A0A087XLN3_POEFO Loading...

mitogen-activated protein kinase kinase

AlphaFold DB , UniProt , Accession A0A087XLN3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 444 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	33.3	Very low	40.4	Very low	242 Å²	242	136.2 Å²	136.2	100%	1.192	71%	0.708	S	S	*	*				0	100.3	0	-86.1	-177.3	162.9	0	0	107.1
2	L	26.3	Very low	41.9	Very low	177 Å²	177	133.1 Å²	133.1	93%	0.927	70%	0.7	S	S	*	*			trans	-80.8	111.5	170.4	-83.3	152	0	0	0	106.6	L4	L2-L4 PolarHBondContact O-N 3.35Å
3	I	30.1	Very low	43.7	Very low	151 Å²	151	129.6 Å²	129.6	77%	0.774	68%	0.678	S	S	*	*			trans	-80.8	111.6	167.1	-64.1	173.6	0	0	0	105.7	N5	I3-N5 PolarHBondContact O-N 3.44Å
4	L	31.8	Very low	46.2	Very low	150 Å²	150	125.8 Å²	125.8	79%	0.785	66%	0.664	S	S	*	*			trans	-67.7	110.3	168.6	-76.7	153.8	0	0	0	107.6	L2 H6	L2-L4 PolarHBondContact O-N 3.35Å; L4-H6 PolarHBondContact O-N 2.94Å
5	N	32.8	Very low	48.8	Very low	140 Å²	140	117.7 Å²	117.7	75%	0.749	62%	0.622	S	S	*	*			trans	-69	99.3	165.9	-84.5	-1.8	0	0	0	107.9	I3	I3-N5 PolarHBondContact O-N 3.44Å
6	H	34.8	Very low	51.1	Low	158 Å²	158	114 Å²	114	73%	0.731	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-65.5	131.2	160.9	-85.6	-70.8	0	0	0	108.4	L4 V8	L4-H6 PolarHBondContact O-N 2.94Å; H6-V8 PolarHBondContact O-N 3.46Å
7	P	41	Very low	53.3	Low	117 Å²	117	107.4 Å²	107.4	76%	0.76	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-62.8	122.2	167.8	25.8	-30.5	0	0	0	108.1
8	V	48.4	Very low	55.3	Low	75 Å²	75	104.8 Å²	104.8	46%	0.455	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-71	130.8	176.9	178.7	0	0	0	0	108.1	H6 M10	H6-V8 PolarHBondContact O-N 3.46Å; V8-M10 PolarHBondContact O-N 3.35Å
9	E	54.3	Low	57.1	Low	154 Å²	154	99.6 Å²	99.6	72%	0.72	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-60.6	132.6	174.6	-74.8	176.2	154.9	0	0	110.1	D11	E9-D11 PolarHBondContact O-N 2.96Å
10	M	57.3	Low	58.6	Low	44 Å²	44	97 Å²	97	22%	0.217	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	2.3	179.9	-82.5	179.2	56.8	0	0	115.2	V8 P33 L79	V8-M10 PolarHBondContact O-N 3.35Å; M10-P33 HydrophobicContact CE-CB 4.32Å; M10-L79 HydrophobicContact CE-CB 3.58Å; M10-L79 HydrophobicContact CE-CD1 3.83Å; M10-L79 HydrophobicContact CE-CG 4.37Å; M10-L79 HydrophobicContact SD-CB 4.42Å
11	D	54.6	Low	59.7	Low	90 Å²	90	93.5 Å²	93.5	48%	0.481	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-0.5	-164.8	-91.9	-34.3	0	0	0	115.4	E9 S34	E9-D11 PolarHBondContact O-N 2.96Å; D11-S34 WeakPolarHBondContact OD1-CB 3.19Å; D11-S34 PolarHBondContact OD1-OG 3.28Å
12	T	57.4	Low	61.6	Low	99 Å²	99	87.7 Å²	87.7	61%	0.607	47%	0.471	S	S	*	.	S	Bend	trans	-92.6	-19.1	-166.5	52.4	0	0	0	0	115.1
13	E	66	Low	63.8	Low	88 Å²	88	87.5 Å²	87.5	41%	0.411	47%	0.47	S	S	.	.	S	Bend	trans	-151.1	149.5	-174.7	-70.3	-165.5	-175	0	0	115.8	R90	E13-R90 VanDerWaalsContact CD-NH1 3.31Å; E13-R90 IonicContact OE1-NH1 3.17Å; E13-R90 PolarHBondContact OE1-NH1 3.38Å; E13-R90 IonicContact OE2-CZ 3.09Å; E13-R90 IonicContact OE2-NH1 2.64Å; E13-R90 PolarHBondContact OE2-NH1 3.43Å; E13-R90 IonicContact OE2-NH2 2.78Å; E13-R90 PolarHBondContact OE2-NH2 2.98Å
14	P	78.8	Confident	66.1	Low	76 Å²	76	81.9 Å²	81.9	49%	0.494	45%	0.449	S	S	.	.			trans	-69.2	142.6	175.2	29.8	-35.7	0	0	0	111.8	V30	P14-V30 CarbonylContact C-O 3.35Å; P14-V30 VanDerWaalsContact CA-O 3.26Å; P14-V30 WeakPolarHBondContact CA-O 3.46Å
15	I	85.3	Confident	68.6	Low	5 Å²	5	77.9 Å²	77.9	3%	0.026	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	158.5	173.9	67.5	177.5	0	0	0	111.2	I17 S29 V30 P33 L79 Y82 M86	I15-I17 HydrophobicContact CD1-CD1 4.29Å; I15-I17 HydrophobicContact CD1-CG1 4.12Å; I15-I17 HydrophobicContact CG1-CG1 4.34Å; I15-S29 WeakPolarHBondContact O-CA 3.26Å; I15-V30 HydrophobicContact CG1-CB 3.89Å; I15-V30 PolarHBondContact N-O 2.77Å; I15-V30 PolarHBondContact O-N 3.23Å; I15-P33 HydrophobicContact CB-CG 4.45Å; I15-P33 HydrophobicContact CD1-CB 3.99Å; I15-P33 HydrophobicContact CD1-CG 3.96Å; I15-P33 HydrophobicContact CG1-CB 4.48Å; I15-P33 HydrophobicContact CG1-CG 3.94Å; I15-P33 HydrophobicContact CG2-CG 3.87Å; I15-L79 HydrophobicContact CD1-CD2 3.57Å; I15-Y82 HydrophobicContact CB-CE1 4.04Å; I15-Y82 HydrophobicContact CG2-CD1 4.37Å; I15-Y82 HydrophobicContact CG2-CE1 4.02Å; I15-M86 HydrophobicContact CG2-SD 4.1Å
16	V	86	Confident	71	Confident	58 Å²	58	76 Å²	76	35%	0.352	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.8	170.3	-175.9	0	0	0	0	108.6	D27 P98 L99	V16-D27 HydrophobicContact CG1-CB 3.9Å; V16-P98 HydrophobicContact CB-CB 4.15Å; V16-P98 HydrophobicContact CB-CG 4.41Å; V16-P98 HydrophobicContact CG1-CB 4.01Å; V16-P98 HydrophobicContact CG1-CG 4.22Å; V16-P98 CarbonylContact O-C 3.56Å; V16-P98 WeakPolarHBondContact O-CA 3.08Å; V16-L99 PolarHBondContact O-N 2.81Å
17	I	88.1	Confident	73.4	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.005	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124	173.8	-57.5	-179.1	0	0	0	108.5	I15 D27 S28 V30 L36 L41 L99 I101	I15-I17 HydrophobicContact CD1-CD1 4.29Å; I15-I17 HydrophobicContact CD1-CG1 4.12Å; I15-I17 HydrophobicContact CG1-CG1 4.34Å; I17-D27 WeakPolarHBondContact O-CA 3.19Å; I17-S28 PolarHBondContact N-O 3.31Å; I17-S28 PolarHBondContact O-N 2.82Å; I17-V30 HydrophobicContact CD1-CG2 3.78Å; I17-V30 HydrophobicContact CG1-CG2 4.21Å; I17-L36 HydrophobicContact CD1-CD2 3.84Å; I17-L41 HydrophobicContact CD1-CD1 4.05Å; I17-L41 HydrophobicContact CG2-CD1 4.33Å; I17-L99 CarbonylContact C-O 3.58Å; I17-L99 WeakPolarHBondContact CA-O 3.3Å; I17-L99 HydrophobicContact CG1-CD2 4.46Å; I17-I101 HydrophobicContact CG2-CD1 3.79Å; I17-I101 HydrophobicContact CG2-CG1 3.96Å; I17-I101 HydrophobicContact CG2-CG2 4.13Å
