6	21%	0.212	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	140	171.4	-63.7	-141.7	-59.9	0	0	111	P205 G236 E237	P205-M234 HydrophobicContact CG-SD 4.37Å; M234-G236 PolarHBondContact O-N 3.38Å; M234-G236 VanDerWaalsContact O-N 3.12Å; M234-E237 HydrophobicContact CB-CG 4.15Å; M234-E237 PolarHBondContact O-N 3.24Å
235	F	61	Low	67.6	Low	147 Å²	147	67.7 Å²	67.7	65%	0.645	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	118.6	167	-86	-77.5	0	0	0	109.2	P205	P205-F235 HydrophobicContact CB-CB 4.35Å; P205-F235 WeakPolarHBondContact O-CB 3.44Å; P205-F235 VanDerWaalsContact O-CD2 3.25Å; P205-F235 WeakPolarHBondContact O-CD2 3.34Å; P205-F235 PolarHBondContact O-N 3.27Å
236	G	53.5	Low	66.2	Low	42 Å²	42	68.4 Å²	68.4	43%	0.433	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.8	-4.1	176.7	0	0	0	0	0	116.8	M234 E239	M234-G236 PolarHBondContact O-N 3.38Å; M234-G236 VanDerWaalsContact O-N 3.12Å; G236-E239 PolarHBondContact O-N 2.91Å
237	E	51.9	Low	64.3	Low	120 Å²	120	69.8 Å²	69.8	56%	0.561	41%	0.409	S	S	*	.	S	Bend	trans	-71.8	-27.9	174.1	-80.4	-178.9	158.8	0	0	113.2	M234	M234-E237 HydrophobicContact CB-CG 4.15Å; M234-E237 PolarHBondContact O-N 3.24Å
238	D	43.5	Very low	62.4	Low	149 Å²	149	78 Å²	78	80%	0.797	45%	0.453	S	S	*	.	S	Bend	trans	-96.9	3.3	173.9	-81.6	-32.4	0	0	0	113.1	E240	D238-E240 PolarHBondContact O-N 3.48Å
239	E	45.9	Very low	60.5	Low	102 Å²	102	84 Å²	84	48%	0.477	48%	0.484	S	S	.	.			trans	-95.1	49.8	-179.9	-66	-166.7	151.8	0	0	113.4	G236 A241 H258	G236-E239 PolarHBondContact O-N 2.91Å; E239-A241 PolarHBondContact O-N 2.98Å; E239-A241 VanDerWaalsContact O-N 3.12Å; E239-H258 IonicContact OE2-CD2 3.91Å; E239-H258 IonicContact OE2-CE1 3.45Å; E239-H258 PolarHBondContact OE2-CE1 3.48Å; E239-H258 IonicContact OE2-NE2 2.64Å; E239-H258 PolarHBondContact OE2-NE2 2.83Å
240	E	44.3	Very low	58.5	Low	202 Å²	202	86.2 Å²	86.2	94%	0.944	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-2.9	153.1	-73.3	-169.3	157.3	0	0	111.9	D238	D238-E240 PolarHBondContact O-N 3.48Å
241	A	42.5	Very low	56.6	Low	87 Å²	87	95.2 Å²	95.2	72%	0.719	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	4.3	-178.7	0	0	0	0	0	115.7	E239 L243	E239-A241 PolarHBondContact O-N 2.98Å; E239-A241 VanDerWaalsContact O-N 3.12Å; A241-L243 PolarHBondContact O-N 3.36Å
242	C	49.4	Very low	54.6	Low	46 Å²	46	99.2 Å²	99.2	31%	0.311	58%	0.576	S	S	.	*			trans	-80.4	107.9	168.4	-165.1	0	0	0	0	111.1	C244 H258	C242-C244 WeakPolarHBondContact CB-SG 3.49Å; C242-C244 PolarHBondContact O-N 3.39Å; C242-C244 WeakPolarHBondContact SG-CB 3.46Å; C242-C244 PolarHBondContact SG-N 3.1Å; C242-C244 CovalentContact SG-SG 2.05Å; C242-C244 PolarHBondContact SG-SG 3.38Å; C242-H258 PolarHBondContact SG-CE1 2.88Å; C242-H258 PolarHBondContact SG-ND1 3.41Å
243	L	50.1	Low	52.9	Low	137 Å²	137	103.7 Å²	103.7	72%	0.717	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-62.1	-4.9	172.8	-66.4	169	0	0	0	113.7	A241 G245 S246	A241-L243 PolarHBondContact O-N 3.36Å; L243-G245 PolarHBondContact O-N 3.13Å; L243-S246 PolarHBondContact O-N 2.99Å; L243-S246 PolarHBondContact O-OG 3.16Å
244	C	56.5	Low	51.3	Low	65 Å²	65	108.7 Å²	108.7	44%	0.439	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-65.2	-18.4	-178.5	50.3	0	0	0	0	114.3	C242 H258	C242-C244 WeakPolarHBondContact CB-SG 3.49Å; C242-C244 PolarHBondContact O-N 3.39Å; C242-C244 WeakPolarHBondContact SG-CB 3.46Å; C242-C244 PolarHBondContact SG-N 3.1Å; C242-C244 CovalentContact SG-SG 2.05Å; C242-C244 PolarHBondContact SG-SG 3.38Å; C244-H258 PolarHBondContact SG-ND1 3.06Å
245	G	49	Very low	50.4	Low	73 Å²	73	108.8 Å²	108.8	75%	0.753	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-84.3	-14.3	169.4	0	0	0	0	0	115	L243	L243-G245 PolarHBondContact O-N 3.13Å
246	S	50	Low	50.1	Low	88 Å²	88	110.4 Å²	110.4	62%	0.615	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-18	-174.3	72.1	0	0	0	0	114.1	L243	L243-S246 PolarHBondContact O-N 2.99Å; L243-S246 PolarHBondContact O-OG 3.16Å
247	A	45.7	Very low	50	Low	48 Å²	48	115.8 Å²	115.8	40%	0.397	67%	0.666	S	S	.	*	S	Bend	trans	-98.1	110.8	173.1	0	0	0	0	0	108.7	L249	A247-L249 HydrophobicContact CB-CD1 3.96Å; A247-L249 HydrophobicContact CB-CG 4.16Å; A247-L249 PolarHBondContact O-N 3.27Å
248	N	48.1	Very low	50	Low	172 Å²	172	113 Å²	113	92%	0.92	65%	0.653	S	S	*	*			trans	-65.2	62.1	168.2	-73.5	-49.1	0	0	0	111
249	L	50.8	Low	50.1	Low	127 Å²	127	111.2 Å²	111.2	67%	0.665	64%	0.643	S	S	*	*			trans	-84.3	120.9	165.2	-67.2	159.1	0	0	0	105.3	A247 V253	A247-L249 HydrophobicContact CB-CD1 3.96Å; A247-L249 HydrophobicContact CB-CG 4.16Å; A247-L249 PolarHBondContact O-N 3.27Å; L249-V253 HydrophobicContact CB-CG2 3.64Å
250	G	49.1	Very low	50	Low	57 Å²	57	114 Å²	114	59%	0.588	65%	0.654	S	S	*	*			trans	-47.5	162.7	-169.7	0	0	0	0	0	114.6	D252 V253	G250-D252 PolarHBondContact O-N 3.37Å; G250-V253 WeakPolarHBondContact O-CG2 3.45Å; G250-V253 PolarHBondContact O-N 3.24Å
251	E	52.5	Low	49.8	Very low	190 Å²	190	110.2 Å²	110.2	89%	0.888	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-3.8	-166	-59.4	-172.8	154.8	0	0	116.9
252	D	50.1	Low	49.7	Very low	163 Å²	163	115.4 Å²	115.4	87%	0.872	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	5.1	-173.6	-92.9	-18.3	0	0	0	116.3	G250	G250-D252 PolarHBondContact O-N 3.37Å
253	V	53.9	Low	49.4	Very low	98 Å²	98	118.1 Å²	118.1	59%	0.594	66%	0.661	S	S	*	*			trans	-104.5	105.8	170.2	-89.6	0	0	0	0	111.4	L249 G250	L249-V253 HydrophobicContact CB-CG2 3.64Å; G250-V253 WeakPolarHBondContact O-CG2 3.45Å; G250-V253 PolarHBondContact O-N 3.24Å
254	L	52.7	Low	48.9	Very low	126 Å²	126	117 Å²	117	66%	0.66	66%	0.66	S	S	*	*			trans	-74.7	128.2	172.3	-65	167.3	0	0	0	109.5	L256 K260	L254-L256 PolarHBondContact O-N 2.88Å; L254-K260 HydrophobicContact CD2-CB 4.43Å
255	C	58.4	Low	48.4	Very low	45 Å²	45	121.7 Å²	121.7	30%	0.304	67%	0.672	S	S	.	*	B	Isolated β-bridge	trans	-67	120.8	167	-176.1	0	0	0	0	107.6	L257 H258	C255-L257 PolarHBondContact O-N 2.97Å; C255-H258 HydrophobicContact CB-CB 4.03Å; C255-H258 CarbonylContact O-C 3.44Å; C255-H258 PolarHBondContact O-N 3.22Å
256	L	54.6	Low	48.2	Very low	182 Å²	182	121.8 Å²	121.8	95%	0.953	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-9.9	177.7	-66.2	171.3	0	0	0	113.1	L254	L254-L256 PolarHBondContact O-N 2.88Å
257	L	51.3	Low	48.2	Very low	155 Å²	155	124 Å²	124	81%	0.812	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-21.1	175.1	-61.5	168.2	0	0	0	113.1	C255	C255-L257 PolarHBondContact O-N 2.97Å
258	H	50.8	Low	48.8	Very low	62 Å²	62	123.8 Å²	123.8	29%	0.287	65%	0.652	S	S	.	*	B	Isolated β-bridge	trans	-130	112.9	-178.7	-59.4	114.7	0	0	0	111.9	E239 C242 C244 C255 K260	E239-H258 IonicContact OE2-CD2 3.91Å; E239-H258 IonicContact OE2-CE1 3.45Å; E239-H258 PolarHBondContact OE2-CE1 3.48Å; E239-H258 IonicContact OE2-NE2 2.64Å; E239-H258 PolarHBondContact OE2-NE2 2.83Å; C242-H258 PolarHBondContact SG-CE1 2.88Å; C242-H258 PolarHBondContact SG-ND1 3.41Å; C244-H258 PolarHBondContact SG-ND1 3.06Å; C255-H258 HydrophobicContact CB-CB 4.03Å; C255-H258 CarbonylContact O-C 3.44Å; C255-H258 PolarHBondContact O-N 3.22Å; H258-K260 PolarHBondContact O-N 3.42Å
259	N	46.8	Very low	49.4	Very low	111 Å²	111	117.8 Å²	117.8	59%	0.594	62%	0.624	S	S	*	*			trans	-76.3	112.1	172.5	-167.6	-6.2	0	0	0	109.9	N261	N259-N261 PolarHBondContact O-N 2.55Å; N259-N261 WeakPolarHBondContact OD1-CB 3.34Å; N259-N261 PolarHBondContact OD1-N 2.87Å; N259-N261 VanDerWaalsContact OD1-N 3.15Å
260	K	42.5	Very low	49.9	Very low	160 Å²	160	113.4 Å²	113.4	70%	0.696	60%	0.603	S	S	*	*			trans	-71.7	2.2	176.9	-121.6	-177.9	-174.4	177.8	0	113.4	L254 H258 K262	L254-K260 HydrophobicContact CD2-CB 4.43Å; H258-K260 PolarHBondContact O-N 3.42Å; K260-K262 PolarHBondContact O-N 3.43Å
261	N	40.4	Very low	50.6	Low	122 Å²	122	114.5 Å²	114.5	65%	0.652	60%	0.595	S	S	*	*	S	Bend	trans	-68.6	104.8	162.9	-76.6	-13.1	0	0	0	107.1	N259 V263	N259-N261 PolarHBondContact O-N 2.55Å; N259-N261 WeakPolarHBondContact OD1-CB 3.34Å; N259-N261 PolarHBondContact OD1-N 2.87Å; N259-N261 VanDerWaalsContact OD1-N 3.15Å; N261-V263 PolarHBondContact O-N 2.78Å
262	K	40.6	Very low	51.6	Low	197 Å²	197	111 Å²	111	86%	0.857	58%	0.579	S	S	*	*			trans	-18.9	99.6	170.3	-74.9	177.2	176	176.3	0	110	K260 V264	K260-K262 PolarHBondContact O-N 3.43Å; K262-V264 VanDerWaalsContact C-N 3.28Å; K262-V264 PolarHBondContact O-N 2.91Å
263	V	42.7	Very low	53	Low	103 Å²	103	103.7 Å²	103.7	62%	0.624	54%	0.54	S	S	*	.			trans	-55.4	108.9	164.9	-179.9	0	0	0	0	102.8	N261 K265	N261-V263 PolarHBondContact O-N 2.78Å; V263-K265 VanDerWaalsContact C-N 3.28Å; V263-K265 PolarHBondContact O-N 3Å
264	V	41.1	Very low	54.6	Low	113 Å²	113	99.8 Å²	99.8	69%	0.685	52%	0.515	S	S	*	.			trans	-54.7	108.8	170.7	174.7	0	0	0	0	102.6	K262 V266	K262-V264 VanDerWaalsContact C-N 3.28Å; K262-V264 PolarHBondContact O-N 2.91Å; V264-V266 HydrophobicContact CB-CG2 4.32Å; V264-V266 HydrophobicContact CG1-CG2 3.74Å; V264-V266 PolarHBondContact O-N 3.05Å
265	K	44.7	Very low	56.2	Low	163 Å²	163	93.8 Å²	93.8	71%	0.709	48%	0.484	S	S	*	.			trans	-63	81.9	167.6	-84.2	-172.2	174.1	-172.3	0	105.1	V263 N267	V263-K265 VanDerWaalsContact C-N 3.28Å; V263-K265 PolarHBondContact O-N 3Å; K265-N267 PolarHBondContact O-N 3.04Å
266	V	45.6	Very low	57.5	Low	75 Å²	75	93.2 Å²	93.2	46%	0.455	48%	0.48	S	S	.	.			trans	-70.2	85.1	158.5	-170.7	0	0	0	0	102.3	V264 R268	V264-V266 HydrophobicContact CB-CG2 4.32Å; V264-V266 HydrophobicContact CG1-CG2 3.74Å; V264-V266 PolarHBondContact O-N 3.05Å; V266-R268 HydrophobicContact CB-CG 4.35Å; V266-R268 HydrophobicContact CG1-CG 3.61Å; V266-R268 PolarHBondContact O-N 3.17Å
267	N	49.7	Very low	58.8	Low	135 Å²	135	88.6 Å²	88.6	72%	0.722	46%	0.463	S	S	*	.			trans	-64.5	83.1	169.8	-84.8	-11.8	0	0	0	105.8	K265	K265-N267 PolarHBondContact O-N 3.04Å
268	R	59.3	Low	59.9	Low	44 Å²	44	85 Å²	85	17%	0.166	46%	0.464	C	S	.	.			trans	-70.8	138.4	174.5	-67.5	-167.6	-178.8	160.3	9	107.9	E168 V169 V266 E272	E168-R268 PolarHBondContact O-NH1 3.49Å; E168-R268 PolarHBondContact O-NH2 2.87Å; V169-R268 PolarHBondContact O-NH1 3.43Å; V266-R268 HydrophobicContact CB-CG 4.35Å; V266-R268 HydrophobicContact CG1-CG 3.61Å; V266-R268 PolarHBondContact O-N 3.17Å; R268-E272 HydrophobicContact CB-CB 4.36Å; R268-E272 WeakPolarHBondContact CB-OE2 3.31Å; R268-E272 WeakPolarHBondContact CG-OE2 3.46Å
269	S	61	Low	61.5	Low	45 Å²	45	84.5 Å²	84.5	32%	0.315	47%	0.465	S	S	.	.			trans	-64.1	144	170	63.1	0	0	0	0	108.8	D271 E272	S269-D271 PolarHBondContact O-N 3.32Å; S269-D271 VanDerWaalsContact O-N 3.08Å; S269-E272 PolarHBondContact N-OE1 3.19Å; S269-E272 WeakPolarHBondContact O-CB 3.46Å; S269-E272 PolarHBondContact O-N 2.86Å; S269-E272 VanDerWaalsContact OG-CD 3.3Å; S269-E272 WeakPolarHBondContact OG-CG 3.39Å; S269-E272 PolarHBondContact OG-OE1 3.46Å
270	P	60.6	Low	63.4	Low	36 Å²	36	83.7 Å²	83.7	23%	0.234	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-54.5	-28.6	176	-25.8	33.3	0	0	0	113.4	E272 L273 C275 T279	P270-E272 VanDerWaalsContact C-N 3.3Å; P270-E272 PolarHBondContact O-N 2.85Å; P270-L273 CarbonylContact O-C 3.6Å; P270-L273 PolarHBondContact O-N 3.41Å; P270-L273 VanDerWaalsContact O-N 3.12Å; P270-C275 HydrophobicContact CB-CB 3.93Å; P270-C275 VanDerWaalsContact O-CB 3.24Å; P270-C275 WeakPolarHBondContact O-CB 3.42Å; P270-C275 PolarHBondContact O-N 3.14Å; P270-T279 WeakPolarHBondContact CB-O 3.47Å
271	D	63.3	Low	65.7	Low	79 Å²	79	79.3 Å²	79.3	42%	0.422	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-64.7	-31	176	-60.9	-28.1	0	0	0	112.3	S269 L273 L274 S277	S269-D271 PolarHBondContact O-N 3.32Å; S269-D271 VanDerWaalsContact O-N 3.08Å; D271-L273 VanDerWaalsContact C-N 3.27Å; D271-L273 PolarHBondContact O-N 2.96Å; D271-L274 PolarHBondContact O-N 2.9Å; D271-S277 WeakPolarHBondContact OD1-CA 3.49Å; D271-S277 PolarHBondContact OD1-OG 3.37Å; D271-S277 VanDerWaalsContact OD1-OG 3.07Å
272	E	73.7	Confident	68.2	Low	116 Å²	116	73.5 Å²	73.5	54%	0.542	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-69.9	-23.8	174.1	-74	158.2	-133.7	0	0	112.7	R268 S269 P270 L274	R268-E272 HydrophobicContact CB-CB 4.36Å; R268-E272 WeakPolarHBondContact CB-OE2 3.31Å; R268-E272 WeakPolarHBondContact CG-OE2 3.46Å; S269-E272 PolarHBondContact N-OE1 3.19Å; S269-E272 WeakPolarHBondContact O-CB 3.46Å; S269-E272 PolarHBondContact O-N 2.86Å; S269-E272 VanDerWaalsContact OG-CD 3.3Å; S269-E272 WeakPolarHBondContact OG-CG 3.39Å; S269-E272 PolarHBondContact OG-OE1 3.46Å; P270-E272 VanDerWaalsContact C-N 3.3Å; P270-E272 PolarHBondContact O-N 2.85Å; E272-L274 VanDerWaalsContact C-N 3.35Å
273	L	79.6	Confident	70.5	Confident	11 Å²	11	64.1 Å²	64.1	6%	0.058	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-98.6	19.9	178.3	-63.8	170.8	0	0	0	112.4	M171 P203 H206 V232 P270 D271 C275 L282	M171-L273 HydrophobicContact CE-CB 4.3Å; M171-L273 HydrophobicContact CE-CD2 4.41Å; M171-L273 WeakPolarHBondContact CE-O 3.46Å; P203-L273 HydrophobicContact CG-CD2 4.22Å; H206-L273 VanDerWaalsContact CD2-CD1 3.45Å; H206-L273 WeakPolarHBondContact CD2-CD1 3.43Å; H206-L273 WeakPolarHBondContact NE2-CD1 3.24Å; V232-L273 HydrophobicContact CG1-CD1 4.08Å; P270-L273 CarbonylContact O-C 3.6Å; P270-L273 PolarHBondContact O-N 3.41Å; P270-L273 VanDerWaalsContact O-N 3.12Å; D271-L273 VanDerWaalsContact C-N 3.27Å; D271-L273 PolarHBondContact O-N 2.96Å; L273-C275 PolarHBondContact O-N 3.24Å; L273-L282 WeakPolarHBondContact O-CD2 3.25Å
274	L	86.6	Confident	72.7	Confident	15 Å²	15	59.8 Å²	59.8	8%	0.079	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	27.6	179.2	-45.4	177.6	0	0	0	113.3	M171 D271 E272 L282 A283 Q286 I287 W290	M171-L274 HydrophobicContact CE-CB 4.42Å; M171-L274 HydrophobicContact CE-CD1 4.14Å; M171-L274 HydrophobicContact CE-CG 4.08Å; M171-L274 HydrophobicContact CG-CD1 3.71Å; M171-L274 HydrophobicContact CG-CG 4.39Å; D271-L274 PolarHBondContact O-N 2.9Å; E272-L274 VanDerWaalsContact C-N 3.35Å; L274-L282 HydrophobicContact CB-CD2 4.44Å; L274-A283 PolarHBondContact O-N 3.09Å; L274-Q286 HydrophobicContact CB-CB 4.13Å; L274-Q286 HydrophobicContact CD2-CB 4.5Å; L274-I287 HydrophobicContact CB-CG1 3.82Å; L274-I287 HydrophobicContact CD1-CG1 3.82Å; L274-I287 HydrophobicContact CG-CG1 4.46Å; L274-W290 HydrophobicContact CD1-CB 4.03Å; L274-W290 HydrophobicContact CD1-CD2 3.76Å; L274-W290 HydrophobicContact CD1-CE3 3.83Å; L274-W290 HydrophobicContact CD1-CG 3.83Å; L274-W290 HydrophobicContact CD2-CB 3.67Å; L274-W290 HydrophobicContact CD2-CG 3.99Å
275	C	88.2	Confident	74.8	Confident	1 Å²	1	59 Å²	59	1%	0.007	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-87.2	161.1	176	-61	0	0	0	0	111.9	V232 P270 L273 T279 F281	V232-C275 VanDerWaalsContact CG2-SG 3.51Å; P270-C275 HydrophobicContact CB-CB 3.93Å; P270-C275 VanDerWaalsContact O-CB 3.24Å; P270-C275 WeakPolarHBondContact O-CB 3.42Å; P270-C275 PolarHBondContact O-N 3.14Å; L273-C275 PolarHBondContact O-N 3.24Å; C275-T279 WeakPolarHBondContact CB-O 3.3Å; C275-F281 CarbonylContact C-O 3.6Å; C275-F281 WeakPolarHBondContact CA-O 3.43Å; C275-F281 VanDerWaalsContact CB-O 3.29Å; C275-F281 WeakPolarHBondContact CB-O 3.46Å
276	S	85.7	Confident	76.9	Confident	32 Å²	32	53.7 Å²	53.7	22%	0.224	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-68.9	138.6	171.7	-52.2	0	0	0	0	109.4	G278 T279 F281 A283	S276-G278 PolarHBondContact O-N 3.04Å; S276-T279 WeakPolarHBondContact CB-OG1 3.41Å; S276-T279 WeakPolarHBondContact O-CA 3.38Å; S276-T279 PolarHBondContact O-N 3.2Å; S276-T279 VanDerWaalsContact O-O 3.14Å; S276-T279 PolarHBondContact O-OG1 2.93Å; S276-F281 PolarHBondContact N-O 3.25Å; S276-A283 VanDerWaalsContact OG-CB 3.25Å; S276-A283 WeakPolarHBondContact OG-CB 3.35Å
277	S	80.3	Confident	79	Confident	85 Å²	85	50.1 Å²	50.1	59%	0.594	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	126.4	-173.8	-57.3	0	0	0	0	112.8	D271 T279	D271-S277 WeakPolarHBondContact OD1-CA 3.49Å; D271-S277 PolarHBondContact OD1-OG 3.37Å; D271-S277 VanDerWaalsContact OD1-OG 3.07Å; S277-T279 VanDerWaalsContact C-N 3.27Å; S277-T279 PolarHBondContact O-N 3.23Å
278	G	75.3	Confident	80.8	Confident	80 Å²	80	44.7 Å²	44.7	83%	0.825	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	6.7	-178.3	0	0	0	0	0	115.1	S276	S276-G278 PolarHBondContact O-N 3.04Å
279	T	84.3	Confident	82.2	Confident	51 Å²	51	50.6 Å²	50.6	31%	0.313	28%	0.281	S	S	.	.	S	Bend	trans	-129.1	166.5	176.4	79.4	0	0	0	0	111.1	P270 C275 S276 S277 F281	P270-T279 WeakPolarHBondContact CB-O 3.47Å; C275-T279 WeakPolarHBondContact CB-O 3.3Å; S276-T279 WeakPolarHBondContact CB-OG1 3.41Å; S276-T279 WeakPolarHBondContact O-CA 3.38Å; S276-T279 PolarHBondContact O-N 3.2Å; S276-T279 VanDerWaalsContact O-O 3.14Å; S276-T279 PolarHBondContact O-OG1 2.93Å; S277-T279 VanDerWaalsContact C-N 3.27Å; S277-T279 PolarHBondContact O-N 3.23Å; T279-F281 PolarHBondContact OG1-N 3.42Å
280	H	87.1	Confident	83.6	Confident	95 Å²	95	50.5 Å²	50.5	44%	0.44	27%	0.273	S	S	.	.	S	Bend	trans	-99.2	13.6	173	-65.7	-83.3	0	0	0	112.7	K231 V232	K231-H280 CarbonylContact C-O 3.44Å; K231-H280 VanDerWaalsContact CA-O 3.27Å; K231-H280 WeakPolarHBondContact CA-O 3.46Å; K231-H280 HydrophobicContact CD-CB 4.43Å; K231-H280 HydrophobicContact CG-CB 3.79Å; K231-H280 WeakPolarHBondContact CG-O 3.46Å; V232-H280 PolarHBondContact N-O 2.93Å
281	F	90.8	Very high	85.1	Confident	68 Å²	68	48.9 Å²	48.9	30%	0.298	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-91.1	135.9	179.6	-69.3	-74.5	0	0	0	110.8	I230 K231 C275 S276 T279 A283 P362	I230-F281 CarbonylContact O-C 3.49Å; I230-F281 WeakPolarHBondContact O-CA 3.48Å; K231-F281 HydrophobicContact CB-CD1 4.02Å; K231-F281 HydrophobicContact CB-CE1 3.94Å; K231-F281 HydrophobicContact CG-CE1 4.41Å; C275-F281 CarbonylContact C-O 3.6Å; C275-F281 WeakPolarHBondContact CA-O 3.43Å; C275-F281 VanDerWaalsContact CB-O 3.29Å; C275-F281 WeakPolarHBondContact CB-O 3.46Å; S276-F281 PolarHBondContact N-O 3.25Å; T279-F281 PolarHBondContact OG1-N 3.42Å; F281-A283 PolarHBondContact O-N 3.1Å; F281-P362 HydrophobicContact CB-CB 3.77Å; F281-P362 HydrophobicContact CG-CB 4.14Å; F281-P362 HydrophobicContact CG-CG 4.41Å
282	L	91.7	Very high	86.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-62.3	128.8	175	-72.6	-177.3	0	0	0	111.1	F200 F208 I230 V232 L273 L274 I287 V339 W364	F200-L282 HydrophobicContact CE2-CD1 4.49Å; F208-L282 HydrophobicContact CD1-CD1 4.13Å; F208-L282 HydrophobicContact CE1-CD1 3.66Å; F208-L282 HydrophobicContact CE1-CD2 4.26Å; F208-L282 HydrophobicContact CE1-CG 4.29Å; F208-L282 HydrophobicContact CZ-CD1 3.89Å; I230-L282 HydrophobicContact CB-CB 4.33Å; I230-L282 HydrophobicContact CB-CD1 3.97Å; I230-L282 HydrophobicContact CB-CG 4.31Å; I230-L282 HydrophobicContact CD1-CD1 4.25Å; I230-L282 HydrophobicContact CG2-CD1 3.54Å; I230-L282 HydrophobicContact CG2-CG 4.12Å; I230-L282 PolarHBondContact O-N 3.32Å; V232-L282 HydrophobicContact CG2-CD2 3.52Å; V232-L282 HydrophobicContact CG2-CG 3.88Å; L273-L282 WeakPolarHBondContact O-CD2 3.25Å; L274-L282 HydrophobicContact CB-CD2 4.44Å; L282-I287 HydrophobicContact CB-CD1 3.87Å; L282-I287 HydrophobicContact CD1-CD1 4.01Å; L282-I287 HydrophobicContact CD2-CD1 4.17Å; L282-I287 HydrophobicContact CG-CD1 4.25Å; L282-V339 HydrophobicContact CD1-CG2 4.07Å; L282-W364 HydrophobicContact CB-CZ2 4.25Å; L282-W364 PolarHBondContact O-NE1 2.9Å; L282-W364 VanDerWaalsContact O-NE1 3.17Å
283	A	89.8	Confident	87.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-97.6	133.3	178.3	0	0	0	0	0	110.4	L274 S276 F281 D285 Q286 I287	L274-A283 PolarHBondContact O-N 3.09Å; S276-A283 VanDerWaalsContact OG-CB 3.25Å; S276-A283 WeakPolarHBondContact OG-CB 3.35Å; F281-A283 PolarHBondContact O-N 3.1Å; A283-D285 VanDerWaalsContact C-N 3.34Å; A283-D285 WeakPolarHBondContact CB-OD1 3.31Å; A283-Q286 HydrophobicContact CB-CB 4.13Å; A283-Q286 HydrophobicContact CB-CG 3.82Å; A283-I287 WeakPolarHBondContact O-CG1 3.46Å; A283-I287 PolarHBondContact O-N 3.48Å
284	K	88	Confident	87.7	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-67.7	-40.4	-177.6	-69.8	175.6	-157.3	173.4	0	110.9	Q286 I287 M288 S358 F359 D361 Y363 W364	K284-Q286 PolarHBondContact O-N 2.83Å; K284-I287 PolarHBondContact O-N 2.93Å; K284-M288 VanDerWaalsContact O-CB 3.3Å; K284-M288 WeakPolarHBondContact O-CB 3.43Å; K284-M288 WeakPolarHBondContact O-CG 3.49Å; K284-M288 PolarHBondContact O-N 2.95Å; K284-S358 PolarHBondContact NZ-OG 2.68Å; K284-F359 PolarHBondContact NZ-O 2.89Å; K284-D361 WeakPolarHBondContact CB-OD1 3.16Å; K284-D361 WeakPolarHBondContact CD-OD1 3.22Å; K284-D361 WeakPolarHBondContact CE-OD1 3.42Å; K284-D361 WeakPolarHBondContact CG-OD1 3.29Å; K284-D361 PolarHBondContact N-OD2 3.42Å; K284-D361 IonicContact NZ-OD1 3.5Å; K284-Y363 WeakPolarHBondContact CE-O 3.46Å; K284-Y363 PolarHBondContact NZ-O 3.05Å; K284-W364 HydrophobicContact CB-CH2 4.34Å; K284-W364 HydrophobicContact CB-CZ2 4.1Å; K284-W364 HydrophobicContact CG-CD2 4.02Å; K284-W364 HydrophobicContact CG-CE3 4.37Å; K284-W364 HydrophobicContact CG-CH2 3.75Å; K284-W364 HydrophobicContact CG-CZ2 3.36Å; K284-W364 HydrophobicContact CG-CZ3 4.27Å
285	D	86	Confident	87.9	Confident	95 Å²	95	44.9 Å²	44.9	51%	0.508	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-43.9	179.6	68.8	-37.3	0	0	0	112	A283 M288 R289	A283-D285 VanDerWaalsContact C-N 3.34Å; A283-D285 WeakPolarHBondContact CB-OD1 3.31Å; D285-M288 PolarHBondContact O-N 2.84Å; D285-R289 VanDerWaalsContact O-CB 3.3Å; D285-R289 WeakPolarHBondContact O-CB 3.28Å; D285-R289 PolarHBondContact O-N 2.85Å
286	Q	88.9	Confident	88.1	Confident	53 Å²	53	47.8 Å²	47.8	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-45.5	177.1	-62.6	-59.5	-21.5	0	0	111.3	L274 A283 K284 R289 W290	L274-Q286 HydrophobicContact CB-CB 4.13Å; L274-Q286 HydrophobicContact CD2-CB 4.5Å; A283-Q286 HydrophobicContact CB-CB 4.13Å; A283-Q286 HydrophobicContact CB-CG 3.82Å; K284-Q286 PolarHBondContact O-N 2.83Å; Q286-R289 PolarHBondContact O-N 2.84Å; Q286-W290 VanDerWaalsContact O-CB 3.32Å; Q286-W290 WeakPolarHBondContact O-CB 3.42Å; Q286-W290 PolarHBondContact O-N 2.96Å
287	I	90.1	Very high	88.4	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-44.2	177.9	-72.5	162.6	0	0	0	111.2	F200 L274 L282 A283 K284 R289 W290 F291 P337 W364	F200-I287 HydrophobicContact CE1-CG2 4.09Å; F200-I287 HydrophobicContact CE2-CD1 4.33Å; F200-I287 HydrophobicContact CZ-CD1 3.73Å; F200-I287 HydrophobicContact CZ-CG1 4.17Å; F200-I287 HydrophobicContact CZ-CG2 4.04Å; L274-I287 HydrophobicContact CB-CG1 3.82Å; L274-I287 HydrophobicContact CD1-CG1 3.82Å; L274-I287 HydrophobicContact CG-CG1 4.46Å; L282-I287 HydrophobicContact CB-CD1 3.87Å; L282-I287 HydrophobicContact CD1-CD1 4.01Å; L282-I287 HydrophobicContact CD2-CD1 4.17Å; L282-I287 HydrophobicContact CG-CD1 4.25Å; A283-I287 WeakPolarHBondContact O-CG1 3.46Å; A283-I287 PolarHBondContact O-N 3.48Å; K284-I287 PolarHBondContact O-N 2.93Å; I287-R289 PolarHBondContact O-N 3Å; I287-W290 PolarHBondContact O-N 3.37Å; I287-F291 VanDerWaalsContact O-CB 3.22Å; I287-F291 WeakPolarHBondContact O-CB 3.4Å; I287-F291 PolarHBondContact O-N 3.41Å; I287-P337 HydrophobicContact CG2-CB 4.16Å; I287-P337 HydrophobicContact CG2-CG 4.09Å; I287-W364 HydrophobicContact CB-CH2 4.22Å; I287-W364 HydrophobicContact CD1-CH2 3.32Å; I287-W364 HydrophobicContact CD1-CZ2 3.45Å; I287-W364 VanDerWaalsContact CD1-CZ2 3.45Å; I287-W364 HydrophobicContact CD1-CZ3 4.46Å; I287-W364 HydrophobicContact CG1-CH2 4.35Å; I287-W364 HydrophobicContact CG2-CH2 4.27Å
288	M	87.5	Confident	89.1	Confident	21 Å²	21	48 Å²	48	10%	0.103	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-43.6	178.9	-70.3	-63.3	-80.1	0	0	111	K284 D285 F291 Q292 D316 A318 P337 S350 Y351	K284-M288 VanDerWaalsContact O-CB 3.3Å; K284-M288 WeakPolarHBondContact O-CB 3.43Å; K284-M288 WeakPolarHBondContact O-CG 3.49Å; K284-M288 PolarHBondContact O-N 2.95Å; D285-M288 PolarHBondContact O-N 2.84Å; M288-F291 PolarHBondContact O-N 2.95Å; M288-Q292 WeakPolarHBondContact O-CB 3.33Å; M288-Q292 PolarHBondContact O-N 3.42Å; M288-D316 VanDerWaalsContact CE-O 3.3Å; M288-D316 WeakPolarHBondContact CE-O 3.29Å; M288-A318 HydrophobicContact CB-CB 4.2Å; M288-A318 HydrophobicContact CE-CB 3.68Å; M288-A318 WeakPolarHBondContact O-CB 3.4Å; M288-A318 HydrophobicContact SD-CB 3.88Å; M288-P337 HydrophobicContact SD-CG 4.05Å; M288-S350 PolarHBondContact SD-OG 2.97Å; M288-Y351 HydrophobicContact CE-CD1 3.31Å; M288-Y351 HydrophobicContact CE-CE1 3.39Å; M288-Y351 HydrophobicContact CE-CG 4.3Å; M288-Y351 HydrophobicContact SD-CD1 3.85Å; M288-Y351 HydrophobicContact SD-CE1 4.01Å