18	R	89.4	Confident	75.2	Confident	62 Å²	62	69.7 Å²	69.7	23%	0.234	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	109.5	175.6	179	165.6	-69.3	164	0.7	110.3	K20 D25 M26 D27 P98 L99 Q100 I101	R18-K20 HydrophobicContact CG-CD 4.41Å; R18-D25 HydrophobicContact CG-CB 3.97Å; R18-M26 CarbonylContact C-O 3.49Å; R18-M26 WeakPolarHBondContact CA-O 3.41Å; R18-D27 VanDerWaalsContact CB-OD1 3.23Å; R18-D27 WeakPolarHBondContact CB-OD1 3.4Å; R18-D27 WeakPolarHBondContact CG-OD1 3.38Å; R18-D27 IonicContact CZ-OD1 3.55Å; R18-D27 IonicContact CZ-OD2 3.53Å; R18-D27 IonicContact NE-OD1 3.51Å; R18-D27 PolarHBondContact NE-OD1 3.32Å; R18-D27 IonicContact NE-OD2 2.67Å; R18-D27 IonicContact NH2-OD1 2.68Å; R18-D27 IonicContact NH2-OD2 2.73Å; R18-D27 PolarHBondContact NH2-OD2 2.77Å; R18-P98 HydrophobicContact CB-CB 3.92Å; R18-L99 PolarHBondContact N-O 2.91Å; R18-Q100 WeakPolarHBondContact O-CA 3.5Å; R18-I101 PolarHBondContact O-N 2.79Å
19	I	88.9	Confident	76.7	Confident	5 Å²	5	70 Å²	70	3%	0.026	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	113.9	174.6	-47.9	-175	0	0	0	108.5	T21 D25 M26 A44 I45 V48 I101 P103	I19-T21 HydrophobicContact CG2-CG2 4.17Å; I19-D25 WeakPolarHBondContact O-CA 3.36Å; I19-M26 PolarHBondContact N-O 3.47Å; I19-M26 PolarHBondContact O-N 3.39Å; I19-A44 HydrophobicContact CD1-CB 4.49Å; I19-I45 HydrophobicContact CD1-CG1 4.06Å; I19-I45 HydrophobicContact CG2-CG1 4.2Å; I19-V48 HydrophobicContact CD1-CG2 4.34Å; I19-I101 HydrophobicContact CB-CG1 4.34Å; I19-I101 HydrophobicContact CG1-CD1 3.98Å; I19-I101 HydrophobicContact CG1-CG1 4.07Å; I19-I101 HydrophobicContact CG2-CG1 4.41Å; I19-P103 HydrophobicContact CG2-CG 3.72Å
20	K	87.2	Confident	78	Confident	48 Å²	48	63.8 Å²	63.8	21%	0.209	36%	0.364	C	S	.	.			trans	-78.8	122.1	178.1	-65.1	-69.1	-162.3	171.5	0	110.1	R18 D25 I101 F102 P103	R18-K20 HydrophobicContact CG-CD 4.41Å; K20-D25 WeakPolarHBondContact CD-OD1 3.32Å; K20-D25 WeakPolarHBondContact CD-OD2 3.43Å; K20-D25 WeakPolarHBondContact CE-OD2 3.34Å; K20-D25 IonicContact NZ-OD1 2.72Å; K20-D25 IonicContact NZ-OD2 3.14Å; K20-D25 PolarHBondContact NZ-OD2 3.19Å; K20-I101 WeakPolarHBondContact CB-O 3.09Å; K20-I101 PolarHBondContact N-O 2.85Å; K20-F102 HydrophobicContact CB-CD1 3.7Å; K20-F102 HydrophobicContact CB-CE1 3.92Å; K20-F102 HydrophobicContact CB-CG 4.21Å; K20-F102 HydrophobicContact CD-CE1 4.26Å; K20-F102 HydrophobicContact CD-CZ 4.41Å; K20-F102 HydrophobicContact CG-CD1 3.76Å; K20-F102 HydrophobicContact CG-CD2 4.37Å; K20-F102 HydrophobicContact CG-CE1 3.5Å; K20-F102 VanDerWaalsContact CG-CE1 3.5Å; K20-F102 HydrophobicContact CG-CE2 4.12Å; K20-F102 HydrophobicContact CG-CG 4.22Å; K20-F102 HydrophobicContact CG-CZ 3.69Å; K20-P103 WeakPolarHBondContact O-CD 3.43Å
21	T	80.8	Confident	78.8	Confident	24 Å²	24	66.7 Å²	66.7	15%	0.147	38%	0.381	C	S	.	.			trans	-131.6	157.2	179.4	91.4	0	0	0	0	112	I19 L23 G24 V48 M49	I19-T21 HydrophobicContact CG2-CG2 4.17Å; T21-L23 PolarHBondContact O-N 3.49Å; T21-L23 PolarHBondContact OG1-N 3.44Å; T21-G24 PolarHBondContact O-N 3.07Å; T21-G24 PolarHBondContact OG1-N 2.78Å; T21-G24 PolarHBondContact OG1-O 3.29Å; T21-V48 HydrophobicContact CG2-CG1 3.59Å; T21-M49 HydrophobicContact CG2-CG 4.22Å; T21-M49 HydrophobicContact CG2-SD 4.19Å
22	P	73.4	Confident	79.9	Confident	119 Å²	119	69.8 Å²	69.8	77%	0.773	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.1	175.4	-21.9	33.6	0	0	0	114.6
23	L	72.9	Confident	80.8	Confident	174 Å²	174	65.1 Å²	65.1	91%	0.911	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-3	-175.7	-65	172.4	0	0	0	113.1	T21	T21-L23 PolarHBondContact O-N 3.49Å; T21-L23 PolarHBondContact OG1-N 3.44Å
24	G	77.9	Confident	81.1	Confident	33 Å²	33	62.9 Å²	62.9	34%	0.34	35%	0.352	S	S	.	.			trans	134.9	148	-177.8	0	0	0	0	0	112.3	T21	T21-G24 PolarHBondContact O-N 3.07Å; T21-G24 PolarHBondContact OG1-N 2.78Å; T21-G24 PolarHBondContact OG1-O 3.29Å
25	D	86.1	Confident	80.9	Confident	66 Å²	66	64.2 Å²	64.2	35%	0.353	36%	0.359	S	S	.	.			trans	-72.3	136.8	178.5	-65.8	-8.7	0	0	0	110.5	R18 I19 K20	R18-D25 HydrophobicContact CG-CB 3.97Å; I19-D25 WeakPolarHBondContact O-CA 3.36Å; K20-D25 WeakPolarHBondContact CD-OD1 3.32Å; K20-D25 WeakPolarHBondContact CD-OD2 3.43Å; K20-D25 WeakPolarHBondContact CE-OD2 3.34Å; K20-D25 IonicContact NZ-OD1 2.72Å; K20-D25 IonicContact NZ-OD2 3.14Å; K20-D25 PolarHBondContact NZ-OD2 3.19Å
26	M	82.4	Confident	80.6	Confident	99 Å²	99	65.3 Å²	65.3	49%	0.488	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.9	176.9	-69.6	-73.2	92.7	0	0	110.7	R18 I19 V48	R18-M26 CarbonylContact C-O 3.49Å; R18-M26 WeakPolarHBondContact CA-O 3.41Å; I19-M26 PolarHBondContact N-O 3.47Å; I19-M26 PolarHBondContact O-N 3.39Å; M26-V48 HydrophobicContact CB-CG1 4.28Å; M26-V48 HydrophobicContact CB-CG2 4.46Å; M26-V48 HydrophobicContact CG-CG1 3.78Å; M26-V48 HydrophobicContact CG-CG2 4.46Å
27	D	84.2	Confident	80.5	Confident	84 Å²	84	65.1 Å²	65.1	45%	0.449	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133.7	178.7	-70.3	-8.5	0	0	0	110.5	V16 I17 R18	V16-D27 HydrophobicContact CG1-CB 3.9Å; I17-D27 WeakPolarHBondContact O-CA 3.19Å; R18-D27 VanDerWaalsContact CB-OD1 3.23Å; R18-D27 WeakPolarHBondContact CB-OD1 3.4Å; R18-D27 WeakPolarHBondContact CG-OD1 3.38Å; R18-D27 IonicContact CZ-OD1 3.55Å; R18-D27 IonicContact CZ-OD2 3.53Å; R18-D27 IonicContact NE-OD1 3.51Å; R18-D27 PolarHBondContact NE-OD1 3.32Å; R18-D27 IonicContact NE-OD2 2.67Å; R18-D27 IonicContact NH2-OD1 2.68Å; R18-D27 IonicContact NH2-OD2 2.73Å; R18-D27 PolarHBondContact NH2-OD2 2.77Å