289	R	88.1	Confident	90	Very high	168 Å²	168	46 Å²	46	63%	0.634	22%	0.216	S	C	*	.	H	α-helix	trans	-62.3	-49.2	175.5	-178.8	177.4	179.8	161.9	-0.5	112.1	D285 Q286 I287 F291 Q292 I293	D285-R289 VanDerWaalsContact O-CB 3.3Å; D285-R289 WeakPolarHBondContact O-CB 3.28Å; D285-R289 PolarHBondContact O-N 2.85Å; Q286-R289 PolarHBondContact O-N 2.84Å; I287-R289 PolarHBondContact O-N 3Å; R289-F291 PolarHBondContact O-N 3.42Å; R289-Q292 PolarHBondContact O-N 2.72Å; R289-I293 HydrophobicContact CG-CD1 3.99Å; R289-I293 VanDerWaalsContact O-CG1 3.3Å; R289-I293 WeakPolarHBondContact O-CG1 3.4Å; R289-I293 PolarHBondContact O-N 2.71Å; R289-I293 VanDerWaalsContact O-N 3.08Å
290	W	90.4	Very high	90.4	Very high	43 Å²	43	46.6 Å²	46.6	16%	0.163	23%	0.227	C	C	.	.	H	α-helix	trans	-57	-50.5	177.4	162.4	81.2	0	0	0	111	M171 V173 F200 L274 Q286 I287 Q292 I293 A294	M171-W290 HydrophobicContact CB-CH2 3.84Å; M171-W290 HydrophobicContact CB-CZ2 3.58Å; M171-W290 HydrophobicContact CG-CZ2 4.43Å; V173-W290 HydrophobicContact CG2-CH2 3.6Å; V173-W290 HydrophobicContact CG2-CZ2 4.05Å; F200-W290 HydrophobicContact CB-CH2 4.32Å; F200-W290 HydrophobicContact CG-CH2 4.49Å; F200-W290 HydrophobicContact CG-CZ3 4.39Å; L274-W290 HydrophobicContact CD1-CB 4.03Å; L274-W290 HydrophobicContact CD1-CD2 3.76Å; L274-W290 HydrophobicContact CD1-CE3 3.83Å; L274-W290 HydrophobicContact CD1-CG 3.83Å; L274-W290 HydrophobicContact CD2-CB 3.67Å; L274-W290 HydrophobicContact CD2-CG 3.99Å; Q286-W290 VanDerWaalsContact O-CB 3.32Å; Q286-W290 WeakPolarHBondContact O-CB 3.42Å; Q286-W290 PolarHBondContact O-N 2.96Å; I287-W290 PolarHBondContact O-N 3.37Å; W290-Q292 VanDerWaalsContact C-N 3.34Å; W290-Q292 PolarHBondContact O-N 3.02Å; W290-I293 PolarHBondContact O-N 3.28Å; W290-A294 WeakPolarHBondContact O-CB 3.3Å; W290-A294 PolarHBondContact O-N 3.11Å
291	F	91.4	Very high	90.7	Very high	1 Å²	1	44 Å²	44	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-39.9	-177.3	-167.6	-108	0	0	0	111.8	V198 I287 M288 R289 I293 A294 V295 A318 L335 P337	V198-F291 HydrophobicContact CB-CE2 4.43Å; V198-F291 HydrophobicContact CB-CZ 4.18Å; V198-F291 HydrophobicContact CG1-CE2 4.05Å; V198-F291 HydrophobicContact CG1-CZ 4.18Å; V198-F291 HydrophobicContact CG2-CZ 4.27Å; I287-F291 VanDerWaalsContact O-CB 3.22Å; I287-F291 WeakPolarHBondContact O-CB 3.4Å; I287-F291 PolarHBondContact O-N 3.41Å; M288-F291 PolarHBondContact O-N 2.95Å; R289-F291 PolarHBondContact O-N 3.42Å; F291-I293 PolarHBondContact O-N 2.73Å; F291-A294 PolarHBondContact O-N 3.23Å; F291-V295 HydrophobicContact CD1-CG2 4.03Å; F291-V295 HydrophobicContact CE1-CG2 3.74Å; F291-V295 HydrophobicContact CE2-CG2 4.26Å; F291-V295 HydrophobicContact CG-CG2 4.43Å; F291-V295 HydrophobicContact CZ-CG2 3.86Å; F291-V295 WeakPolarHBondContact O-CB 3.49Å; F291-V295 VanDerWaalsContact O-CG2 3.29Å; F291-V295 WeakPolarHBondContact O-CG2 3.35Å; F291-V295 PolarHBondContact O-N 3.47Å; F291-A318 HydrophobicContact CB-CB 4.41Å; F291-A318 HydrophobicContact CD1-CB 4.17Å; F291-L335 HydrophobicContact CE1-CB 3.85Å; F291-L335 HydrophobicContact CZ-CB 4.05Å; F291-P337 HydrophobicContact CB-CB 4.38Å; F291-P337 HydrophobicContact CB-CG 4.11Å; F291-P337 HydrophobicContact CD1-CB 4.23Å; F291-P337 HydrophobicContact CD1-CG 3.85Å; F291-P337 HydrophobicContact CD2-CB 3.91Å; F291-P337 HydrophobicContact CD2-CG 4.36Å; F291-P337 HydrophobicContact CE1-CG 4.35Å; F291-P337 HydrophobicContact CE2-CB 4.21Å; F291-P337 HydrophobicContact CG-CB 3.92Å; F291-P337 HydrophobicContact CG-CG 3.85Å; F291-P337 HydrophobicContact CZ-CB 4.49Å
292	Q	89.7	Confident	90.9	Very high	45 Å²	45	41.1 Å²	41.1	21%	0.21	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-44	176.5	-169.4	177.1	14	0	0	111.9	M288 R289 W290 T296 F312 A318	M288-Q292 WeakPolarHBondContact O-CB 3.33Å; M288-Q292 PolarHBondContact O-N 3.42Å; R289-Q292 PolarHBondContact O-N 2.72Å; W290-Q292 VanDerWaalsContact C-N 3.34Å; W290-Q292 PolarHBondContact O-N 3.02Å; Q292-T296 VanDerWaalsContact O-CB 3.32Å; Q292-T296 WeakPolarHBondContact O-CB 3.47Å; Q292-T296 PolarHBondContact O-N 2.85Å; Q292-T296 PolarHBondContact O-OG1 3.43Å; Q292-F312 HydrophobicContact CG-CD1 4.48Å; Q292-F312 HydrophobicContact CG-CE1 4.39Å; Q292-A318 HydrophobicContact CB-CB 3.78Å
293	I	89.6	Confident	91	Very high	78 Å²	78	43.3 Å²	43.3	40%	0.4	23%	0.229	S	C	.	.	H	α-helix	trans	-62.8	-45.6	176.8	-67.6	167.4	0	0	0	110	R289 W290 F291 T296 K297	R289-I293 HydrophobicContact CG-CD1 3.99Å; R289-I293 VanDerWaalsContact O-CG1 3.3Å; R289-I293 WeakPolarHBondContact O-CG1 3.4Å; R289-I293 PolarHBondContact O-N 2.71Å; R289-I293 VanDerWaalsContact O-N 3.08Å; W290-I293 PolarHBondContact O-N 3.28Å; F291-I293 PolarHBondContact O-N 2.73Å; I293-T296 PolarHBondContact O-N 2.88Å; I293-K297 HydrophobicContact CG2-CD 4.16Å; I293-K297 WeakPolarHBondContact O-CG 3.24Å; I293-K297 PolarHBondContact O-N 3.49Å
294	A	91.6	Very high	91.1	Very high	15 Å²	15	50.4 Å²	50.4	12%	0.124	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-49.8	179.8	0	0	0	0	0	111.7	L161 W290 F291 T296 K297 A298	L161-A294 HydrophobicContact CD1-CB 3.77Å; L161-A294 HydrophobicContact CG-CB 4.09Å; W290-A294 WeakPolarHBondContact O-CB 3.3Å; W290-A294 PolarHBondContact O-N 3.11Å; F291-A294 PolarHBondContact O-N 3.23Å; A294-T296 VanDerWaalsContact C-N 3.34Å; A294-T296 PolarHBondContact O-N 2.79Å; A294-K297 PolarHBondContact O-N 3.21Å; A294-A298 WeakPolarHBondContact O-CB 3.32Å; A294-A298 PolarHBondContact O-N 2.8Å
295	V	92.4	Very high	91.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-39.9	177.5	171.7	0	0	0	0	111.7	L157 L161 F291 A298 W299 F312 L321 L335	L157-V295 HydrophobicContact CD2-CG1 4.15Å; L161-V295 HydrophobicContact CD1-CG2 4.24Å; F291-V295 HydrophobicContact CD1-CG2 4.03Å; F291-V295 HydrophobicContact CE1-CG2 3.74Å; F291-V295 HydrophobicContact CE2-CG2 4.26Å; F291-V295 HydrophobicContact CG-CG2 4.43Å; F291-V295 HydrophobicContact CZ-CG2 3.86Å; F291-V295 WeakPolarHBondContact O-CB 3.49Å; F291-V295 VanDerWaalsContact O-CG2 3.29Å; F291-V295 WeakPolarHBondContact O-CG2 3.35Å; F291-V295 PolarHBondContact O-N 3.47Å; V295-A298 PolarHBondContact O-N 3.5Å; V295-W299 WeakPolarHBondContact O-CB 3.4Å; V295-W299 PolarHBondContact O-N 3.01Å; V295-F312 HydrophobicContact CG1-CE1 3.97Å; V295-F312 HydrophobicContact CG1-CZ 3.99Å; V295-L321 HydrophobicContact CG1-CD1 4.46Å; V295-L321 HydrophobicContact CG1-CD2 4.32Å; V295-L335 HydrophobicContact CG2-CD1 4.45Å
296	T	91.9	Very high	91.7	Very high	62 Å²	62	53.7 Å²	53.7	38%	0.38	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-44.8	177.8	-58.9	0	0	0	0	111.6	Q292 I293 A294 A300 F312	Q292-T296 VanDerWaalsContact O-CB 3.32Å; Q292-T296 WeakPolarHBondContact O-CB 3.47Å; Q292-T296 PolarHBondContact O-N 2.85Å; Q292-T296 PolarHBondContact O-OG1 3.43Å; I293-T296 PolarHBondContact O-N 2.88Å; A294-T296 VanDerWaalsContact C-N 3.34Å; A294-T296 PolarHBondContact O-N 2.79Å; T296-A300 PolarHBondContact O-N 3.12Å; T296-F312 VanDerWaalsContact OG1-CZ 3.26Å; T296-F312 WeakPolarHBondContact OG1-CZ 3.49Å
297	K	92.1	Very high	91.7	Very high	120 Å²	120	55.6 Å²	55.6	52%	0.522	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-45.5	176.4	-74.6	178.7	179.1	179.3	0	111.7	M164 I293 A294 W299 A300 G301	M164-K297 HydrophobicContact CE-CB 3.8Å; M164-K297 HydrophobicContact CE-CD 4.12Å; M164-K297 HydrophobicContact CE-CG 4.43Å; M164-K297 HydrophobicContact SD-CB 4.15Å; I293-K297 HydrophobicContact CG2-CD 4.16Å; I293-K297 WeakPolarHBondContact O-CG 3.24Å; I293-K297 PolarHBondContact O-N 3.49Å; A294-K297 PolarHBondContact O-N 3.21Å; K297-W299 VanDerWaalsContact C-N 3.33Å; K297-W299 PolarHBondContact O-N 3.21Å; K297-A300 WeakPolarHBondContact O-CB 3.09Å; K297-A300 PolarHBondContact O-N 2.91Å; K297-G301 PolarHBondContact O-N 3.14Å; K297-G301 VanDerWaalsContact O-N 3.09Å
298	A	93.7	Very high	91.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.9	-43.4	178.6	0	0	0	0	0	111.7	L157 S160 L161 A294 V295 G301 I302	L157-A298 HydrophobicContact CD1-CB 3.78Å; S160-A298 WeakPolarHBondContact OG-CA 3.26Å; S160-A298 PolarHBondContact OG-O 3.49Å; L161-A298 HydrophobicContact CB-CB 3.88Å; A294-A298 WeakPolarHBondContact O-CB 3.32Å; A294-A298 PolarHBondContact O-N 2.8Å; V295-A298 PolarHBondContact O-N 3.5Å; A298-G301 PolarHBondContact O-N 3.19Å; A298-I302 PolarHBondContact O-N 2.91Å
299	W	94.6	Very high	92.1	Very high	38 Å²	38	60.4 Å²	60.4	14%	0.144	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-44.1	174.9	172.6	-119.1	0	0	0	112	F153 L157 V295 K297 G301 I302 S303 Y306 F308 V310	F153-W299 AromaticContact CE2-CE3 3.94Å; F153-W299 HydrophobicContact CE2-CE3 3.94Å; F153-W299 AromaticContact CE2-CZ3 3.68Å; F153-W299 HydrophobicContact CE2-CZ3 3.68Å; F153-W299 HydrophobicContact CZ-CE3 4.16Å; F153-W299 HydrophobicContact CZ-CZ3 4.21Å; L157-W299 HydrophobicContact CD1-CB 4.01Å; V295-W299 WeakPolarHBondContact O-CB 3.4Å; V295-W299 PolarHBondContact O-N 3.01Å; K297-W299 VanDerWaalsContact C-N 3.33Å; K297-W299 PolarHBondContact O-N 3.21Å; W299-G301 PolarHBondContact O-N 3.28Å; W299-I302 HydrophobicContact CE3-CD1 4.42Å; W299-I302 HydrophobicContact CE3-CG1 3.94Å; W299-I302 HydrophobicContact CZ3-CG1 4.35Å; W299-I302 PolarHBondContact O-N 2.93Å; W299-I302 VanDerWaalsContact O-N 3.14Å; W299-S303 WeakPolarHBondContact O-CA 3.23Å; W299-S303 WeakPolarHBondContact O-CB 3.3Å; W299-S303 PolarHBondContact O-N 3.05Å; W299-Y306 HydrophobicContact CH2-CD2 4.38Å; W299-Y306 AromaticContact CZ3-CD2 3.82Å; W299-Y306 HydrophobicContact CZ3-CD2 3.82Å; W299-Y306 HydrophobicContact CZ3-CG 4.36Å; W299-F308 HydrophobicContact CH2-CD2 4.1Å; W299-F308 AromaticContact CH2-CE2 3.7Å; W299-F308 HydrophobicContact CH2-CE2 3.7Å; W299-F308 AromaticContact CZ3-CE2 3.98Å; W299-F308 HydrophobicContact CZ3-CE2 3.98Å; W299-V310 HydrophobicContact CD2-CB 4.16Å; W299-V310 HydrophobicContact CD2-CG2 4.04Å; W299-V310 HydrophobicContact CE3-CG2 4.12Å; W299-V310 HydrophobicContact CH2-CB 4.46Å; W299-V310 HydrophobicContact CH2-CG2 3.6Å; W299-V310 HydrophobicContact CZ2-CB 3.87Å; W299-V310 HydrophobicContact CZ2-CG2 3.49Å; W299-V310 VanDerWaalsContact CZ2-CG2 3.49Å; W299-V310 HydrophobicContact CZ3-CG2 3.92Å
300	A	93.5	Very high	92.3	Very high	65 Å²	65	53.3 Å²	53.3	54%	0.537	28%	0.279	S	S	.	.	H	α-helix	trans	-55.9	-38.7	175.9	0	0	0	0	0	111.6	T296 K297 S303	T296-A300 PolarHBondContact O-N 3.12Å; K297-A300 WeakPolarHBondContact O-CB 3.09Å; K297-A300 PolarHBondContact O-N 2.91Å; A300-S303 PolarHBondContact O-OG 3.24Å; A300-S303 VanDerWaalsContact O-OG 3.1Å
301	G	93.1	Very high	92.4	Very high	40 Å²	40	54.5 Å²	54.5	41%	0.412	29%	0.291	S	S	.	.	H	α-helix	trans	-64.6	-37.5	176.6	0	0	0	0	0	114.8	K297 A298 W299 H304	K297-G301 PolarHBondContact O-N 3.14Å; K297-G301 VanDerWaalsContact O-N 3.09Å; A298-G301 PolarHBondContact O-N 3.19Å; W299-G301 PolarHBondContact O-N 3.28Å; G301-H304 PolarHBondContact O-CE1 3.43Å; G301-H304 PolarHBondContact O-ND1 2.87Å
302	I	94.7	Very high	92.2	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.036	30%	0.304	C	S	.	.	H	α-helix	trans	-107.2	-6.3	-175.2	66.6	177.7	0	0	0	114.7	D156 L157 A298 W299 H304 K305 Y306	D156-I302 HydrophobicContact CB-CD1 4.22Å; L157-I302 HydrophobicContact CB-CD1 4Å; L157-I302 HydrophobicContact CD1-CD1 3.89Å; A298-I302 PolarHBondContact O-N 2.91Å; W299-I302 HydrophobicContact CE3-CD1 4.42Å; W299-I302 HydrophobicContact CE3-CG1 3.94Å; W299-I302 HydrophobicContact CZ3-CG1 4.35Å; W299-I302 PolarHBondContact O-N 2.93Å; W299-I302 VanDerWaalsContact O-N 3.14Å; I302-H304 PolarHBondContact O-N 3.29Å; I302-K305 HydrophobicContact CB-CD 4.33Å; I302-K305 WeakPolarHBondContact O-CB 3.41Å; I302-K305 PolarHBondContact O-N 3.48Å; I302-Y306 HydrophobicContact CB-CE2 4.48Å; I302-Y306 HydrophobicContact CD1-CE2 4.08Å; I302-Y306 HydrophobicContact CG1-CE2 4.31Å; I302-Y306 WeakPolarHBondContact O-CD2 3.3Å
303	S	93.4	Very high	91.9	Very high	46 Å²	46	60.3 Å²	60.3	32%	0.322	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-52.3	-34.4	-175.6	57.7	0	0	0	0	113.5	W299 A300 K305 Y306	W299-S303 WeakPolarHBondContact O-CA 3.23Å; W299-S303 WeakPolarHBondContact O-CB 3.3Å; W299-S303 PolarHBondContact O-N 3.05Å; A300-S303 PolarHBondContact O-OG 3.24Å; A300-S303 VanDerWaalsContact O-OG 3.1Å; S303-K305 PolarHBondContact O-N 3.06Å; S303-Y306 PolarHBondContact O-N 3.33Å
304	H	92.5	Very high	91.1	Very high	149 Å²	149	58.6 Å²	58.6	69%	0.69	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-65	-19	178.2	68.9	-88.3	0	0	0	114.7	G301 I302 Y306	G301-H304 PolarHBondContact O-CE1 3.43Å; G301-H304 PolarHBondContact O-ND1 2.87Å; I302-H304 PolarHBondContact O-N 3.29Å; H304-Y306 VanDerWaalsContact C-N 3.29Å
305	K	92.6	Very high	89.7	Confident	124 Å²	124	64.7 Å²	64.7	54%	0.539	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-78.2	-15	177.8	-60.4	-178	-179.7	177.3	0	112.7	I302 S303	I302-K305 HydrophobicContact CB-CD 4.33Å; I302-K305 WeakPolarHBondContact O-CB 3.41Å; I302-K305 PolarHBondContact O-N 3.48Å; S303-K305 PolarHBondContact O-N 3.06Å
306	Y	93.1	Very high	88.2	Confident	53 Å²	53	71.3 Å²	71.3	21%	0.208	37%	0.373	C	S	.	.			trans	-121.8	144.7	-164.8	-68.8	-73.1	0	0	0	112.6	F153 D156 W299 I302 S303 H304 F308	F153-Y306 HydrophobicContact CD2-CE1 4.3Å; F153-Y306 HydrophobicContact CD2-CE2 4.2Å; F153-Y306 AromaticContact CD2-CZ 3.95Å; F153-Y306 HydrophobicContact CE2-CE2 4.43Å; D156-Y306 VanDerWaalsContact CB-OH 3.3Å; D156-Y306 WeakPolarHBondContact CB-OH 3.38Å; D156-Y306 PolarHBondContact OD2-OH 3.06Å; W299-Y306 HydrophobicContact CH2-CD2 4.38Å; W299-Y306 AromaticContact CZ3-CD2 3.82Å; W299-Y306 HydrophobicContact CZ3-CD2 3.82Å; W299-Y306 HydrophobicContact CZ3-CG 4.36Å; I302-Y306 HydrophobicContact CB-CE2 4.48Å; I302-Y306 HydrophobicContact CD1-CE2 4.08Å; I302-Y306 HydrophobicContact CG1-CE2 4.31Å; I302-Y306 WeakPolarHBondContact O-CD2 3.3Å; S303-Y306 PolarHBondContact O-N 3.33Å; H304-Y306 VanDerWaalsContact C-N 3.29Å; Y306-F308 HydrophobicContact CD1-CD1 4.26Å; Y306-F308 AromaticContact CD1-CE1 3.19Å; Y306-F308 HydrophobicContact CD1-CE1 3.19Å; Y306-F308 HydrophobicContact CD1-CE2 4.34Å; Y306-F308 AromaticContact CD1-CZ 3.25Å; Y306-F308 HydrophobicContact CD1-CZ 3.25Å; Y306-F308 HydrophobicContact CD2-CZ 4.21Å; Y306-F308 AromaticContact CE1-CE1 3.94Å; Y306-F308 HydrophobicContact CE1-CE1 3.94Å; Y306-F308 AromaticContact CE1-CZ 3.82Å; Y306-F308 HydrophobicContact CE1-CZ 3.82Å; Y306-F308 AromaticContact CG-CE1 3.71Å; Y306-F308 HydrophobicContact CG-CE1 3.71Å; Y306-F308 HydrophobicContact CG-CE2 4.12Å; Y306-F308 AromaticContact CG-CZ 3.42Å; Y306-F308 HydrophobicContact CG-CZ 3.42Å; Y306-F308 VanDerWaalsContact CG-CZ 3.42Å
307	D	90.8	Very high	87.3	Confident	92 Å²	92	68.9 Å²	68.9	49%	0.492	36%	0.36	S	S	.	.	S	Bend	trans	-106.5	46.7	177.1	-165.6	26.2	0	0	0	112.6	R326	D307-R326 VanDerWaalsContact CG-CZ 3.45Å; D307-R326 IonicContact OD1-CZ 2.81Å; D307-R326 IonicContact OD1-NE 2.83Å; D307-R326 PolarHBondContact OD1-NE 3.4Å; D307-R326 IonicContact OD1-NH2 3.25Å; D307-R326 PolarHBondContact OD1-NH2 2.96Å; D307-R326 WeakPolarHBondContact OD2-CD 3.08Å; D307-R326 IonicContact OD2-CZ 2.79Å; D307-R326 IonicContact OD2-NE 3.03Å; D307-R326 PolarHBondContact OD2-NE 3.01Å; D307-R326 IonicContact OD2-NH1 3.87Å; D307-R326 IonicContact OD2-NH2 3.67Å
308	F	93.8	Very high	86.3	Confident	22 Å²	22	63.2 Å²	63.2	10%	0.096	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	159.3	174.4	53.6	-108.5	0	0	0	110.9	F149 F153 W299 Y306 V310 I323 R324 F325	F149-F308 HydrophobicContact CE2-CD1 4.31Å; F149-F308 AromaticContact CE2-CE1 3.57Å; F149-F308 HydrophobicContact CE2-CE1 3.57Å; F149-F308 HydrophobicContact CE2-CZ 4.12Å; F149-F308 HydrophobicContact CZ-CD1 4.14Å; F149-F308 AromaticContact CZ-CE1 3.51Å; F149-F308 HydrophobicContact CZ-CE1 3.51Å; F149-F308 AromaticContact CZ-CZ 3.76Å; F149-F308 HydrophobicContact CZ-CZ 3.76Å; F153-F308 HydrophobicContact CD2-CE2 4.17Å; F153-F308 AromaticContact CD2-CZ 3.73Å; F153-F308 HydrophobicContact CD2-CZ 3.73Å; F153-F308 AromaticContact CE2-CE2 3.88Å; F153-F308 HydrophobicContact CE2-CE2 3.88Å; F153-F308 AromaticContact CE2-CZ 3.9Å; F153-F308 HydrophobicContact CE2-CZ 3.9Å; F153-F308 HydrophobicContact CG-CZ 4.4Å; F153-F308 HydrophobicContact CZ-CE2 4.35Å; W299-F308 HydrophobicContact CH2-CD2 4.1Å; W299-F308 AromaticContact CH2-CE2 3.7Å; W299-F308 HydrophobicContact CH2-CE2 3.7Å; W299-F308 AromaticContact CZ3-CE2 3.98Å; W299-F308 HydrophobicContact CZ3-CE2 3.98Å; Y306-F308 HydrophobicContact CD1-CD1 4.26Å; Y306-F308 AromaticContact CD1-CE1 3.19Å; Y306-F308 HydrophobicContact CD1-CE1 3.19Å; Y306-F308 HydrophobicContact CD1-CE2 4.34Å; Y306-F308 AromaticContact CD1-CZ 3.25Å; Y306-F308 HydrophobicContact CD1-CZ 3.25Å; Y306-F308 HydrophobicContact CD2-CZ 4.21Å; Y306-F308 AromaticContact CE1-CE1 3.94Å; Y306-F308 HydrophobicContact CE1-CE1 3.94Å; Y306-F308 AromaticContact CE1-CZ 3.82Å; Y306-F308 HydrophobicContact CE1-CZ 3.82Å; Y306-F308 AromaticContact CG-CE1 3.71Å; Y306-F308 HydrophobicContact CG-CE1 3.71Å; Y306-F308 HydrophobicContact CG-CE2 4.12Å; Y306-F308 AromaticContact CG-CZ 3.42Å; Y306-F308 HydrophobicContact CG-CZ 3.42Å; Y306-F308 VanDerWaalsContact CG-CZ 3.42Å; F308-V310 HydrophobicContact CD2-CG2 3.85Å; F308-V310 HydrophobicContact CE2-CG2 3.71Å; F308-I323 HydrophobicContact CB-CG2 4.22Å; F308-I323 HydrophobicContact CD1-CG2 4.42Å; F308-I323 HydrophobicContact CD2-CG2 3.54Å; F308-I323 HydrophobicContact CE2-CG2 3.94Å; F308-I323 HydrophobicContact CG-CG2 3.82Å; F308-R324 WeakPolarHBondContact CB-O 3.4Å; F308-F325 HydrophobicContact CB-CD1 4.1Å; F308-F325 HydrophobicContact CB-CE1 4.45Å; F308-F325 HydrophobicContact CB-CG 4.47Å; F308-F325 HydrophobicContact CD1-CD1 4.22Å; F308-F325 AromaticContact CD1-CE1 3.83Å; F308-F325 HydrophobicContact CD1-CE1 3.83Å; F308-F325 HydrophobicContact CD1-CZ 4.5Å; F308-F325 HydrophobicContact CE1-CE1 4.5Å; F308-F325 HydrophobicContact CG-CE1 4.42Å
309	E	91.4	Very high	85.7	Confident	101 Å²	101	63.2 Å²	63.2	47%	0.472	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138	176.8	-66	165.6	-171	0	0	109.9	I323 R324	E309-I323 CarbonylContact O-C 3.58Å; E309-I323 WeakPolarHBondContact O-CA 3.26Å; E309-R324 HydrophobicContact CB-CB 4.42Å; E309-R324 VanDerWaalsContact CD-NH2 3.3Å; E309-R324 PolarHBondContact N-O 3.35Å; E309-R324 PolarHBondContact O-N 3.38Å; E309-R324 IonicContact OE1-NH2 3.65Å; E309-R324 PolarHBondContact OE1-NH2 2.94Å; E309-R324 IonicContact OE2-CZ 3.88Å; E309-R324 VanDerWaalsContact OE2-CZ 3.25Å; E309-R324 IonicContact OE2-NE 3.97Å; E309-R324 PolarHBondContact OE2-NE 3.03Å; E309-R324 IonicContact OE2-NH2 3.85Å; E309-R324 PolarHBondContact OE2-NH2 3.18Å
310	V	93.1	Very high	85.4	Confident	19 Å²	19	61.6 Å²	61.6	12%	0.115	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.6	171.7	-178.8	0	0	0	0	108.6	F153 W299 F308 L321 K322 I323	F153-V310 HydrophobicContact CZ-CG2 4Å; W299-V310 HydrophobicContact CD2-CB 4.16Å; W299-V310 HydrophobicContact CD2-CG2 4.04Å; W299-V310 HydrophobicContact CE3-CG2 4.12Å; W299-V310 HydrophobicContact CH2-CB 4.46Å; W299-V310 HydrophobicContact CH2-CG2 3.6Å; W299-V310 HydrophobicContact CZ2-CB 3.87Å; W299-V310 HydrophobicContact CZ2-CG2 3.49Å; W299-V310 VanDerWaalsContact CZ2-CG2 3.49Å; W299-V310 HydrophobicContact CZ3-CG2 3.92Å; F308-V310 HydrophobicContact CD2-CG2 3.85Å; F308-V310 HydrophobicContact CE2-CG2 3.71Å; V310-L321 HydrophobicContact CG1-CB 4.22Å; V310-L321 HydrophobicContact CG1-CD1 4.43Å; V310-L321 HydrophobicContact CG1-CD2 4.05Å; V310-L321 HydrophobicContact CG1-CG 4.46Å; V310-K322 WeakPolarHBondContact CA-O 3.5Å; V310-I323 HydrophobicContact CG2-CG1 4.38Å
311	T	90.7	Very high	85.3	Confident	68 Å²	68	58.5 Å²	58.5	42%	0.417	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.8	173.7	69.1	0	0	0	0	111.7	L321 K322	T311-L321 CarbonylContact O-C 3.55Å; T311-K322 PolarHBondContact N-O 3.47Å; T311-K322 PolarHBondContact O-N 3.02Å
312	F	87.4	Confident	85.3	Confident	62 Å²	62	60.6 Å²	60.6	27%	0.272	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132	173.1	-65.5	-97.2	0	0	0	109.3	Q292 V295 T296 L321	Q292-F312 HydrophobicContact CG-CD1 4.48Å; Q292-F312 HydrophobicContact CG-CE1 4.39Å; V295-F312 HydrophobicContact CG1-CE1 3.97Å; V295-F312 HydrophobicContact CG1-CZ 3.99Å; T296-F312 VanDerWaalsContact OG1-CZ 3.26Å; T296-F312 WeakPolarHBondContact OG1-CZ 3.49Å; F312-L321 HydrophobicContact CD1-CD2 3.64Å; F312-L321 HydrophobicContact CE1-CD2 3.46Å; F312-L321 VanDerWaalsContact CE1-CD2 3.46Å; F312-L321 HydrophobicContact CE2-CD2 4.44Å; F312-L321 HydrophobicContact CG-CD2 4.23Å; F312-L321 HydrophobicContact CZ-CD2 3.88Å
313	R	84.1	Confident	85.3	Confident	105 Å²	105	60.3 Å²	60.3	40%	0.396	30%	0.3	S	S	.	.			trans	-90.3	-31	-172.3	-63.9	-169.3	-62.4	151.4	3.7	114.1	A320 K322 N334	R313-A320 HydrophobicContact CB-CB 4.27Å; R313-A320 PolarHBondContact N-O 3.44Å; R313-K322 HydrophobicContact CG-CB 3.7Å; R313-N334 PolarHBondContact NH2-OD1 2.9Å
314	S	71.9	Confident	85.2	Confident	42 Å²	42	63.6 Å²	63.6	29%	0.294	31%	0.306	S	S	.	.			trans	-145.3	144.1	-177.1	-178.4	0	0	0	0	109.9	D316	S314-D316 VanDerWaalsContact C-N 3.3Å; S314-D316 PolarHBondContact OG-N 2.99Å
315	L	62.3	Low	85.1	Confident	143 Å²	143	58.7 Å²	58.7	75%	0.749	28%	0.283	S	S	*	.	S	Bend	trans	-73.5	-28.1	169.3	-63.4	174.5	0	0	0	111	A317	L315-A317 PolarHBondContact O-N 3.27Å
316	D	62.1	Low	85	Confident	140 Å²	140	62.5 Å²	62.5	75%	0.749	29%	0.293	S	S	*	.	S	Bend	trans	-78.3	-7.9	179.5	-50.6	-41.5	0	0	0	112.6	M288 S314	M288-D316 VanDerWaalsContact CE-O 3.3Å; M288-D316 WeakPolarHBondContact CE-O 3.29Å; S314-D316 VanDerWaalsContact C-N 3.3Å; S314-D316 PolarHBondContact OG-N 2.99Å
317	A	72	Confident	84.8	Confident	11 Å²	11	64.2 Å²	64.2	9%	0.091	31%	0.313	C	S	.	.			trans	-134	83.8	-178.7	0	0	0	0	0	110.7	L315 G319 A320 Y351	L315-A317 PolarHBondContact O-N 3.27Å; A317-G319 PolarHBondContact O-N 3.34Å; A317-A320 HydrophobicContact CB-CB 3.61Å; A317-A320 WeakPolarHBondContact O-CB 3.2Å; A317-A320 PolarHBondContact O-N 3.1Å; A317-Y351 HydrophobicContact CB-CD2 4.3Å; A317-Y351 HydrophobicContact CB-CE1 4.24Å; A317-Y351 HydrophobicContact CB-CE2 3.58Å
318	A	71.3	Confident	84.5	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.008	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.6	-39.3	-176	0	0	0	0	0	115.8	M288 F291 Q292	M288-A318 HydrophobicContact CB-CB 4.2Å; M288-A318 HydrophobicContact CE-CB 3.68Å; M288-A318 WeakPolarHBondContact O-CB 3.4Å; M288-A318 HydrophobicContact SD-CB 3.88Å; F291-A318 HydrophobicContact CB-CB 4.41Å; F291-A318 HydrophobicContact CD1-CB 4.17Å; Q292-A318 HydrophobicContact CB-CB 3.78Å
319	G	80.8	Confident	84.2	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	18.3	179.5	0	0	0	0	0	115.2	A317 L321 N334 L335	A317-G319 PolarHBondContact O-N 3.34Å; G319-L321 PolarHBondContact O-N 3.28Å; G319-L321 VanDerWaalsContact O-N 3.09Å; G319-N334 CarbonylContact O-C 3.57Å; G319-N334 WeakPolarHBondContact O-CA 3.33Å; G319-L335 VanDerWaalsContact CA-O 3.24Å; G319-L335 WeakPolarHBondContact CA-O 3.14Å; G319-L335 PolarHBondContact O-N 3.39Å
320	A	89.3	Confident	84.2	Confident	3 Å²	3	65.1 Å²	65.1	3%	0.025	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	89.3	174.7	0	0	0	0	0	110.9	R313 A317	R313-A320 HydrophobicContact CB-CB 4.27Å; R313-A320 PolarHBondContact N-O 3.44Å; A317-A320 HydrophobicContact CB-CB 3.61Å; A317-A320 WeakPolarHBondContact O-CB 3.2Å; A317-A320 PolarHBondContact O-N 3.1Å