28	S	79.2	Confident	80.3	Confident	59 Å²	59	66.2 Å²	66.2	41%	0.413	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.5	174.5	-168.6	0	0	0	0	109.8	I17	I17-S28 PolarHBondContact N-O 3.31Å; I17-S28 PolarHBondContact O-N 2.82Å
29	S	80.8	Confident	79.9	Confident	81 Å²	81	67.5 Å²	67.5	57%	0.566	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	132.3	175.8	54.8	0	0	0	0	110.5	I15	I15-S29 WeakPolarHBondContact O-CA 3.26Å
30	V	81.1	Confident	79.5	Confident	24 Å²	24	70.7 Å²	70.7	15%	0.145	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	111.5	176.1	179.5	0	0	0	0	108.4	P14 I15 I17 L36	P14-V30 CarbonylContact C-O 3.35Å; P14-V30 VanDerWaalsContact CA-O 3.26Å; P14-V30 WeakPolarHBondContact CA-O 3.46Å; I15-V30 HydrophobicContact CG1-CB 3.89Å; I15-V30 PolarHBondContact N-O 2.77Å; I15-V30 PolarHBondContact O-N 3.23Å; I17-V30 HydrophobicContact CD1-CG2 3.78Å; I17-V30 HydrophobicContact CG1-CG2 4.21Å; V30-L36 HydrophobicContact CG1-CB 4.41Å; V30-L36 HydrophobicContact CG1-CD2 4.41Å; V30-L36 HydrophobicContact CG2-CD2 4.43Å
31	D	74.4	Confident	79.2	Confident	106 Å²	106	68.8 Å²	68.8	57%	0.567	39%	0.387	S	S	*	.	S	Bend	trans	-72.1	-32.3	-175.1	-63.4	-42	0	0	0	113.2
32	Y	76.8	Confident	79.2	Confident	155 Å²	155	68 Å²	68	61%	0.608	38%	0.382	S	S	*	.			trans	-131.9	87.7	-178.2	-60	-77.8	0	0	0	110.8	S34 V35	Y32-S34 PolarHBondContact O-N 3.19Å; Y32-V35 PolarHBondContact O-N 3.43Å
33	P	76.8	Confident	79.4	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.006	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.2	-177.1	-23.5	33	0	0	0	114.1	M10 I15 V35 L36 L79	M10-P33 HydrophobicContact CE-CB 4.32Å; I15-P33 HydrophobicContact CB-CG 4.45Å; I15-P33 HydrophobicContact CD1-CB 3.99Å; I15-P33 HydrophobicContact CD1-CG 3.96Å; I15-P33 HydrophobicContact CG1-CB 4.48Å; I15-P33 HydrophobicContact CG1-CG 3.94Å; I15-P33 HydrophobicContact CG2-CG 3.87Å; P33-V35 VanDerWaalsContact C-N 3.29Å; P33-V35 PolarHBondContact O-N 2.6Å; P33-L36 WeakPolarHBondContact O-CB 3.2Å; P33-L36 PolarHBondContact O-N 2.91Å; P33-L79 WeakPolarHBondContact O-CD1 3.48Å
34	S	72.8	Confident	79.7	Confident	40 Å²	40	58.5 Å²	58.5	28%	0.28	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-27.3	180	64.7	0	0	0	0	114.5	D11 Y32	D11-S34 WeakPolarHBondContact OD1-CB 3.19Å; D11-S34 PolarHBondContact OD1-OG 3.28Å; Y32-S34 PolarHBondContact O-N 3.19Å
35	V	74.4	Confident	79.9	Confident	105 Å²	105	56.9 Å²	56.9	64%	0.636	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-15	-176.6	-163.4	0	0	0	0	111	Y32 P33 N37	Y32-V35 PolarHBondContact O-N 3.43Å; P33-V35 VanDerWaalsContact C-N 3.29Å; P33-V35 PolarHBondContact O-N 2.6Å; V35-N37 PolarHBondContact O-N 3.22Å
36	L	79.5	Confident	79.6	Confident	27 Å²	27	58.7 Å²	58.7	14%	0.141	32%	0.317	C	S	.	.			trans	-66	122.1	178	-171.3	70.7	0	0	0	110.1	I17 V30 P33 D40 L75 L79	I17-L36 HydrophobicContact CD1-CD2 3.84Å; V30-L36 HydrophobicContact CG1-CB 4.41Å; V30-L36 HydrophobicContact CG1-CD2 4.41Å; V30-L36 HydrophobicContact CG2-CD2 4.43Å; P33-L36 WeakPolarHBondContact O-CB 3.2Å; P33-L36 PolarHBondContact O-N 2.91Å; L36-D40 HydrophobicContact CD1-CB 3.96Å; L36-L75 HydrophobicContact CG-CD2 4.42Å; L36-L79 HydrophobicContact CD2-CD1 4.49Å
37	N	84.1	Confident	79.3	Confident	55 Å²	55	60 Å²	60	29%	0.294	33%	0.326	S	S	.	.			trans	-103	161.9	171.6	71.3	64.1	0	0	0	111.4	V35 N39 D40 L41 D72	V35-N37 PolarHBondContact O-N 3.22Å; N37-N39 PolarHBondContact O-N 3.4Å; N37-N39 WeakPolarHBondContact OD1-CA 3.38Å; N37-N39 WeakPolarHBondContact OD1-CB 3.35Å; N37-N39 PolarHBondContact OD1-N 3.38Å; N37-D40 VanDerWaalsContact CG-CG 3.4Å; N37-D40 PolarHBondContact N-OD2 2.9Å; N37-D40 PolarHBondContact ND2-OD1 2.98Å; N37-D40 VanDerWaalsContact ND2-OD1 3.14Å; N37-D40 PolarHBondContact ND2-OD2 3.42Å; N37-D40 WeakPolarHBondContact O-CB 3.31Å; N37-D40 PolarHBondContact O-N 2.89Å; N37-D40 VanDerWaalsContact OD1-CG 3.3Å; N37-D40 PolarHBondContact OD1-N 2.86Å; N37-D40 PolarHBondContact OD1-OD1 3.05Å; N37-L41 PolarHBondContact O-N 3.25Å; N37-D72 WeakPolarHBondContact CA-OD1 3.48Å; N37-D72 WeakPolarHBondContact CB-OD1 3.47Å
38	F	82.8	Confident	79	Confident	23 Å²	23	58.6 Å²	58.6	10%	0.101	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-35.4	-177.2	175.3	-109.9	0	0	0	112.3	L41 L42 F57 V69 R70 D72 L75	F38-L41 PolarHBondContact O-N 3.48Å; F38-L42 HydrophobicContact CD1-CD1 4Å; F38-L42 HydrophobicContact CD1-CG 4.45Å; F38-L42 HydrophobicContact CE1-CD1 3.38Å; F38-L42 HydrophobicContact CE1-CG 4.02Å; F38-L42 HydrophobicContact CE2-CD1 4.47Å; F38-L42 HydrophobicContact CE2-CD2 4.44Å; F38-L42 HydrophobicContact CE2-CG 4.27Å; F38-L42 HydrophobicContact CZ-CD1 3.65Å; F38-L42 HydrophobicContact CZ-CD2 4.1Å; F38-L42 HydrophobicContact CZ-CG 3.89Å; F38-L42 WeakPolarHBondContact O-CG 3.47Å; F38-L42 PolarHBondContact O-N 3.48Å; F38-F57 AromaticContact CD2-CE1 3.61Å; F38-F57 HydrophobicContact CD2-CE1 3.61Å; F38-F57 HydrophobicContact CD2-CZ 4.13Å; F38-F57 AromaticContact CE2-CD1 3.92Å; F38-F57 HydrophobicContact CE2-CD1 3.92Å; F38-F57 AromaticContact CE2-CE1 3.36Å; F38-F57 HydrophobicContact CE2-CE1 3.36Å; F38-F57 HydrophobicContact CE2-CZ 4.13Å; F38-V69 HydrophobicContact CD2-CG1 3.95Å; F38-V69 HydrophobicContact CE2-CG1 4.02Å; F38-V69 WeakPolarHBondContact CE2-O 3.4Å; F38-R70 WeakPolarHBondContact CE1-O 3.32Å; F38-D72 WeakPolarHBondContact CB-OD1 3.27Å; F38-D72 PolarHBondContact N-OD1 3.31Å; F38-L75 HydrophobicContact CB-CD2 4.27Å; F38-L75 VanDerWaalsContact N-CD2 3.32Å