321	L	91.8	Very high	84	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	146.2	-178	-53.3	177.8	0	0	0	112.2	F153 L157 V295 V310 T311 F312 G319 L333 L335	F153-L321 HydrophobicContact CE1-CD1 4.31Å; L157-L321 HydrophobicContact CD2-CD1 4.05Å; V295-L321 HydrophobicContact CG1-CD1 4.46Å; V295-L321 HydrophobicContact CG1-CD2 4.32Å; V310-L321 HydrophobicContact CG1-CB 4.22Å; V310-L321 HydrophobicContact CG1-CD1 4.43Å; V310-L321 HydrophobicContact CG1-CD2 4.05Å; V310-L321 HydrophobicContact CG1-CG 4.46Å; T311-L321 CarbonylContact O-C 3.55Å; F312-L321 HydrophobicContact CD1-CD2 3.64Å; F312-L321 HydrophobicContact CE1-CD2 3.46Å; F312-L321 VanDerWaalsContact CE1-CD2 3.46Å; F312-L321 HydrophobicContact CE2-CD2 4.44Å; F312-L321 HydrophobicContact CG-CD2 4.23Å; F312-L321 HydrophobicContact CZ-CD2 3.88Å; G319-L321 PolarHBondContact O-N 3.28Å; G319-L321 VanDerWaalsContact O-N 3.09Å; L321-L333 WeakPolarHBondContact CA-O 3.4Å; L321-L333 HydrophobicContact CB-CB 4.32Å; L321-L333 HydrophobicContact CD1-CD2 4.29Å; L321-L333 PolarHBondContact N-O 2.89Å; L321-L333 PolarHBondContact O-N 3.14Å; L321-L333 VanDerWaalsContact O-O 3.13Å; L321-L335 HydrophobicContact CD1-CD1 3.85Å; L321-L335 HydrophobicContact CD1-CG 4.33Å
322	K	92.9	Very high	84.1	Confident	84 Å²	84	61.7 Å²	61.7	37%	0.365	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.7	169.8	-174.9	-177.3	-178.3	-177.2	0	108.4	V310 T311 R313 V330	V310-K322 WeakPolarHBondContact CA-O 3.5Å; T311-K322 PolarHBondContact N-O 3.47Å; T311-K322 PolarHBondContact O-N 3.02Å; R313-K322 HydrophobicContact CG-CB 3.7Å; K322-V330 HydrophobicContact CD-CG1 4.22Å; K322-V330 HydrophobicContact CG-CG1 3.64Å
323	I	93.3	Very high	84.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	118.3	179.5	-54.7	173.6	0	0	0	107.6	F149 F153 F308 E309 V310 F325 V330 I331 L333	F149-I323 HydrophobicContact CE1-CD1 3.85Å; F149-I323 HydrophobicContact CE1-CG2 4.26Å; F149-I323 HydrophobicContact CZ-CD1 4.33Å; F149-I323 HydrophobicContact CZ-CG2 4.19Å; F153-I323 HydrophobicContact CD1-CD1 3.62Å; F153-I323 HydrophobicContact CE1-CD1 3.65Å; F153-I323 HydrophobicContact CE1-CG1 4.37Å; F153-I323 HydrophobicContact CG-CD1 4.44Å; F308-I323 HydrophobicContact CB-CG2 4.22Å; F308-I323 HydrophobicContact CD1-CG2 4.42Å; F308-I323 HydrophobicContact CD2-CG2 3.54Å; F308-I323 HydrophobicContact CE2-CG2 3.94Å; F308-I323 HydrophobicContact CG-CG2 3.82Å; E309-I323 CarbonylContact O-C 3.58Å; E309-I323 WeakPolarHBondContact O-CA 3.26Å; V310-I323 HydrophobicContact CG2-CG1 4.38Å; I323-F325 HydrophobicContact CG2-CD2 4.48Å; I323-F325 HydrophobicContact CG2-CE2 3.92Å; I323-F325 HydrophobicContact CG2-CZ 4.1Å; I323-V330 VanDerWaalsContact O-CA 3.32Å; I323-V330 WeakPolarHBondContact O-CA 3.26Å; I323-I331 HydrophobicContact CB-CB 4.4Å; I323-I331 PolarHBondContact N-O 3.34Å; I323-I331 PolarHBondContact O-N 3.43Å; I323-L333 HydrophobicContact CD1-CD2 4.43Å
324	R	92.7	Very high	84.7	Confident	115 Å²	115	53.8 Å²	53.8	43%	0.434	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	114.5	179.9	-171.2	177.7	86.4	104.1	-0.3	110	F308 E309 V330	F308-R324 WeakPolarHBondContact CB-O 3.4Å; E309-R324 HydrophobicContact CB-CB 4.42Å; E309-R324 VanDerWaalsContact CD-NH2 3.3Å; E309-R324 PolarHBondContact N-O 3.35Å; E309-R324 PolarHBondContact O-N 3.38Å; E309-R324 IonicContact OE1-NH2 3.65Å; E309-R324 PolarHBondContact OE1-NH2 2.94Å; E309-R324 IonicContact OE2-CZ 3.88Å; E309-R324 VanDerWaalsContact OE2-CZ 3.25Å; E309-R324 IonicContact OE2-NE 3.97Å; E309-R324 PolarHBondContact OE2-NE 3.03Å; E309-R324 IonicContact OE2-NH2 3.85Å; E309-R324 PolarHBondContact OE2-NH2 3.18Å; R324-V330 HydrophobicContact CG-CG2 4.34Å
325	F	91	Very high	85.7	Confident	47 Å²	47	51.8 Å²	51.8	21%	0.206	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	156.4	175.3	-63.7	-92.3	0	0	0	110.9	F149 F308 I323 S327 G328 K329 I331	F149-F325 HydrophobicContact CD1-CZ 4.09Å; F149-F325 HydrophobicContact CD2-CZ 4.41Å; F149-F325 HydrophobicContact CE1-CE1 4.49Å; F149-F325 HydrophobicContact CE1-CE2 4.32Å; F149-F325 AromaticContact CE1-CZ 3.57Å; F149-F325 HydrophobicContact CE1-CZ 3.57Å; F149-F325 HydrophobicContact CE2-CE1 4.09Å; F149-F325 AromaticContact CE2-CZ 3.93Å; F149-F325 HydrophobicContact CE2-CZ 3.93Å; F149-F325 HydrophobicContact CG-CZ 4.49Å; F149-F325 AromaticContact CZ-CE1 3.99Å; F149-F325 HydrophobicContact CZ-CE1 3.99Å; F149-F325 AromaticContact CZ-CZ 3.49Å; F149-F325 HydrophobicContact CZ-CZ 3.49Å; F149-F325 VanDerWaalsContact CZ-CZ 3.49Å; F308-F325 HydrophobicContact CB-CD1 4.1Å; F308-F325 HydrophobicContact CB-CE1 4.45Å; F308-F325 HydrophobicContact CB-CG 4.47Å; F308-F325 HydrophobicContact CD1-CD1 4.22Å; F308-F325 AromaticContact CD1-CE1 3.83Å; F308-F325 HydrophobicContact CD1-CE1 3.83Å; F308-F325 HydrophobicContact CD1-CZ 4.5Å; F308-F325 HydrophobicContact CE1-CE1 4.5Å; F308-F325 HydrophobicContact CG-CE1 4.42Å; I323-F325 HydrophobicContact CG2-CD2 4.48Å; I323-F325 HydrophobicContact CG2-CE2 3.92Å; I323-F325 HydrophobicContact CG2-CZ 4.1Å; F325-S327 WeakPolarHBondContact CB-OG 3.34Å; F325-S327 PolarHBondContact O-N 3.04Å; F325-S327 VanDerWaalsContact O-N 3.12Å; F325-G328 PolarHBondContact O-N 3.03Å; F325-K329 HydrophobicContact CD2-CB 4.19Å; F325-K329 WeakPolarHBondContact CD2-O 3.28Å; F325-K329 PolarHBondContact N-O 3.21Å; F325-I331 HydrophobicContact CE2-CD1 3.55Å; F325-I331 HydrophobicContact CE2-CG1 3.93Å; F325-I331 HydrophobicContact CZ-CD1 3.92Å
326	R	89.6	Confident	87.1	Confident	203 Å²	203	45.2 Å²	45.2	77%	0.766	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-27	171.1	-66	-170.4	180	-171.3	6	113.5	D307 G328	D307-R326 VanDerWaalsContact CG-CZ 3.45Å; D307-R326 IonicContact OD1-CZ 2.81Å; D307-R326 IonicContact OD1-NE 2.83Å; D307-R326 PolarHBondContact OD1-NE 3.4Å; D307-R326 IonicContact OD1-NH2 3.25Å; D307-R326 PolarHBondContact OD1-NH2 2.96Å; D307-R326 WeakPolarHBondContact OD2-CD 3.08Å; D307-R326 IonicContact OD2-CZ 2.79Å; D307-R326 IonicContact OD2-NE 3.03Å; D307-R326 PolarHBondContact OD2-NE 3.01Å; D307-R326 IonicContact OD2-NH1 3.87Å; D307-R326 IonicContact OD2-NH2 3.67Å; R326-G328 PolarHBondContact O-N 3.05Å
327	S	87.8	Confident	88.6	Confident	90 Å²	90	38.6 Å²	38.6	63%	0.629	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.2	174.6	62.4	0	0	0	0	114.2	F325 K329	F325-S327 WeakPolarHBondContact CB-OG 3.34Å; F325-S327 PolarHBondContact O-N 3.04Å; F325-S327 VanDerWaalsContact O-N 3.12Å; S327-K329 PolarHBondContact O-N 3.23Å; S327-K329 PolarHBondContact OG-N 3.09Å
328	G	86.3	Confident	89.7	Confident	51 Å²	51	38 Å²	38	53%	0.526	19%	0.188	S	C	.	.	S	Bend	trans	82	-6.6	-173.7	0	0	0	0	0	113.9	F325 R326	F325-G328 PolarHBondContact O-N 3.03Å; R326-G328 PolarHBondContact O-N 3.05Å
329	K	87.4	Confident	90.8	Very high	133 Å²	133	38 Å²	38	58%	0.578	19%	0.188	S	C	*	.			trans	-63.8	141.2	172.4	-69.2	-170.2	177	-169	0	110.2	F325 S327	F325-K329 HydrophobicContact CD2-CB 4.19Å; F325-K329 WeakPolarHBondContact CD2-O 3.28Å; F325-K329 PolarHBondContact N-O 3.21Å; S327-K329 PolarHBondContact O-N 3.23Å; S327-K329 PolarHBondContact OG-N 3.09Å
330	V	89.6	Confident	91.5	Very high	49 Å²	49	41 Å²	41	30%	0.297	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127	178.5	177.2	0	0	0	0	109.3	K322 I323 R324	K322-V330 HydrophobicContact CD-CG1 4.22Å; K322-V330 HydrophobicContact CG-CG1 3.64Å; I323-V330 VanDerWaalsContact O-CA 3.32Å; I323-V330 WeakPolarHBondContact O-CA 3.26Å; R324-V330 HydrophobicContact CG-CG2 4.34Å
331	I	90.8	Very high	91.6	Very high	11 Å²	11	40.8 Å²	40.8	6%	0.056	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.9	169.5	-61.7	172.6	0	0	0	107.8	V146 F149 V150 I323 F325	V146-I331 HydrophobicContact CB-CD1 4.48Å; V146-I331 HydrophobicContact CG1-CD1 4.01Å; V146-I331 HydrophobicContact CG1-CG1 4.33Å; V146-I331 HydrophobicContact CG1-CG2 4.23Å; V146-I331 HydrophobicContact CG2-CD1 4.08Å; F149-I331 HydrophobicContact CD1-CD1 3.64Å; F149-I331 HydrophobicContact CE1-CD1 3.93Å; V150-I331 HydrophobicContact CG2-CG2 3.76Å; I323-I331 HydrophobicContact CB-CB 4.4Å; I323-I331 PolarHBondContact N-O 3.34Å; I323-I331 PolarHBondContact O-N 3.43Å; F325-I331 HydrophobicContact CE2-CD1 3.55Å; F325-I331 HydrophobicContact CE2-CG1 3.93Å; F325-I331 HydrophobicContact CZ-CD1 3.92Å
332	V	91.4	Very high	91.5	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.8	174.9	171.5	0	0	0	0	108.3	P191 L192 M193 C194	P191-V332 HydrophobicContact CB-CG2 4.1Å; P191-V332 HydrophobicContact CG-CG2 4.11Å; L192-V332 PolarHBondContact O-N 2.87Å; M193-V332 CarbonylContact C-O 3.58Å; M193-V332 VanDerWaalsContact CA-O 3.31Å; M193-V332 WeakPolarHBondContact CA-O 3.26Å; M193-V332 HydrophobicContact CB-CB 4.28Å; M193-V332 HydrophobicContact CB-CG1 4.17Å; M193-V332 HydrophobicContact CE-CG1 4.25Å; M193-V332 HydrophobicContact CG-CG1 3.92Å; C194-V332 PolarHBondContact N-O 3.35Å
333	L	92.1	Very high	91.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.3	179.8	173.7	58.4	0	0	0	109	V150 F153 C194 L196 L321 I323 L335	V150-L333 HydrophobicContact CG1-CD1 3.58Å; V150-L333 HydrophobicContact CG1-CD2 4.35Å; F153-L333 HydrophobicContact CD1-CD2 3.87Å; F153-L333 HydrophobicContact CE1-CD2 4.01Å; C194-L333 HydrophobicContact CB-CD1 4.07Å; C194-L333 CarbonylContact O-C 3.52Å; C194-L333 WeakPolarHBondContact O-CA 3.31Å; L196-L333 HydrophobicContact CD1-CD1 3.74Å; L196-L333 HydrophobicContact CG-CD1 3.77Å; L321-L333 WeakPolarHBondContact CA-O 3.4Å; L321-L333 HydrophobicContact CB-CB 4.32Å; L321-L333 HydrophobicContact CD1-CD2 4.29Å; L321-L333 PolarHBondContact N-O 2.89Å; L321-L333 PolarHBondContact O-N 3.14Å; L321-L333 VanDerWaalsContact O-O 3.13Å; I323-L333 HydrophobicContact CD1-CD2 4.43Å; L333-L335 HydrophobicContact CD1-CD2 4.2Å; L333-L335 HydrophobicContact CD2-CD2 4.15Å; L333-L335 HydrophobicContact CD2-CG 4.39Å; L333-L335 HydrophobicContact CG-CD2 4.17Å; L333-L335 HydrophobicContact CG-CG 4.29Å
334	N	91.9	Very high	91.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	109.8	170.4	-62.1	-42.2	0	0	0	108.4	C194 D195 L196 R313 G319 I336 P353	C194-N334 PolarHBondContact O-N 3.38Å; D195-N334 PolarHBondContact OD1-ND2 3.44Å; L196-N334 PolarHBondContact N-O 3.13Å; R313-N334 PolarHBondContact NH2-OD1 2.9Å; G319-N334 CarbonylContact O-C 3.57Å; G319-N334 WeakPolarHBondContact O-CA 3.33Å; N334-I336 HydrophobicContact CB-CD1 4.35Å; N334-I336 HydrophobicContact CB-CG1 4.17Å; N334-P353 HydrophobicContact CB-CG 4.46Å
335	L	93.2	Very high	91.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	117.3	164.5	-57.7	177.6	0	0	0	107.5	A154 L157 L196 V198 F291 V295 G319 L321 L333	A154-L335 HydrophobicContact CB-CD2 4.38Å; L157-L335 HydrophobicContact CD2-CD1 3.72Å; L196-L335 HydrophobicContact CB-CD2 3.94Å; L196-L335 HydrophobicContact CD1-CD2 3.77Å; L196-L335 HydrophobicContact CG-CD2 4.32Å; V198-L335 HydrophobicContact CG2-CB 4.28Å; V198-L335 HydrophobicContact CG2-CD2 4.3Å; F291-L335 HydrophobicContact CE1-CB 3.85Å; F291-L335 HydrophobicContact CZ-CB 4.05Å; V295-L335 HydrophobicContact CG2-CD1 4.45Å; G319-L335 VanDerWaalsContact CA-O 3.24Å; G319-L335 WeakPolarHBondContact CA-O 3.14Å; G319-L335 PolarHBondContact O-N 3.39Å; L321-L335 HydrophobicContact CD1-CD1 3.85Å; L321-L335 HydrophobicContact CD1-CG 4.33Å; L333-L335 HydrophobicContact CD1-CD2 4.2Å; L333-L335 HydrophobicContact CD2-CD2 4.15Å; L333-L335 HydrophobicContact CD2-CG 4.39Å; L333-L335 HydrophobicContact CG-CD2 4.17Å; L333-L335 HydrophobicContact CG-CG 4.29Å
336	I	92.2	Very high	91.2	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	109.7	-173.4	-54.4	161.3	0	0	0	107.6	D195 L196 L197 V198 N334 V338 V349 Y351 P353	D195-I336 HydrophobicContact CB-CD1 4.38Å; L196-I336 PolarHBondContact O-N 3.45Å; L197-I336 HydrophobicContact CD2-CB 4.24Å; L197-I336 HydrophobicContact CD2-CD1 4.14Å; V198-I336 PolarHBondContact N-O 2.95Å; N334-I336 HydrophobicContact CB-CD1 4.35Å; N334-I336 HydrophobicContact CB-CG1 4.17Å; I336-V338 HydrophobicContact CG2-CG1 4.22Å; I336-V338 PolarHBondContact O-N 3.21Å; I336-V349 HydrophobicContact CG2-CG1 3.32Å; I336-Y351 HydrophobicContact CG1-CE1 4.47Å; I336-Y351 HydrophobicContact CG2-CE1 4.17Å; I336-P353 HydrophobicContact CD1-CG 3.77Å; I336-P353 HydrophobicContact CG1-CG 4.48Å
337	P	93.3	Very high	91.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	129.7	175.8	27.5	-31.9	0	0	0	108.9	V198 F200 I287 M288 F291 S350	V198-P337 WeakPolarHBondContact O-CA 3.32Å; F200-P337 HydrophobicContact CD1-CB 4.14Å; F200-P337 HydrophobicContact CE1-CB 4.12Å; I287-P337 HydrophobicContact CG2-CB 4.16Å; I287-P337 HydrophobicContact CG2-CG 4.09Å; M288-P337 HydrophobicContact SD-CG 4.05Å; F291-P337 HydrophobicContact CB-CB 4.38Å; F291-P337 HydrophobicContact CB-CG 4.11Å; F291-P337 HydrophobicContact CD1-CB 4.23Å; F291-P337 HydrophobicContact CD1-CG 3.85Å; F291-P337 HydrophobicContact CD2-CB 3.91Å; F291-P337 HydrophobicContact CD2-CG 4.36Å; F291-P337 HydrophobicContact CE1-CG 4.35Å; F291-P337 HydrophobicContact CE2-CB 4.21Å; F291-P337 HydrophobicContact CG-CB 3.92Å; F291-P337 HydrophobicContact CG-CG 3.85Å; F291-P337 HydrophobicContact CZ-CB 4.49Å; P337-S350 PolarHBondContact O-OG 2.89Å
338	V	94.6	Very high	91.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.4	-178.5	-61.3	0	0	0	0	111.6	L197 V198 P199 F200 I336 Y347 F348 V349	L197-V338 HydrophobicContact CB-CG1 4.07Å; L197-V338 HydrophobicContact CB-CG2 3.92Å; L197-V338 HydrophobicContact CD2-CG1 3.92Å; L197-V338 HydrophobicContact CG-CG1 4.4Å; V198-V338 PolarHBondContact O-N 2.93Å; P199-V338 CarbonylContact C-O 3.57Å; P199-V338 VanDerWaalsContact CA-O 3.26Å; P199-V338 WeakPolarHBondContact CA-O 3.45Å; P199-V338 HydrophobicContact CB-CG2 4.33Å; P199-V338 HydrophobicContact CG-CG2 4.15Å; F200-V338 WeakPolarHBondContact CD1-O 3.33Å; F200-V338 WeakPolarHBondContact CE1-O 3.42Å; F200-V338 PolarHBondContact N-O 3.24Å; I336-V338 HydrophobicContact CG2-CG1 4.22Å; I336-V338 PolarHBondContact O-N 3.21Å; V338-Y347 HydrophobicContact CB-CD1 4.31Å; V338-Y347 HydrophobicContact CG2-CD1 3.59Å; V338-Y347 HydrophobicContact CG2-CE1 4.35Å; V338-Y347 HydrophobicContact CG2-CG 4.19Å; V338-F348 WeakPolarHBondContact CA-O 3.36Å; V338-F348 VanDerWaalsContact CB-O 3.22Å; V338-F348 WeakPolarHBondContact CB-O 3.43Å; V338-V349 HydrophobicContact CG1-CB 4.42Å; V338-V349 HydrophobicContact CG1-CG1 4.21Å; V338-V349 HydrophobicContact CG1-CG2 4.14Å
339	V	95.1	Very high	92	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.7	167.4	178.5	0	0	0	0	108	F200 F208 Y210 I230 L282 Y347 F348	F200-V339 HydrophobicContact CD1-CG2 4.45Å; F200-V339 HydrophobicContact CE1-CG2 3.64Å; F200-V339 HydrophobicContact CE2-CG2 3.84Å; F200-V339 HydrophobicContact CZ-CG2 3.26Å; F208-V339 HydrophobicContact CD2-CG1 3.37Å; F208-V339 HydrophobicContact CD2-CG2 4.43Å; F208-V339 HydrophobicContact CE2-CB 4.46Å; F208-V339 HydrophobicContact CE2-CG1 3.69Å; F208-V339 HydrophobicContact CE2-CG2 3.96Å; F208-V339 HydrophobicContact CG-CG1 4.22Å; F208-V339 HydrophobicContact CZ-CG2 4.49Å; Y210-V339 HydrophobicContact CE1-CG1 3.82Å; I230-V339 HydrophobicContact CD1-CB 3.8Å; I230-V339 HydrophobicContact CD1-CG1 4.15Å; I230-V339 HydrophobicContact CD1-CG2 3.83Å; I230-V339 HydrophobicContact CG2-CG1 4.49Å; L282-V339 HydrophobicContact CD1-CG2 4.07Å; V339-Y347 CarbonylContact O-C 3.5Å; V339-Y347 WeakPolarHBondContact O-CA 3.32Å; V339-F348 HydrophobicContact CB-CB 4.3Å; V339-F348 PolarHBondContact N-O 3.06Å; V339-F348 PolarHBondContact O-N 3.13Å
340	Q	94.9	Very high	91.7	Very high	62 Å²	62	21.8 Å²	21.8	29%	0.29	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	134.9	173.3	-167.6	176.4	0.1	0	0	109.3	Y210 E342 T344 Y347	Y210-Q340 PolarHBondContact OH-O 3.16Å; Q340-E342 VanDerWaalsContact CG-O 3.31Å; Q340-E342 WeakPolarHBondContact CG-O 3.45Å; Q340-E342 PolarHBondContact O-N 2.89Å; Q340-T344 WeakPolarHBondContact CG-O 3.07Å; Q340-T344 PolarHBondContact NE2-O 3.2Å; Q340-Y347 HydrophobicContact CB-CD1 3.92Å; Q340-Y347 HydrophobicContact CB-CE1 3.72Å; Q340-Y347 HydrophobicContact CG-CD1 4.06Å; Q340-Y347 HydrophobicContact CG-CE1 3.58Å
341	L	92.9	Very high	91.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.105	C	C	.	.			trans	-81.6	101.2	174.7	174.4	65.5	0	0	0	108.5	Y210 L212 T344 A346 F348 L366 F478	Y210-L341 HydrophobicContact CD1-CD1 3.98Å; Y210-L341 HydrophobicContact CD2-CD1 3.78Å; Y210-L341 HydrophobicContact CE1-CD1 4.45Å; Y210-L341 HydrophobicContact CE2-CD1 4.31Å; Y210-L341 HydrophobicContact CG-CD1 3.58Å; L212-L341 HydrophobicContact CD1-CD1 4.28Å; L212-L341 HydrophobicContact CD1-CD2 4.25Å; L212-L341 HydrophobicContact CD2-CD1 4.24Å; L212-L341 HydrophobicContact CD2-CD2 4.31Å; L341-T344 WeakPolarHBondContact O-CB 3.49Å; L341-T344 PolarHBondContact O-N 2.95Å; L341-T344 VanDerWaalsContact O-N 3.16Å; L341-T344 PolarHBondContact O-OG1 2.76Å; L341-A346 HydrophobicContact CB-CB 4.31Å; L341-A346 WeakPolarHBondContact CB-O 3.5Å; L341-A346 HydrophobicContact CD2-CB 4.12Å; L341-A346 PolarHBondContact N-O 2.97Å; L341-F348 HydrophobicContact CB-CD2 4.4Å; L341-F348 HydrophobicContact CB-CE2 4.02Å; L341-F348 HydrophobicContact CD1-CE2 3.65Å; L341-F348 HydrophobicContact CD1-CZ 4.1Å; L341-F348 HydrophobicContact CG-CE2 4.32Å; L341-L366 HydrophobicContact CD2-CD2 3.96Å; L341-F478 HydrophobicContact CD2-CE2 3.85Å; L341-F478 HydrophobicContact CD2-CZ 3.48Å; L341-F478 VanDerWaalsContact CD2-CZ 3.48Å
342	E	87.7	Confident	90.2	Very high	92 Å²	92	23.4 Å²	23.4	43%	0.43	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	-139.5	-175.6	-55.3	157.6	-178.4	0	0	109.5	Y210 Q340 T344 R477	Y210-E342 HydrophobicContact CD2-CG 3.99Å; Y210-E342 HydrophobicContact CE2-CG 3.8Å; Y210-E342 PolarHBondContact OH-N 3.23Å; Q340-E342 VanDerWaalsContact CG-O 3.31Å; Q340-E342 WeakPolarHBondContact CG-O 3.45Å; Q340-E342 PolarHBondContact O-N 2.89Å; E342-T344 VanDerWaalsContact C-N 3.33Å; E342-T344 PolarHBondContact O-N 3.01Å; E342-R477 VanDerWaalsContact CD-NH2 3.34Å; E342-R477 IonicContact OE1-CZ 3.74Å; E342-R477 IonicContact OE1-NH1 3.05Å; E342-R477 PolarHBondContact OE1-NH1 3.15Å; E342-R477 IonicContact OE1-NH2 3.54Å; E342-R477 PolarHBondContact OE1-NH2 3.32Å; E342-R477 IonicContact OE2-CZ 2.68Å; E342-R477 IonicContact OE2-NH1 3.52Å; E342-R477 PolarHBondContact OE2-NH1 3.3Å; E342-R477 VanDerWaalsContact OE2-NH1 3.15Å; E342-R477 IonicContact OE2-NH2 2.72Å; E342-R477 PolarHBondContact OE2-NH2 3.38Å
343	D	86.6	Confident	88.6	Confident	161 Å²	161	25.9 Å²	25.9	86%	0.861	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	34.9	175.9	-62	-47.9	0	0	0	113.1
344	T	91.9	Very high	86.9	Confident	27 Å²	27	29.9 Å²	29.9	17%	0.166	16%	0.16	C	C	.	.	S	Bend	trans	-106.5	163.9	-175.6	74.6	0	0	0	0	113.4	Q340 L341 E342 A346 P475	Q340-T344 WeakPolarHBondContact CG-O 3.07Å; Q340-T344 PolarHBondContact NE2-O 3.2Å; L341-T344 WeakPolarHBondContact O-CB 3.49Å; L341-T344 PolarHBondContact O-N 2.95Å; L341-T344 VanDerWaalsContact O-N 3.16Å; L341-T344 PolarHBondContact O-OG1 2.76Å; E342-T344 VanDerWaalsContact C-N 3.33Å; E342-T344 PolarHBondContact O-N 3.01Å; T344-A346 PolarHBondContact O-N 2.7Å; T344-A346 VanDerWaalsContact O-N 3.08Å; T344-P475 HydrophobicContact CG2-CG 4.02Å
345	D	92.9	Very high	85.4	Confident	27 Å²	27	34.3 Å²	34.3	14%	0.144	18%	0.184	C	C	.	.	S	Bend	trans	-79.2	27	174.5	-74.7	-16.9	0	0	0	112.3	V370 C371 N374	D345-V370 HydrophobicContact CB-CB 4.28Å; D345-V370 HydrophobicContact CB-CG1 3.96Å; D345-C371 VanDerWaalsContact CB-SG 3.57Å; D345-C371 PolarHBondContact O-SG 2.73Å; D345-C371 VanDerWaalsContact O-SG 3.38Å; D345-N374 PolarHBondContact OD2-ND2 2.86Å
346	A	94.3	Very high	83.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.			trans	-117.4	140	178.9	0	0	0	0	0	110.2	L341 T344 L368 P475 F478	L341-A346 HydrophobicContact CB-CB 4.31Å; L341-A346 WeakPolarHBondContact CB-O 3.5Å; L341-A346 HydrophobicContact CD2-CB 4.12Å; L341-A346 PolarHBondContact N-O 2.97Å; T344-A346 PolarHBondContact O-N 2.7Å; T344-A346 VanDerWaalsContact O-N 3.08Å; A346-L368 HydrophobicContact CB-CD2 3.55Å; A346-P475 HydrophobicContact CB-CG 4.07Å; A346-F478 HydrophobicContact CB-CE2 3.93Å
347	Y	94.9	Very high	81.4	Confident	12 Å²	12	46.5 Å²	46.5	5%	0.047	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.9	-170.1	-62.8	-90.6	0	0	0	111	I177 L197 P199 V338 V339 Q340 L366 S367 V370	I177-Y347 HydrophobicContact CD1-CE1 4.15Å; L197-Y347 HydrophobicContact CD1-CD2 4.18Å; L197-Y347 HydrophobicContact CD1-CG 4.32Å; P199-Y347 HydrophobicContact CG-CE1 4.07Å; V338-Y347 HydrophobicContact CB-CD1 4.31Å; V338-Y347 HydrophobicContact CG2-CD1 3.59Å; V338-Y347 HydrophobicContact CG2-CE1 4.35Å; V338-Y347 HydrophobicContact CG2-CG 4.19Å; V339-Y347 CarbonylContact O-C 3.5Å; V339-Y347 WeakPolarHBondContact O-CA 3.32Å; Q340-Y347 HydrophobicContact CB-CD1 3.92Å; Q340-Y347 HydrophobicContact CB-CE1 3.72Å; Q340-Y347 HydrophobicContact CG-CD1 4.06Å; Q340-Y347 HydrophobicContact CG-CE1 3.58Å; Y347-L366 CarbonylContact O-C 3.45Å; Y347-L366 WeakPolarHBondContact O-CA 3.45Å; Y347-S367 PolarHBondContact N-O 3.08Å; Y347-S367 VanDerWaalsContact N-O 3.1Å; Y347-S367 PolarHBondContact O-N 3.26Å; Y347-V370 HydrophobicContact CD2-CG2 4.03Å; Y347-V370 HydrophobicContact CE2-CB 4.09Å; Y347-V370 HydrophobicContact CE2-CG2 3.56Å
348	F	93.8	Very high	80	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	131.6	165.2	-66.7	-83	0	0	0	109.7	Y210 L212 I230 V338 V339 L341 W364 P365 L366	Y210-F348 HydrophobicContact CD1-CD2 4.14Å; Y210-F348 AromaticContact CD1-CE2 3.37Å; Y210-F348 HydrophobicContact CD1-CE2 3.37Å; Y210-F348 HydrophobicContact CD1-CZ 4.08Å; Y210-F348 HydrophobicContact CE1-CD2 4.26Å; Y210-F348 AromaticContact CE1-CE2 3.88Å; Y210-F348 HydrophobicContact CE1-CE2 3.88Å; Y210-F348 HydrophobicContact CG-CE2 4.14Å; L212-F348 HydrophobicContact CD2-CE1 4.04Å; L212-F348 HydrophobicContact CD2-CZ 3.5Å; I230-F348 HydrophobicContact CD1-CB 3.73Å; I230-F348 HydrophobicContact CD1-CD1 4.4Å; I230-F348 HydrophobicContact CD1-CD2 3.95Å; I230-F348 HydrophobicContact CD1-CG 3.79Å; I230-F348 HydrophobicContact CG1-CD1 4.47Å; I230-F348 HydrophobicContact CG1-CD2 4.12Å; I230-F348 HydrophobicContact CG1-CE2 4.32Å; I230-F348 HydrophobicContact CG1-CG 4.17Å; V338-F348 WeakPolarHBondContact CA-O 3.36Å; V338-F348 VanDerWaalsContact CB-O 3.22Å; V338-F348 WeakPolarHBondContact CB-O 3.43Å; V339-F348 HydrophobicContact CB-CB 4.3Å; V339-F348 PolarHBondContact N-O 3.06Å; V339-F348 PolarHBondContact O-N 3.13Å; L341-F348 HydrophobicContact CB-CD2 4.4Å; L341-F348 HydrophobicContact CB-CE2 4.02Å; L341-F348 HydrophobicContact CD1-CE2 3.65Å; L341-F348 HydrophobicContact CD1-CZ 4.1Å; L341-F348 HydrophobicContact CG-CE2 4.32Å; F348-W364 HydrophobicContact CB-CB 4.03Å; F348-W364 HydrophobicContact CB-CE3 4.27Å; F348-W364 HydrophobicContact CD1-CB 3.65Å; F348-W364 HydrophobicContact CG-CB 4.23Å; F348-P365 WeakPolarHBondContact CA-O 3.34Å; F348-L366 HydrophobicContact CD1-CD1 3.79Å; F348-L366 HydrophobicContact CD1-CG 3.82Å; F348-L366 HydrophobicContact CE1-CD1 3.37Å; F348-L366 HydrophobicContact CE1-CD2 4.29Å; F348-L366 HydrophobicContact CE1-CG 3.73Å; F348-L366 HydrophobicContact CZ-CD1 4.18Å; F348-L366 HydrophobicContact CZ-CD2 4.42Å; F348-L366 HydrophobicContact CZ-CG 4.33Å
349	V	90.5	Very high	79.1	Confident	2 Å²	2	52 Å²	52	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.8	-172.9	-164.9	0	0	0	0	109.9	I336 V338 Y351 F352 P365	I336-V349 HydrophobicContact CG2-CG1 3.32Å; V338-V349 HydrophobicContact CG1-CB 4.42Å; V338-V349 HydrophobicContact CG1-CG1 4.21Å; V338-V349 HydrophobicContact CG1-CG2 4.14Å; V349-Y351 VanDerWaalsContact C-N 3.33Å; V349-Y351 WeakPolarHBondContact CG1-O 3.21Å; V349-Y351 PolarHBondContact O-N 2.72Å; V349-F352 HydrophobicContact CG2-CE1 4.33Å; V349-P365 HydrophobicContact CB-CG 4.45Å; V349-P365 PolarHBondContact N-O 2.8Å; V349-P365 WeakPolarHBondContact O-CD 3.35Å; V349-P365 WeakPolarHBondContact O-CG 3.44Å
350	S	80.6	Confident	78.6	Confident	4 Å²	4	55.4 Å²	55.4	3%	0.028	30%	0.299	C	S	.	.	S	Bend	trans	-66.6	-34.1	177.3	52.8	0	0	0	0	113	M288 P337	M288-S350 PolarHBondContact SD-OG 2.97Å; P337-S350 PolarHBondContact O-OG 2.89Å
351	Y	76.6	Confident	78	Confident	26 Å²	26	55.7 Å²	55.7	10%	0.102	30%	0.302	C	S	.	.			trans	-159.3	153.2	174.1	69.2	-76.8	0	0	0	110.6	M288 A317 I336 V349 P353	M288-Y351 HydrophobicContact CE-CD1 3.31Å; M288-Y351 HydrophobicContact CE-CE1 3.39Å; M288-Y351 HydrophobicContact CE-CG 4.3Å; M288-Y351 HydrophobicContact SD-CD1 3.85Å; M288-Y351 HydrophobicContact SD-CE1 4.01Å; A317-Y351 HydrophobicContact CB-CD2 4.3Å; A317-Y351 HydrophobicContact CB-CE1 4.24Å; A317-Y351 HydrophobicContact CB-CE2 3.58Å; I336-Y351 HydrophobicContact CG1-CE1 4.47Å; I336-Y351 HydrophobicContact CG2-CE1 4.17Å; V349-Y351 VanDerWaalsContact C-N 3.33Å; V349-Y351 WeakPolarHBondContact CG1-O 3.21Å; V349-Y351 PolarHBondContact O-N 2.72Å; Y351-P353 HydrophobicContact CD2-CG 4.44Å; Y351-P353 HydrophobicContact CE2-CB 4.28Å; Y351-P353 HydrophobicContact CE2-CG 3.89Å