39	N	80.6	Confident	78.7	Confident	89 Å²	89	57.4 Å²	57.4	48%	0.476	31%	0.309	S	S	.	.	H	α-helix	trans	-70.6	-36.9	179.1	-174.4	73.2	0	0	0	112.1	N37 L41 L42 V43	N37-N39 PolarHBondContact O-N 3.4Å; N37-N39 WeakPolarHBondContact OD1-CA 3.38Å; N37-N39 WeakPolarHBondContact OD1-CB 3.35Å; N37-N39 PolarHBondContact OD1-N 3.38Å; N39-L41 VanDerWaalsContact C-N 3.29Å; N39-L41 PolarHBondContact O-N 3.49Å; N39-L42 PolarHBondContact O-N 3.49Å; N39-V43 WeakPolarHBondContact O-CG2 3.41Å; N39-V43 PolarHBondContact O-N 2.88Å
40	D	80.3	Confident	78.1	Confident	72 Å²	72	58.4 Å²	58.4	39%	0.385	31%	0.314	S	S	.	.	H	α-helix	trans	-59.4	-43.2	175.6	-61.1	-21.6	0	0	0	110.9	L36 N37 V43 A44	L36-D40 HydrophobicContact CD1-CB 3.96Å; N37-D40 VanDerWaalsContact CG-CG 3.4Å; N37-D40 PolarHBondContact N-OD2 2.9Å; N37-D40 PolarHBondContact ND2-OD1 2.98Å; N37-D40 VanDerWaalsContact ND2-OD1 3.14Å; N37-D40 PolarHBondContact ND2-OD2 3.42Å; N37-D40 WeakPolarHBondContact O-CB 3.31Å; N37-D40 PolarHBondContact O-N 2.89Å; N37-D40 VanDerWaalsContact OD1-CG 3.3Å; N37-D40 PolarHBondContact OD1-N 2.86Å; N37-D40 PolarHBondContact OD1-OD1 3.05Å; D40-V43 PolarHBondContact O-N 3.35Å; D40-A44 PolarHBondContact O-N 2.85Å
41	L	82.4	Confident	77.1	Confident	8 Å²	8	66.3 Å²	66.3	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-70.7	-35.5	178.3	-167.3	59	0	0	0	112	I17 N37 F38 N39 V43 A44 I45 F57 L75 I101	I17-L41 HydrophobicContact CD1-CD1 4.05Å; I17-L41 HydrophobicContact CG2-CD1 4.33Å; N37-L41 PolarHBondContact O-N 3.25Å; F38-L41 PolarHBondContact O-N 3.48Å; N39-L41 VanDerWaalsContact C-N 3.29Å; N39-L41 PolarHBondContact O-N 3.49Å; L41-V43 VanDerWaalsContact C-N 3.33Å; L41-A44 PolarHBondContact O-N 2.86Å; L41-I45 HydrophobicContact CG-CD1 4.35Å; L41-I45 WeakPolarHBondContact O-CD1 3.47Å; L41-I45 WeakPolarHBondContact O-CG1 3.43Å; L41-I45 PolarHBondContact O-N 3.34Å; L41-F57 HydrophobicContact CB-CE1 4.45Å; L41-F57 HydrophobicContact CD2-CE1 3.69Å; L41-F57 HydrophobicContact CD2-CE2 3.89Å; L41-F57 HydrophobicContact CD2-CZ 3.33Å; L41-F57 HydrophobicContact CG-CE1 4.13Å; L41-F57 HydrophobicContact CG-CZ 4.27Å; L41-L75 HydrophobicContact CD2-CD1 4.14Å; L41-I101 HydrophobicContact CD1-CD1 3.83Å; L41-I101 HydrophobicContact CD2-CD1 3.9Å; L41-I101 HydrophobicContact CG-CD1 3.93Å
42	L	80.8	Confident	76.4	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.047	33%	0.329	C	S	.	.	H	α-helix	trans	-64	-36.7	171	-76.3	-176.3	0	0	0	112.7	F38 N39 I45 R46 V54 F57	F38-L42 HydrophobicContact CD1-CD1 4Å; F38-L42 HydrophobicContact CD1-CG 4.45Å; F38-L42 HydrophobicContact CE1-CD1 3.38Å; F38-L42 HydrophobicContact CE1-CG 4.02Å; F38-L42 HydrophobicContact CE2-CD1 4.47Å; F38-L42 HydrophobicContact CE2-CD2 4.44Å; F38-L42 HydrophobicContact CE2-CG 4.27Å; F38-L42 HydrophobicContact CZ-CD1 3.65Å; F38-L42 HydrophobicContact CZ-CD2 4.1Å; F38-L42 HydrophobicContact CZ-CG 3.89Å; F38-L42 WeakPolarHBondContact O-CG 3.47Å; F38-L42 PolarHBondContact O-N 3.48Å; N39-L42 PolarHBondContact O-N 3.49Å; L42-I45 HydrophobicContact CD2-CD1 4.5Å; L42-I45 PolarHBondContact O-N 3.13Å; L42-R46 WeakPolarHBondContact O-CB 3.45Å; L42-R46 VanDerWaalsContact O-CG 3.24Å; L42-R46 WeakPolarHBondContact O-CG 3.23Å; L42-R46 PolarHBondContact O-N 3.37Å; L42-V54 HydrophobicContact CD2-CG1 3.9Å; L42-F57 HydrophobicContact CD2-CD1 4.27Å
43	V	77.8	Confident	75.9	Confident	60 Å²	60	58.9 Å²	58.9	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-64.4	-48.7	174.1	171.2	0	0	0	0	109.8	N39 D40 L41 I45 R46 D47	N39-V43 WeakPolarHBondContact O-CG2 3.41Å; N39-V43 PolarHBondContact O-N 2.88Å; D40-V43 PolarHBondContact O-N 3.35Å; L41-V43 VanDerWaalsContact C-N 3.33Å; V43-I45 VanDerWaalsContact C-N 3.29Å; V43-I45 PolarHBondContact O-N 3.1Å; V43-R46 WeakPolarHBondContact O-CA 3.35Å; V43-R46 WeakPolarHBondContact O-CB 3.44Å; V43-R46 PolarHBondContact O-N 3.4Å; V43-D47 PolarHBondContact O-N 2.69Å
44	A	78.7	Confident	75.6	Confident	32 Å²	32	58.9 Å²	58.9	26%	0.264	33%	0.325	S	S	.	.	H	α-helix	trans	-58.1	-40.4	176.6	0	0	0	0	0	112.4	I19 D40 L41 D47 V48	I19-A44 HydrophobicContact CD1-CB 4.49Å; D40-A44 PolarHBondContact O-N 2.85Å; L41-A44 PolarHBondContact O-N 2.86Å; A44-D47 PolarHBondContact O-N 3.1Å; A44-V48 WeakPolarHBondContact O-CG2 3.13Å; A44-V48 PolarHBondContact O-N 3.11Å
45	I	81.1	Confident	75.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-38.9	174.8	-66.4	162.6	0	0	0	111.5	I19 L41 L42 V43 V48 M49 V54 F57 I101 P103	I19-I45 HydrophobicContact CD1-CG1 4.06Å; I19-I45 HydrophobicContact CG2-CG1 4.2Å; L41-I45 HydrophobicContact CG-CD1 4.35Å; L41-I45 WeakPolarHBondContact O-CD1 3.47Å; L41-I45 WeakPolarHBondContact O-CG1 3.43Å; L41-I45 PolarHBondContact O-N 3.34Å; L42-I45 HydrophobicContact CD2-CD1 4.5Å; L42-I45 PolarHBondContact O-N 3.13Å; V43-I45 VanDerWaalsContact C-N 3.29Å; V43-I45 PolarHBondContact O-N 3.1Å; I45-V48 PolarHBondContact O-N 3.07Å; I45-M49 WeakPolarHBondContact O-CB 3.29Å; I45-M49 PolarHBondContact O-N 2.78Å; I45-V54 HydrophobicContact CG2-CB 4.08Å; I45-V54 HydrophobicContact CG2-CG1 3.93Å; I45-V54 HydrophobicContact CG2-CG2 3.8Å; I45-F57 HydrophobicContact CD1-CB 3.98Å; I45-F57 HydrophobicContact CD1-CD1 3.65Å; I45-F57 HydrophobicContact CD1-CE1 4.43Å; I45-F57 HydrophobicContact CD1-CG 3.97Å; I45-I101 HydrophobicContact CD1-CD1 3.86Å; I45-I101 HydrophobicContact CG1-CD1 4.07Å; I45-P103 HydrophobicContact CG1-CG 4.44Å; I45-P103 HydrophobicContact CG2-CB 3.68Å; I45-P103 HydrophobicContact CG2-CG 3.6Å