352	F	72.2	Confident	77.7	Confident	67 Å²	67	57.2 Å²	57.2	29%	0.294	31%	0.313	S	S	.	.			trans	-92.1	126.2	164.9	-70.6	-65.1	0	0	0	109.6	V349 S354 D355 P365	V349-F352 HydrophobicContact CG2-CE1 4.33Å; F352-S354 PolarHBondContact O-N 2.86Å; F352-D355 HydrophobicContact CB-CB 3.79Å; F352-D355 PolarHBondContact O-N 2.82Å; F352-D355 VanDerWaalsContact O-N 3.14Å; F352-P365 HydrophobicContact CD2-CB 4.09Å; F352-P365 HydrophobicContact CD2-CG 4.26Å; F352-P365 HydrophobicContact CE2-CB 3.31Å; F352-P365 HydrophobicContact CE2-CG 3.9Å; F352-P365 HydrophobicContact CZ-CB 3.87Å; F352-P365 HydrophobicContact CZ-CG 4.48Å
353	P	59.1	Low	77.8	Confident	57 Å²	57	55.8 Å²	55.8	37%	0.37	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.7	178.9	-25	32.6	0	0	0	115.1	N334 I336 Y351	N334-P353 HydrophobicContact CB-CG 4.46Å; I336-P353 HydrophobicContact CD1-CG 3.77Å; I336-P353 HydrophobicContact CG1-CG 4.48Å; Y351-P353 HydrophobicContact CD2-CG 4.44Å; Y351-P353 HydrophobicContact CE2-CB 4.28Å; Y351-P353 HydrophobicContact CE2-CG 3.89Å
354	S	55.6	Low	78	Confident	84 Å²	84	48.1 Å²	48.1	59%	0.587	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	2.7	-177.2	59.6	0	0	0	0	114.6	F352	F352-S354 PolarHBondContact O-N 2.86Å
355	D	61	Low	77.9	Confident	94 Å²	94	47 Å²	47	50%	0.503	26%	0.256	S	S	.	.			trans	-117.6	131	-177	-158	-16	0	0	0	110.9	F352 N357	F352-D355 HydrophobicContact CB-CB 3.79Å; F352-D355 PolarHBondContact O-N 2.82Å; F352-D355 VanDerWaalsContact O-N 3.14Å; D355-N357 PolarHBondContact OD1-N 3.29Å
356	H	48	Very low	77.9	Confident	158 Å²	158	46.3 Å²	46.3	73%	0.731	25%	0.252	S	S	*	.	S	Bend	trans	-93	-10	179.6	-64.5	-68.5	0	0	0	112.5
357	N	53.5	Low	77.8	Confident	103 Å²	103	47 Å²	47	55%	0.551	26%	0.256	S	S	*	.			trans	-110.9	77.8	179.2	-89.7	12.5	0	0	0	110.3	D355	D355-N357 PolarHBondContact OD1-N 3.29Å
358	S	64.3	Low	77.8	Confident	72 Å²	72	46.6 Å²	46.6	50%	0.503	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-65.9	140.5	169.9	-169.7	0	0	0	0	110	K284	K284-S358 PolarHBondContact NZ-OG 2.68Å
359	F	74.9	Confident	77.8	Confident	44 Å²	44	47.2 Å²	47.2	19%	0.193	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-55.4	143.4	169.7	-69.7	-65	0	0	0	110.4	M224 K284 Y363 P365	M224-F359 HydrophobicContact CB-CD1 4.1Å; M224-F359 HydrophobicContact CB-CE1 3.88Å; M224-F359 HydrophobicContact CG-CD1 3.9Å; M224-F359 HydrophobicContact CG-CE1 3.95Å; M224-F359 HydrophobicContact SD-CD1 4.44Å; K284-F359 PolarHBondContact NZ-O 2.89Å; F359-Y363 WeakPolarHBondContact CB-O 3.21Å; F359-P365 HydrophobicContact CD2-CB 3.74Å; F359-P365 HydrophobicContact CD2-CG 4.25Å; F359-P365 HydrophobicContact CE2-CB 3.81Å
360	P	84.1	Confident	78	Confident	72 Å²	72	47.3 Å²	47.3	47%	0.468	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-64.8	149	174.1	28.1	-33.1	0	0	0	110.2	M224 Y363	M224-P360 HydrophobicContact CE-CG 3.81Å; M224-P360 HydrophobicContact SD-CG 4.49Å; P360-Y363 HydrophobicContact CG-CD2 4.37Å; P360-Y363 WeakPolarHBondContact O-CB 3.29Å; P360-Y363 PolarHBondContact O-N 3.25Å
361	D	83.3	Confident	78.7	Confident	67 Å²	67	47.1 Å²	47.1	36%	0.358	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	141.4	170.2	-77.9	0.4	0	0	0	109.7	K284	K284-D361 WeakPolarHBondContact CB-OD1 3.16Å; K284-D361 WeakPolarHBondContact CD-OD1 3.22Å; K284-D361 WeakPolarHBondContact CE-OD1 3.42Å; K284-D361 WeakPolarHBondContact CG-OD1 3.29Å; K284-D361 PolarHBondContact N-OD2 3.42Å; K284-D361 IonicContact NZ-OD1 3.5Å
362	P	86.9	Confident	79.6	Confident	33 Å²	33	46.5 Å²	46.5	21%	0.214	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	cis	-95.4	22.4	8.6	38.5	-36.4	0	0	0	114.4	T229 F281	T229-P362 HydrophobicContact CG2-CB 4.45Å; T229-P362 HydrophobicContact CG2-CG 4Å; F281-P362 HydrophobicContact CB-CB 3.77Å; F281-P362 HydrophobicContact CG-CB 4.14Å; F281-P362 HydrophobicContact CG-CG 4.41Å
363	Y	88.7	Confident	80.6	Confident	61 Å²	61	45.6 Å²	45.6	24%	0.239	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-87.8	122.4	-175.2	-62.1	-75.1	0	0	0	112.2	I220 M224 T229 K284 F359 P360	I220-Y363 HydrophobicContact CD1-CD1 4.35Å; I220-Y363 HydrophobicContact CD1-CE1 4.22Å; I220-Y363 HydrophobicContact CG1-CD1 4.26Å; I220-Y363 HydrophobicContact CG1-CE1 3.74Å; M224-Y363 HydrophobicContact SD-CD2 4.05Å; M224-Y363 HydrophobicContact SD-CE2 4.3Å; M224-Y363 HydrophobicContact SD-CG 4.38Å; T229-Y363 HydrophobicContact CG2-CD1 3.54Å; T229-Y363 HydrophobicContact CG2-CE1 3.63Å; T229-Y363 HydrophobicContact CG2-CG 4.33Å; K284-Y363 WeakPolarHBondContact CE-O 3.46Å; K284-Y363 PolarHBondContact NZ-O 3.05Å; F359-Y363 WeakPolarHBondContact CB-O 3.21Å; P360-Y363 HydrophobicContact CG-CD2 4.37Å; P360-Y363 WeakPolarHBondContact O-CB 3.29Å; P360-Y363 PolarHBondContact O-N 3.25Å
364	W	90.9	Very high	82.3	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	131.8	-179.2	-70.3	68.8	0	0	0	111.2	S227 G228 I230 L282 K284 I287 F348	S227-W364 CarbonylContact C-O 3.36Å; S227-W364 WeakPolarHBondContact CA-O 3.43Å; S227-W364 WeakPolarHBondContact CB-O 3.05Å; G228-W364 PolarHBondContact N-O 3.03Å; G228-W364 WeakPolarHBondContact O-CB 3.24Å; G228-W364 PolarHBondContact O-N 3.35Å; I230-W364 HydrophobicContact CD1-CB 4.46Å; I230-W364 HydrophobicContact CD1-CD2 3.97Å; I230-W364 HydrophobicContact CD1-CE3 4.35Å; I230-W364 HydrophobicContact CD1-CG 3.97Å; I230-W364 HydrophobicContact CG1-CG 4.5Å; L282-W364 HydrophobicContact CB-CZ2 4.25Å; L282-W364 PolarHBondContact O-NE1 2.9Å; L282-W364 VanDerWaalsContact O-NE1 3.17Å; K284-W364 HydrophobicContact CB-CH2 4.34Å; K284-W364 HydrophobicContact CB-CZ2 4.1Å; K284-W364 HydrophobicContact CG-CD2 4.02Å; K284-W364 HydrophobicContact CG-CE3 4.37Å; K284-W364 HydrophobicContact CG-CH2 3.75Å; K284-W364 HydrophobicContact CG-CZ2 3.36Å; K284-W364 HydrophobicContact CG-CZ3 4.27Å; I287-W364 HydrophobicContact CB-CH2 4.22Å; I287-W364 HydrophobicContact CD1-CH2 3.32Å; I287-W364 HydrophobicContact CD1-CZ2 3.45Å; I287-W364 VanDerWaalsContact CD1-CZ2 3.45Å; I287-W364 HydrophobicContact CD1-CZ3 4.46Å; I287-W364 HydrophobicContact CG1-CH2 4.35Å; I287-W364 HydrophobicContact CG2-CH2 4.27Å; F348-W364 HydrophobicContact CB-CB 4.03Å; F348-W364 HydrophobicContact CB-CE3 4.27Å; F348-W364 HydrophobicContact CD1-CB 3.65Å; F348-W364 HydrophobicContact CG-CB 4.23Å
365	P	90.3	Very high	84.2	Confident	4 Å²	4	41 Å²	41	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	143.8	170.5	25.1	-30.6	0	0	0	111.5	F348 V349 F352 F359	F348-P365 WeakPolarHBondContact CA-O 3.34Å; V349-P365 HydrophobicContact CB-CG 4.45Å; V349-P365 PolarHBondContact N-O 2.8Å; V349-P365 WeakPolarHBondContact O-CD 3.35Å; V349-P365 WeakPolarHBondContact O-CG 3.44Å; F352-P365 HydrophobicContact CD2-CB 4.09Å; F352-P365 HydrophobicContact CD2-CG 4.26Å; F352-P365 HydrophobicContact CE2-CB 3.31Å; F352-P365 HydrophobicContact CE2-CG 3.9Å; F352-P365 HydrophobicContact CZ-CB 3.87Å; F352-P365 HydrophobicContact CZ-CG 4.48Å; F359-P365 HydrophobicContact CD2-CB 3.74Å; F359-P365 HydrophobicContact CD2-CG 4.25Å; F359-P365 HydrophobicContact CE2-CB 3.81Å
366	L	91.7	Very high	85.8	Confident	13 Å²	13	37.4 Å²	37.4	7%	0.068	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	136.2	169	-78.3	94.5	0	0	0	112.3	L212 W213 C226 L341 Y347 F348 F478	L212-L366 HydrophobicContact CD2-CD1 4.13Å; L212-L366 HydrophobicContact CD2-CD2 4.12Å; W213-L366 HydrophobicContact CE3-CD1 3.83Å; W213-L366 HydrophobicContact CH2-CD1 4.36Å; W213-L366 HydrophobicContact CH2-CD2 4.22Å; W213-L366 HydrophobicContact CZ3-CB 4.44Å; W213-L366 HydrophobicContact CZ3-CD1 3.38Å; W213-L366 HydrophobicContact CZ3-CD2 3.71Å; W213-L366 HydrophobicContact CZ3-CG 4.01Å; C226-L366 WeakPolarHBondContact O-CD1 3.47Å; C226-L366 PolarHBondContact O-N 2.97Å; L341-L366 HydrophobicContact CD2-CD2 3.96Å; Y347-L366 CarbonylContact O-C 3.45Å; Y347-L366 WeakPolarHBondContact O-CA 3.45Å; F348-L366 HydrophobicContact CD1-CD1 3.79Å; F348-L366 HydrophobicContact CD1-CG 3.82Å; F348-L366 HydrophobicContact CE1-CD1 3.37Å; F348-L366 HydrophobicContact CE1-CD2 4.29Å; F348-L366 HydrophobicContact CE1-CG 3.73Å; F348-L366 HydrophobicContact CZ-CD1 4.18Å; F348-L366 HydrophobicContact CZ-CD2 4.42Å; F348-L366 HydrophobicContact CZ-CG 4.33Å; L366-F478 HydrophobicContact CD2-CE1 4.44Å; L366-F478 HydrophobicContact CD2-CE2 3.89Å; L366-F478 HydrophobicContact CD2-CZ 3.48Å; L366-F478 VanDerWaalsContact CD2-CZ 3.48Å
367	S	92.7	Very high	88	Confident	13 Å²	13	35.1 Å²	35.1	9%	0.091	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.6	169.2	177.7	0	0	0	0	110.8	Y347 A369	Y347-S367 PolarHBondContact N-O 3.08Å; Y347-S367 VanDerWaalsContact N-O 3.1Å; Y347-S367 PolarHBondContact O-N 3.26Å; S367-A369 WeakPolarHBondContact OG-CB 3.22Å; S367-A369 PolarHBondContact OG-N 3Å
368	L	94.4	Very high	90	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.026	17%	0.169	C	C	.	.			trans	-106.6	21.1	170.2	-61.5	178.1	0	0	0	111.6	A346 V370 C371 E372 L462 I463 F478	A346-L368 HydrophobicContact CB-CD2 3.55Å; L368-V370 PolarHBondContact O-N 3.23Å; L368-V370 VanDerWaalsContact O-N 3.16Å; L368-C371 HydrophobicContact CB-CB 4.3Å; L368-C371 WeakPolarHBondContact O-CA 3.39Å; L368-C371 WeakPolarHBondContact O-CB 3.41Å; L368-C371 PolarHBondContact O-N 3.36Å; L368-E372 WeakPolarHBondContact O-CG 3.49Å; L368-E372 PolarHBondContact O-N 2.74Å; L368-L462 HydrophobicContact CB-CD1 3.74Å; L368-L462 HydrophobicContact CD1-CB 4.09Å; L368-L462 HydrophobicContact CD1-CD1 4.18Å; L368-I463 HydrophobicContact CD1-CD1 3.78Å; L368-I463 HydrophobicContact CD1-CG1 3.56Å; L368-F478 HydrophobicContact CD1-CD2 4.41Å; L368-F478 HydrophobicContact CD2-CD2 3.92Å; L368-F478 HydrophobicContact CD2-CE2 4.03Å
369	A	93.7	Very high	91.4	Very high	13 Å²	13	29.8 Å²	29.8	11%	0.107	15%	0.149	C	C	.	.	H	α-helix	trans	-57.7	-33.1	-175.7	0	0	0	0	0	113.2	V179 S367 E372 R373	V179-A369 HydrophobicContact CB-CB 4.01Å; V179-A369 HydrophobicContact CG1-CB 3.97Å; S367-A369 WeakPolarHBondContact OG-CB 3.22Å; S367-A369 PolarHBondContact OG-N 3Å; A369-E372 PolarHBondContact O-N 3.09Å; A369-R373 WeakPolarHBondContact O-CB 3.45Å; A369-R373 PolarHBondContact O-N 2.82Å
370	V	94.8	Very high	92.3	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.024	16%	0.157	C	C	.	.	H	α-helix	trans	-68.6	-45.5	175.5	-178.3	0	0	0	0	110.9	I177 V179 L197 D345 Y347 L368 E372 R373 N374	I177-V370 HydrophobicContact CG2-CG2 3.79Å; V179-V370 HydrophobicContact CG1-CG2 3.93Å; L197-V370 HydrophobicContact CD1-CG2 4.25Å; D345-V370 HydrophobicContact CB-CB 4.28Å; D345-V370 HydrophobicContact CB-CG1 3.96Å; Y347-V370 HydrophobicContact CD2-CG2 4.03Å; Y347-V370 HydrophobicContact CE2-CB 4.09Å; Y347-V370 HydrophobicContact CE2-CG2 3.56Å; L368-V370 PolarHBondContact O-N 3.23Å; L368-V370 VanDerWaalsContact O-N 3.16Å; V370-E372 VanDerWaalsContact C-N 3.32Å; V370-E372 PolarHBondContact O-N 3.37Å; V370-R373 PolarHBondContact O-N 3Å; V370-N374 WeakPolarHBondContact O-CB 3.46Å; V370-N374 PolarHBondContact O-N 2.99Å; V370-N374 PolarHBondContact O-ND2 3.02Å; V370-N374 PolarHBondContact O-OD1 2.95Å
371	C	95	Very high	92.7	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.7	-42.5	172.9	-68.2	0	0	0	0	111.9	D345 L368 N374 L375 L462 I472 V474	D345-C371 VanDerWaalsContact CB-SG 3.57Å; D345-C371 PolarHBondContact O-SG 2.73Å; D345-C371 VanDerWaalsContact O-SG 3.38Å; L368-C371 HydrophobicContact CB-CB 4.3Å; L368-C371 WeakPolarHBondContact O-CA 3.39Å; L368-C371 WeakPolarHBondContact O-CB 3.41Å; L368-C371 PolarHBondContact O-N 3.36Å; C371-N374 PolarHBondContact O-N 3.32Å; C371-L375 WeakPolarHBondContact O-CB 3.08Å; C371-L375 PolarHBondContact O-N 3.14Å; C371-L462 HydrophobicContact CB-CD1 3.49Å; C371-L462 VanDerWaalsContact CB-CD1 3.49Å; C371-I472 HydrophobicContact CB-CG2 4.45Å; C371-I472 WeakPolarHBondContact O-CG2 3.35Å; C371-V474 HydrophobicContact CB-CG2 4.05Å
372	E	95.4	Very high	93.2	Very high	13 Å²	13	39 Å²	39	6%	0.061	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-44.6	177.6	-69	165.6	-160.7	0	0	112.2	L368 A369 V370 N374 L375 L376 Y415 K418 H460 L462	L368-E372 WeakPolarHBondContact O-CG 3.49Å; L368-E372 PolarHBondContact O-N 2.74Å; A369-E372 PolarHBondContact O-N 3.09Å; V370-E372 VanDerWaalsContact C-N 3.32Å; V370-E372 PolarHBondContact O-N 3.37Å; E372-N374 VanDerWaalsContact C-N 3.26Å; E372-N374 PolarHBondContact O-N 2.85Å; E372-L375 WeakPolarHBondContact O-CB 3.46Å; E372-L375 PolarHBondContact O-N 3.35Å; E372-L376 WeakPolarHBondContact O-CG 3.47Å; E372-L376 PolarHBondContact O-N 3.06Å; E372-Y415 WeakPolarHBondContact OE1-CE2 3.42Å; E372-Y415 PolarHBondContact OE1-OH 3.32Å; E372-Y415 WeakPolarHBondContact OE2-CE2 3.07Å; E372-K418 WeakPolarHBondContact OE2-CE 3.42Å; E372-K418 IonicContact OE2-NZ 2.81Å; E372-K418 PolarHBondContact OE2-NZ 3.08Å; E372-H460 IonicContact OE1-CE1 3.64Å; E372-L462 HydrophobicContact CB-CD1 4.48Å; E372-L462 HydrophobicContact CG-CD1 3.58Å; E372-L462 HydrophobicContact CG-CG 4.18Å
373	R	94.5	Very high	93.6	Very high	47 Å²	47	38.3 Å²	38.3	18%	0.177	18%	0.177	C	C	.	.	H	α-helix	trans	-58.4	-43.4	174.6	-178.1	-175.3	71	170.4	0.8	110.3	G178 E184 A369 V370 L376 K377	G178-R373 PolarHBondContact O-NH1 2.89Å; E184-R373 HydrophobicContact CG-CB 4.36Å; E184-R373 HydrophobicContact CG-CG 4.15Å; A369-R373 WeakPolarHBondContact O-CB 3.45Å; A369-R373 PolarHBondContact O-N 2.82Å; V370-R373 PolarHBondContact O-N 3Å; R373-L376 PolarHBondContact O-N 3.35Å; R373-K377 WeakPolarHBondContact O-CB 3.42Å; R373-K377 WeakPolarHBondContact O-CG 3.35Å; R373-K377 PolarHBondContact O-N 2.78Å
374	N	94.9	Very high	93.8	Very high	44 Å²	44	37.4 Å²	37.4	24%	0.235	18%	0.179	C	C	.	.	H	α-helix	trans	-65.3	-40.8	177.3	-68.3	-13	0	0	0	111.3	D345 V370 C371 E372 K377 Y378	D345-N374 PolarHBondContact OD2-ND2 2.86Å; V370-N374 WeakPolarHBondContact O-CB 3.46Å; V370-N374 PolarHBondContact O-N 2.99Å; V370-N374 PolarHBondContact O-ND2 3.02Å; V370-N374 PolarHBondContact O-OD1 2.95Å; C371-N374 PolarHBondContact O-N 3.32Å; E372-N374 VanDerWaalsContact C-N 3.26Å; E372-N374 PolarHBondContact O-N 2.85Å; N374-K377 PolarHBondContact O-N 3.06Å; N374-Y378 WeakPolarHBondContact O-CB 3.4Å; N374-Y378 PolarHBondContact O-N 3.33Å
375	L	95.4	Very high	93.7	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-46.5	173.8	175	60.8	0	0	0	112	C371 E372 K377 Y378 L379 V422 L426 L462 I472	C371-L375 WeakPolarHBondContact O-CB 3.08Å; C371-L375 PolarHBondContact O-N 3.14Å; E372-L375 WeakPolarHBondContact O-CB 3.46Å; E372-L375 PolarHBondContact O-N 3.35Å; L375-K377 VanDerWaalsContact C-N 3.35Å; L375-K377 PolarHBondContact O-N 2.8Å; L375-Y378 WeakPolarHBondContact O-CB 3.33Å; L375-Y378 PolarHBondContact O-N 2.9Å; L375-L379 HydrophobicContact CD1-CD1 3.77Å; L375-L379 HydrophobicContact CD1-CD2 4.49Å; L375-L379 HydrophobicContact CD1-CG 3.9Å; L375-L379 HydrophobicContact CG-CD1 3.81Å; L375-L379 HydrophobicContact CG-CG 4.37Å; L375-L379 WeakPolarHBondContact O-CB 3.49Å; L375-L379 VanDerWaalsContact O-CG 3.28Å; L375-L379 WeakPolarHBondContact O-CG 3.38Å; L375-L379 PolarHBondContact O-N 2.8Å; L375-V422 HydrophobicContact CD2-CG1 3.58Å; L375-L426 HydrophobicContact CD1-CD2 4.19Å; L375-L426 HydrophobicContact CD2-CD1 4.41Å; L375-L462 HydrophobicContact CD2-CD2 3.57Å; L375-I472 HydrophobicContact CB-CD1 4.28Å; L375-I472 HydrophobicContact CB-CG1 4.22Å; L375-I472 HydrophobicContact CB-CG2 4.18Å; L375-I472 HydrophobicContact CD1-CD1 4.27Å; L375-I472 HydrophobicContact CD1-CG1 3.92Å
376	L	94.6	Very high	93.5	Very high	20 Å²	20	51.9 Å²	51.9	11%	0.105	25%	0.25	C	S	.	.	H	α-helix	trans	-61.3	-43.5	176.9	-73.4	177.7	0	0	0	111.6	E184 E372 R373 Y378 L379 A380 V422 L425	E184-L376 HydrophobicContact CB-CD1 4.46Å; E184-L376 HydrophobicContact CG-CD1 4.27Å; E372-L376 WeakPolarHBondContact O-CG 3.47Å; E372-L376 PolarHBondContact O-N 3.06Å; R373-L376 PolarHBondContact O-N 3.35Å; L376-Y378 VanDerWaalsContact C-N 3.34Å; L376-Y378 PolarHBondContact O-N 2.94Å; L376-L379 PolarHBondContact O-N 3.18Å; L376-A380 VanDerWaalsContact O-CB 3.25Å; L376-A380 WeakPolarHBondContact O-CB 3.47Å; L376-A380 PolarHBondContact O-N 3.44Å; L376-V422 HydrophobicContact CD2-CG2 3.89Å; L376-L425 HydrophobicContact CD2-CD1 4.24Å
377	K	94.1	Very high	93.6	Very high	110 Å²	110	52 Å²	52	48%	0.478	25%	0.252	S	S	.	.	H	α-helix	trans	-60.7	-43	174.2	-75.7	177.9	178.9	-178.9	0	111.9	R373 N374 L375 K381	R373-K377 WeakPolarHBondContact O-CB 3.42Å; R373-K377 WeakPolarHBondContact O-CG 3.35Å; R373-K377 PolarHBondContact O-N 2.78Å; N374-K377 PolarHBondContact O-N 3.06Å; L375-K377 VanDerWaalsContact C-N 3.35Å; L375-K377 PolarHBondContact O-N 2.8Å; K377-K381 WeakPolarHBondContact O-CG 3.38Å; K377-K381 PolarHBondContact O-N 3.33Å
378	Y	94.9	Very high	93.7	Very high	45 Å²	45	51.5 Å²	51.5	18%	0.176	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-46.4	177.5	173.8	-87	0	0	0	111.8	N374 L375 L376 K381 R382 P469 D471 I472	N374-Y378 WeakPolarHBondContact O-CB 3.4Å; N374-Y378 PolarHBondContact O-N 3.33Å; L375-Y378 WeakPolarHBondContact O-CB 3.33Å; L375-Y378 PolarHBondContact O-N 2.9Å; L376-Y378 VanDerWaalsContact C-N 3.34Å; L376-Y378 PolarHBondContact O-N 2.94Å; Y378-K381 PolarHBondContact O-N 2.95Å; Y378-R382 VanDerWaalsContact CZ-CZ 3.45Å; Y378-R382 PolarHBondContact OH-NH1 3.29Å; Y378-R382 VanDerWaalsContact OH-NH1 3.17Å; Y378-R382 PolarHBondContact OH-NH2 3.3Å; Y378-P469 HydrophobicContact CD1-CG 3.92Å; Y378-P469 HydrophobicContact CE1-CB 3.92Å; Y378-P469 HydrophobicContact CE1-CG 3.32Å; Y378-D471 HydrophobicContact CE2-CB 4.2Å; Y378-D471 WeakPolarHBondContact CE2-OD2 3.21Å; Y378-I472 HydrophobicContact CD1-CD1 4.4Å; Y378-I472 HydrophobicContact CD2-CD1 4.25Å; Y378-I472 HydrophobicContact CG-CD1 3.87Å
379	L	93.9	Very high	93.7	Very high	17 Å²	17	52 Å²	52	9%	0.089	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-45.8	178.5	-69.8	167.6	0	0	0	110.9	L375 L376 K381 R382 L383 L425 L426	L375-L379 HydrophobicContact CD1-CD1 3.77Å; L375-L379 HydrophobicContact CD1-CD2 4.49Å; L375-L379 HydrophobicContact CD1-CG 3.9Å; L375-L379 HydrophobicContact CG-CD1 3.81Å; L375-L379 HydrophobicContact CG-CG 4.37Å; L375-L379 WeakPolarHBondContact O-CB 3.49Å; L375-L379 VanDerWaalsContact O-CG 3.28Å; L375-L379 WeakPolarHBondContact O-CG 3.38Å; L375-L379 PolarHBondContact O-N 2.8Å; L376-L379 PolarHBondContact O-N 3.18Å; L379-K381 PolarHBondContact O-N 2.94Å; L379-R382 WeakPolarHBondContact O-CA 2.8Å; L379-R382 WeakPolarHBondContact O-CB 3.47Å; L379-R382 PolarHBondContact O-N 3.21Å; L379-L383 WeakPolarHBondContact O-CG 3.26Å; L379-L383 PolarHBondContact O-N 2.93Å; L379-L383 VanDerWaalsContact O-N 3.17Å; L379-L425 HydrophobicContact CD1-CB 3.92Å; L379-L425 HydrophobicContact CD1-CD1 4.23Å; L379-L426 HydrophobicContact CD1-CD2 4.48Å; L379-L426 HydrophobicContact CD2-CD2 4.3Å
380	A	93.1	Very high	93.6	Very high	42 Å²	42	53.6 Å²	53.6	35%	0.347	26%	0.257	S	S	.	.	H	α-helix	trans	-55.3	-37.2	-179.9	0	0	0	0	0	113	L376 R382 L383	L376-A380 VanDerWaalsContact O-CB 3.25Å; L376-A380 WeakPolarHBondContact O-CB 3.47Å; L376-A380 PolarHBondContact O-N 3.44Å; A380-R382 PolarHBondContact O-N 3.11Å; A380-L383 PolarHBondContact O-N 3.24Å
381	K	94.3	Very high	93.6	Very high	184 Å²	184	55.6 Å²	55.6	80%	0.8	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.3	175.6	-71	176.4	-178.5	-176.4	0	114.1	K377 Y378 L379	K377-K381 WeakPolarHBondContact O-CG 3.38Å; K377-K381 PolarHBondContact O-N 3.33Å; Y378-K381 PolarHBondContact O-N 2.95Å; L379-K381 PolarHBondContact O-N 2.94Å
382	R	93.8	Very high	93.5	Very high	150 Å²	150	55.6 Å²	55.6	57%	0.566	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-9.7	-177.4	-65.4	-179.4	163.3	-152.4	-3.8	113.3	Y378 L379 A380 T430	Y378-R382 VanDerWaalsContact CZ-CZ 3.45Å; Y378-R382 PolarHBondContact OH-NH1 3.29Å; Y378-R382 VanDerWaalsContact OH-NH1 3.17Å; Y378-R382 PolarHBondContact OH-NH2 3.3Å; L379-R382 WeakPolarHBondContact O-CA 2.8Å; L379-R382 WeakPolarHBondContact O-CB 3.47Å; L379-R382 PolarHBondContact O-N 3.21Å; A380-R382 PolarHBondContact O-N 3.11Å; R382-T430 HydrophobicContact CB-CG2 4.28Å; R382-T430 WeakPolarHBondContact O-CB 3.5Å
383	L	95.1	Very high	93.5	Very high	19 Å²	19	55.2 Å²	55.2	10%	0.099	27%	0.265	C	S	.	.	S	Bend	trans	-78.7	157.1	176.9	-66.8	176.2	0	0	0	110.6	L379 A380 S387 H389 L425 T430 W433	L379-L383 WeakPolarHBondContact O-CG 3.26Å; L379-L383 PolarHBondContact O-N 2.93Å; L379-L383 VanDerWaalsContact O-N 3.17Å; A380-L383 PolarHBondContact O-N 3.24Å; L383-S387 WeakPolarHBondContact CB-OG 3.36Å; L383-H389 HydrophobicContact CD1-CB 4.09Å; L383-H389 VanDerWaalsContact CD1-CG 3.47Å; L383-H389 WeakPolarHBondContact CD1-ND1 3.32Å; L383-L425 HydrophobicContact CD1-CD2 3.88Å; L383-L425 HydrophobicContact CD2-CD2 4.06Å; L383-T430 HydrophobicContact CD2-CG2 4.31Å; L383-W433 HydrophobicContact CD2-CB 3.87Å; L383-W433 HydrophobicContact CD2-CG 3.8Å
384	P	93.4	Very high	93.4	Very high	43 Å²	43	53.2 Å²	53.2	28%	0.279	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-55	153.2	171.5	-24.7	33.6	0	0	0	112	N386 S387 T430	P384-N386 PolarHBondContact O-N 2.89Å; P384-S387 VanDerWaalsContact O-CB 3.32Å; P384-S387 WeakPolarHBondContact O-CB 3.48Å; P384-S387 PolarHBondContact O-N 3.21Å; P384-S387 PolarHBondContact O-OG 3.46Å; P384-T430 WeakPolarHBondContact CD-O 3.46Å; P384-T430 WeakPolarHBondContact CG-O 3.39Å
385	Q	87.8	Confident	93.4	Very high	181 Å²	181	51.1 Å²	51.1	85%	0.846	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	136.3	168.9	-167.9	175.1	6.3	0	0	109.3
386	N	86.4	Confident	93.3	Very high	127 Å²	127	51.1 Å²	51.1	68%	0.679	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	45.2	-174.7	-54.3	-28.1	0	0	0	113.5	P384 A435	P384-N386 PolarHBondContact O-N 2.89Å; N386-A435 WeakPolarHBondContact O-CB 3.49Å; N386-A435 PolarHBondContact O-N 3.47Å
387	S	93.8	Very high	93.2	Very high	16 Å²	16	50.6 Å²	50.6	11%	0.112	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-70.2	143.4	176.6	49.4	0	0	0	0	112.5	L383 P384 H389 W433	L383-S387 WeakPolarHBondContact CB-OG 3.36Å; P384-S387 VanDerWaalsContact O-CB 3.32Å; P384-S387 WeakPolarHBondContact O-CB 3.48Å; P384-S387 PolarHBondContact O-N 3.21Å; P384-S387 PolarHBondContact O-OG 3.46Å; S387-H389 VanDerWaalsContact C-N 3.26Å; S387-H389 PolarHBondContact O-N 3.14Å; S387-H389 PolarHBondContact OG-CE1 3.38Å; S387-H389 PolarHBondContact OG-ND1 3.09Å; S387-W433 CarbonylContact C-O 3.55Å; S387-W433 WeakPolarHBondContact CA-O 3.36Å; S387-W433 WeakPolarHBondContact CB-O 3.35Å
388	C	93.8	Very high	93.2	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	22%	0.221	C	C	.	.	S	Bend	trans	-82.1	3.7	-172.4	69	0	0	0	0	114.5	H391 C392 W433 L438	C388-H391 WeakPolarHBondContact O-CB 3.31Å; C388-H391 PolarHBondContact O-N 2.99Å; C388-C392 PolarHBondContact O-N 3.41Å; C388-C392 PolarHBondContact O-SG 3.25Å; C388-W433 PolarHBondContact N-O 3Å; C388-L438 HydrophobicContact CB-CB 3.93Å; C388-L438 HydrophobicContact CB-CD1 3.95Å
389	H	94.2	Very high	93.1	Very high	16 Å²	16	43.2 Å²	43.2	7%	0.074	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-49	-170.7	68.1	-68.1	0	0	0	112.8	L383 S387 H391 C392 L393 M421 L425 W433	L383-H389 HydrophobicContact CD1-CB 4.09Å; L383-H389 VanDerWaalsContact CD1-CG 3.47Å; L383-H389 WeakPolarHBondContact CD1-ND1 3.32Å; S387-H389 VanDerWaalsContact C-N 3.26Å; S387-H389 PolarHBondContact O-N 3.14Å; S387-H389 PolarHBondContact OG-CE1 3.38Å; S387-H389 PolarHBondContact OG-ND1 3.09Å; H389-H391 VanDerWaalsContact C-N 3.28Å; H389-H391 PolarHBondContact O-N 3.02Å; H389-C392 PolarHBondContact O-N 3.01Å; H389-L393 PolarHBondContact O-N 3.17Å; H389-M421 VanDerWaalsContact C-CE 3.41Å; H389-M421 HydrophobicContact CB-CE 3.72Å; H389-M421 WeakPolarHBondContact O-CE 3.43Å; H389-L425 HydrophobicContact CB-CD2 4.09Å; H389-W433 HydrophobicContact CB-CD2 4.48Å; H389-W433 HydrophobicContact CB-CE3 3.81Å; H389-W433 HydrophobicContact CB-CZ3 4.15Å
390	L	93.1	Very high	93.1	Very high	45 Å²	45	42.6 Å²	42.6	24%	0.236	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-36.5	176.1	-61.8	-179	0	0	0	111.5	W186 C392 L393 Q394	W186-L390 HydrophobicContact CB-CD2 4.29Å; L390-C392 PolarHBondContact O-N 3.37Å; L390-L393 PolarHBondContact O-N 2.7Å; L390-Q394 WeakPolarHBondContact O-CB 3.48Å; L390-Q394 WeakPolarHBondContact O-CG 3.2Å; L390-Q394 PolarHBondContact O-N 3.36Å
391	H	93.3	Very high	93	Very high	46 Å²	46	45.2 Å²	45.2	21%	0.213	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-42.1	176	-65.6	113.4	0	0	0	112.7	C132 T136 C388 H389 L393 Q394 V395 L438	C132-H391 HydrophobicContact CB-CB 4.47Å; C132-H391 VanDerWaalsContact CB-CD2 3.43Å; C132-H391 WeakPolarHBondContact CB-CD2 3.45Å; T136-H391 PolarHBondContact OG1-NE2 2.94Å; C388-H391 WeakPolarHBondContact O-CB 3.31Å; C388-H391 PolarHBondContact O-N 2.99Å; H389-H391 VanDerWaalsContact C-N 3.28Å; H389-H391 PolarHBondContact O-N 3.02Å; H391-L393 VanDerWaalsContact C-N 3.32Å; H391-L393 PolarHBondContact O-N 3.47Å; H391-Q394 PolarHBondContact CD2-OE1 2.72Å; H391-Q394 WeakPolarHBondContact O-CB 3.35Å; H391-Q394 PolarHBondContact O-N 2.65Å; H391-V395 WeakPolarHBondContact O-CG2 3.42Å; H391-V395 PolarHBondContact O-N 3.35Å; H391-L438 HydrophobicContact CB-CD1 3.72Å
392	C	94.6	Very high	92.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-44.4	174.3	-65.1	0	0	0	0	111.4	C388 H389 L390 V395 A396 M421 L442	C388-C392 PolarHBondContact O-N 3.41Å; C388-C392 PolarHBondContact O-SG 3.25Å; H389-C392 PolarHBondContact O-N 3.01Å; L390-C392 PolarHBondContact O-N 3.37Å; C392-V395 PolarHBondContact O-N 3.31Å; C392-A396 WeakPolarHBondContact O-CB 3.27Å; C392-A396 PolarHBondContact O-N 3.37Å; C392-M421 HydrophobicContact CB-CE 3.52Å; C392-L442 HydrophobicContact CB-CD1 4.34Å
393	L	94.2	Very high	92.8	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-67.4	-39.8	179.3	-173.3	57.8	0	0	0	111.7	W186 H389 L390 H391 T397 F417 K418	W186-L393 HydrophobicContact CB-CD2 4.21Å; W186-L393 HydrophobicContact CB-CG 4.47Å; W186-L393 HydrophobicContact CD2-CD2 3.42Å; W186-L393 VanDerWaalsContact CD2-CD2 3.42Å; W186-L393 HydrophobicContact CD2-CG 3.83Å; W186-L393 HydrophobicContact CE3-CD2 3.92Å; W186-L393 HydrophobicContact CE3-CG 3.8Å; W186-L393 HydrophobicContact CG-CD2 3.56Å; W186-L393 HydrophobicContact CG-CG 4.14Å; W186-L393 HydrophobicContact CZ2-CD2 4.21Å; W186-L393 HydrophobicContact CZ3-CG 4.35Å; H389-L393 PolarHBondContact O-N 3.17Å; L390-L393 PolarHBondContact O-N 2.7Å; H391-L393 VanDerWaalsContact C-N 3.32Å; H391-L393 PolarHBondContact O-N 3.47Å; L393-T397 HydrophobicContact CD1-CG2 3.85Å; L393-T397 HydrophobicContact CG-CG2 4.34Å; L393-T397 WeakPolarHBondContact O-CB 3.4Å; L393-T397 WeakPolarHBondContact O-CG2 3.41Å; L393-T397 PolarHBondContact O-N 3.27Å; L393-T397 PolarHBondContact O-OG1 3.1Å; L393-F417 HydrophobicContact CD1-CB 4.05Å; L393-K418 HydrophobicContact CD1-CB 4.26Å; L393-K418 HydrophobicContact CD2-CB 4.41Å; L393-K418 HydrophobicContact CD2-CG 4.38Å
394	Q	93.4	Very high	92.6	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.019	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-50.4	174.1	-77.3	174.8	-21.4	0	0	111.6	W186 V188 L390 H391 T397 F398	W186-Q394 HydrophobicContact CB-CG 4.04Å; W186-Q394 WeakPolarHBondContact O-CG 3.08Å; V188-Q394 HydrophobicContact CG2-CB 3.33Å; V188-Q394 HydrophobicContact CG2-CG 3.44Å; V188-Q394 VanDerWaalsContact CG2-CG 3.44Å; L390-Q394 WeakPolarHBondContact O-CB 3.48Å; L390-Q394 WeakPolarHBondContact O-CG 3.2Å; L390-Q394 PolarHBondContact O-N 3.36Å; H391-Q394 PolarHBondContact CD2-OE1 2.72Å; H391-Q394 WeakPolarHBondContact O-CB 3.35Å; H391-Q394 PolarHBondContact O-N 2.65Å; Q394-T397 PolarHBondContact O-OG1 3.01Å; Q394-F398 WeakPolarHBondContact O-CB 3.48Å; Q394-F398 PolarHBondContact O-N 3.09Å
395	V	93.6	Very high	92.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-50.2	178.2	173.9	0	0	0	0	110.8	M123 L128 F131 H391 C392 T397 F398 L399 L442 L515	M123-V395 HydrophobicContact SD-CG1 4.45Å; L128-V395 HydrophobicContact CD2-CG1 4.05Å; L128-V395 HydrophobicContact CD2-CG2 3.98Å; F131-V395 HydrophobicContact CD1-CG2 3.54Å; F131-V395 HydrophobicContact CE1-CB 4.25Å; F131-V395 HydrophobicContact CE1-CG2 3.5Å; F131-V395 VanDerWaalsContact CE1-CG2 3.5Å; H391-V395 WeakPolarHBondContact O-CG2 3.42Å; H391-V395 PolarHBondContact O-N 3.35Å; C392-V395 PolarHBondContact O-N 3.31Å; V395-T397 PolarHBondContact O-N 3.38Å; V395-F398 PolarHBondContact O-N 2.95Å; V395-L399 HydrophobicContact CG1-CD1 3.81Å; V395-L399 HydrophobicContact CG1-CG 4.3Å; V395-L399 WeakPolarHBondContact O-CB 3.47Å; V395-L399 VanDerWaalsContact O-CG 3.31Å; V395-L399 WeakPolarHBondContact O-CG 3.35Å; V395-L399 PolarHBondContact O-N 2.89Å; V395-L442 HydrophobicContact CB-CD1 4.19Å; V395-L442 HydrophobicContact CB-CD2 4.19Å; V395-L442 HydrophobicContact CG1-CD1 4.12Å; V395-L442 HydrophobicContact CG1-CD2 3.59Å; V395-L515 HydrophobicContact CG1-CD1 4.39Å; V395-L515 HydrophobicContact CG1-CD2 4.34Å
396	A	94.6	Very high	92.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-43.1	-176.7	0	0	0	0	0	112.5	C392 L399 H400 F417 L442 F446	C392-A396 WeakPolarHBondContact O-CB 3.27Å; C392-A396 PolarHBondContact O-N 3.37Å; A396-L399 PolarHBondContact O-N 3.09Å; A396-H400 WeakPolarHBondContact O-CB 3.42Å; A396-H400 PolarHBondContact O-N 2.88Å; A396-F417 HydrophobicContact CB-CD1 3.64Å; A396-F417 HydrophobicContact CB-CE1 4.16Å; A396-F417 HydrophobicContact CB-CG 4.33Å; A396-L442 HydrophobicContact CB-CD1 4.34Å; A396-F446 HydrophobicContact CB-CE1 3.89Å; A396-F446 HydrophobicContact CB-CZ 4.05Å
397	T	93.1	Very high	92.6	Very high	9 Å²	9	29.9 Å²	29.9	6%	0.055	16%	0.157	C	C	.	.	H	α-helix	trans	-74.1	-32.6	179.9	57.9	0	0	0	0	112.6	W186 L393 Q394 V395 R401 F417	W186-T397 HydrophobicContact CE3-CG2 4.23Å; W186-T397 HydrophobicContact CZ3-CG2 3.7Å; L393-T397 HydrophobicContact CD1-CG2 3.85Å; L393-T397 HydrophobicContact CG-CG2 4.34Å; L393-T397 WeakPolarHBondContact O-CB 3.4Å; L393-T397 WeakPolarHBondContact O-CG2 3.41Å; L393-T397 PolarHBondContact O-N 3.27Å; L393-T397 PolarHBondContact O-OG1 3.1Å; Q394-T397 PolarHBondContact O-OG1 3.01Å; V395-T397 PolarHBondContact O-N 3.38Å; T397-R401 WeakPolarHBondContact O-CB 3.12Å; T397-R401 PolarHBondContact O-N 3.21Å; T397-F417 HydrophobicContact CG2-CB 4.13Å
398	F	92.7	Very high	92.3	Very high	1 Å²	1	30.8 Å²	30.8	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-51.9	169.9	168.3	-95	0	0	0	111.5	F131 V188 Q394 V395 H400 R401 K402 L515 Y518	F131-F398 HydrophobicContact CE2-CB 4.26Å; F131-F398 AromaticContact CE2-CD1 3.61Å; F131-F398 HydrophobicContact CE2-CD1 3.61Å; F131-F398 AromaticContact CE2-CD2 3.86Å; F131-F398 HydrophobicContact CE2-CD2 3.86Å; F131-F398 AromaticContact CE2-CE1 3.87Å; F131-F398 HydrophobicContact CE2-CE1 3.87Å; F131-F398 HydrophobicContact CE2-CE2 4.09Å; F131-F398 AromaticContact CE2-CG 3.62Å; F131-F398 HydrophobicContact CE2-CG 3.62Å; F131-F398 HydrophobicContact CE2-CZ 4.1Å; F131-F398 HydrophobicContact CZ-CB 3.68Å; F131-F398 AromaticContact CZ-CD1 3.83Å; F131-F398 HydrophobicContact CZ-CD1 3.83Å; F131-F398 HydrophobicContact CZ-CD2 4.06Å; F131-F398 AromaticContact CZ-CG 3.57Å; F131-F398 HydrophobicContact CZ-CG 3.57Å; V188-F398 HydrophobicContact CB-CB 4.49Å; V188-F398 HydrophobicContact CG1-CB 4.15Å; V188-F398 HydrophobicContact CG1-CD2 4.02Å; V188-F398 HydrophobicContact CG1-CG 4.44Å; Q394-F398 WeakPolarHBondContact O-CB 3.48Å; Q394-F398 PolarHBondContact O-N 3.09Å; V395-F398 PolarHBondContact O-N 2.95Å; F398-H400 PolarHBondContact O-N 2.81Å; F398-R401 PolarHBondContact O-N 2.95Å; F398-K402 HydrophobicContact CD2-CG 4.37Å; F398-K402 HydrophobicContact CE1-CG 4.05Å; F398-K402 HydrophobicContact CE2-CD 4.43Å; F398-K402 HydrophobicContact CE2-CG 3.89Å; F398-K402 HydrophobicContact CZ-CD 4.35Å; F398-K402 HydrophobicContact CZ-CG 3.7Å; F398-K402 WeakPolarHBondContact O-CG 3.31Å; F398-K402 PolarHBondContact O-N 2.8Å; F398-L515 HydrophobicContact CD1-CD2 4.18Å; F398-L515 HydrophobicContact CE1-CD2 4.15Å; F398-Y518 HydrophobicContact CE2-CD1 4.2Å; F398-Y518 AromaticContact CE2-CD2 3.57Å; F398-Y518 HydrophobicContact CE2-CD2 3.57Å; F398-Y518 HydrophobicContact CE2-CE1 4.43Å; F398-Y518 AromaticContact CE2-CE2 3.84Å; F398-Y518 HydrophobicContact CE2-CE2 3.84Å; F398-Y518 AromaticContact CE2-CG 3.75Å; F398-Y518 HydrophobicContact CE2-CG 3.75Å; F398-Y518 HydrophobicContact CZ-CD1 4.28Å; F398-Y518 AromaticContact CZ-CD2 3.74Å; F398-Y518 HydrophobicContact CZ-CD2 3.74Å; F398-Y518 HydrophobicContact CZ-CE2 4.47Å; F398-Y518 AromaticContact CZ-CG 3.62Å; F398-Y518 HydrophobicContact CZ-CG 3.62Å
399	L	93.1	Very high	91.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-47.5	180	-73.6	175	0	0	0	111.2	V395 A396 R401 K402 Q403 F446 M507 A511 L514 L515	V395-L399 HydrophobicContact CG1-CD1 3.81Å; V395-L399 HydrophobicContact CG1-CG 4.3Å; V395-L399 WeakPolarHBondContact O-CB 3.47Å; V395-L399 VanDerWaalsContact O-CG 3.31Å; V395-L399 WeakPolarHBondContact O-CG 3.35Å; V395-L399 PolarHBondContact O-N 2.89Å; A396-L399 PolarHBondContact O-N 3.09Å; L399-R401 VanDerWaalsContact C-N 3.34Å; L399-R401 PolarHBondContact O-N 3.49Å; L399-K402 PolarHBondContact O-N 2.84Å; L399-Q403 WeakPolarHBondContact O-CB 3.45Å; L399-Q403 PolarHBondContact O-N 3.3Å; L399-F446 HydrophobicContact CD1-CZ 3.92Å; L399-M507 HydrophobicContact CB-CG 3.94Å; L399-M507 HydrophobicContact CB-SD 4.18Å; L399-A511 HydrophobicContact CD1-CB 3.69Å; L399-A511 HydrophobicContact CD2-CB 3.87Å; L399-A511 HydrophobicContact CG-CB 4.41Å; L399-L514 HydrophobicContact CD2-CB 3.91Å; L399-L514 HydrophobicContact CD2-CD1 4.16Å; L399-L515 HydrophobicContact CD2-CG 4.13Å
400	H	93.5	Very high	91.7	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-57.7	-46	176.3	172	54	0	0	0	111.9	A396 F398 K402 Q403 L404 L412 F417 H503 M507	A396-H400 WeakPolarHBondContact O-CB 3.42Å; A396-H400 PolarHBondContact O-N 2.88Å; F398-H400 PolarHBondContact O-N 2.81Å; H400-K402 PolarHBondContact O-N 3.3Å; H400-Q403 PolarHBondContact O-N 3.2Å; H400-L404 WeakPolarHBondContact O-CG 3.09Å; H400-L404 PolarHBondContact O-N 2.9Å; H400-L412 PolarHBondContact CE1-O 3.21Å; H400-L412 PolarHBondContact NE2-O 3.43Å; H400-L412 VanDerWaalsContact NE2-O 3.1Å; H400-F417 HydrophobicContact CB-CD2 4.36Å; H400-F417 HydrophobicContact CB-CE2 3.59Å; H400-F417 HydrophobicContact CB-CZ 3.83Å; H400-F417 AromaticContact CD2-CE2 3.77Å; H400-F417 AromaticContact CG-CE2 3.48Å; H400-F417 VanDerWaalsContact CG-CE2 3.48Å; H400-F417 AromaticContact ND1-CE2 3.94Å; H400-H503 AromaticContact CE1-NE2 3.49Å; H400-H503 PolarHBondContact CE1-NE2 3.25Å; H400-H503 AromaticContact ND1-CD2 3.95Å; H400-H503 AromaticContact ND1-CE1 3.82Å; H400-H503 AromaticContact ND1-NE2 2.94Å; H400-H503 PolarHBondContact ND1-NE2 2.92Å; H400-M507 VanDerWaalsContact CA-SD 3.51Å; H400-M507 HydrophobicContact CB-SD 3.77Å; H400-M507 PolarHBondContact N-SD 3.37Å
401	R	90.9	Very high	91.5	Very high	97 Å²	97	37.7 Å²	37.7	37%	0.366	21%	0.206	S	C	.	.	H	α-helix	trans	-66.6	-37.6	179.9	-171.5	172	177.9	168.3	-2.5	113	C189 Q190 T397 F398 L399 L404 S405	C189-R401 VanDerWaalsContact CB-CD 3.48Å; C189-R401 VanDerWaalsContact CB-NH1 3.34Å; C189-R401 PolarHBondContact O-NH1 3.25Å; Q190-R401 PolarHBondContact O-NH2 2.92Å; T397-R401 WeakPolarHBondContact O-CB 3.12Å; T397-R401 PolarHBondContact O-N 3.21Å; F398-R401 PolarHBondContact O-N 2.95Å; L399-R401 VanDerWaalsContact C-N 3.34Å; L399-R401 PolarHBondContact O-N 3.49Å; R401-L404 PolarHBondContact O-N 2.59Å; R401-S405 PolarHBondContact O-N 3.24Å
402	K	91	Very high	91.5	Very high	68 Å²	68	35.6 Å²	35.6	30%	0.296	20%	0.196	S	C	.	.	H	α-helix	trans	-64.8	-43.1	172.8	-75.1	-66.4	-170.7	165.7	0	110.9	F398 L399 H400 L404 S405 L514	F398-K402 HydrophobicContact CD2-CG 4.37Å; F398-K402 HydrophobicContact CE1-CG 4.05Å; F398-K402 HydrophobicContact CE2-CD 4.43Å; F398-K402 HydrophobicContact CE2-CG 3.89Å; F398-K402 HydrophobicContact CZ-CD 4.35Å; F398-K402 HydrophobicContact CZ-CG 3.7Å; F398-K402 WeakPolarHBondContact O-CG 3.31Å; F398-K402 PolarHBondContact O-N 2.8Å; L399-K402 PolarHBondContact O-N 2.84Å; H400-K402 PolarHBondContact O-N 3.3Å; K402-L404 VanDerWaalsContact C-N 3.35Å; K402-L404 PolarHBondContact O-N 3.1Å; K402-S405 PolarHBondContact O-N 3.36Å; K402-S405 VanDerWaalsContact O-N 3.17Å; K402-S405 PolarHBondContact O-OG 3.44Å; K402-L514 HydrophobicContact CB-CD1 3.95Å; K402-L514 HydrophobicContact CB-CD2 4.09Å
403	Q	92.4	Very high	91.4	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-39.1	175.9	-167.3	66.3	22.6	0	0	112.1	L399 H400 S405 L406 T407 E506 M507 N510	L399-Q403 WeakPolarHBondContact O-CB 3.45Å; L399-Q403 PolarHBondContact O-N 3.3Å; H400-Q403 PolarHBondContact O-N 3.2Å; Q403-S405 PolarHBondContact O-N 3.36Å; Q403-L406 WeakPolarHBondContact O-CA 3.39Å; Q403-L406 WeakPolarHBondContact O-CB 3.44Å; Q403-L406 PolarHBondContact O-N 2.91Å; Q403-T407 HydrophobicContact CG-CG2 3.99Å; Q403-T407 PolarHBondContact O-N 2.84Å; Q403-T407 PolarHBondContact O-OG1 2.76Å; Q403-T407 VanDerWaalsContact O-OG1 3.11Å; Q403-E506 PolarHBondContact NE2-OE2 3.42Å; Q403-M507 HydrophobicContact CB-CB 3.92Å; Q403-M507 HydrophobicContact CB-CG 4.09Å; Q403-M507 HydrophobicContact CG-CB 3.86Å; Q403-N510 PolarHBondContact OE1-ND2 3.17Å
404	L	91.4	Very high	91.3	Very high	52 Å²	52	39.2 Å²	39.2	27%	0.272	22%	0.22	S	C	.	.	H	α-helix	trans	-56.9	-36	175.3	-78.1	174.6	0	0	0	111.7	H400 R401 K402 L406 G408	H400-L404 WeakPolarHBondContact O-CG 3.09Å; H400-L404 PolarHBondContact O-N 2.9Å; R401-L404 PolarHBondContact O-N 2.59Å; K402-L404 VanDerWaalsContact C-N 3.35Å; K402-L404 PolarHBondContact O-N 3.1Å; L404-L406 PolarHBondContact O-N 3.47Å; L404-G408 WeakPolarHBondContact CD2-O 3.4Å; L404-G408 VanDerWaalsContact O-CA 3.31Å; L404-G408 WeakPolarHBondContact O-CA 3.42Å; L404-G408 PolarHBondContact O-N 3.47Å
405	S	89.6	Confident	91.3	Very high	92 Å²	92	42.1 Å²	42.1	64%	0.643	23%	0.232	S	C	*	.	H	α-helix	trans	-68.9	-17.7	175.9	71	0	0	0	0	114.2	R401 K402 Q403	R401-S405 PolarHBondContact O-N 3.24Å; K402-S405 PolarHBondContact O-N 3.36Å; K402-S405 VanDerWaalsContact O-N 3.17Å; K402-S405 PolarHBondContact O-OG 3.44Å; Q403-S405 PolarHBondContact O-N 3.36Å
406	L	90	Very high	91.4	Very high	113 Å²	113	43.2 Å²	43.2	59%	0.592	24%	0.237	S	C	*	.	H	α-helix	trans	-98.1	-40.7	179.4	-59.5	175.1	0	0	0	112.2	Q403 L404	Q403-L406 WeakPolarHBondContact O-CA 3.39Å; Q403-L406 WeakPolarHBondContact O-CB 3.44Å; Q403-L406 PolarHBondContact O-N 2.91Å; L404-L406 PolarHBondContact O-N 3.47Å
407	T	88	Confident	91.4	Very high	55 Å²	55	43.2 Å²	43.2	34%	0.337	24%	0.237	S	C	.	.	H	α-helix	trans	-101.1	-12.3	-173	60.3	0	0	0	0	114.3	Q403 H503 E506	Q403-T407 HydrophobicContact CG-CG2 3.99Å; Q403-T407 PolarHBondContact O-N 2.84Å; Q403-T407 PolarHBondContact O-OG1 2.76Å; Q403-T407 VanDerWaalsContact O-OG1 3.11Å; T407-H503 PolarHBondContact OG1-ND1 3.33Å; T407-E506 WeakPolarHBondContact CG2-OE2 3.46Å
408	G	86.9	Confident	91.6	Very high	36 Å²	36	43.3 Å²	43.3	37%	0.371	24%	0.236	S	C	.	.			trans	79	-161.1	-167	0	0	0	0	0	112.6	L404	L404-G408 WeakPolarHBondContact CD2-O 3.4Å; L404-G408 VanDerWaalsContact O-CA 3.31Å; L404-G408 WeakPolarHBondContact O-CA 3.42Å; L404-G408 PolarHBondContact O-N 3.47Å
409	E	85.6	Confident	91.8	Very high	164 Å²	164	43.4 Å²	43.4	77%	0.766	24%	0.237	S	C	*	.			trans	-60.8	145.8	-172.6	-66.3	-179.8	179.3	0	0	113.5
410	S	90.1	Very high	92	Very high	21 Å²	21	43.4 Å²	43.4	15%	0.147	24%	0.237	C	C	.	.			trans	-135.9	151.7	176.4	-173.5	0	0	0	0	108.9	L412 H503	S410-L412 PolarHBondContact O-N 3.48Å; S410-L412 PolarHBondContact OG-N 2.85Å; S410-H503 PolarHBondContact OG-CD2 3.42Å
411	A	90.6	Very high	92.1	Very high	22 Å²	22	43.4 Å²	43.4	18%	0.182	24%	0.237	C	C	.	.	S	Bend	trans	-69.4	-20.8	169.9	0	0	0	0	0	112.1	H416 L490 L496 T500	A411-H416 PolarHBondContact O-CE1 3.47Å; A411-H416 PolarHBondContact O-ND1 3.22Å; A411-L490 HydrophobicContact CB-CD2 3.56Å; A411-L490 HydrophobicContact CB-CG 4.49Å; A411-L496 HydrophobicContact CB-CD1 3.99Å; A411-L496 HydrophobicContact CB-CD2 4.11Å; A411-L496 HydrophobicContact CB-CG 3.96Å; A411-T500 HydrophobicContact CB-CG2 4.19Å; A411-T500 VanDerWaalsContact CB-OG1 3.31Å; A411-T500 WeakPolarHBondContact CB-OG1 3.01Å; A411-T500 PolarHBondContact N-OG1 3.07Å
412	L	93.3	Very high	92.4	Very high	3 Å²	3	39 Å²	39	2%	0.016	22%	0.221	C	C	.	.			trans	-68.3	142.8	171.4	-73.9	173.5	0	0	0	109.9	H400 S410 H416 F417 L453 F487 T500 F504	H400-L412 PolarHBondContact CE1-O 3.21Å; H400-L412 PolarHBondContact NE2-O 3.43Å; H400-L412 VanDerWaalsContact NE2-O 3.1Å; S410-L412 PolarHBondContact O-N 3.48Å; S410-L412 PolarHBondContact OG-N 2.85Å; L412-H416 HydrophobicContact CD2-CB 3.96Å; L412-F417 HydrophobicContact CB-CE2 4.47Å; L412-L453 HydrophobicContact CD1-CD1 4.36Å; L412-F487 HydrophobicContact CD2-CE1 3.98Å; L412-F487 HydrophobicContact CD2-CZ 3.74Å; L412-T500 HydrophobicContact CB-CG2 4.45Å; L412-T500 HydrophobicContact CD1-CG2 4.04Å; L412-T500 HydrophobicContact CD2-CG2 4.5Å; L412-T500 HydrophobicContact CG-CG2 3.62Å; L412-F504 HydrophobicContact CD1-CB 3.96Å; L412-F504 HydrophobicContact CD1-CD2 3.77Å; L412-F504 HydrophobicContact CD1-CG 4.25Å
413	T	92	Very high	92.7	Very high	36 Å²	36	37.2 Å²	37.2	22%	0.221	21%	0.213	C	C	.	.			trans	-139.6	165.6	-179.6	69.5	0	0	0	0	107.5	Y415 H416 F417	T413-Y415 PolarHBondContact O-N 3.48Å; T413-Y415 VanDerWaalsContact O-N 3.1Å; T413-Y415 WeakPolarHBondContact OG1-CB 3.32Å; T413-Y415 PolarHBondContact OG1-N 3.1Å; T413-H416 PolarHBondContact N-ND1 2.89Å; T413-H416 WeakPolarHBondContact O-CB 3.36Å; T413-H416 PolarHBondContact O-N 2.72Å; T413-H416 PolarHBondContact OG1-ND1 3.47Å; T413-F417 VanDerWaalsContact O-CD2 3.31Å; T413-F417 WeakPolarHBondContact O-CD2 3.41Å
414	S	91.8	Very high	92.9	Very high	45 Å²	45	37.9 Å²	37.9	32%	0.315	22%	0.217	S	C	.	.	H	α-helix	trans	-58.2	-25.6	174.9	-62.4	0	0	0	0	112.7	F417 K418	S414-F417 PolarHBondContact O-N 3.06Å; S414-K418 PolarHBondContact O-N 2.83Å
415	Y	92.8	Very high	93.2	Very high	66 Å²	66	35.9 Å²	35.9	26%	0.259	21%	0.207	S	C	.	.	H	α-helix	trans	-66.6	-36.3	176	-174.2	-114.8	0	0	0	112.6	E372 T413 K418 T419 H460 L486	E372-Y415 WeakPolarHBondContact OE1-CE2 3.42Å; E372-Y415 PolarHBondContact OE1-OH 3.32Å; E372-Y415 WeakPolarHBondContact OE2-CE2 3.07Å; T413-Y415 PolarHBondContact O-N 3.48Å; T413-Y415 VanDerWaalsContact O-N 3.1Å; T413-Y415 WeakPolarHBondContact OG1-CB 3.32Å; T413-Y415 PolarHBondContact OG1-N 3.1Å; Y415-K418 HydrophobicContact CD2-CD 4.46Å; Y415-K418 PolarHBondContact O-N 3.42Å; Y415-T419 WeakPolarHBondContact O-CB 3.43Å; Y415-T419 PolarHBondContact O-N 3.09Å; Y415-T419 PolarHBondContact O-OG1 3.29Å; Y415-H460 PolarHBondContact OH-CD2 3.22Å; Y415-H460 PolarHBondContact OH-CE1 2.98Å; Y415-H460 PolarHBondContact OH-NE2 3.39Å; Y415-L486 HydrophobicContact CD1-CD1 4.24Å; Y415-L486 HydrophobicContact CE1-CD1 3.79Å; Y415-L486 HydrophobicContact CE1-CD2 4.3Å
416	H	95.4	Very high	93.5	Very high	22 Å²	22	32.9 Å²	32.9	10%	0.102	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-41.5	175.3	-62.8	123.8	0	0	0	112	A411 L412 T413 T419 A420 L458 F487	A411-H416 PolarHBondContact O-CE1 3.47Å; A411-H416 PolarHBondContact O-ND1 3.22Å; L412-H416 HydrophobicContact CD2-CB 3.96Å; T413-H416 PolarHBondContact N-ND1 2.89Å; T413-H416 WeakPolarHBondContact O-CB 3.36Å; T413-H416 PolarHBondContact O-N 2.72Å; T413-H416 PolarHBondContact OG1-ND1 3.47Å; H416-T419 PolarHBondContact O-N 3.3Å; H416-A420 PolarHBondContact O-N 3.4Å; H416-L458 HydrophobicContact CB-CD2 3.97Å; H416-F487 HydrophobicContact CB-CE1 4.46Å; H416-F487 AromaticContact CD2-CE1 3.63Å; H416-F487 AromaticContact CG-CE1 3.9Å; H416-F487 AromaticContact NE2-CE1 3.87Å
417	F	96	Very high	93.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.7	-42.6	173.9	-69.2	-85.7	0	0	0	112.3	L393 A396 T397 H400 L412 T413 S414 T419 A420 M421 F446 L449 F504 M507	L393-F417 HydrophobicContact CD1-CB 4.05Å; A396-F417 HydrophobicContact CB-CD1 3.64Å; A396-F417 HydrophobicContact CB-CE1 4.16Å; A396-F417 HydrophobicContact CB-CG 4.33Å; T397-F417 HydrophobicContact CG2-CB 4.13Å; H400-F417 HydrophobicContact CB-CD2 4.36Å; H400-F417 HydrophobicContact CB-CE2 3.59Å; H400-F417 HydrophobicContact CB-CZ 3.83Å; H400-F417 AromaticContact CD2-CE2 3.77Å; H400-F417 AromaticContact CG-CE2 3.48Å; H400-F417 VanDerWaalsContact CG-CE2 3.48Å; H400-F417 AromaticContact ND1-CE2 3.94Å; L412-F417 HydrophobicContact CB-CE2 4.47Å; T413-F417 VanDerWaalsContact O-CD2 3.31Å; T413-F417 WeakPolarHBondContact O-CD2 3.41Å; S414-F417 PolarHBondContact O-N 3.06Å; F417-T419 VanDerWaalsContact C-N 3.33Å; F417-T419 PolarHBondContact O-N 3.5Å; F417-A420 PolarHBondContact O-N 2.96Å; F417-M421 WeakPolarHBondContact O-CB 3.2Å; F417-M421 PolarHBondContact O-N 2.98Å; F417-F446 HydrophobicContact CE1-CD1 4.38Å; F417-F446 HydrophobicContact CE1-CE1 4.05Å; F417-L449 HydrophobicContact CD1-CD1 3.2Å; F417-L449 HydrophobicContact CE1-CD1 3.33Å; F417-L449 HydrophobicContact CG-CD1 3.95Å; F417-L449 HydrophobicContact CZ-CD1 4.15Å; F417-F504 HydrophobicContact CE1-CE2 4.29Å; F417-F504 HydrophobicContact CZ-CE2 4.48Å; F417-M507 HydrophobicContact CE1-CE 4.02Å; F417-M507 HydrophobicContact CE1-SD 4.36Å; F417-M507 HydrophobicContact CZ-CE 3.96Å; F417-M507 HydrophobicContact CZ-SD 3.87Å
418	K	96.2	Very high	93.9	Very high	11 Å²	11	29.4 Å²	29.4	5%	0.048	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-44.9	173.2	-176.1	-171	-179	-175.2	0	111.1	E184 W186 E372 L393 S414 Y415 M421 V422	E184-K418 IonicContact OE1-NZ 3.02Å; E184-K418 PolarHBondContact OE1-NZ 3.38Å; E184-K418 WeakPolarHBondContact OE2-CE 3.21Å; E184-K418 IonicContact OE2-NZ 2.8Å; E184-K418 PolarHBondContact OE2-NZ 3.32Å; W186-K418 HydrophobicContact CZ2-CD 4.22Å; E372-K418 WeakPolarHBondContact OE2-CE 3.42Å; E372-K418 IonicContact OE2-NZ 2.81Å; E372-K418 PolarHBondContact OE2-NZ 3.08Å; L393-K418 HydrophobicContact CD1-CB 4.26Å; L393-K418 HydrophobicContact CD2-CB 4.41Å; L393-K418 HydrophobicContact CD2-CG 4.38Å; S414-K418 PolarHBondContact O-N 2.83Å; Y415-K418 HydrophobicContact CD2-CD 4.46Å; Y415-K418 PolarHBondContact O-N 3.42Å; K418-M421 WeakPolarHBondContact O-CB 3.36Å; K418-M421 PolarHBondContact O-N 3.39Å; K418-V422 WeakPolarHBondContact O-CG2 3.12Å; K418-V422 PolarHBondContact O-N 2.91Å
419	T	97.1	Very high	94.2	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-48.4	-179.8	-62.6	0	0	0	0	111.6	Y415 H416 F417 M421 V422 H423 L458 Y459 A461 L486	Y415-T419 WeakPolarHBondContact O-CB 3.43Å; Y415-T419 PolarHBondContact O-N 3.09Å; Y415-T419 PolarHBondContact O-OG1 3.29Å; H416-T419 PolarHBondContact O-N 3.3Å; F417-T419 VanDerWaalsContact C-N 3.33Å; F417-T419 PolarHBondContact O-N 3.5Å; T419-M421 VanDerWaalsContact C-N 3.28Å; T419-M421 PolarHBondContact O-N 2.94Å; T419-V422 PolarHBondContact O-N 3.41Å; T419-H423 PolarHBondContact O-CD2 2.95Å; T419-H423 PolarHBondContact O-N 3.38Å; T419-L458 HydrophobicContact CG2-CD1 3.97Å; T419-L458 HydrophobicContact CG2-CD2 4.43Å; T419-L458 HydrophobicContact CG2-CG 4.12Å; T419-Y459 VanDerWaalsContact CG2-O 3.26Å; T419-Y459 WeakPolarHBondContact CG2-O 2.8Å; T419-A461 HydrophobicContact CG2-CB 4.25Å; T419-L486 HydrophobicContact CG2-CD1 3.92Å
420	A	97.5	Very high	94.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.4	-43.1	174.7	0	0	0	0	0	112	H416 F417 H423 L424 F448 L449	H416-A420 PolarHBondContact O-N 3.4Å; F417-A420 PolarHBondContact O-N 2.96Å; A420-H423 PolarHBondContact O-N 3.23Å; A420-L424 WeakPolarHBondContact O-CG 3.31Å; A420-L424 PolarHBondContact O-N 3.15Å; A420-F448 HydrophobicContact CB-CD1 3.52Å; A420-F448 HydrophobicContact CB-CE1 3.98Å; A420-F448 HydrophobicContact CB-CG 4.44Å; A420-L449 HydrophobicContact CB-CD1 4.25Å; A420-L449 HydrophobicContact CB-CD2 3.75Å; A420-L449 HydrophobicContact CB-CG 3.66Å
421	M	96.3	Very high	94.6	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.02	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-43.2	178.2	-176.2	56.4	144.3	0	0	112.9	H389 C392 F417 K418 T419 H423 L424 L425 W433 V445	H389-M421 VanDerWaalsContact C-CE 3.41Å; H389-M421 HydrophobicContact CB-CE 3.72Å; H389-M421 WeakPolarHBondContact O-CE 3.43Å; C392-M421 HydrophobicContact CB-CE 3.52Å; F417-M421 WeakPolarHBondContact O-CB 3.2Å; F417-M421 PolarHBondContact O-N 2.98Å; K418-M421 WeakPolarHBondContact O-CB 3.36Å; K418-M421 PolarHBondContact O-N 3.39Å; T419-M421 VanDerWaalsContact C-N 3.28Å; T419-M421 PolarHBondContact O-N 2.94Å; M421-H423 VanDerWaalsContact C-N 3.35Å; M421-L424 PolarHBondContact O-N 2.95Å; M421-L425 HydrophobicContact CG-CD1 4.16Å; M421-L425 WeakPolarHBondContact O-CG 3.31Å; M421-L425 PolarHBondContact O-N 3.37Å; M421-W433 HydrophobicContact CE-CE3 4.37Å; M421-W433 HydrophobicContact CE-CH2 3.87Å; M421-W433 HydrophobicContact CE-CZ3 3.44Å; M421-W433 VanDerWaalsContact CE-CZ3 3.44Å; M421-W433 HydrophobicContact SD-CH2 3.43Å; M421-W433 WeakPolarHBondContact SD-CH2 3.24Å; M421-W433 HydrophobicContact SD-CZ3 3.67Å; M421-V445 HydrophobicContact SD-CG2 3.66Å