46	R	79.9	Confident	76.5	Confident	104 Å²	104	57.1 Å²	57.1	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-68.6	-33.7	177.6	-74.7	170.8	-169.1	162.8	7.7	112.6	L42 V43 V48 M49 P50 V54	L42-R46 WeakPolarHBondContact O-CB 3.45Å; L42-R46 VanDerWaalsContact O-CG 3.24Å; L42-R46 WeakPolarHBondContact O-CG 3.23Å; L42-R46 PolarHBondContact O-N 3.37Å; V43-R46 WeakPolarHBondContact O-CA 3.35Å; V43-R46 WeakPolarHBondContact O-CB 3.44Å; V43-R46 PolarHBondContact O-N 3.4Å; R46-V48 PolarHBondContact O-N 2.6Å; R46-M49 CarbonylContact O-C 3.49Å; R46-M49 PolarHBondContact O-N 2.63Å; R46-P50 WeakPolarHBondContact O-CA 3.17Å; R46-V54 PolarHBondContact NH2-O 3.26Å
47	D	77.1	Confident	76.9	Confident	126 Å²	126	55.8 Å²	55.8	67%	0.674	31%	0.307	S	S	*	.	H	α-helix	trans	-64.6	-35.1	175	-70.1	-17.9	0	0	0	111.2	V43 A44	V43-D47 PolarHBondContact O-N 2.69Å; A44-D47 PolarHBondContact O-N 3.1Å
48	V	77	Confident	77.3	Confident	55 Å²	55	54.9 Å²	54.9	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-83	-29.3	176.8	-177	0	0	0	0	112.2	I19 T21 M26 A44 I45 R46	I19-V48 HydrophobicContact CD1-CG2 4.34Å; T21-V48 HydrophobicContact CG2-CG1 3.59Å; M26-V48 HydrophobicContact CB-CG1 4.28Å; M26-V48 HydrophobicContact CB-CG2 4.46Å; M26-V48 HydrophobicContact CG-CG1 3.78Å; M26-V48 HydrophobicContact CG-CG2 4.46Å; A44-V48 WeakPolarHBondContact O-CG2 3.13Å; A44-V48 PolarHBondContact O-N 3.11Å; I45-V48 PolarHBondContact O-N 3.07Å; R46-V48 PolarHBondContact O-N 2.6Å
49	M	74.3	Confident	77.7	Confident	34 Å²	34	54.8 Å²	54.8	17%	0.167	30%	0.3	C	S	.	.			trans	-130.1	67.5	-178.6	-61.6	-173.4	62	0	0	112.3	T21 I45 R46 E51 A52 P103	T21-M49 HydrophobicContact CG2-CG 4.22Å; T21-M49 HydrophobicContact CG2-SD 4.19Å; I45-M49 WeakPolarHBondContact O-CB 3.29Å; I45-M49 PolarHBondContact O-N 2.78Å; R46-M49 CarbonylContact O-C 3.49Å; R46-M49 PolarHBondContact O-N 2.63Å; M49-E51 PolarHBondContact O-N 3.35Å; M49-E51 VanDerWaalsContact O-N 3.16Å; M49-A52 HydrophobicContact CB-CB 4.03Å; M49-A52 HydrophobicContact CE-CB 3.92Å; M49-A52 PolarHBondContact O-N 2.86Å; M49-P103 HydrophobicContact SD-CB 3.79Å; M49-P103 HydrophobicContact SD-CG 3.78Å
50	P	66.8	Low	78	Confident	102 Å²	102	54.3 Å²	54.3	66%	0.662	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.5	-172.4	21.8	-32.4	0	0	0	114.1	R46 A52	R46-P50 WeakPolarHBondContact O-CA 3.17Å; P50-A52 VanDerWaalsContact C-N 3.34Å
51	E	61	Low	78.1	Confident	190 Å²	190	52.8 Å²	52.8	89%	0.888	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.1	179.3	-58.5	-62.1	160.8	0	0	113.4	M49	M49-E51 PolarHBondContact O-N 3.35Å; M49-E51 VanDerWaalsContact O-N 3.16Å
52	A	60.2	Low	77.8	Confident	17 Å²	17	59.2 Å²	59.2	14%	0.14	32%	0.316	C	S	.	.	S	Bend	trans	-100.4	125.5	-177.7	0	0	0	0	0	111.4	M49 P50 V54 A105	M49-A52 HydrophobicContact CB-CB 4.03Å; M49-A52 HydrophobicContact CE-CB 3.92Å; M49-A52 PolarHBondContact O-N 2.86Å; P50-A52 VanDerWaalsContact C-N 3.34Å; A52-V54 VanDerWaalsContact C-N 3.26Å; A52-V54 HydrophobicContact CB-CG2 3.8Å; A52-V54 PolarHBondContact O-N 2.78Å; A52-A105 HydrophobicContact CB-CB 4.43Å
53	T	66.3	Low	77.6	Confident	88 Å²	88	64.7 Å²	64.7	54%	0.54	35%	0.35	S	S	.	.			trans	-77	80.8	168.4	36.3	0	0	0	0	109.5	G106	T53-G106 PolarHBondContact O-N 3.38Å
54	V	70.9	Confident	77.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	116.7	177.7	-171.5	0	0	0	0	109.5	L42 I45 R46 A52 A56 P103	L42-V54 HydrophobicContact CD2-CG1 3.9Å; I45-V54 HydrophobicContact CG2-CB 4.08Å; I45-V54 HydrophobicContact CG2-CG1 3.93Å; I45-V54 HydrophobicContact CG2-CG2 3.8Å; R46-V54 PolarHBondContact NH2-O 3.26Å; A52-V54 VanDerWaalsContact C-N 3.26Å; A52-V54 HydrophobicContact CB-CG2 3.8Å; A52-V54 PolarHBondContact O-N 2.78Å; V54-A56 WeakPolarHBondContact CG1-O 3.29Å; V54-P103 HydrophobicContact CG1-CB 4.3Å; V54-P103 HydrophobicContact CG2-CB 4.15Å
55	T	78.6	Confident	77.6	Confident	103 Å²	103	67.2 Å²	67.2	63%	0.632	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	-5.5	175.7	61.3	0	0	0	0	112.6
56	A	85.9	Confident	77.8	Confident	5 Å²	5	72.2 Å²	72.2	4%	0.041	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	159.7	179.2	0	0	0	0	0	109.3	V54 T68 V69 R70 R104	V54-A56 WeakPolarHBondContact CG1-O 3.29Å; A56-T68 HydrophobicContact CB-CG2 3.89Å; A56-V69 WeakPolarHBondContact CB-O 3.19Å; A56-R70 HydrophobicContact CB-CG 3.94Å; A56-R104 WeakPolarHBondContact O-CB 3.3Å; A56-R104 PolarHBondContact O-N 2.95Å; A56-R104 VanDerWaalsContact O-N 3.09Å