422	V	97	Very high	94.8	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.03	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-40.8	177.3	173.6	0	0	0	0	111	L375 L376 K418 T419 L424 L425 L426 A461	L375-V422 HydrophobicContact CD2-CG1 3.58Å; L376-V422 HydrophobicContact CD2-CG2 3.89Å; K418-V422 WeakPolarHBondContact O-CG2 3.12Å; K418-V422 PolarHBondContact O-N 2.91Å; T419-V422 PolarHBondContact O-N 3.41Å; V422-L424 VanDerWaalsContact C-N 3.31Å; V422-L424 PolarHBondContact O-N 3.25Å; V422-L425 PolarHBondContact O-N 2.95Å; V422-L426 HydrophobicContact CG1-CD1 3.94Å; V422-L426 HydrophobicContact CG1-CG 4.31Å; V422-L426 WeakPolarHBondContact O-CB 3.42Å; V422-L426 VanDerWaalsContact O-CG 3.3Å; V422-L426 WeakPolarHBondContact O-CG 3.4Å; V422-L426 PolarHBondContact O-N 3.03Å; V422-A461 HydrophobicContact CB-CB 4.01Å; V422-A461 HydrophobicContact CG1-CB 3.7Å
423	H	97.3	Very high	94.9	Very high	29 Å²	29	36.7 Å²	36.7	13%	0.134	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-41.6	173.8	-80.3	-61.9	0	0	0	112.5	T419 A420 M421 L426 S427 F448 Y459	T419-H423 PolarHBondContact O-CD2 2.95Å; T419-H423 PolarHBondContact O-N 3.38Å; A420-H423 PolarHBondContact O-N 3.23Å; M421-H423 VanDerWaalsContact C-N 3.35Å; H423-L426 PolarHBondContact O-N 2.76Å; H423-S427 WeakPolarHBondContact O-CB 3.21Å; H423-S427 PolarHBondContact O-N 2.69Å; H423-S427 VanDerWaalsContact O-N 3.11Å; H423-S427 PolarHBondContact O-OG 3.34Å; H423-F448 HydrophobicContact CB-CE1 4.26Å; H423-F448 HydrophobicContact CB-CE2 4.04Å; H423-F448 HydrophobicContact CB-CZ 3.65Å; H423-F448 AromaticContact CG-CZ 3.94Å; H423-Y459 PolarHBondContact NE2-O 3.29Å
424	L	96.8	Very high	95	Very high	17 Å²	17	35.9 Å²	35.9	9%	0.089	20%	0.197	C	C	.	.	H	α-helix	trans	-65.8	-41.9	175.3	-71.9	171.1	0	0	0	111.9	A420 M421 V422 L426 S427 T428 W433 D444 V445 F448	A420-L424 WeakPolarHBondContact O-CG 3.31Å; A420-L424 PolarHBondContact O-N 3.15Å; M421-L424 PolarHBondContact O-N 2.95Å; V422-L424 VanDerWaalsContact C-N 3.31Å; V422-L424 PolarHBondContact O-N 3.25Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 3.08Å; L424-S427 WeakPolarHBondContact CA-OG 3.21Å; L424-S427 PolarHBondContact O-N 3.03Å; L424-S427 PolarHBondContact O-OG 3.33Å; L424-T428 WeakPolarHBondContact O-CB 3.31Å; L424-T428 PolarHBondContact O-N 2.83Å; L424-T428 PolarHBondContact O-OG1 3.36Å; L424-W433 HydrophobicContact CB-CH2 4Å; L424-W433 HydrophobicContact CB-CZ2 3.96Å; L424-D444 HydrophobicContact CD1-CB 4.1Å; L424-D444 HydrophobicContact CD2-CB 4.36Å; L424-V445 HydrophobicContact CD1-CB 4.16Å; L424-V445 HydrophobicContact CD1-CG2 3.6Å; L424-F448 HydrophobicContact CD1-CB 4.33Å; L424-F448 HydrophobicContact CD2-CD2 4.21Å; L424-F448 HydrophobicContact CG-CD2 4.43Å
425	L	96.4	Very high	94.9	Very high	10 Å²	10	36.8 Å²	36.8	5%	0.052	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-36.8	176.4	-76.6	165	0	0	0	112.4	L376 L379 L383 H389 M421 V422 W433	L376-L425 HydrophobicContact CD2-CD1 4.24Å; L379-L425 HydrophobicContact CD1-CB 3.92Å; L379-L425 HydrophobicContact CD1-CD1 4.23Å; L383-L425 HydrophobicContact CD1-CD2 3.88Å; L383-L425 HydrophobicContact CD2-CD2 4.06Å; H389-L425 HydrophobicContact CB-CD2 4.09Å; M421-L425 HydrophobicContact CG-CD1 4.16Å; M421-L425 WeakPolarHBondContact O-CG 3.31Å; M421-L425 PolarHBondContact O-N 3.37Å; V422-L425 PolarHBondContact O-N 2.95Å; L425-W433 HydrophobicContact CB-CZ2 4.43Å; L425-W433 HydrophobicContact CD2-CD2 3.82Å; L425-W433 HydrophobicContact CD2-CE3 4.29Å; L425-W433 HydrophobicContact CD2-CG 4.32Å; L425-W433 HydrophobicContact CD2-CH2 4.2Å; L425-W433 HydrophobicContact CD2-CZ2 3.71Å; L425-W433 HydrophobicContact CD2-CZ3 4.48Å; L425-W433 HydrophobicContact CG-CH2 4.19Å; L425-W433 HydrophobicContact CG-CZ2 3.85Å
426	L	95.6	Very high	94.8	Very high	29 Å²	29	38.8 Å²	38.8	15%	0.152	24%	0.237	C	C	.	.	H	α-helix	trans	-76.6	-22.5	178.5	-70.3	174.1	0	0	0	113.6	L375 L379 V422 H423 L424 N465 K467 V468	L375-L426 HydrophobicContact CD1-CD2 4.19Å; L375-L426 HydrophobicContact CD2-CD1 4.41Å; L379-L426 HydrophobicContact CD1-CD2 4.48Å; L379-L426 HydrophobicContact CD2-CD2 4.3Å; V422-L426 HydrophobicContact CG1-CD1 3.94Å; V422-L426 HydrophobicContact CG1-CG 4.31Å; V422-L426 WeakPolarHBondContact O-CB 3.42Å; V422-L426 VanDerWaalsContact O-CG 3.3Å; V422-L426 WeakPolarHBondContact O-CG 3.4Å; V422-L426 PolarHBondContact O-N 3.03Å; H423-L426 PolarHBondContact O-N 2.76Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 3.08Å; L426-N465 WeakPolarHBondContact CD1-ND2 3.48Å; L426-K467 HydrophobicContact CB-CB 4.23Å; L426-V468 HydrophobicContact CD1-CG2 4.05Å
427	S	94.2	Very high	94.7	Very high	64 Å²	64	39 Å²	39	45%	0.448	24%	0.241	S	C	.	.	H	α-helix	trans	-104.2	-20.1	-176.8	55.2	0	0	0	0	114.1	H423 L424	H423-S427 WeakPolarHBondContact O-CB 3.21Å; H423-S427 PolarHBondContact O-N 2.69Å; H423-S427 VanDerWaalsContact O-N 3.11Å; H423-S427 PolarHBondContact O-OG 3.34Å; L424-S427 WeakPolarHBondContact CA-OG 3.21Å; L424-S427 PolarHBondContact O-N 3.03Å; L424-S427 PolarHBondContact O-OG 3.33Å
428	T	93.7	Very high	94.5	Very high	30 Å²	30	40.1 Å²	40.1	18%	0.184	25%	0.247	C	C	.	.	S	Bend	trans	-97.5	142	-177.5	-56.9	0	0	0	0	111.1	L424 T430 A432	L424-T428 WeakPolarHBondContact O-CB 3.31Å; L424-T428 PolarHBondContact O-N 2.83Å; L424-T428 PolarHBondContact O-OG1 3.36Å; T428-T430 PolarHBondContact O-N 2.94Å; T428-A432 HydrophobicContact CG2-CB 3.61Å
429	R	92.6	Very high	94.3	Very high	210 Å²	210	42.9 Å²	42.9	79%	0.792	26%	0.26	S	S	*	.			trans	-55.6	137.4	169.6	-60.8	-175.9	-172.2	179.1	2.8	111.4	S431 A432	R429-S431 VanDerWaalsContact C-N 3.25Å; R429-S431 PolarHBondContact O-N 3.24Å; R429-A432 WeakPolarHBondContact O-CB 3.46Å; R429-A432 PolarHBondContact O-N 3.48Å
430	T	92.8	Very high	94	Very high	67 Å²	67	50.2 Å²	50.2	41%	0.411	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-57.5	-36.7	-177.9	54.7	0	0	0	0	112.9	R382 L383 P384 T428 A432 W433	R382-T430 HydrophobicContact CB-CG2 4.28Å; R382-T430 WeakPolarHBondContact O-CB 3.5Å; L383-T430 HydrophobicContact CD2-CG2 4.31Å; P384-T430 WeakPolarHBondContact CD-O 3.46Å; P384-T430 WeakPolarHBondContact CG-O 3.39Å; T428-T430 PolarHBondContact O-N 2.94Å; T430-A432 PolarHBondContact O-N 3.05Å; T430-A432 VanDerWaalsContact O-N 3.16Å; T430-W433 PolarHBondContact O-N 3.46Å
431	S	92.1	Very high	93.9	Very high	92 Å²	92	51.7 Å²	51.7	64%	0.643	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-62	-21.2	178.7	58.9	0	0	0	0	114.7	R429 W433	R429-S431 VanDerWaalsContact C-N 3.25Å; R429-S431 PolarHBondContact O-N 3.24Å; S431-W433 PolarHBondContact O-N 2.85Å
432	A	94.4	Very high	93.8	Very high	30 Å²	30	51.5 Å²	51.5	25%	0.248	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-76.4	-5.6	-180	0	0	0	0	0	113.9	T428 R429 T430 S437	T428-A432 HydrophobicContact CG2-CB 3.61Å; R429-A432 WeakPolarHBondContact O-CB 3.46Å; R429-A432 PolarHBondContact O-N 3.48Å; T430-A432 PolarHBondContact O-N 3.05Å; T430-A432 VanDerWaalsContact O-N 3.16Å; A432-S437 WeakPolarHBondContact O-CB 3.37Å; A432-S437 PolarHBondContact O-OG 3.49Å
433	W	95.9	Very high	93.7	Very high	1 Å²	1	55 Å²	55	0%	0.004	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-97.7	13.4	-176.2	-67.3	95.3	0	0	0	114.1	L383 S387 C388 H389 M421 L424 L425 T430 S431 R441	L383-W433 HydrophobicContact CD2-CB 3.87Å; L383-W433 HydrophobicContact CD2-CG 3.8Å; S387-W433 CarbonylContact C-O 3.55Å; S387-W433 WeakPolarHBondContact CA-O 3.36Å; S387-W433 WeakPolarHBondContact CB-O 3.35Å; C388-W433 PolarHBondContact N-O 3Å; H389-W433 HydrophobicContact CB-CD2 4.48Å; H389-W433 HydrophobicContact CB-CE3 3.81Å; H389-W433 HydrophobicContact CB-CZ3 4.15Å; M421-W433 HydrophobicContact CE-CE3 4.37Å; M421-W433 HydrophobicContact CE-CH2 3.87Å; M421-W433 HydrophobicContact CE-CZ3 3.44Å; M421-W433 VanDerWaalsContact CE-CZ3 3.44Å; M421-W433 HydrophobicContact SD-CH2 3.43Å; M421-W433 WeakPolarHBondContact SD-CH2 3.24Å; M421-W433 HydrophobicContact SD-CZ3 3.67Å; L424-W433 HydrophobicContact CB-CH2 4Å; L424-W433 HydrophobicContact CB-CZ2 3.96Å; L425-W433 HydrophobicContact CB-CZ2 4.43Å; L425-W433 HydrophobicContact CD2-CD2 3.82Å; L425-W433 HydrophobicContact CD2-CE3 4.29Å; L425-W433 HydrophobicContact CD2-CG 4.32Å; L425-W433 HydrophobicContact CD2-CH2 4.2Å; L425-W433 HydrophobicContact CD2-CZ2 3.71Å; L425-W433 HydrophobicContact CD2-CZ3 4.48Å; L425-W433 HydrophobicContact CG-CH2 4.19Å; L425-W433 HydrophobicContact CG-CZ2 3.85Å; T430-W433 PolarHBondContact O-N 3.46Å; S431-W433 PolarHBondContact O-N 2.85Å; W433-R441 HydrophobicContact CD2-CG 4.39Å; W433-R441 HydrophobicContact CE3-CB 4.14Å; W433-R441 HydrophobicContact CE3-CG 3.82Å; W433-R441 HydrophobicContact CZ3-CB 3.81Å; W433-R441 HydrophobicContact CZ3-CG 3.94Å
434	G	93.6	Very high	93.6	Very high	18 Å²	18	55.8 Å²	55.8	19%	0.186	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-61.8	156.4	177	0	0	0	0	0	112.9	A436 S437	G434-A436 PolarHBondContact O-N 3.49Å; G434-A436 VanDerWaalsContact O-N 3.09Å; G434-S437 WeakPolarHBondContact O-CB 3.31Å; G434-S437 PolarHBondContact O-N 3.12Å
435	A	90.4	Very high	93.6	Very high	64 Å²	64	55.1 Å²	55.1	53%	0.529	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-48.7	-39.8	-177	0	0	0	0	0	114.6	N386 S437 L438	N386-A435 WeakPolarHBondContact O-CB 3.49Å; N386-A435 PolarHBondContact O-N 3.47Å; A435-S437 PolarHBondContact O-N 2.91Å; A435-L438 PolarHBondContact O-N 3.33Å
436	A	90.4	Very high	93.6	Very high	108 Å²	108	54.8 Å²	54.8	89%	0.893	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-67.3	-13.8	-179.7	0	0	0	0	0	114.1	G434	G434-A436 PolarHBondContact O-N 3.49Å; G434-A436 VanDerWaalsContact O-N 3.09Å
437	S	91.6	Very high	93.6	Very high	27 Å²	27	55.4 Å²	55.4	19%	0.189	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-95.6	5.7	-178.7	-57.2	0	0	0	0	113.4	A432 G434 A435 E439 R440 R441	A432-S437 WeakPolarHBondContact O-CB 3.37Å; A432-S437 PolarHBondContact O-OG 3.49Å; G434-S437 WeakPolarHBondContact O-CB 3.31Å; G434-S437 PolarHBondContact O-N 3.12Å; A435-S437 PolarHBondContact O-N 2.91Å; S437-E439 PolarHBondContact O-N 3.32Å; S437-R440 PolarHBondContact O-N 3.01Å; S437-R440 VanDerWaalsContact O-N 3.16Å; S437-R441 WeakPolarHBondContact O-CG 3.5Å; S437-R441 PolarHBondContact O-N 2.86Å
438	L	92.2	Very high	93.7	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.12	31%	0.307	C	S	.	.	H	α-helix	trans	-47.5	-53.7	-176.3	173.1	63.8	0	0	0	113.2	L128 C132 C388 H391 A435 R440 R441 L442	L128-L438 HydrophobicContact CB-CD2 4.27Å; C132-L438 VanDerWaalsContact SG-CD2 3.56Å; C388-L438 HydrophobicContact CB-CB 3.93Å; C388-L438 HydrophobicContact CB-CD1 3.95Å; H391-L438 HydrophobicContact CB-CD1 3.72Å; A435-L438 PolarHBondContact O-N 3.33Å; L438-R440 PolarHBondContact O-N 2.81Å; L438-R441 PolarHBondContact O-N 3.42Å; L438-L442 VanDerWaalsContact O-CB 3.22Å; L438-L442 WeakPolarHBondContact O-CB 3.45Å; L438-L442 PolarHBondContact O-N 3.18Å
439	E	91.6	Very high	93.9	Very high	70 Å²	70	53.9 Å²	53.9	33%	0.327	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-48.5	-178.6	-176.8	-171.8	175.4	0	0	111.5	K125 L128 S437 L442 Q443	K125-E439 WeakPolarHBondContact CE-OE2 3.37Å; K125-E439 WeakPolarHBondContact CG-OE2 3.4Å; K125-E439 IonicContact NZ-OE2 2.77Å; L128-E439 HydrophobicContact CD1-CB 4.38Å; L128-E439 HydrophobicContact CD1-CG 4.49Å; S437-E439 PolarHBondContact O-N 3.32Å; E439-L442 PolarHBondContact O-N 3.1Å; E439-Q443 PolarHBondContact O-N 3.16Å
440	R	92.6	Very high	94.1	Very high	156 Å²	156	46 Å²	46	59%	0.589	27%	0.27	S	S	*	.	H	α-helix	trans	-62.1	-49.7	179.3	-177	179.4	-70.7	140.6	-3.3	111.1	S437 L438 L442 Q443 D444	S437-R440 PolarHBondContact O-N 3.01Å; S437-R440 VanDerWaalsContact O-N 3.16Å; L438-R440 PolarHBondContact O-N 2.81Å; R440-L442 VanDerWaalsContact C-N 3.3Å; R440-L442 PolarHBondContact O-N 2.83Å; R440-Q443 WeakPolarHBondContact O-CB 3.45Å; R440-Q443 PolarHBondContact O-N 3.03Å; R440-Q443 VanDerWaalsContact O-N 3.14Å; R440-D444 PolarHBondContact O-N 2.97Å
441	R	94.8	Very high	94.3	Very high	31 Å²	31	48.7 Å²	48.7	12%	0.117	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-35.5	-179.9	-66.8	-59.9	86	169.4	5.6	112.3	W433 S437 L438 D444 V445	W433-R441 HydrophobicContact CD2-CG 4.39Å; W433-R441 HydrophobicContact CE3-CB 4.14Å; W433-R441 HydrophobicContact CE3-CG 3.82Å; W433-R441 HydrophobicContact CZ3-CB 3.81Å; W433-R441 HydrophobicContact CZ3-CG 3.94Å; S437-R441 WeakPolarHBondContact O-CG 3.5Å; S437-R441 PolarHBondContact O-N 2.86Å; L438-R441 PolarHBondContact O-N 3.42Å; R441-D444 WeakPolarHBondContact CA-OD2 3.27Å; R441-D444 IonicContact CZ-OD2 3.03Å; R441-D444 IonicContact NE-OD2 2.71Å; R441-D444 PolarHBondContact NE-OD2 3.48Å; R441-D444 IonicContact NH1-OD2 3.91Å; R441-D444 IonicContact NH2-OD1 3.99Å; R441-D444 IonicContact NH2-OD2 3.32Å; R441-D444 PolarHBondContact NH2-OD2 3.29Å; R441-D444 PolarHBondContact O-N 3.16Å; R441-V445 WeakPolarHBondContact O-CG2 3.47Å; R441-V445 PolarHBondContact O-N 3.26Å; R441-V445 VanDerWaalsContact O-N 3.1Å
442	L	94.6	Very high	94.5	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-42.4	173.2	-179.2	63.7	0	0	0	111.2	M123 L128 C392 V395 A396 L438 E439 R440 D444 V445 F446	M123-L442 HydrophobicContact CE-CD2 3.93Å; M123-L442 HydrophobicContact SD-CD2 3.78Å; L128-L442 HydrophobicContact CD1-CD2 4.42Å; L128-L442 HydrophobicContact CD2-CD2 3.91Å; C392-L442 HydrophobicContact CB-CD1 4.34Å; V395-L442 HydrophobicContact CB-CD1 4.19Å; V395-L442 HydrophobicContact CB-CD2 4.19Å; V395-L442 HydrophobicContact CG1-CD1 4.12Å; V395-L442 HydrophobicContact CG1-CD2 3.59Å; A396-L442 HydrophobicContact CB-CD1 4.34Å; L438-L442 VanDerWaalsContact O-CB 3.22Å; L438-L442 WeakPolarHBondContact O-CB 3.45Å; L438-L442 PolarHBondContact O-N 3.18Å; E439-L442 PolarHBondContact O-N 3.1Å; R440-L442 VanDerWaalsContact C-N 3.3Å; R440-L442 PolarHBondContact O-N 2.83Å; L442-D444 VanDerWaalsContact C-N 3.32Å; L442-D444 PolarHBondContact O-N 3.33Å; L442-V445 WeakPolarHBondContact O-CB 3.31Å; L442-V445 PolarHBondContact O-N 2.83Å; L442-F446 HydrophobicContact CD1-CD2 4.18Å; L442-F446 HydrophobicContact CD1-CE2 3.49Å; L442-F446 VanDerWaalsContact CD1-CE2 3.49Å; L442-F446 HydrophobicContact CD1-CZ 3.74Å; L442-F446 HydrophobicContact CD2-CE2 4.02Å; L442-F446 HydrophobicContact CG-CD2 4Å; L442-F446 HydrophobicContact CG-CE2 3.47Å; L442-F446 VanDerWaalsContact CG-CE2 3.47Å; L442-F446 HydrophobicContact CG-CZ 4.23Å; L442-F446 WeakPolarHBondContact O-CD2 3.38Å; L442-F446 PolarHBondContact O-N 2.88Å; L442-F446 VanDerWaalsContact O-N 3.15Å
443	Q	93.7	Very high	94.6	Very high	79 Å²	79	43.4 Å²	43.4	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-59.4	-43.5	173	-173.7	178	9.3	0	0	111.3	E439 R440 V445 F446 S447	E439-Q443 PolarHBondContact O-N 3.16Å; R440-Q443 WeakPolarHBondContact O-CB 3.45Å; R440-Q443 PolarHBondContact O-N 3.03Å; R440-Q443 VanDerWaalsContact O-N 3.14Å; Q443-V445 VanDerWaalsContact C-N 3.3Å; Q443-V445 PolarHBondContact O-N 3.36Å; Q443-F446 PolarHBondContact O-N 3.47Å; Q443-F446 VanDerWaalsContact O-N 3.15Å; Q443-S447 WeakPolarHBondContact O-CB 3.43Å; Q443-S447 PolarHBondContact O-N 2.92Å; Q443-S447 PolarHBondContact O-OG 2.94Å
444	D	95.8	Very high	94.6	Very high	45 Å²	45	49.3 Å²	49.3	24%	0.241	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-38.8	177.4	-58.4	-55.1	0	0	0	112.2	L424 R440 R441 L442 S447 F448	L424-D444 HydrophobicContact CD1-CB 4.1Å; L424-D444 HydrophobicContact CD2-CB 4.36Å; R440-D444 PolarHBondContact O-N 2.97Å; R441-D444 WeakPolarHBondContact CA-OD2 3.27Å; R441-D444 IonicContact CZ-OD2 3.03Å; R441-D444 IonicContact NE-OD2 2.71Å; R441-D444 PolarHBondContact NE-OD2 3.48Å; R441-D444 IonicContact NH1-OD2 3.91Å; R441-D444 IonicContact NH2-OD1 3.99Å; R441-D444 IonicContact NH2-OD2 3.32Å; R441-D444 PolarHBondContact NH2-OD2 3.29Å; R441-D444 PolarHBondContact O-N 3.16Å; L442-D444 VanDerWaalsContact C-N 3.32Å; L442-D444 PolarHBondContact O-N 3.33Å; D444-S447 PolarHBondContact O-N 2.96Å; D444-F448 WeakPolarHBondContact O-CB 3.32Å; D444-F448 PolarHBondContact O-N 3.37Å
445	V	96.3	Very high	94.7	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-59.7	-46.9	174.4	172.2	0	0	0	0	110.8	M421 L424 R441 L442 Q443 F448 L449	M421-V445 HydrophobicContact SD-CG2 3.66Å; L424-V445 HydrophobicContact CD1-CB 4.16Å; L424-V445 HydrophobicContact CD1-CG2 3.6Å; R441-V445 WeakPolarHBondContact O-CG2 3.47Å; R441-V445 PolarHBondContact O-N 3.26Å; R441-V445 VanDerWaalsContact O-N 3.1Å; L442-V445 WeakPolarHBondContact O-CB 3.31Å; L442-V445 PolarHBondContact O-N 2.83Å; Q443-V445 VanDerWaalsContact C-N 3.3Å; Q443-V445 PolarHBondContact O-N 3.36Å; V445-F448 PolarHBondContact O-N 3.15Å; V445-L449 HydrophobicContact CG1-CD1 4.39Å; V445-L449 PolarHBondContact O-N 2.92Å
446	F	96.3	Very high	94.9	Very high	3 Å²	3	53 Å²	53	1%	0.013	27%	0.265	C	S	.	.	H	α-helix	trans	-69.6	-41.6	179.9	-65.5	-49.5	0	0	0	112.6	M122 M123 A396 L399 F417 L442 Q443 F448 L449 Q450 F504 M507 L508	M122-F446 HydrophobicContact CE-CB 4.41Å; M122-F446 HydrophobicContact CE-CD2 3.37Å; M122-F446 HydrophobicContact CE-CE2 3.95Å; M122-F446 HydrophobicContact CE-CG 4.26Å; M123-F446 HydrophobicContact CE-CE2 4.14Å; A396-F446 HydrophobicContact CB-CE1 3.89Å; A396-F446 HydrophobicContact CB-CZ 4.05Å; L399-F446 HydrophobicContact CD1-CZ 3.92Å; F417-F446 HydrophobicContact CE1-CD1 4.38Å; F417-F446 HydrophobicContact CE1-CE1 4.05Å; L442-F446 HydrophobicContact CD1-CD2 4.18Å; L442-F446 HydrophobicContact CD1-CE2 3.49Å; L442-F446 VanDerWaalsContact CD1-CE2 3.49Å; L442-F446 HydrophobicContact CD1-CZ 3.74Å; L442-F446 HydrophobicContact CD2-CE2 4.02Å; L442-F446 HydrophobicContact CG-CD2 4Å; L442-F446 HydrophobicContact CG-CE2 3.47Å; L442-F446 VanDerWaalsContact CG-CE2 3.47Å; L442-F446 HydrophobicContact CG-CZ 4.23Å; L442-F446 WeakPolarHBondContact O-CD2 3.38Å; L442-F446 PolarHBondContact O-N 2.88Å; L442-F446 VanDerWaalsContact O-N 3.15Å; Q443-F446 PolarHBondContact O-N 3.47Å; Q443-F446 VanDerWaalsContact O-N 3.15Å; F446-F448 VanDerWaalsContact C-N 3.33Å; F446-F448 PolarHBondContact O-N 3.32Å; F446-L449 PolarHBondContact O-N 3.46Å; F446-Q450 WeakPolarHBondContact O-CB 3.36Å; F446-Q450 PolarHBondContact O-N 3.14Å; F446-F504 HydrophobicContact CB-CZ 4.24Å; F446-F504 HydrophobicContact CD1-CE2 4.16Å; F446-F504 HydrophobicContact CD1-CZ 4.17Å; F446-F504 WeakPolarHBondContact O-CZ 3.28Å; F446-M507 HydrophobicContact CD1-CE 4.05Å; F446-M507 HydrophobicContact CE1-CE 3.67Å; F446-M507 HydrophobicContact CZ-CE 4.5Å; F446-L508 HydrophobicContact CB-CD2 4.01Å; F446-L508 HydrophobicContact CD1-CD2 3.69Å; F446-L508 HydrophobicContact CD2-CD2 3.81Å; F446-L508 HydrophobicContact CE1-CD2 4.02Å; F446-L508 HydrophobicContact CE2-CD2 4.07Å; F446-L508 HydrophobicContact CG-CD2 3.57Å; F446-L508 HydrophobicContact CZ-CD2 4.19Å
447	S	95.9	Very high	95.2	Very high	43 Å²	43	52.8 Å²	52.8	30%	0.301	24%	0.241	S	C	.	.	H	α-helix	trans	-63.2	-39.5	175.1	-64	0	0	0	0	111.8	Q443 D444 Q450 K451	Q443-S447 WeakPolarHBondContact O-CB 3.43Å; Q443-S447 PolarHBondContact O-N 2.92Å; Q443-S447 PolarHBondContact O-OG 2.94Å; D444-S447 PolarHBondContact O-N 2.96Å; S447-Q450 PolarHBondContact O-N 3.4Å; S447-K451 WeakPolarHBondContact O-CB 3.46Å; S447-K451 PolarHBondContact O-N 3.01Å
448	F	97.3	Very high	95.4	Very high	61 Å²	61	51.5 Å²	51.5	27%	0.268	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-46	174.8	-174.9	-82.7	0	0	0	111.4	A420 H423 L424 D444 V445 F446 K451 S452 L458	A420-F448 HydrophobicContact CB-CD1 3.52Å; A420-F448 HydrophobicContact CB-CE1 3.98Å; A420-F448 HydrophobicContact CB-CG 4.44Å; H423-F448 HydrophobicContact CB-CE1 4.26Å; H423-F448 HydrophobicContact CB-CE2 4.04Å; H423-F448 HydrophobicContact CB-CZ 3.65Å; H423-F448 AromaticContact CG-CZ 3.94Å; L424-F448 HydrophobicContact CD1-CB 4.33Å; L424-F448 HydrophobicContact CD2-CD2 4.21Å; L424-F448 HydrophobicContact CG-CD2 4.43Å; D444-F448 WeakPolarHBondContact O-CB 3.32Å; D444-F448 PolarHBondContact O-N 3.37Å; V445-F448 PolarHBondContact O-N 3.15Å; F446-F448 VanDerWaalsContact C-N 3.33Å; F446-F448 PolarHBondContact O-N 3.32Å; F448-K451 PolarHBondContact O-N 3.4Å; F448-S452 WeakPolarHBondContact CE1-OG 3.43Å; F448-S452 WeakPolarHBondContact O-CB 3.42Å; F448-S452 PolarHBondContact O-N 2.97Å; F448-S452 PolarHBondContact O-OG 2.93Å; F448-L458 HydrophobicContact CE1-CD1 3.73Å
449	L	97.1	Very high	95.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.1	-40.2	177.1	-79.4	171	0	0	0	112.7	F417 A420 V445 F446 S452 L453 L458 F504	F417-L449 HydrophobicContact CD1-CD1 3.2Å; F417-L449 HydrophobicContact CE1-CD1 3.33Å; F417-L449 HydrophobicContact CG-CD1 3.95Å; F417-L449 HydrophobicContact CZ-CD1 4.15Å; A420-L449 HydrophobicContact CB-CD1 4.25Å; A420-L449 HydrophobicContact CB-CD2 3.75Å; A420-L449 HydrophobicContact CB-CG 3.66Å; V445-L449 HydrophobicContact CG1-CD1 4.39Å; V445-L449 PolarHBondContact O-N 2.92Å; F446-L449 PolarHBondContact O-N 3.46Å; L449-S452 WeakPolarHBondContact O-CB 3.22Å; L449-S452 PolarHBondContact O-N 3.49Å; L449-L453 WeakPolarHBondContact O-CG 3.41Å; L449-L453 PolarHBondContact O-N 2.72Å; L449-L458 HydrophobicContact CD2-CD2 4.25Å; L449-F504 HydrophobicContact CB-CE2 3.93Å; L449-F504 HydrophobicContact CB-CZ 3.92Å; L449-F504 HydrophobicContact CD1-CE2 4.22Å
450	Q	96.4	Very high	95.7	Very high	45 Å²	45	51.5 Å²	51.5	21%	0.21	23%	0.229	C	C	.	.	H	α-helix	trans	-58.6	-49.2	175.5	-173.7	174.6	-1.3	0	0	110.7	F446 S447 S452 L453 Q454 F504	F446-Q450 WeakPolarHBondContact O-CB 3.36Å; F446-Q450 PolarHBondContact O-N 3.14Å; S447-Q450 PolarHBondContact O-N 3.4Å; Q450-S452 VanDerWaalsContact C-N 3.33Å; Q450-S452 PolarHBondContact O-N 3Å; Q450-L453 PolarHBondContact O-N 3.16Å; Q450-Q454 WeakPolarHBondContact O-CG 3.19Å; Q450-Q454 PolarHBondContact O-N 2.82Å; Q450-F504 HydrophobicContact CB-CE1 3.87Å; Q450-F504 HydrophobicContact CB-CZ 4.49Å; Q450-F504 HydrophobicContact CG-CE1 4.44Å
451	K	97	Very high	95.9	Very high	123 Å²	123	44.2 Å²	44.2	54%	0.535	20%	0.202	S	C	.	.	H	α-helix	trans	-60.5	-43.7	175.2	-177.3	173.2	177	173.6	0	111.5	S447 F448 L453 Q454 E455	S447-K451 WeakPolarHBondContact O-CB 3.46Å; S447-K451 PolarHBondContact O-N 3.01Å; F448-K451 PolarHBondContact O-N 3.4Å; K451-L453 VanDerWaalsContact C-N 3.3Å; K451-L453 PolarHBondContact O-N 2.82Å; K451-Q454 PolarHBondContact O-N 3.29Å; K451-E455 WeakPolarHBondContact CE-OE1 3.37Å; K451-E455 WeakPolarHBondContact CG-OE1 3.37Å; K451-E455 IonicContact NZ-OE1 3.34Å; K451-E455 WeakPolarHBondContact O-CB 3.34Å; K451-E455 WeakPolarHBondContact O-CG 3.34Å; K451-E455 PolarHBondContact O-N 2.94Å
452	S	97.4	Very high	95.9	Very high	7 Å²	7	42.8 Å²	42.8	5%	0.049	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-38.1	177.2	-58.6	0	0	0	0	112.3	F448 L449 Q450 K456 R457	F448-S452 WeakPolarHBondContact CE1-OG 3.43Å; F448-S452 WeakPolarHBondContact O-CB 3.42Å; F448-S452 PolarHBondContact O-N 2.97Å; F448-S452 PolarHBondContact O-OG 2.93Å; L449-S452 WeakPolarHBondContact O-CB 3.22Å; L449-S452 PolarHBondContact O-N 3.49Å; Q450-S452 VanDerWaalsContact C-N 3.33Å; Q450-S452 PolarHBondContact O-N 3Å; S452-K456 CarbonylContact O-C 3.45Å; S452-K456 WeakPolarHBondContact O-CA 3.33Å; S452-K456 PolarHBondContact O-N 3.12Å; S452-R457 VanDerWaalsContact CA-O 3.31Å; S452-R457 WeakPolarHBondContact CA-O 3.44Å; S452-R457 VanDerWaalsContact CB-O 3.24Å; S452-R457 WeakPolarHBondContact CB-O 3.32Å; S452-R457 PolarHBondContact O-N 2.9Å