57	F	88.9	Confident	78	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	165.7	171.5	59.2	-92.9	0	0	0	109.7	F38 L41 L42 I45 T68 V69 L75 M78 I101 F102	F38-F57 AromaticContact CD2-CE1 3.61Å; F38-F57 HydrophobicContact CD2-CE1 3.61Å; F38-F57 HydrophobicContact CD2-CZ 4.13Å; F38-F57 AromaticContact CE2-CD1 3.92Å; F38-F57 HydrophobicContact CE2-CD1 3.92Å; F38-F57 AromaticContact CE2-CE1 3.36Å; F38-F57 HydrophobicContact CE2-CE1 3.36Å; F38-F57 HydrophobicContact CE2-CZ 4.13Å; L41-F57 HydrophobicContact CB-CE1 4.45Å; L41-F57 HydrophobicContact CD2-CE1 3.69Å; L41-F57 HydrophobicContact CD2-CE2 3.89Å; L41-F57 HydrophobicContact CD2-CZ 3.33Å; L41-F57 HydrophobicContact CG-CE1 4.13Å; L41-F57 HydrophobicContact CG-CZ 4.27Å; L42-F57 HydrophobicContact CD2-CD1 4.27Å; I45-F57 HydrophobicContact CD1-CB 3.98Å; I45-F57 HydrophobicContact CD1-CD1 3.65Å; I45-F57 HydrophobicContact CD1-CE1 4.43Å; I45-F57 HydrophobicContact CD1-CG 3.97Å; F57-T68 CarbonylContact O-C 3.58Å; F57-T68 WeakPolarHBondContact O-CA 3.47Å; F57-V69 HydrophobicContact CD2-CB 4.07Å; F57-V69 HydrophobicContact CD2-CG2 4.32Å; F57-V69 HydrophobicContact CE1-CB 4.31Å; F57-V69 HydrophobicContact CE1-CG1 4.2Å; F57-V69 HydrophobicContact CE2-CB 3.56Å; F57-V69 HydrophobicContact CE2-CG1 3.92Å; F57-V69 HydrophobicContact CE2-CG2 3.75Å; F57-V69 HydrophobicContact CZ-CB 3.67Å; F57-V69 HydrophobicContact CZ-CG1 3.54Å; F57-V69 HydrophobicContact CZ-CG2 4.26Å; F57-V69 PolarHBondContact N-O 2.97Å; F57-V69 PolarHBondContact O-N 3.14Å; F57-L75 HydrophobicContact CZ-CD1 4.31Å; F57-M78 HydrophobicContact CE2-CE 3.87Å; F57-M78 HydrophobicContact CE2-SD 3.89Å; F57-M78 HydrophobicContact CZ-CE 4.32Å; F57-I101 HydrophobicContact CD2-CB 3.94Å; F57-I101 HydrophobicContact CD2-CD1 4.4Å; F57-I101 HydrophobicContact CD2-CG2 4.03Å; F57-I101 HydrophobicContact CE2-CB 4.49Å; F57-I101 HydrophobicContact CE2-CG2 4.11Å; F57-F102 CarbonylContact C-O 3.59Å; F57-F102 WeakPolarHBondContact CA-O 3.49Å
58	E	91.8	Very high	78.6	Confident	36 Å²	36	65.3 Å²	65.3	17%	0.168	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152.5	-179.3	-70	166.3	-175.7	0	0	110.4	I67 T68 I101 F102 R104	E58-I67 CarbonylContact C-O 3.59Å; E58-I67 WeakPolarHBondContact CA-O 3.15Å; E58-T68 HydrophobicContact CG-CG2 4Å; E58-T68 PolarHBondContact OE1-OG1 2.74Å; E58-I101 CarbonylContact O-C 3.57Å; E58-I101 WeakPolarHBondContact O-CA 3.45Å; E58-F102 HydrophobicContact CB-CB 4.35Å; E58-F102 PolarHBondContact N-O 3.36Å; E58-F102 WeakPolarHBondContact O-CD2 3.47Å; E58-F102 PolarHBondContact O-N 2.95Å; E58-R104 IonicContact OE1-CZ 2.87Å; E58-R104 IonicContact OE1-NE 2.72Å; E58-R104 IonicContact OE1-NH1 3.49Å; E58-R104 PolarHBondContact OE1-NH1 3.27Å
59	Y	91.9	Very high	79.1	Confident	21 Å²	21	62.7 Å²	62.7	8%	0.082	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	164	166.6	75.3	-80.3	0	0	0	109.7	R66 I67 V69 M78 Y81	Y59-R66 WeakPolarHBondContact O-CA 3.13Å; Y59-I67 HydrophobicContact CD1-CB 3.91Å; Y59-I67 HydrophobicContact CD1-CG2 4.24Å; Y59-I67 WeakPolarHBondContact CD1-O 3.43Å; Y59-I67 HydrophobicContact CE1-CB 3.49Å; Y59-I67 VanDerWaalsContact CE1-CB 3.49Å; Y59-I67 HydrophobicContact CE1-CD1 4.38Å; Y59-I67 HydrophobicContact CE1-CG1 4.46Å; Y59-I67 HydrophobicContact CE1-CG2 3.46Å; Y59-I67 VanDerWaalsContact CE1-CG2 3.46Å; Y59-I67 HydrophobicContact CE2-CB 4.47Å; Y59-I67 HydrophobicContact CE2-CD1 4.22Å; Y59-I67 PolarHBondContact N-O 2.6Å; Y59-I67 PolarHBondContact O-N 2.78Å; Y59-I67 WeakPolarHBondContact OH-CD1 3.46Å; Y59-V69 HydrophobicContact CD1-CG2 3.74Å; Y59-V69 HydrophobicContact CE1-CG2 3.98Å; Y59-M78 HydrophobicContact CD1-CB 4.08Å; Y59-M78 HydrophobicContact CD1-CG 3.52Å; Y59-M78 HydrophobicContact CD1-SD 3.48Å; Y59-M78 WeakPolarHBondContact CD1-SD 3.31Å; Y59-M78 HydrophobicContact CD2-CG 3.91Å; Y59-M78 HydrophobicContact CD2-SD 4.47Å; Y59-M78 HydrophobicContact CE1-CB 3.73Å; Y59-M78 HydrophobicContact CE1-CG 3.65Å; Y59-M78 HydrophobicContact CE1-SD 4.15Å; Y59-M78 HydrophobicContact CE2-CG 4.06Å; Y59-M78 HydrophobicContact CG-CG 3.64Å; Y59-M78 HydrophobicContact CG-SD 3.65Å; Y59-Y81 AromaticContact CE2-CD1 3.84Å; Y59-Y81 HydrophobicContact CE2-CD1 3.84Å; Y59-Y81 HydrophobicContact CE2-CE1 4.04Å
60	E	87.1	Confident	79.8	Confident	78 Å²	78	67.4 Å²	67.4	36%	0.364	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.8	174.3	-70.4	178.2	-174.8	0	0	110.1	D65 R66 F102	E60-D65 WeakPolarHBondContact CA-O 3.09Å; E60-R66 IonicContact OE1-CZ 2.84Å; E60-R66 IonicContact OE1-NE 3.37Å; E60-R66 IonicContact OE1-NH1 2.75Å; E60-R66 PolarHBondContact OE1-NH1 3.09Å; E60-R66 VanDerWaalsContact OE1-NH1 3.13Å; E60-R66 IonicContact OE1-NH2 3.48Å; E60-R66 PolarHBondContact OE1-NH2 2.92Å; E60-F102 HydrophobicContact CG-CE2 4.24Å
61	D	82.3	Confident	80.6	Confident	40 Å²	40	64.2 Å²	64.2	21%	0.214	34%	0.337	C	S	.	.			trans	-86.9	-175.8	169.9	73.1	8.5	0	0	0	112.5	V63 G64 D65 I67	D61-V63 PolarHBondContact O-N 3.1Å; D61-V63 WeakPolarHBondContact OD1-CA 3.46Å; D61-V63 PolarHBondContact OD1-N 2.93Å; D61-G64 PolarHBondContact O-N 3.28Å; D61-G64 PolarHBondContact OD1-N 3.5Å; D61-D65 PolarHBondContact N-O 3.43Å; D61-D65 VanDerWaalsContact N-O 3.16Å; D61-D65 PolarHBondContact OD1-N 2.79Å; D61-I67 HydrophobicContact CB-CD1 3.78Å; D61-I67 HydrophobicContact CB-CG1 4.46Å
62	E	76.3	Confident	81.6	Confident	143 Å²	143	58.3 Å²	58.3	67%	0.668	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.4	-179.2	-96.2	160.6	-130.6	0	0	113.4	Y81	E62-Y81 WeakPolarHBondContact CA-OH 3.47Å; E62-Y81 WeakPolarHBondContact CB-OH 3.23Å; E62-Y81 WeakPolarHBondContact CG-OH 3.22Å; E62-Y81 PolarHBondContact N-OH 2.97Å; E62-Y81 WeakPolarHBondContact OE1-CE2 3.29Å
63	V	75.3	Confident	82.7	Confident	125 Å²	125	64.1 Å²	64.1	76%	0.758	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-7.4	-178.7	-161.5	0	0	0	0	111	D61	D61-V63 PolarHBondContact O-N 3.1Å; D61-V63 WeakPolarHBondContact OD1-CA 3.46Å; D61-V63 PolarHBondContact OD1-N 2.93Å
64	G	75.4	Confident	83.7	Confident	41 Å²	41	63.5 Å²	63.5	42%	0.423	33%	0.326	S	S	.	.			trans	86.8	13.6	-177.8	0	0	0	0	0	113.8	D61	D61-G64 PolarHBondContact O-N 3.28Å; D61-G64 PolarHBondContact OD1-N 3.5Å
65	D	81.2	Confident	84.5	Confident	103 Å²	103	63.5 Å²	63.5	55%	0.551	33%	0.327	S	S	*	.			trans	-79.1	141.7	178.6	-83	-24.6	0	0	0	111.6	E60 D61 I67	E60-D65 WeakPolarHBondContact CA-O 3.09Å; D61-D65 PolarHBondContact N-O 3.43Å; D61-D65 VanDerWaalsContact N-O 3.16Å; D61-D65 PolarHBondContact OD1-N 2.79Å; D65-I67 PolarHBondContact O-N 2.88Å
66	R	85.2	Confident	84.9	Confident	106 Å²	106	64.1 Å²	64.1	40%	0.4	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	98.7	179.6	-64.6	-68.1	-174	-178.9	-3.4	110.8	Y59 E60	Y59-R66 WeakPolarHBondContact O-CA 3.13Å; E60-R66 IonicContact OE1-CZ 2.84Å; E60-R66 IonicContact OE1-NE 3.37Å; E60-R66 IonicContact OE1-NH1 2.75Å; E60-R66 PolarHBondContact OE1-NH1 3.09Å; E60-R66 VanDerWaalsContact OE1-NH1 3.13Å; E60-R66 IonicContact OE1-NH2 3.48Å; E60-R66 PolarHBondContact OE1-NH2 2.92Å
67	I	84.6	Confident	84.8	Confident	62 Å²	62	66.7 Å²	66.7	32%	0.318	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	122.9	177.4	-56.8	-177.3	0	0	0	109.4	E58 Y59 D61 D65	E58-I67 CarbonylContact C-O 3.59Å; E58-I67 WeakPolarHBondContact CA-O 3.15Å; Y59-I67 HydrophobicContact CD1-CB 3.91Å; Y59-I67 HydrophobicContact CD1-CG2 4.24Å; Y59-I67 WeakPolarHBondContact CD1-O 3.43Å; Y59-I67 HydrophobicContact CE1-CB 3.49Å; Y59-I67 VanDerWaalsContact CE1-CB 3.49Å; Y59-I67 HydrophobicContact CE1-CD1 4.38Å; Y59-I67 HydrophobicContact CE1-CG1 4.46Å; Y59-I67 HydrophobicContact CE1-CG2 3.46Å; Y59-I67 VanDerWaalsContact CE1-CG2 3.46Å; Y59-I67 HydrophobicContact CE2-CB 4.47Å; Y59-I67 HydrophobicContact CE2-CD1 4.22Å; Y59-I67 PolarHBondContact N-O 2.6Å; Y59-I67 PolarHBondContact O-N 2.78Å; Y59-I67 WeakPolarHBondContact OH-CD1 3.46Å; D61-I67 HydrophobicContact CB-CD1 3.78Å; D61-I67 HydrophobicContact CB-CG1 4.46Å; D65-I67 PolarHBondContact O-N 2.88Å
68	T	90.5	Very high	85	Confident	22 Å²	22	66.7 Å²	66.7	14%	0.135	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133	179	-42.2	0	0	0	0	112.2	A56 F57 E58 R70	A56-T68 HydrophobicContact CB-CG2 3.89Å; F57-T68 CarbonylContact O-C 3.58Å; F57-T68 WeakPolarHBondContact O-CA 3.47Å; E58-T68 HydrophobicContact CG-CG2 4Å; E58-T68 PolarHBondContact OE1-OG1 2.74Å; T68-R70 VanDerWaalsContact CB-CZ 3.46Å; T68-R70 VanDerWaalsContact CB-NH2 3.28Å; T68-R70 HydrophobicContact CG2-CG 3.92Å; T68-R70 VanDerWaalsContact CG2-NH2 3.29Å; T68-R70 PolarHBondContact OG1-NH2 2.91Å
69	V	86.7	Confident	84.7	Confident	1 Å²	1	65 Å²	65	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.2	173.7	-175.2	0	0	0	0	110	F38 A56 F57 Y59 E74 L75 M78	F38-V69 HydrophobicContact CD2-CG1 3.95Å; F38-V69 HydrophobicContact CE2-CG1 4.02Å; F38-V69 WeakPolarHBondContact CE2-O 3.4Å; A56-V69 WeakPolarHBondContact CB-O 3.19Å; F57-V69 HydrophobicContact CD2-CB 4.07Å; F57-V69 HydrophobicContact CD2-CG2 4.32Å; F57-V69 HydrophobicContact CE1-CB 4.31Å; F57-V69 HydrophobicContact CE1-CG1 4.2Å; F57-V69 HydrophobicContact CE2-CB 3.56Å; F57-V69 HydrophobicContact CE2-CG1 3.92Å; F57-V69 HydrophobicContact CE2-CG2 3.75Å; F57-V69 HydrophobicContact CZ-CB 3.67Å; F57-V69 HydrophobicContact CZ-CG1 3.54Å; F57-V69 HydrophobicContact CZ-CG2 4.26Å; F57-V69 PolarHBondContact N-O 2.97Å; F57-V69 PolarHBondContact O-N 3.14Å; Y59-V69 HydrophobicContact CD1-CG2 3.74Å; Y59-V69 HydrophobicContact CE1-CG2 3.98Å; V69-E74 HydrophobicContact CG1-CB 3.96Å; V69-L75 HydrophobicContact CG1-CB 4.08Å; V69-M78 HydrophobicContact CG2-CB 4.37Å; V69-M78 HydrophobicContact CG2-SD 3.82Å
70	R	88.2	Confident	84.5	Confident	133 Å²	133	66.5 Å²	66.5	50%	0.502	35%	0.347	S	S	.	.			trans	-135.8	-0.8	-175.1	-51.4	-171.3	-179.8	79	1.1	113.6	F38 A56 T68 E74	F38-R70 WeakPolarHBondContact CE1-O 3.32Å; A56-R70 HydrophobicContact CB-CG 3.94Å; T68-R70 VanDerWaalsContact CB-CZ 3.46Å; T68-R70 VanDerWaalsContact CB-NH2 3.28Å; T68-R70 HydrophobicContact CG2-CG 3.92Å; T68-R70 VanDerWaalsContact CG2-NH2 3.29Å; T68-R70 PolarHBondContact OG1-NH2 2.91Å; R70-E74 VanDerWaalsContact CA-OE2 3.31Å; R70-E74 WeakPolarHBondContact CA-OE2 3.4Å; R70-E74 WeakPolarHBondContact CB-OE2 3.46Å; R70-E74 PolarHBondContact N-OE2 3.02Å
71	S	84.9	Confident	84.5	Confident	34 Å²	34	65.7 Å²	65.7	24%	0.238	34%	0.341	C	S	.	.	S	Bend	trans	-151.5	165.9	-173	58.5	0	0	0	0	112.5	E73 E74 L75	S71-E73 VanDerWaalsContact C-N 3.33Å; S71-E74 PolarHBondContact N-OE2 3.28Å; S71-E74 PolarHBondContact O-N 2.97Å; S71-E74 WeakPolarHBondContact OG-CB 3.24Å; S71-E74 VanDerWaalsContact OG-CD 3.28Å; S71-E74 VanDerWaalsContact OG-CG 3.25Å; S71-E74 WeakPolarHBondContact OG-CG 3.38Å; S71-E74 PolarHBondContact OG-N 2.85Å; S71-E74 PolarHBondContact OG-OE2 3.1Å; S71-L75 WeakPolarHBondContact O-CB 3.28Å; S71-L75 PolarHBondContact O-N 3.33Å
72	D	80.9	Confident	84.7	Confident	66 Å²	66	64.7 Å²	64.7	35%	0.353	34%	0.335	S	S	.	.	H	α-helix	trans	-65.6	-35	175.6	-74.6	-46.4	0	0	0	112.1	N37 F38 L75 K76	N37-D72 WeakPolarHBondContact CA-OD1 3.48Å; N37-D72 WeakPolarHBondContact CB-OD1 3.47Å; F38-D72 WeakPolarHBondContact CB-OD1 3.27Å; F38-D72 PolarHBondContact N-OD1 3.31Å; D72-L75 PolarHBondContact O-N 3.31Å; D72-K76 WeakPolarHBondContact O-CB 3.08Å; D72-K76 VanDerWaalsContact O-CG 3.3Å; D72-K76 WeakPolarHBondContact O-CG 3.41Å; D72-K76 PolarHBondContact O-N 3.27Å
73	E	83.4	Confident	85.1	Confident	139 Å²	139	58.9 Å²	58.9	65%	0.65	31%	0.31	S	S	*	.	H	α-helix	trans	-65.9	-45.5	176.7	-68.1	73.6	-161.6	0	0	111.7	S71 L75 K76 A77	S71-E73 VanDerWaalsContact C-N 3.33Å; E73-L75 VanDerWaalsContact C-N 3.34Å; E73-K76 PolarHBondContact O-N 3.25Å; E73-A77 PolarHBondContact O-N 2.78Å