453	L	96.4	Very high	95.9	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-68.6	-45.7	175.1	-74.1	167.3	0	0	0	111.2	L412 L449 Q450 K451 E455 K456 F487 L490 Y497 T500 F504	L412-L453 HydrophobicContact CD1-CD1 4.36Å; L449-L453 WeakPolarHBondContact O-CG 3.41Å; L449-L453 PolarHBondContact O-N 2.72Å; Q450-L453 PolarHBondContact O-N 3.16Å; K451-L453 VanDerWaalsContact C-N 3.3Å; K451-L453 PolarHBondContact O-N 2.82Å; L453-E455 VanDerWaalsContact C-N 3.31Å; L453-E455 PolarHBondContact O-N 3.4Å; L453-K456 WeakPolarHBondContact O-CA 3.48Å; L453-K456 WeakPolarHBondContact O-CG 3.17Å; L453-K456 PolarHBondContact O-N 3.49Å; L453-F487 HydrophobicContact CD2-CD2 4.31Å; L453-F487 HydrophobicContact CD2-CE2 3.65Å; L453-F487 HydrophobicContact CD2-CZ 3.88Å; L453-F487 HydrophobicContact CG-CE2 3.93Å; L453-F487 HydrophobicContact CG-CZ 4.34Å; L453-L490 HydrophobicContact CD2-CD1 3.9Å; L453-Y497 VanDerWaalsContact O-CE2 3.27Å; L453-Y497 WeakPolarHBondContact O-CE2 3.34Å; L453-Y497 PolarHBondContact O-OH 3.15Å; L453-T500 HydrophobicContact CD2-CG2 3.99Å; L453-F504 HydrophobicContact CD1-CB 3.88Å; L453-F504 HydrophobicContact CD1-CD1 3.89Å; L453-F504 HydrophobicContact CD1-CD2 4.25Å; L453-F504 HydrophobicContact CD1-CG 3.74Å
454	Q	95.4	Very high	95.8	Very high	125 Å²	125	39.9 Å²	39.9	58%	0.584	19%	0.187	S	C	*	.	H	α-helix	trans	-57.6	-44.7	176.8	-72.6	170.2	-26.3	0	0	111.7	Q450 K451 K456	Q450-Q454 WeakPolarHBondContact O-CG 3.19Å; Q450-Q454 PolarHBondContact O-N 2.82Å; K451-Q454 PolarHBondContact O-N 3.29Å; Q454-K456 PolarHBondContact O-N 3.5Å
455	E	95.7	Very high	95.7	Very high	84 Å²	84	38.8 Å²	38.8	39%	0.393	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-6.8	175.5	-66.1	-178.6	-164.2	0	0	113.3	K451 L453 R457	K451-E455 WeakPolarHBondContact CE-OE1 3.37Å; K451-E455 WeakPolarHBondContact CG-OE1 3.37Å; K451-E455 IonicContact NZ-OE1 3.34Å; K451-E455 WeakPolarHBondContact O-CB 3.34Å; K451-E455 WeakPolarHBondContact O-CG 3.34Å; K451-E455 PolarHBondContact O-N 2.94Å; L453-E455 VanDerWaalsContact C-N 3.31Å; L453-E455 PolarHBondContact O-N 3.4Å; E455-R457 HydrophobicContact CB-CB 4.04Å; E455-R457 WeakPolarHBondContact O-CB 3.31Å; E455-R457 PolarHBondContact O-N 2.69Å; E455-R457 IonicContact OE2-CZ 3.77Å; E455-R457 IonicContact OE2-NE 2.59Å; E455-R457 PolarHBondContact OE2-NE 3.1Å; E455-R457 IonicContact OE2-NH2 2.81Å; E455-R457 PolarHBondContact OE2-NH2 3.49Å
456	K	95.3	Very high	95.4	Very high	74 Å²	74	50 Å²	50	32%	0.322	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	37.2	-170.4	-57.9	175.5	-175.3	168.9	0	112.6	S452 L453 Q454 N485 F487 V491 Y497	S452-K456 CarbonylContact O-C 3.45Å; S452-K456 WeakPolarHBondContact O-CA 3.33Å; S452-K456 PolarHBondContact O-N 3.12Å; L453-K456 WeakPolarHBondContact O-CA 3.48Å; L453-K456 WeakPolarHBondContact O-CG 3.17Å; L453-K456 PolarHBondContact O-N 3.49Å; Q454-K456 PolarHBondContact O-N 3.5Å; K456-N485 PolarHBondContact O-ND2 3.29Å; K456-F487 WeakPolarHBondContact O-CB 3.44Å; K456-V491 HydrophobicContact CB-CG2 3.8Å; K456-V491 HydrophobicContact CD-CG2 4.47Å; K456-Y497 HydrophobicContact CD-CD2 4.42Å; K456-Y497 HydrophobicContact CD-CE2 4.32Å; K456-Y497 HydrophobicContact CG-CD2 4.08Å; K456-Y497 HydrophobicContact CG-CE2 3.71Å
457	R	95.3	Very high	95.2	Very high	104 Å²	104	56.1 Å²	56.1	39%	0.392	25%	0.25	S	S	.	.			trans	-142.5	113.6	-169.1	-167.6	173.1	68.8	132.9	-4	111.2	S452 E455 Y459 N485	S452-R457 VanDerWaalsContact CA-O 3.31Å; S452-R457 WeakPolarHBondContact CA-O 3.44Å; S452-R457 VanDerWaalsContact CB-O 3.24Å; S452-R457 WeakPolarHBondContact CB-O 3.32Å; S452-R457 PolarHBondContact O-N 2.9Å; E455-R457 HydrophobicContact CB-CB 4.04Å; E455-R457 WeakPolarHBondContact O-CB 3.31Å; E455-R457 PolarHBondContact O-N 2.69Å; E455-R457 IonicContact OE2-CZ 3.77Å; E455-R457 IonicContact OE2-NE 2.59Å; E455-R457 PolarHBondContact OE2-NE 3.1Å; E455-R457 IonicContact OE2-NH2 2.81Å; E455-R457 PolarHBondContact OE2-NH2 3.49Å; R457-Y459 WeakPolarHBondContact CD-OH 3.46Å; R457-Y459 HydrophobicContact CG-CD2 4.48Å; R457-Y459 HydrophobicContact CG-CE1 4.13Å; R457-Y459 HydrophobicContact CG-CE2 4.03Å; R457-Y459 PolarHBondContact NH1-OH 2.9Å; R457-N485 WeakPolarHBondContact CA-OD1 3.49Å
458	L	96.4	Very high	95.1	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	24%	0.238	C	C	.	.			trans	-135	105.3	171.2	176.1	60.3	0	0	0	107.9	H416 T419 F448 L449 N485 L486 F487	H416-L458 HydrophobicContact CB-CD2 3.97Å; T419-L458 HydrophobicContact CG2-CD1 3.97Å; T419-L458 HydrophobicContact CG2-CD2 4.43Å; T419-L458 HydrophobicContact CG2-CG 4.12Å; F448-L458 HydrophobicContact CE1-CD1 3.73Å; L449-L458 HydrophobicContact CD2-CD2 4.25Å; L458-N485 PolarHBondContact N-OD1 3.17Å; L458-N485 PolarHBondContact O-OD1 3.43Å; L458-L486 HydrophobicContact CD2-CD1 4.41Å; L458-L486 HydrophobicContact CG-CD1 4.37Å; L458-L486 WeakPolarHBondContact O-CB 3.47Å; L458-L486 PolarHBondContact O-N 3.12Å; L458-F487 HydrophobicContact CB-CD1 4.12Å; L458-F487 HydrophobicContact CB-CD2 3.68Å; L458-F487 HydrophobicContact CB-CE1 4.18Å; L458-F487 HydrophobicContact CB-CE2 3.74Å; L458-F487 HydrophobicContact CB-CG 3.88Å; L458-F487 HydrophobicContact CB-CZ 4Å; L458-F487 HydrophobicContact CD2-CD1 4.4Å; L458-F487 HydrophobicContact CD2-CE1 3.77Å; L458-F487 HydrophobicContact CD2-CE2 4.22Å; L458-F487 HydrophobicContact CD2-CZ 3.66Å; L458-F487 HydrophobicContact CG-CZ 4.49Å
459	Y	95.8	Very high	94.8	Very high	82 Å²	82	52.8 Å²	52.8	32%	0.322	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-74.9	146.1	-179.1	-65.6	-59.8	0	0	0	112.3	T419 H423 R457 A461 P483 I484 N485	T419-Y459 VanDerWaalsContact CG2-O 3.26Å; T419-Y459 WeakPolarHBondContact CG2-O 2.8Å; H423-Y459 PolarHBondContact NE2-O 3.29Å; R457-Y459 WeakPolarHBondContact CD-OH 3.46Å; R457-Y459 HydrophobicContact CG-CD2 4.48Å; R457-Y459 HydrophobicContact CG-CE1 4.13Å; R457-Y459 HydrophobicContact CG-CE2 4.03Å; R457-Y459 PolarHBondContact NH1-OH 2.9Å; Y459-A461 PolarHBondContact O-N 3.38Å; Y459-P483 HydrophobicContact CD1-CB 3.55Å; Y459-P483 HydrophobicContact CD2-CB 4.39Å; Y459-P483 HydrophobicContact CE1-CB 3.82Å; Y459-P483 WeakPolarHBondContact CE1-O 3.49Å; Y459-P483 HydrophobicContact CG-CB 3.85Å; Y459-I484 CarbonylContact C-O 3.42Å; Y459-I484 VanDerWaalsContact CA-O 3.23Å; Y459-I484 WeakPolarHBondContact CA-O 3.35Å; Y459-N485 HydrophobicContact CD1-CB 4.33Å; Y459-N485 HydrophobicContact CE1-CB 4.36Å
460	H	95.3	Very high	94.4	Very high	11 Å²	11	60.6 Å²	60.6	5%	0.051	27%	0.27	C	S	.	.			trans	-54.5	136	170.7	-165.8	-73	0	0	0	110.3	E372 Y415 L462 I463 I484 L486	E372-H460 IonicContact OE1-CE1 3.64Å; Y415-H460 PolarHBondContact OH-CD2 3.22Å; Y415-H460 PolarHBondContact OH-CE1 2.98Å; Y415-H460 PolarHBondContact OH-NE2 3.39Å; H460-L462 VanDerWaalsContact C-N 3.26Å; H460-L462 PolarHBondContact ND1-N 3.44Å; H460-L462 VanDerWaalsContact ND1-N 3.2Å; H460-L462 PolarHBondContact O-N 3.43Å; H460-I463 HydrophobicContact CB-CB 4.22Å; H460-I463 HydrophobicContact CB-CD1 4.42Å; H460-I463 HydrophobicContact CB-CG1 4.46Å; H460-I484 HydrophobicContact CB-CB 4.37Å; H460-I484 PolarHBondContact N-O 3.49Å; H460-L486 HydrophobicContact CB-CD2 4.37Å
461	A	95.3	Very high	94.1	Very high	3 Å²	3	64 Å²	64	3%	0.025	29%	0.289	C	S	.	.	S	Bend	trans	-64.6	-29.9	-172.9	0	0	0	0	0	113.8	T419 V422 Y459 N465	T419-A461 HydrophobicContact CG2-CB 4.25Å; V422-A461 HydrophobicContact CB-CB 4.01Å; V422-A461 HydrophobicContact CG1-CB 3.7Å; Y459-A461 PolarHBondContact O-N 3.38Å; A461-N465 VanDerWaalsContact O-CB 3.3Å; A461-N465 WeakPolarHBondContact O-CB 3.44Å; A461-N465 PolarHBondContact O-ND2 2.82Å
462	L	95.6	Very high	93.7	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	27%	0.265	C	S	.	.	S	Bend	trans	-102.6	-32.6	-174.9	-61.5	178.9	0	0	0	115.7	L368 C371 E372 L375 H460 V468 V474	L368-L462 HydrophobicContact CB-CD1 3.74Å; L368-L462 HydrophobicContact CD1-CB 4.09Å; L368-L462 HydrophobicContact CD1-CD1 4.18Å; C371-L462 HydrophobicContact CB-CD1 3.49Å; C371-L462 VanDerWaalsContact CB-CD1 3.49Å; E372-L462 HydrophobicContact CB-CD1 4.48Å; E372-L462 HydrophobicContact CG-CD1 3.58Å; E372-L462 HydrophobicContact CG-CG 4.18Å; L375-L462 HydrophobicContact CD2-CD2 3.57Å; H460-L462 VanDerWaalsContact C-N 3.26Å; H460-L462 PolarHBondContact ND1-N 3.44Å; H460-L462 VanDerWaalsContact ND1-N 3.2Å; H460-L462 PolarHBondContact O-N 3.43Å; L462-V468 HydrophobicContact CD2-CG1 4.06Å; L462-V468 HydrophobicContact CD2-CG2 3.98Å; L462-V474 HydrophobicContact CB-CG2 4.44Å; L462-V474 HydrophobicContact CD1-CG2 4.29Å; L462-V474 HydrophobicContact CD2-CG2 4.23Å
463	I	94.6	Very high	93.2	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.015	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	126.4	-167.6	-58.2	170.6	0	0	0	108.8	W213 C226 L368 H460 N465 F478 A481 I484	W213-I463 HydrophobicContact CZ2-CD1 4.19Å; C226-I463 WeakPolarHBondContact SG-CD1 3.35Å; L368-I463 HydrophobicContact CD1-CD1 3.78Å; L368-I463 HydrophobicContact CD1-CG1 3.56Å; H460-I463 HydrophobicContact CB-CB 4.22Å; H460-I463 HydrophobicContact CB-CD1 4.42Å; H460-I463 HydrophobicContact CB-CG1 4.46Å; I463-N465 PolarHBondContact O-N 3Å; I463-N465 VanDerWaalsContact O-N 3.16Å; I463-F478 HydrophobicContact CG1-CB 4.44Å; I463-A481 HydrophobicContact CG2-CB 4Å; I463-I484 HydrophobicContact CB-CD1 4.35Å; I463-I484 HydrophobicContact CD1-CD1 3.81Å; I463-I484 HydrophobicContact CG2-CD1 3.7Å; I463-I484 HydrophobicContact CG2-CG1 4Å
464	G	91.8	Very high	93	Very high	16 Å²	16	67.3 Å²	67.3	17%	0.165	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	8.7	-174.3	0	0	0	0	0	114.7	R466 F478 A481	G464-R466 PolarHBondContact O-N 2.99Å; G464-F478 PolarHBondContact N-O 3.47Å; G464-A481 WeakPolarHBondContact CA-O 3.33Å
465	N	93.4	Very high	92.8	Very high	22 Å²	22	61.8 Å²	61.8	12%	0.118	27%	0.274	C	S	.	.			trans	-94.5	101.3	-177.3	-171.2	-3.8	0	0	0	112	L426 A461 I463 K467 V468	L426-N465 WeakPolarHBondContact CD1-ND2 3.48Å; A461-N465 VanDerWaalsContact O-CB 3.3Å; A461-N465 WeakPolarHBondContact O-CB 3.44Å; A461-N465 PolarHBondContact O-ND2 2.82Å; I463-N465 PolarHBondContact O-N 3Å; I463-N465 VanDerWaalsContact O-N 3.16Å; N465-K467 PolarHBondContact O-N 3.08Å; N465-K467 WeakPolarHBondContact OD1-CB 3.38Å; N465-K467 PolarHBondContact OD1-N 3.34Å; N465-V468 HydrophobicContact CB-CG2 3.94Å; N465-V468 PolarHBondContact O-N 3.16Å
466	R	89.4	Confident	92.5	Very high	237 Å²	237	62 Å²	62	89%	0.894	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-13.7	179.1	-60.6	-178.8	-178.3	167.3	0.6	114.3	G464 V468	G464-R466 PolarHBondContact O-N 2.99Å; R466-V468 VanDerWaalsContact C-N 3.29Å
467	K	92.1	Very high	92.3	Very high	132 Å²	132	62 Å²	62	57%	0.574	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-12.7	177.2	-59.6	-176.9	-179.5	178.3	0	112.7	L426 N465	L426-K467 HydrophobicContact CB-CB 4.23Å; N465-K467 PolarHBondContact O-N 3.08Å; N465-K467 WeakPolarHBondContact OD1-CB 3.38Å; N465-K467 PolarHBondContact OD1-N 3.34Å
468	V	94.2	Very high	92.1	Very high	9 Å²	9	57 Å²	57	6%	0.055	25%	0.254	C	S	.	.	S	Bend	trans	-70.8	126.8	177.8	179.3	0	0	0	0	109.4	L426 L462 N465 R466 I472 V474	L426-V468 HydrophobicContact CD1-CG2 4.05Å; L462-V468 HydrophobicContact CD2-CG1 4.06Å; L462-V468 HydrophobicContact CD2-CG2 3.98Å; N465-V468 HydrophobicContact CB-CG2 3.94Å; N465-V468 PolarHBondContact O-N 3.16Å; R466-V468 VanDerWaalsContact C-N 3.29Å; V468-I472 HydrophobicContact CG1-CB 3.98Å; V468-I472 HydrophobicContact CG1-CG1 4.09Å; V468-I472 HydrophobicContact CG1-CG2 4.39Å; V468-V474 HydrophobicContact CG1-CG2 4.45Å
469	P	92.2	Very high	91.8	Very high	25 Å²	25	59.2 Å²	59.2	16%	0.162	26%	0.262	C	S	.	.			trans	-58.5	146.3	177.9	-20.4	29.4	0	0	0	112.7	Y378 D471 I472	Y378-P469 HydrophobicContact CD1-CG 3.92Å; Y378-P469 HydrophobicContact CE1-CB 3.92Å; Y378-P469 HydrophobicContact CE1-CG 3.32Å; P469-D471 PolarHBondContact O-N 3.4Å; P469-I472 HydrophobicContact CB-CG1 4.27Å; P469-I472 HydrophobicContact CG-CG1 4.39Å; P469-I472 PolarHBondContact O-N 3.19Å; P469-I472 VanDerWaalsContact O-N 3.15Å
470	Q	88.6	Confident	91.6	Very high	164 Å²	164	62.9 Å²	62.9	77%	0.766	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.1	178.4	-70.7	-177.2	-9.3	0	0	113.2	I472 R479	Q470-I472 PolarHBondContact O-N 3.38Å; Q470-R479 PolarHBondContact O-NH2 3.49Å
471	D	89.3	Confident	91.3	Very high	116 Å²	116	63.2 Å²	63.2	62%	0.62	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.6	176.8	-58.5	-31.7	0	0	0	113.2	Y378 P469 R473	Y378-D471 HydrophobicContact CE2-CB 4.2Å; Y378-D471 WeakPolarHBondContact CE2-OD2 3.21Å; P469-D471 PolarHBondContact O-N 3.4Å; D471-R473 PolarHBondContact O-N 3.02Å
472	I	89.1	Confident	91	Very high	5 Å²	5	70.7 Å²	70.7	3%	0.026	32%	0.318	C	S	.	.	S	Bend	trans	-80.1	111.9	171.9	-46.5	-50.7	0	0	0	106.1	C371 L375 Y378 V468 P469 Q470 V474 R479	C371-I472 HydrophobicContact CB-CG2 4.45Å; C371-I472 WeakPolarHBondContact O-CG2 3.35Å; L375-I472 HydrophobicContact CB-CD1 4.28Å; L375-I472 HydrophobicContact CB-CG1 4.22Å; L375-I472 HydrophobicContact CB-CG2 4.18Å; L375-I472 HydrophobicContact CD1-CD1 4.27Å; L375-I472 HydrophobicContact CD1-CG1 3.92Å; Y378-I472 HydrophobicContact CD1-CD1 4.4Å; Y378-I472 HydrophobicContact CD2-CD1 4.25Å; Y378-I472 HydrophobicContact CG-CD1 3.87Å; V468-I472 HydrophobicContact CG1-CB 3.98Å; V468-I472 HydrophobicContact CG1-CG1 4.09Å; V468-I472 HydrophobicContact CG1-CG2 4.39Å; P469-I472 HydrophobicContact CB-CG1 4.27Å; P469-I472 HydrophobicContact CG-CG1 4.39Å; P469-I472 PolarHBondContact O-N 3.19Å; P469-I472 VanDerWaalsContact O-N 3.15Å; Q470-I472 PolarHBondContact O-N 3.38Å; I472-V474 HydrophobicContact CB-CG2 4.44Å; I472-V474 HydrophobicContact CG2-CG2 3.86Å; I472-V474 PolarHBondContact O-N 3.23Å; I472-R479 PolarHBondContact O-NH2 3.41Å; I472-R479 VanDerWaalsContact O-NH2 3.11Å
473	R	86.7	Confident	90.9	Very high	191 Å²	191	73 Å²	73	72%	0.721	33%	0.333	S	S	*	.			trans	-64.7	43.9	-177.2	-62.7	-179.3	175.2	-173.8	-3.8	114.3	D471	D471-R473 PolarHBondContact O-N 3.02Å
474	V	91.4	Very high	90.7	Very high	8 Å²	8	73.3 Å²	73.3	5%	0.048	34%	0.335	C	S	.	.			trans	-69.2	128.6	170.7	177.7	0	0	0	0	108.2	C371 L462 V468 I472 E476 F478	C371-V474 HydrophobicContact CB-CG2 4.05Å; L462-V474 HydrophobicContact CB-CG2 4.44Å; L462-V474 HydrophobicContact CD1-CG2 4.29Å; L462-V474 HydrophobicContact CD2-CG2 4.23Å; V468-V474 HydrophobicContact CG1-CG2 4.45Å; I472-V474 HydrophobicContact CB-CG2 4.44Å; I472-V474 HydrophobicContact CG2-CG2 3.86Å; I472-V474 PolarHBondContact O-N 3.23Å; V474-E476 PolarHBondContact O-N 3.47Å; V474-F478 HydrophobicContact CG1-CB 4.07Å
475	P	91.8	Very high	90.7	Very high	10 Å²	10	74 Å²	74	7%	0.065	34%	0.335	C	S	.	.			trans	-51.5	135	175.4	-29.2	35.2	0	0	0	112.5	T344 A346 R477 F478 R479	T344-P475 HydrophobicContact CG2-CG 4.02Å; A346-P475 HydrophobicContact CB-CG 4.07Å; P475-R477 HydrophobicContact CB-CG 3.97Å; P475-R477 PolarHBondContact O-N 3.21Å; P475-F478 HydrophobicContact CB-CD2 3.69Å; P475-F478 HydrophobicContact CB-CE2 3.94Å; P475-F478 HydrophobicContact CB-CG 4.15Å; P475-F478 HydrophobicContact CG-CD2 3.62Å; P475-F478 HydrophobicContact CG-CE2 3.65Å; P475-F478 WeakPolarHBondContact O-CB 3.44Å; P475-F478 PolarHBondContact O-N 2.98Å; P475-R479 PolarHBondContact O-N 3.4Å; P475-R479 VanDerWaalsContact O-N 3.14Å
476	E	89.8	Confident	90.7	Very high	88 Å²	88	74.8 Å²	74.8	41%	0.411	34%	0.339	S	S	.	.	H	α-helix	trans	-60.2	-34.7	-172.6	-171.4	66.8	-178.6	0	0	112.6	V474 F478 R479 K480	V474-E476 PolarHBondContact O-N 3.47Å; E476-F478 VanDerWaalsContact C-N 3.29Å; E476-F478 PolarHBondContact O-N 2.94Å; E476-R479 PolarHBondContact O-N 2.86Å; E476-R479 IonicContact OE2-CZ 3.1Å; E476-R479 IonicContact OE2-NH1 3.44Å; E476-R479 PolarHBondContact OE2-NH1 3.28Å; E476-K480 HydrophobicContact CG-CD 4.23Å; E476-K480 PolarHBondContact O-N 3.46Å; E476-K480 WeakPolarHBondContact OE1-CE 3.28Å; E476-K480 IonicContact OE1-NZ 3.71Å; E476-K480 PolarHBondContact OE1-NZ 3.3Å; E476-K480 VanDerWaalsContact OE1-NZ 3.1Å
477	R	89.8	Confident	90.8	Very high	74 Å²	74	63.6 Å²	63.6	28%	0.279	30%	0.297	S	S	.	.	H	α-helix	trans	-55.9	-40	171.5	51.9	-179.3	172.7	-122.6	-14	112.9	E342 P475 A481	E342-R477 VanDerWaalsContact CD-NH2 3.34Å; E342-R477 IonicContact OE1-CZ 3.74Å; E342-R477 IonicContact OE1-NH1 3.05Å; E342-R477 PolarHBondContact OE1-NH1 3.15Å; E342-R477 IonicContact OE1-NH2 3.54Å; E342-R477 PolarHBondContact OE1-NH2 3.32Å; E342-R477 IonicContact OE2-CZ 2.68Å; E342-R477 IonicContact OE2-NH1 3.52Å; E342-R477 PolarHBondContact OE2-NH1 3.3Å; E342-R477 VanDerWaalsContact OE2-NH1 3.15Å; E342-R477 IonicContact OE2-NH2 2.72Å; E342-R477 PolarHBondContact OE2-NH2 3.38Å; P475-R477 HydrophobicContact CB-CG 3.97Å; P475-R477 PolarHBondContact O-N 3.21Å; R477-A481 WeakPolarHBondContact O-CB 3.49Å; R477-A481 PolarHBondContact O-N 2.92Å
478	F	92.4	Very high	90.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-78.4	-30.6	179.2	-56.1	-22.2	0	0	0	112.2	L212 W213 L341 A346 L366 L368 I463 G464 V474 P475 E476 K480	L212-F478 HydrophobicContact CD1-CE1 4.1Å; L212-F478 HydrophobicContact CD1-CZ 4.28Å; L212-F478 HydrophobicContact CD2-CZ 4.48Å; W213-F478 HydrophobicContact CE3-CE1 4.43Å; W213-F478 AromaticContact CH2-CD1 3.45Å; W213-F478 HydrophobicContact CH2-CD1 3.45Å; W213-F478 VanDerWaalsContact CH2-CD1 3.45Å; W213-F478 AromaticContact CH2-CE1 3.16Å; W213-F478 HydrophobicContact CH2-CE1 3.16Å; W213-F478 HydrophobicContact CH2-CE2 4.3Å; W213-F478 HydrophobicContact CH2-CG 4.18Å; W213-F478 AromaticContact CH2-CZ 3.64Å; W213-F478 HydrophobicContact CH2-CZ 3.64Å; W213-F478 AromaticContact CZ2-CD1 3.85Å; W213-F478 HydrophobicContact CZ2-CD1 3.85Å; W213-F478 AromaticContact CZ2-CE1 3.96Å; W213-F478 HydrophobicContact CZ2-CE1 3.96Å; W213-F478 HydrophobicContact CZ3-CD1 4.16Å; W213-F478 AromaticContact CZ3-CE1 3.42Å; W213-F478 HydrophobicContact CZ3-CE1 3.42Å; W213-F478 VanDerWaalsContact CZ3-CE1 3.42Å; W213-F478 AromaticContact CZ3-CZ 3.77Å; W213-F478 HydrophobicContact CZ3-CZ 3.77Å; L341-F478 HydrophobicContact CD2-CE2 3.85Å; L341-F478 HydrophobicContact CD2-CZ 3.48Å; L341-F478 VanDerWaalsContact CD2-CZ 3.48Å; A346-F478 HydrophobicContact CB-CE2 3.93Å; L366-F478 HydrophobicContact CD2-CE1 4.44Å; L366-F478 HydrophobicContact CD2-CE2 3.89Å; L366-F478 HydrophobicContact CD2-CZ 3.48Å; L366-F478 VanDerWaalsContact CD2-CZ 3.48Å; L368-F478 HydrophobicContact CD1-CD2 4.41Å; L368-F478 HydrophobicContact CD2-CD2 3.92Å; L368-F478 HydrophobicContact CD2-CE2 4.03Å; I463-F478 HydrophobicContact CG1-CB 4.44Å; G464-F478 PolarHBondContact N-O 3.47Å; V474-F478 HydrophobicContact CG1-CB 4.07Å; P475-F478 HydrophobicContact CB-CD2 3.69Å; P475-F478 HydrophobicContact CB-CE2 3.94Å; P475-F478 HydrophobicContact CB-CG 4.15Å; P475-F478 HydrophobicContact CG-CD2 3.62Å; P475-F478 HydrophobicContact CG-CE2 3.65Å; P475-F478 WeakPolarHBondContact O-CB 3.44Å; P475-F478 PolarHBondContact O-N 2.98Å; E476-F478 VanDerWaalsContact C-N 3.29Å; E476-F478 PolarHBondContact O-N 2.94Å; F478-K480 VanDerWaalsContact C-N 3.32Å
479	R	90.4	Very high	90.3	Very high	47 Å²	47	64.8 Å²	64.8	18%	0.177	31%	0.305	C	S	.	.	H	α-helix	trans	-66.6	-35.9	173.8	-172.3	179.5	-71.3	146.4	-6.1	111.8	Q470 I472 P475 E476	Q470-R479 PolarHBondContact O-NH2 3.49Å; I472-R479 PolarHBondContact O-NH2 3.41Å; I472-R479 VanDerWaalsContact O-NH2 3.11Å; P475-R479 PolarHBondContact O-N 3.4Å; P475-R479 VanDerWaalsContact O-N 3.14Å; E476-R479 PolarHBondContact O-N 2.86Å; E476-R479 IonicContact OE2-CZ 3.1Å; E476-R479 IonicContact OE2-NH1 3.44Å; E476-R479 PolarHBondContact OE2-NH1 3.28Å
480	K	89.6	Confident	90.2	Very high	159 Å²	159	63.7 Å²	63.7	69%	0.691	30%	0.297	S	S	*	.	H	α-helix	trans	-88.8	-15.2	179.6	-69.3	176.8	178.5	158.9	0	114.5	E476 F478	E476-K480 HydrophobicContact CG-CD 4.23Å; E476-K480 PolarHBondContact O-N 3.46Å; E476-K480 WeakPolarHBondContact OE1-CE 3.28Å; E476-K480 IonicContact OE1-NZ 3.71Å; E476-K480 PolarHBondContact OE1-NZ 3.3Å; E476-K480 VanDerWaalsContact OE1-NZ 3.1Å; F478-K480 VanDerWaalsContact C-N 3.32Å
481	A	90.3	Very high	90.2	Very high	17 Å²	17	58.8 Å²	58.8	14%	0.14	28%	0.279	C	S	.	.	S	Bend	trans	-62.2	159.4	178.5	0	0	0	0	0	112.4	C214 I463 G464 R477	C214-A481 HydrophobicContact CB-CB 4.33Å; I463-A481 HydrophobicContact CG2-CB 4Å; G464-A481 WeakPolarHBondContact CA-O 3.33Å; R477-A481 WeakPolarHBondContact O-CB 3.49Å; R477-A481 PolarHBondContact O-N 2.92Å
482	E	89.4	Confident	90	Very high	160 Å²	160	58.5 Å²	58.5	75%	0.748	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-61.4	140.2	170.8	-169.1	-180	170.5	0	0	110.6	I484	E482-I484 PolarHBondContact O-N 3.13Å
483	P	92	Very high	90	Very high	49 Å²	49	64.7 Å²	64.7	32%	0.318	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-58.8	125.8	176.6	-25.4	34.8	0	0	0	112.9	Y459	Y459-P483 HydrophobicContact CD1-CB 3.55Å; Y459-P483 HydrophobicContact CD2-CB 4.39Å; Y459-P483 HydrophobicContact CE1-CB 3.82Å; Y459-P483 WeakPolarHBondContact CE1-O 3.49Å; Y459-P483 HydrophobicContact CG-CB 3.85Å
484	I	90.6	Very high	90.2	Very high	10 Å²	10	65.5 Å²	65.5	5%	0.051	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-89.7	126.5	-174.7	-64.8	174.5	0	0	0	110.5	W213 Q225 C226 Y459 H460 I463 E482	W213-I484 HydrophobicContact CZ2-CD1 3.84Å; Q225-I484 HydrophobicContact CB-CD1 4.22Å; Q225-I484 HydrophobicContact CB-CG1 4.41Å; Q225-I484 HydrophobicContact CB-CG2 4.13Å; C226-I484 HydrophobicContact CB-CD1 4.47Å; C226-I484 WeakPolarHBondContact SG-CD1 3.38Å; Y459-I484 CarbonylContact C-O 3.42Å; Y459-I484 VanDerWaalsContact CA-O 3.23Å; Y459-I484 WeakPolarHBondContact CA-O 3.35Å; H460-I484 HydrophobicContact CB-CB 4.37Å; H460-I484 PolarHBondContact N-O 3.49Å; I463-I484 HydrophobicContact CB-CD1 4.35Å; I463-I484 HydrophobicContact CD1-CD1 3.81Å; I463-I484 HydrophobicContact CG2-CD1 3.7Å; I463-I484 HydrophobicContact CG2-CG1 4Å; E482-I484 PolarHBondContact O-N 3.13Å
485	N	92.6	Very high	90.2	Very high	32 Å²	32	74.4 Å²	74.4	17%	0.171	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-87	110.3	179.6	-178.2	14.3	0	0	0	111.9	K456 R457 L458 Y459 F487 R488	K456-N485 PolarHBondContact O-ND2 3.29Å; R457-N485 WeakPolarHBondContact CA-OD1 3.49Å; L458-N485 PolarHBondContact N-OD1 3.17Å; L458-N485 PolarHBondContact O-OD1 3.43Å; Y459-N485 HydrophobicContact CD1-CB 4.33Å; Y459-N485 HydrophobicContact CE1-CB 4.36Å; N485-F487 PolarHBondContact O-N 2.85Å; N485-F487 PolarHBondContact OD1-N 3.45Å; N485-R488 WeakPolarHBondContact O-CB 2.79Å; N485-R488 PolarHBondContact O-N 3.23Å
486	L	92.1	Very high	90.2	Very high	38 Å²	38	76.6 Å²	76.6	20%	0.199	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.6	175.9	-58.1	-179.1	0	0	0	113	Y415 T419 L458 H460 R488	Y415-L486 HydrophobicContact CD1-CD1 4.24Å; Y415-L486 HydrophobicContact CE1-CD1 3.79Å; Y415-L486 HydrophobicContact CE1-CD2 4.3Å; T419-L486 HydrophobicContact CG2-CD1 3.92Å; L458-L486 HydrophobicContact CD2-CD1 4.41Å; L458-L486 HydrophobicContact CG-CD1 4.37Å; L458-L486 WeakPolarHBondContact O-CB 3.47Å; L458-L486 PolarHBondContact O-N 3.12Å; H460-L486 HydrophobicContact CB-CD2 4.37Å; L486-R488 VanDerWaalsContact C-N 3.28Å; L486-R488 PolarHBondContact O-N 2.83Å
487	F	92.9	Very high	90.5	Very high	2 Å²	2	74.6 Å²	74.6	1%	0.009	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	15.1	177.9	-72	-9.5	0	0	0	113.7	L412 H416 L453 K456 L458 N485 S489 L490 V491	L412-F487 HydrophobicContact CD2-CE1 3.98Å; L412-F487 HydrophobicContact CD2-CZ 3.74Å; H416-F487 HydrophobicContact CB-CE1 4.46Å; H416-F487 AromaticContact CD2-CE1 3.63Å; H416-F487 AromaticContact CG-CE1 3.9Å; H416-F487 AromaticContact NE2-CE1 3.87Å; L453-F487 HydrophobicContact CD2-CD2 4.31Å; L453-F487 HydrophobicContact CD2-CE2 3.65Å; L453-F487 HydrophobicContact CD2-CZ 3.88Å; L453-F487 HydrophobicContact CG-CE2 3.93Å; L453-F487 HydrophobicContact CG-CZ 4.34Å; K456-F487 WeakPolarHBondContact O-CB 3.44Å; L458-F487 HydrophobicContact CB-CD1 4.12Å; L458-F487 HydrophobicContact CB-CD2 3.68Å; L458-F487 HydrophobicContact CB-CE1 4.18Å; L458-F487 HydrophobicContact CB-CE2 3.74Å; L458-F487 HydrophobicContact CB-CG 3.88Å; L458-F487 HydrophobicContact CB-CZ 4Å; L458-F487 HydrophobicContact CD2-CD1 4.4Å; L458-F487 HydrophobicContact CD2-CE1 3.77Å; L458-F487 HydrophobicContact CD2-CE2 4.22Å; L458-F487 HydrophobicContact CD2-CZ 3.66Å; L458-F487 HydrophobicContact CG-CZ 4.49Å; N485-F487 PolarHBondContact O-N 2.85Å; N485-F487 PolarHBondContact OD1-N 3.45Å; F487-S489 PolarHBondContact O-N 2.89Å; F487-L490 HydrophobicContact CB-CB 4.37Å; F487-L490 HydrophobicContact CB-CD1 4.07Å; F487-L490 HydrophobicContact CB-CG 4.33Å; F487-L490 HydrophobicContact CD1-CD1 3.8Å; F487-L490 HydrophobicContact CD1-CG 4.49Å; F487-L490 HydrophobicContact CD2-CD1 4.12Å; F487-L490 HydrophobicContact CE1-CD1 4.22Å; F487-L490 HydrophobicContact CG-CD1 3.75Å; F487-L490 HydrophobicContact CG-CG 4.47Å; F487-L490 WeakPolarHBondContact O-CA 3.31Å; F487-L490 WeakPolarHBondContact O-CB 3.47Å; F487-L490 PolarHBondContact O-N 3.24Å; F487-V491 PolarHBondContact O-N 2.96Å
488	R	88.1	Confident	90.7	Very high	113 Å²	113	73.2 Å²	73.2	43%	0.426	35%	0.345	S	S	.	.	H	α-helix	trans	-53.7	-40.9	177.6	-175.3	61.5	175.3	157.2	1.1	112.5	N485 L486 L490 V491 L492	N485-R488 WeakPolarHBondContact O-CB 2.79Å; N485-R488 PolarHBondContact O-N 3.23Å; L486-R488 VanDerWaalsContact C-N 3.28Å; L486-R488 PolarHBondContact O-N 2.83Å; R488-L490 VanDerWaalsContact C-N 3.26Å; R488-L490 PolarHBondContact O-N 3.16Å; R488-V491 WeakPolarHBondContact O-CB 3.45Å; R488-V491 PolarHBondContact O-N 3.24Å; R488-V491 VanDerWaalsContact O-N 3.11Å; R488-L492 PolarHBondContact O-N 3.45Å
489	S	86.5	Confident	90.7	Very high	53 Å²	53	75.1 Å²	75.1	37%	0.371	36%	0.36	S	S	.	.	H	α-helix	trans	-62.2	-32.1	176.9	62.7	0	0	0	0	113.1	F487 V491 L492 R493	F487-S489 PolarHBondContact O-N 2.89Å; S489-V491 VanDerWaalsContact C-N 3.34Å; S489-L492 PolarHBondContact O-N 2.9Å; S489-R493 WeakPolarHBondContact O-CB 3.47Å; S489-R493 PolarHBondContact O-N 3.11Å
490	L	90.1	Very high	91	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-72.9	-27.7	176.2	-58.7	-173	0	0	0	112.7	A411 L453 F487 R488 L496 Y497 T500	A411-L490 HydrophobicContact CB-CD2 3.56Å; A411-L490 HydrophobicContact CB-CG 4.49Å; L453-L490 HydrophobicContact CD2-CD1 3.9Å; F487-L490 HydrophobicContact CB-CB 4.37Å; F487-L490 HydrophobicContact CB-CD1 4.07Å; F487-L490 HydrophobicContact CB-CG 4.33Å; F487-L490 HydrophobicContact CD1-CD1 3.8Å; F487-L490 HydrophobicContact CD1-CG 4.49Å; F487-L490 HydrophobicContact CD2-CD1 4.12Å; F487-L490 HydrophobicContact CE1-CD1 4.22Å; F487-L490 HydrophobicContact CG-CD1 3.75Å; F487-L490 HydrophobicContact CG-CG 4.47Å; F487-L490 WeakPolarHBondContact O-CA 3.31Å; F487-L490 WeakPolarHBondContact O-CB 3.47Å; F487-L490 PolarHBondContact O-N 3.24Å; R488-L490 VanDerWaalsContact C-N 3.26Å; R488-L490 PolarHBondContact O-N 3.16Å; L490-L496 HydrophobicContact CD2-CD2 4.02Å; L490-L496 HydrophobicContact CD2-CG 3.85Å; L490-Y497 HydrophobicContact CB-CD2 4.16Å; L490-Y497 HydrophobicContact CD1-CD2 4.48Å; L490-T500 HydrophobicContact CD1-CG2 4.28Å
491	V	88.6	Confident	91.3	Very high	62 Å²	62	66.8 Å²	66.8	38%	0.376	33%	0.328	S	S	.	.	H	α-helix	trans	-66.7	-43.1	172	-178.6	0	0	0	0	110.1	K456 F487 R488 S489	K456-V491 HydrophobicContact CB-CG2 3.8Å; K456-V491 HydrophobicContact CD-CG2 4.47Å; F487-V491 PolarHBondContact O-N 2.96Å; R488-V491 WeakPolarHBondContact O-CB 3.45Å; R488-V491 PolarHBondContact O-N 3.24Å; R488-V491 VanDerWaalsContact O-N 3.11Å; S489-V491 VanDerWaalsContact C-N 3.34Å
492	L	85.3	Confident	91.5	Very high	109 Å²	109	72.4 Å²	72.4	57%	0.571	35%	0.346	S	S	*	.	H	α-helix	trans	-79	-32.3	-175.5	-59.3	175.5	0	0	0	113	R488 S489	R488-L492 PolarHBondContact O-N 3.45Å; S489-L492 PolarHBondContact O-N 2.9Å
493	R	89.3	Confident	91.8	Very high	135 Å²	135	65 Å²	65	51%	0.509	31%	0.311	S	S	.	.			trans	-114.1	91.3	-171.4	-63.9	179.7	170.8	-169.8	-4.3	112.2	S489 K495 L496 Y497	S489-R493 WeakPolarHBondContact O-CB 3.47Å; S489-R493 PolarHBondContact O-N 3.11Å; R493-K495 PolarHBondContact O-N 3.43Å; R493-L496 HydrophobicContact CB-CB 3.72Å; R493-L496 HydrophobicContact CB-CD2 4.28Å; R493-L496 WeakPolarHBondContact O-CB 3.46Å; R493-L496 PolarHBondContact O-N 2.9Å; R493-L496 VanDerWaalsContact O-N 3.15Å; R493-Y497 PolarHBondContact O-N 3.36Å
494	R	91.1	Very high	91.9	Very high	209 Å²	209	62.9 Å²	62.9	79%	0.789	30%	0.297	S	S	*	.	H	α-helix	trans	-55.8	-42.3	-178.3	-172.1	177.1	-178.3	176.3	1.8	114.2	Y497 A498	R494-Y497 PolarHBondContact O-N 3.49Å; R494-A498 PolarHBondContact O-N 2.97Å
495	K	92.3	Very high	92.1	Very high	194 Å²	194	66 Å²	66	84%	0.843	31%	0.311	S	S	*	.	H	α-helix	trans	-64.8	-43.4	178.5	-69	-176.6	-179.8	177.8	0	111.7	R493 A498 A499	R493-K495 PolarHBondContact O-N 3.43Å; K495-A498 PolarHBondContact O-N 2.79Å; K495-A499 WeakPolarHBondContact O-CB 3.33Å; K495-A499 PolarHBondContact O-N 2.99Å
496	L	91.7	Very high	92.2	Very high	56 Å²	56	67.5 Å²	67.5	29%	0.293	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-43.5	176.9	-176.6	63.9	0	0	0	110.9	A411 L490 R493 A499 T500	A411-L496 HydrophobicContact CB-CD1 3.99Å; A411-L496 HydrophobicContact CB-CD2 4.11Å; A411-L496 HydrophobicContact CB-CG 3.96Å; L490-L496 HydrophobicContact CD2-CD2 4.02Å; L490-L496 HydrophobicContact CD2-CG 3.85Å; R493-L496 HydrophobicContact CB-CB 3.72Å; R493-L496 HydrophobicContact CB-CD2 4.28Å; R493-L496 WeakPolarHBondContact O-CB 3.46Å; R493-L496 PolarHBondContact O-N 2.9Å; R493-L496 VanDerWaalsContact O-N 3.15Å; L496-A499 PolarHBondContact O-N 3.2Å; L496-T500 VanDerWaalsContact O-CB 3.28Å; L496-T500 WeakPolarHBondContact O-CB 3.31Å; L496-T500 PolarHBondContact O-N 3.45Å; L496-T500 PolarHBondContact O-OG1 3.05Å
497	Y	94.5	Very high	92.3	Very high	47 Å²	47	65.7 Å²	65.7	18%	0.184	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-52.2	174.2	173.5	-107.8	0	0	0	112.3	L453 K456 L490 R493 R494 A499 T500 V501	L453-Y497 VanDerWaalsContact O-CE2 3.27Å; L453-Y497 WeakPolarHBondContact O-CE2 3.34Å; L453-Y497 PolarHBondContact O-OH 3.15Å; K456-Y497 HydrophobicContact CD-CD2 4.42Å; K456-Y497 HydrophobicContact CD-CE2 4.32Å; K456-Y497 HydrophobicContact CG-CD2 4.08Å; K456-Y497 HydrophobicContact CG-CE2 3.71Å; L490-Y497 HydrophobicContact CB-CD2 4.16Å; L490-Y497 HydrophobicContact CD1-CD2 4.48Å; R493-Y497 PolarHBondContact O-N 3.36Å; R494-Y497 PolarHBondContact O-N 3.49Å; Y497-A499 VanDerWaalsContact C-N 3.33Å; Y497-A499 PolarHBondContact O-N 2.81Å; Y497-T500 PolarHBondContact O-N 2.9Å; Y497-T500 VanDerWaalsContact O-N 3.12Å; Y497-V501 HydrophobicContact CD2-CG2 4.01Å; Y497-V501 HydrophobicContact CE1-CG2 4.1Å; Y497-V501 HydrophobicContact CE2-CG2 3.49Å; Y497-V501 VanDerWaalsContact CE2-CG2 3.49Å; Y497-V501 WeakPolarHBondContact O-CG2 3.39Å; Y497-V501 PolarHBondContact O-N 3.44Å
498	A	93.9	Very high	92.3	Very high	45 Å²	45	67 Å²	67	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-60.2	-41.8	180	0	0	0	0	0	112.4	R494 K495 R502	R494-A498 PolarHBondContact O-N 2.97Å; K495-A498 PolarHBondContact O-N 2.79Å; A498-R502 WeakPolarHBondContact O-CB 3.43Å; A498-R502 PolarHBondContact O-N 3Å
499	A	94.2	Very high	92.4	Very high	39 Å²	39	71.7 Å²	71.7	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-40.6	175	0	0	0	0	0	112.1	K495 L496 Y497 R502 H503	K495-A499 WeakPolarHBondContact O-CB 3.33Å; K495-A499 PolarHBondContact O-N 2.99Å; L496-A499 PolarHBondContact O-N 3.2Å; Y497-A499 VanDerWaalsContact C-N 3.33Å; Y497-A499 PolarHBondContact O-N 2.81Å; A499-R502 PolarHBondContact O-N 3.27Å; A499-H503 WeakPolarHBondContact O-CB 3.45Å; A499-H503 PolarHBondContact O-N 2.85Å
500	T	95.2	Very high	92.6	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-67.2	-42.9	179.9	-58.7	0	0	0	0	112	A411 L412 L453 L490 L496 Y497 H503 F504	A411-T500 HydrophobicContact CB-CG2 4.19Å; A411-T500 VanDerWaalsContact CB-OG1 3.31Å; A411-T500 WeakPolarHBondContact CB-OG1 3.01Å; A411-T500 PolarHBondContact N-OG1 3.07Å; L412-T500 HydrophobicContact CB-CG2 4.45Å; L412-T500 HydrophobicContact CD1-CG2 4.04Å; L412-T500 HydrophobicContact CD2-CG2 4.5Å; L412-T500 HydrophobicContact CG-CG2 3.62Å; L453-T500 HydrophobicContact CD2-CG2 3.99Å; L490-T500 HydrophobicContact CD1-CG2 4.28Å; L496-T500 VanDerWaalsContact O-CB 3.28Å; L496-T500 WeakPolarHBondContact O-CB 3.31Å; L496-T500 PolarHBondContact O-N 3.45Å; L496-T500 PolarHBondContact O-OG1 3.05Å; Y497-T500 PolarHBondContact O-N 2.9Å; Y497-T500 VanDerWaalsContact O-N 3.12Å; T500-H503 PolarHBondContact O-N 3.46Å; T500-F504 PolarHBondContact O-N 3.43Å
501	V	95.8	Very high	92.6	Very high	31 Å²	31	71.5 Å²	71.5	19%	0.188	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-46.9	175.4	171.7	0	0	0	0	110.7	Y497 H503 F504 Q505	Y497-V501 HydrophobicContact CD2-CG2 4.01Å; Y497-V501 HydrophobicContact CE1-CG2 4.1Å; Y497-V501 HydrophobicContact CE2-CG2 3.49Å; Y497-V501 VanDerWaalsContact CE2-CG2 3.49Å; Y497-V501 WeakPolarHBondContact O-CG2 3.39Å; Y497-V501 PolarHBondContact O-N 3.44Å; V501-H503 PolarHBondContact O-N 3.39Å; V501-F504 PolarHBondContact O-N 3.28Å; V501-Q505 HydrophobicContact CG1-CG 4.44Å; V501-Q505 WeakPolarHBondContact O-CG 3.41Å; V501-Q505 PolarHBondContact O-N 3Å
502	R	94.7	Very high	92.6	Very high	136 Å²	136	70.5 Å²	70.5	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-47.5	176.7	-169.2	-170	-54	120.6	3.3	111.4	A498 A499 F504 Q505 E506	A498-R502 WeakPolarHBondContact O-CB 3.43Å; A498-R502 PolarHBondContact O-N 3Å; A499-R502 PolarHBondContact O-N 3.27Å; R502-F504 VanDerWaalsContact C-N 3.31Å; R502-F504 PolarHBondContact O-N 3.01Å; R502-Q505 PolarHBondContact O-N 3.19Å; R502-E506 WeakPolarHBondContact CD-OE1 3.38Å; R502-E506 HydrophobicContact CG-CG 4.36Å; R502-E506 WeakPolarHBondContact CG-OE1 3.2Å; R502-E506 WeakPolarHBondContact O-CB 3.35Å; R502-E506 WeakPolarHBondContact O-CG 3.24Å; R502-E506 PolarHBondContact O-N 3.06Å
503	H	95.6	Very high	92.6	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.019	32%	0.322	C	S	.	.	H	α-helix	trans	-55.2	-46.3	176	172.2	91.2	0	0	0	111.8	H400 T407 S410 A499 T500 V501 E506 M507	H400-H503 AromaticContact CE1-NE2 3.49Å; H400-H503 PolarHBondContact CE1-NE2 3.25Å; H400-H503 AromaticContact ND1-CD2 3.95Å; H400-H503 AromaticContact ND1-CE1 3.82Å; H400-H503 AromaticContact ND1-NE2 2.94Å; H400-H503 PolarHBondContact ND1-NE2 2.92Å; T407-H503 PolarHBondContact OG1-ND1 3.33Å; S410-H503 PolarHBondContact OG-CD2 3.42Å; A499-H503 WeakPolarHBondContact O-CB 3.45Å; A499-H503 PolarHBondContact O-N 2.85Å; T500-H503 PolarHBondContact O-N 3.46Å; V501-H503 PolarHBondContact O-N 3.39Å; H503-E506 PolarHBondContact O-N 3.43Å; H503-M507 VanDerWaalsContact O-CB 3.31Å; H503-M507 WeakPolarHBondContact O-CB 3.5Å; H503-M507 PolarHBondContact O-N 3.04Å
504	F	95.9	Very high	92.5	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-42.3	179.7	-175.3	-101	0	0	0	112.3	L412 F417 F446 L449 Q450 L453 T500 V501 R502 M507 L508	L412-F504 HydrophobicContact CD1-CB 3.96Å; L412-F504 HydrophobicContact CD1-CD2 3.77Å; L412-F504 HydrophobicContact CD1-CG 4.25Å; F417-F504 HydrophobicContact CE1-CE2 4.29Å; F417-F504 HydrophobicContact CZ-CE2 4.48Å; F446-F504 HydrophobicContact CB-CZ 4.24Å; F446-F504 HydrophobicContact CD1-CE2 4.16Å; F446-F504 HydrophobicContact CD1-CZ 4.17Å; F446-F504 WeakPolarHBondContact O-CZ 3.28Å; L449-F504 HydrophobicContact CB-CE2 3.93Å; L449-F504 HydrophobicContact CB-CZ 3.92Å; L449-F504 HydrophobicContact CD1-CE2 4.22Å; Q450-F504 HydrophobicContact CB-CE1 3.87Å; Q450-F504 HydrophobicContact CB-CZ 4.49Å; Q450-F504 HydrophobicContact CG-CE1 4.44Å; L453-F504 HydrophobicContact CD1-CB 3.88Å; L453-F504 HydrophobicContact CD1-CD1 3.89Å; L453-F504 HydrophobicContact CD1-CD2 4.25Å; L453-F504 HydrophobicContact CD1-CG 3.74Å; T500-F504 PolarHBondContact O-N 3.43Å; V501-F504 PolarHBondContact O-N 3.28Å; R502-F504 VanDerWaalsContact C-N 3.31Å; R502-F504 PolarHBondContact O-N 3.01Å; F504-M507 HydrophobicContact CD2-CE 3.63Å; F504-M507 HydrophobicContact CE2-CE 3.6Å; F504-M507 HydrophobicContact CZ-CE 4.47Å; F504-M507 WeakPolarHBondContact O-CB 3.37Å; F504-M507 PolarHBondContact O-N 3.44Å; F504-L508 HydrophobicContact CD1-CD1 4.14Å; F504-L508 HydrophobicContact CE1-CD1 3.55Å; F504-L508 HydrophobicContact CE1-CG 4.26Å; F504-L508 HydrophobicContact CZ-CD1 3.94Å; F504-L508 HydrophobicContact CZ-CG 4.37Å; F504-L508 WeakPolarHBondContact O-CG 3.31Å; F504-L508 PolarHBondContact O-N 3.15Å; F504-L508 VanDerWaalsContact O-N 3.13Å
505	Q	94.1	Very high	92.2	Very high	76 Å²	76	54.2 Å²	54.2	36%	0.355	26%	0.264	S	S	.	.	H	α-helix	trans	-64.4	-44.7	176.8	-71.3	171	-30.4	0	0	112	V501 R502 L508 R509	V501-Q505 HydrophobicContact CG1-CG 4.44Å; V501-Q505 WeakPolarHBondContact O-CG 3.41Å; V501-Q505 PolarHBondContact O-N 3Å; R502-Q505 PolarHBondContact O-N 3.19Å; Q505-L508 PolarHBondContact O-N 3.29Å; Q505-R509 WeakPolarHBondContact O-CB 3.29Å; Q505-R509 PolarHBondContact O-N 3.37Å
506	E	93.7	Very high	91.7	Very high	64 Å²	64	49.1 Å²	49.1	30%	0.299	24%	0.243	S	C	.	.	H	α-helix	trans	-65.8	-38.9	177.2	-69.3	173.4	176	0	0	111.8	Q403 T407 R502 H503 L508 R509 N510	Q403-E506 PolarHBondContact NE2-OE2 3.42Å; T407-E506 WeakPolarHBondContact CG2-OE2 3.46Å; R502-E506 WeakPolarHBondContact CD-OE1 3.38Å; R502-E506 HydrophobicContact CG-CG 4.36Å; R502-E506 WeakPolarHBondContact CG-OE1 3.2Å; R502-E506 WeakPolarHBondContact O-CB 3.35Å; R502-E506 WeakPolarHBondContact O-CG 3.24Å; R502-E506 PolarHBondContact O-N 3.06Å; H503-E506 PolarHBondContact O-N 3.43Å; E506-L508 VanDerWaalsContact C-N 3.32Å; E506-L508 PolarHBondContact O-N 3.45Å; E506-R509 PolarHBondContact O-N 3.37Å; E506-N510 VanDerWaalsContact O-CB 3.31Å; E506-N510 WeakPolarHBondContact O-CB 3.3Å; E506-N510 PolarHBondContact O-N 3.09Å; E506-N510 PolarHBondContact O-ND2 2.78Å
507	M	94.6	Very high	91.2	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-55.8	-46.9	173.2	-178	-166.5	70.7	0	0	111.2	L399 H400 Q403 F417 F446 H503 F504 N510 A511	L399-M507 HydrophobicContact CB-CG 3.94Å; L399-M507 HydrophobicContact CB-SD 4.18Å; H400-M507 VanDerWaalsContact CA-SD 3.51Å; H400-M507 HydrophobicContact CB-SD 3.77Å; H400-M507 PolarHBondContact N-SD 3.37Å; Q403-M507 HydrophobicContact CB-CB 3.92Å; Q403-M507 HydrophobicContact CB-CG 4.09Å; Q403-M507 HydrophobicContact CG-CB 3.86Å; F417-M507 HydrophobicContact CE1-CE 4.02Å; F417-M507 HydrophobicContact CE1-SD 4.36Å; F417-M507 HydrophobicContact CZ-CE 3.96Å; F417-M507 HydrophobicContact CZ-SD 3.87Å; F446-M507 HydrophobicContact CD1-CE 4.05Å; F446-M507 HydrophobicContact CE1-CE 3.67Å; F446-M507 HydrophobicContact CZ-CE 4.5Å; H503-M507 VanDerWaalsContact O-CB 3.31Å; H503-M507 WeakPolarHBondContact O-CB 3.5Å; H503-M507 PolarHBondContact O-N 3.04Å; F504-M507 HydrophobicContact CD2-CE 3.63Å; F504-M507 HydrophobicContact CE2-CE 3.6Å; F504-M507 HydrophobicContact CZ-CE 4.47Å; F504-M507 WeakPolarHBondContact O-CB 3.37Å; F504-M507 PolarHBondContact O-N 3.44Å; M507-N510 PolarHBondContact O-N 2.82Å; M507-A511 WeakPolarHBondContact O-CB 3Å; M507-A511 PolarHBondContact O-N 3.01Å
508	L	92.7	Very high	90.2	Very high	30 Å²	30	53.9 Å²	53.9	16%	0.157	26%	0.264	C	S	.	.	H	α-helix	trans	-67.7	-40.1	178.4	-66.7	-178.1	0	0	0	112.1	M122 F446 F504 Q505 E506 N510 A511	M122-L508 HydrophobicContact CE-CD2 4.26Å; F446-L508 HydrophobicContact CB-CD2 4.01Å; F446-L508 HydrophobicContact CD1-CD2 3.69Å; F446-L508 HydrophobicContact CD2-CD2 3.81Å; F446-L508 HydrophobicContact CE1-CD2 4.02Å; F446-L508 HydrophobicContact CE2-CD2 4.07Å; F446-L508 HydrophobicContact CG-CD2 3.57Å; F446-L508 HydrophobicContact CZ-CD2 4.19Å; F504-L508 HydrophobicContact CD1-CD1 4.14Å; F504-L508 HydrophobicContact CE1-CD1 3.55Å; F504-L508 HydrophobicContact CE1-CG 4.26Å; F504-L508 HydrophobicContact CZ-CD1 3.94Å; F504-L508 HydrophobicContact CZ-CG 4.37Å; F504-L508 WeakPolarHBondContact O-CG 3.31Å; F504-L508 PolarHBondContact O-N 3.15Å; F504-L508 VanDerWaalsContact O-N 3.13Å; Q505-L508 PolarHBondContact O-N 3.29Å; E506-L508 VanDerWaalsContact C-N 3.32Å; E506-L508 PolarHBondContact O-N 3.45Å; L508-N510 VanDerWaalsContact C-N 3.32Å; L508-N510 PolarHBondContact O-N 3.33Å; L508-A511 WeakPolarHBondContact O-CB 3.34Å; L508-A511 PolarHBondContact O-N 3.37Å
509	R	91.3	Very high	88.9	Confident	211 Å²	211	52.4 Å²	52.4	80%	0.796	25%	0.25	S	C	*	.	H	α-helix	trans	-62.2	-39.8	176.7	-175.7	-178.8	177.1	-171.7	-0.3	112.1	Q505 E506	Q505-R509 WeakPolarHBondContact O-CB 3.29Å; Q505-R509 PolarHBondContact O-N 3.37Å; E506-R509 PolarHBondContact O-N 3.37Å
510	N	90.8	Very high	87	Confident	50 Å²	50	55 Å²	55	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-86	-9.9	-177.3	-64.8	-22.3	0	0	0	113.2	Q403 E506 M507 L508 V513 L514	Q403-N510 PolarHBondContact OE1-ND2 3.17Å; E506-N510 VanDerWaalsContact O-CB 3.31Å; E506-N510 WeakPolarHBondContact O-CB 3.3Å; E506-N510 PolarHBondContact O-N 3.09Å; E506-N510 PolarHBondContact O-ND2 2.78Å; M507-N510 PolarHBondContact O-N 2.82Å; L508-N510 VanDerWaalsContact C-N 3.32Å; L508-N510 PolarHBondContact O-N 3.33Å; N510-V513 PolarHBondContact O-N 3.46Å; N510-L514 HydrophobicContact CB-CD1 3.87Å; N510-L514 HydrophobicContact CB-CG 4.17Å; N510-L514 WeakPolarHBondContact O-CG 3.46Å; N510-L514 PolarHBondContact O-N 3.45Å
511	A	90.3	Very high	84.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-53.8	-44.9	-171.7	0	0	0	0	0	114.9	M123 L399 M507 L508 V513 L514 L515	M123-A511 HydrophobicContact CE-CB 4.22Å; L399-A511 HydrophobicContact CD1-CB 3.69Å; L399-A511 HydrophobicContact CD2-CB 3.87Å; L399-A511 HydrophobicContact CG-CB 4.41Å; M507-A511 WeakPolarHBondContact O-CB 3Å; M507-A511 PolarHBondContact O-N 3.01Å; L508-A511 WeakPolarHBondContact O-CB 3.34Å; L508-A511 PolarHBondContact O-N 3.37Å; A511-V513 PolarHBondContact O-N 3.06Å; A511-L514 PolarHBondContact O-N 3.46Å; A511-L515 WeakPolarHBondContact O-CG 3.48Å; A511-L515 PolarHBondContact O-N 3.48Å; A511-L515 VanDerWaalsContact O-N 3.09Å
512	P	87	Confident	82.2	Confident	40 Å²	40	70.1 Å²	70.1	26%	0.26	33%	0.33	S	S	.	.	H	α-helix	trans	-60	-46.4	178.6	-24.1	35.1	0	0	0	112.5	L515 E516	P512-L515 PolarHBondContact O-N 2.87Å; P512-E516 WeakPolarHBondContact O-CG 3.44Å; P512-E516 PolarHBondContact O-N 3.26Å
513	V	86.9	Confident	79.4	Confident	95 Å²	95	68.7 Å²	68.7	58%	0.576	34%	0.341	S	S	*	.	H	α-helix	trans	-65.5	-44.2	-178.6	-179.1	0	0	0	0	111	N510 A511 L515 E516 E517	N510-V513 PolarHBondContact O-N 3.46Å; A511-V513 PolarHBondContact O-N 3.06Å; V513-L515 VanDerWaalsContact C-N 3.28Å; V513-L515 PolarHBondContact O-N 3.25Å; V513-E516 PolarHBondContact O-N 2.96Å; V513-E517 PolarHBondContact O-N 3.31Å
514	L	86.6	Confident	76.5	Confident	15 Å²	15	75.9 Å²	75.9	8%	0.079	38%	0.379	C	S	.	.	H	α-helix	trans	-65.2	-31.8	-179.6	-69.2	174.9	0	0	0	112.9	L399 K402 N510 A511	L399-L514 HydrophobicContact CD2-CB 3.91Å; L399-L514 HydrophobicContact CD2-CD1 4.16Å; K402-L514 HydrophobicContact CB-CD1 3.95Å; K402-L514 HydrophobicContact CB-CD2 4.09Å; N510-L514 HydrophobicContact CB-CD1 3.87Å; N510-L514 HydrophobicContact CB-CG 4.17Å; N510-L514 WeakPolarHBondContact O-CG 3.46Å; N510-L514 PolarHBondContact O-N 3.45Å; A511-L514 PolarHBondContact O-N 3.46Å
515	L	85.4	Confident	73.5	Confident	1 Å²	1	79.1 Å²	79.1	1%	0.005	41%	0.414	C	S	.	.	H	α-helix	trans	-75.9	-45.1	176	-73.8	167.9	0	0	0	111.5	M123 L128 F131 V395 F398 L399 A511 P512 V513 E517 Y518 T519	M123-L515 HydrophobicContact CG-CD1 3.39Å; M123-L515 HydrophobicContact SD-CD1 3.2Å; M123-L515 WeakPolarHBondContact SD-CD1 3.49Å; L128-L515 HydrophobicContact CD2-CD1 3.94Å; F131-L515 HydrophobicContact CB-CD2 4.25Å; F131-L515 HydrophobicContact CD1-CD2 4.36Å; F131-L515 HydrophobicContact CD2-CD2 3.6Å; F131-L515 HydrophobicContact CE2-CD2 3.97Å; F131-L515 HydrophobicContact CG-CD2 3.81Å; F131-L515 HydrophobicContact CZ-CD2 4.47Å; V395-L515 HydrophobicContact CG1-CD1 4.39Å; V395-L515 HydrophobicContact CG1-CD2 4.34Å; F398-L515 HydrophobicContact CD1-CD2 4.18Å; F398-L515 HydrophobicContact CE1-CD2 4.15Å; L399-L515 HydrophobicContact CD2-CG 4.13Å; A511-L515 WeakPolarHBondContact O-CG 3.48Å; A511-L515 PolarHBondContact O-N 3.48Å; A511-L515 VanDerWaalsContact O-N 3.09Å; P512-L515 PolarHBondContact O-N 2.87Å; V513-L515 VanDerWaalsContact C-N 3.28Å; V513-L515 PolarHBondContact O-N 3.25Å; L515-E517 PolarHBondContact O-N 2.95Å; L515-Y518 PolarHBondContact O-N 2.62Å; L515-Y518 VanDerWaalsContact O-N 3.15Å; L515-T519 PolarHBondContact O-N 2.78Å; L515-T519 PolarHBondContact O-OG1 3.05Å
516	E	81.8	Confident	70.4	Confident	87 Å²	87	85.2 Å²	85.2	41%	0.407	46%	0.463	S	S	.	.	H	α-helix	trans	-59.4	-43.7	177.5	-74.8	177.1	-171.4	0	0	112.4	P512 V513 Y518 T519	P512-E516 WeakPolarHBondContact O-CG 3.44Å; P512-E516 PolarHBondContact O-N 3.26Å; V513-E516 PolarHBondContact O-N 2.96Å; E516-Y518 PolarHBondContact O-N 2.9Å; E516-T519 CarbonylContact O-C 3.23Å; E516-T519 VanDerWaalsContact O-C 3.23Å; E516-T519 PolarHBondContact O-N 3.31Å; E516-T519 VanDerWaalsContact O-O 3.13Å
517	E	79.9	Confident	69.2	Low	138 Å²	138	86.3 Å²	86.3	65%	0.645	47%	0.471	S	S	*	.	H	α-helix	trans	-60.1	-35.1	176.9	-167.9	-166.6	155.6	0	0	112	V513 L515	V513-E517 PolarHBondContact O-N 3.31Å; L515-E517 PolarHBondContact O-N 2.95Å
518	Y	73.8	Confident	67.9	Low	66 Å²	66	90.8 Å²	90.8	26%	0.259	50%	0.496	S	S	.	.	H	α-helix	trans	-81.6	-21.3	-178.9	-161.9	-99.8	0	0	0	113.5	F131 K134 F398 L515 E516 P520	F131-Y518 AromaticContact CD2-CD1 3.65Å; F131-Y518 HydrophobicContact CD2-CD1 3.65Å; F131-Y518 HydrophobicContact CD2-CE1 4.28Å; F131-Y518 HydrophobicContact CD2-CG 4.49Å; F131-Y518 AromaticContact CE2-CD1 3.66Å; F131-Y518 HydrophobicContact CE2-CD1 3.66Å; F131-Y518 HydrophobicContact CE2-CE1 4.03Å; F131-Y518 HydrophobicContact CE2-CG 4.4Å; K134-Y518 HydrophobicContact CD-CD1 4.34Å; K134-Y518 HydrophobicContact CD-CE1 4.06Å; K134-Y518 PolarHBondContact NZ-O 3.32Å; F398-Y518 HydrophobicContact CE2-CD1 4.2Å; F398-Y518 AromaticContact CE2-CD2 3.57Å; F398-Y518 HydrophobicContact CE2-CD2 3.57Å; F398-Y518 HydrophobicContact CE2-CE1 4.43Å; F398-Y518 AromaticContact CE2-CE2 3.84Å; F398-Y518 HydrophobicContact CE2-CE2 3.84Å; F398-Y518 AromaticContact CE2-CG 3.75Å; F398-Y518 HydrophobicContact CE2-CG 3.75Å; F398-Y518 HydrophobicContact CZ-CD1 4.28Å; F398-Y518 AromaticContact CZ-CD2 3.74Å; F398-Y518 HydrophobicContact CZ-CD2 3.74Å; F398-Y518 HydrophobicContact CZ-CE2 4.47Å; F398-Y518 AromaticContact CZ-CG 3.62Å; F398-Y518 HydrophobicContact CZ-CG 3.62Å; L515-Y518 PolarHBondContact O-N 2.62Å; L515-Y518 VanDerWaalsContact O-N 3.15Å; E516-Y518 PolarHBondContact O-N 2.9Å; Y518-P520 VanDerWaalsContact C-CD 3.4Å; Y518-P520 VanDerWaalsContact O-CD 3.24Å; Y518-P520 WeakPolarHBondContact O-CD 3.38Å
519	T	67.1	Low	66.5	Low	14 Å²	14	94.2 Å²	94.2	9%	0.086	52%	0.515	C	S	.	.	S	Bend	trans	-112.2	72.3	174.6	57.9	0	0	0	0	110	N130 F131 L515 E516 Y521	N130-T519 HydrophobicContact CB-CG2 3.98Å; F131-T519 HydrophobicContact CB-CG2 3.8Å; L515-T519 PolarHBondContact O-N 2.78Å; L515-T519 PolarHBondContact O-OG1 3.05Å; E516-T519 CarbonylContact O-C 3.23Å; E516-T519 VanDerWaalsContact O-C 3.23Å; E516-T519 PolarHBondContact O-N 3.31Å; E516-T519 VanDerWaalsContact O-O 3.13Å; T519-Y521 PolarHBondContact O-N 2.85Å; T519-Y521 VanDerWaalsContact O-N 3.13Å
520	P	53.2	Low	65	Low	94 Å²	94	87.4 Å²	87.4	61%	0.61	50%	0.498	S	S	*	.			trans	-57.4	128	172.6	24.5	-31.2	0	0	0	107.9	Y518 L522	Y518-P520 VanDerWaalsContact C-CD 3.4Å; Y518-P520 VanDerWaalsContact O-CD 3.24Å; Y518-P520 WeakPolarHBondContact O-CD 3.38Å; P520-L522 PolarHBondContact O-N 3.01Å
521	Y	47.9	Very low	63.4	Low	183 Å²	183	89.7 Å²	89.7	72%	0.718	51%	0.512	S	S	*	.			trans	-45	117.5	177.6	-73.2	-92.9	0	0	0	109.2	T519 S523	T519-Y521 PolarHBondContact O-N 2.85Å; T519-Y521 VanDerWaalsContact O-N 3.13Å; Y521-S523 PolarHBondContact O-N 3.13Å
522	L	43.5	Very low	61.6	Low	164 Å²	164	95.7 Å²	95.7	86%	0.859	55%	0.547	S	S	*	.			trans	-64.3	91.2	152.7	-76.9	164.4	0	0	0	104.5	P520 N524	P520-L522 PolarHBondContact O-N 3.01Å; L522-N524 PolarHBondContact O-N 3.24Å
523	S	34.6	Very low	59.8	Low	106 Å²	106	99.6 Å²	99.6	74%	0.741	57%	0.567	S	S	*	*			trans	-54	113.9	164.3	-174.9	0	0	0	0	105.5	Y521 G525	Y521-S523 PolarHBondContact O-N 3.13Å; S523-G525 VanDerWaalsContact C-N 3.27Å; S523-G525 PolarHBondContact O-N 2.81Å
524	N	34.6	Very low	57.7	Low	155 Å²	155	100 Å²	100	83%	0.829	57%	0.566	S	S	*	*			trans	-54.4	100	167.4	-76.4	-28.4	0	0	0	106.4	L522 C526	L522-N524 PolarHBondContact O-N 3.24Å; N524-C526 PolarHBondContact O-N 2.99Å
525	G	33	Very low	55.3	Low	72 Å²	72	107.1 Å²	107.1	74%	0.742	61%	0.607	S	S	*	*			trans	-64.5	117.4	172	0	0	0	0	0	108.3	S523	S523-G525 VanDerWaalsContact C-N 3.27Å; S523-G525 PolarHBondContact O-N 2.81Å
526	C	29.1	Very low	52.6	Low	205 Å²	205	116.7 Å²	116.7	100%	1.385	66%	0.662	S	S	*	*			trans	-55.7	0	153.4	-73.2	0	0	0	0	111.1	N524	N524-C526 PolarHBondContact O-N 2.99Å

Retrieved 526 of 526 residues in 142.3 ms (Link to these results)

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