74	E	88.4	Confident	85.5	Confident	75 Å²	75	56.1 Å²	56.1	35%	0.35	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-36.1	176	-70.7	166.3	159	0	0	111.5	V69 R70 S71 A77 M78	V69-E74 HydrophobicContact CG1-CB 3.96Å; R70-E74 VanDerWaalsContact CA-OE2 3.31Å; R70-E74 WeakPolarHBondContact CA-OE2 3.4Å; R70-E74 WeakPolarHBondContact CB-OE2 3.46Å; R70-E74 PolarHBondContact N-OE2 3.02Å; S71-E74 PolarHBondContact N-OE2 3.28Å; S71-E74 PolarHBondContact O-N 2.97Å; S71-E74 WeakPolarHBondContact OG-CB 3.24Å; S71-E74 VanDerWaalsContact OG-CD 3.28Å; S71-E74 VanDerWaalsContact OG-CG 3.25Å; S71-E74 WeakPolarHBondContact OG-CG 3.38Å; S71-E74 PolarHBondContact OG-N 2.85Å; S71-E74 PolarHBondContact OG-OE2 3.1Å; E74-A77 PolarHBondContact O-N 3.35Å; E74-M78 WeakPolarHBondContact O-CB 3.44Å; E74-M78 PolarHBondContact O-N 3.2Å
75	L	87.1	Confident	85.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-47.2	172.7	173.2	63.8	0	0	0	110.9	L36 F38 L41 F57 V69 S71 D72 E73 A77 M78 L79	L36-L75 HydrophobicContact CG-CD2 4.42Å; F38-L75 HydrophobicContact CB-CD2 4.27Å; F38-L75 VanDerWaalsContact N-CD2 3.32Å; L41-L75 HydrophobicContact CD2-CD1 4.14Å; F57-L75 HydrophobicContact CZ-CD1 4.31Å; V69-L75 HydrophobicContact CG1-CB 4.08Å; S71-L75 WeakPolarHBondContact O-CB 3.28Å; S71-L75 PolarHBondContact O-N 3.33Å; D72-L75 PolarHBondContact O-N 3.31Å; E73-L75 VanDerWaalsContact C-N 3.34Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 2.63Å; L75-M78 HydrophobicContact CD1-CE 3.46Å; L75-M78 VanDerWaalsContact CD1-CE 3.46Å; L75-M78 WeakPolarHBondContact O-CB 3.45Å; L75-M78 PolarHBondContact O-N 3.3Å; L75-L79 HydrophobicContact CD1-CD1 3.94Å; L75-L79 HydrophobicContact CD1-CG 3.98Å; L75-L79 HydrophobicContact CG-CD1 3.91Å; L75-L79 HydrophobicContact CG-CG 4.34Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 VanDerWaalsContact O-CG 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.16Å; L75-L79 PolarHBondContact O-N 3.47Å
76	K	86.6	Confident	86	Confident	116 Å²	116	51.4 Å²	51.4	50%	0.504	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-39.6	177.8	-75.3	173.5	-177.1	177.8	0	112.1	D72 E73 L79 S80	D72-K76 WeakPolarHBondContact O-CB 3.08Å; D72-K76 VanDerWaalsContact O-CG 3.3Å; D72-K76 WeakPolarHBondContact O-CG 3.41Å; D72-K76 PolarHBondContact O-N 3.27Å; E73-K76 PolarHBondContact O-N 3.25Å; K76-L79 PolarHBondContact O-N 3.17Å; K76-S80 VanDerWaalsContact O-CB 3.26Å; K76-S80 WeakPolarHBondContact O-CB 3.45Å; K76-S80 PolarHBondContact O-N 2.93Å
77	A	84.9	Confident	85.8	Confident	59 Å²	59	48.9 Å²	48.9	49%	0.488	25%	0.25	S	S	.	.	H	α-helix	trans	-62.7	-45.6	174.8	0	0	0	0	0	111.4	E73 E74 L75 S80 Y81	E73-A77 PolarHBondContact O-N 2.78Å; E74-A77 PolarHBondContact O-N 3.35Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 2.63Å; A77-S80 PolarHBondContact O-N 3.47Å; A77-Y81 VanDerWaalsContact O-CB 3.28Å; A77-Y81 WeakPolarHBondContact O-CB 3.36Å; A77-Y81 PolarHBondContact O-N 3.16Å
78	M	91.7	Very high	85.7	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.8	-46.9	175.1	178.9	-172.3	77.2	0	0	112	F57 Y59 V69 E74 L75 Y81 Y82 L99 I101	F57-M78 HydrophobicContact CE2-CE 3.87Å; F57-M78 HydrophobicContact CE2-SD 3.89Å; F57-M78 HydrophobicContact CZ-CE 4.32Å; Y59-M78 HydrophobicContact CD1-CB 4.08Å; Y59-M78 HydrophobicContact CD1-CG 3.52Å; Y59-M78 HydrophobicContact CD1-SD 3.48Å; Y59-M78 WeakPolarHBondContact CD1-SD 3.31Å; Y59-M78 HydrophobicContact CD2-CG 3.91Å; Y59-M78 HydrophobicContact CD2-SD 4.47Å; Y59-M78 HydrophobicContact CE1-CB 3.73Å; Y59-M78 HydrophobicContact CE1-CG 3.65Å; Y59-M78 HydrophobicContact CE1-SD 4.15Å; Y59-M78 HydrophobicContact CE2-CG 4.06Å; Y59-M78 HydrophobicContact CG-CG 3.64Å; Y59-M78 HydrophobicContact CG-SD 3.65Å; V69-M78 HydrophobicContact CG2-CB 4.37Å; V69-M78 HydrophobicContact CG2-SD 3.82Å; E74-M78 WeakPolarHBondContact O-CB 3.44Å; E74-M78 PolarHBondContact O-N 3.2Å; L75-M78 HydrophobicContact CD1-CE 3.46Å; L75-M78 VanDerWaalsContact CD1-CE 3.46Å; L75-M78 WeakPolarHBondContact O-CB 3.45Å; L75-M78 PolarHBondContact O-N 3.3Å; M78-Y81 WeakPolarHBondContact O-CB 3.29Å; M78-Y81 PolarHBondContact O-N 3.36Å; M78-Y82 WeakPolarHBondContact O-CB 3.5Å; M78-Y82 PolarHBondContact O-N 3.28Å; M78-L99 HydrophobicContact CE-CD2 3.74Å; M78-L99 HydrophobicContact CG-CD1 4.45Å; M78-L99 HydrophobicContact CG-CD2 4.49Å; M78-L99 HydrophobicContact SD-CD2 4.4Å; M78-I101 HydrophobicContact CE-CG2 4.39Å; M78-I101 HydrophobicContact SD-CG2 4.37Å
79	L	86.7	Confident	85.2	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-43.2	180	-69.3	173.4	0	0	0	111.6	M10 I15 P33 L36 L75 K76 Y81 Y82 C83 L99	M10-L79 HydrophobicContact CE-CB 3.58Å; M10-L79 HydrophobicContact CE-CD1 3.83Å; M10-L79 HydrophobicContact CE-CG 4.37Å; M10-L79 HydrophobicContact SD-CB 4.42Å; I15-L79 HydrophobicContact CD1-CD2 3.57Å; P33-L79 WeakPolarHBondContact O-CD1 3.48Å; L36-L79 HydrophobicContact CD2-CD1 4.49Å; L75-L79 HydrophobicContact CD1-CD1 3.94Å; L75-L79 HydrophobicContact CD1-CG 3.98Å; L75-L79 HydrophobicContact CG-CD1 3.91Å; L75-L79 HydrophobicContact CG-CG 4.34Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 VanDerWaalsContact O-CG 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.16Å; L75-L79 PolarHBondContact O-N 3.47Å; K76-L79 PolarHBondContact O-N 3.17Å; L79-Y81 VanDerWaalsContact C-N 3.33Å; L79-Y81 PolarHBondContact O-N 3.2Å; L79-Y82 PolarHBondContact O-N 3.49Å; L79-C83 WeakPolarHBondContact O-CB 3.44Å; L79-C83 PolarHBondContact O-N 3.45Å; L79-C83 PolarHBondContact O-SG 3.33Å; L79-L99 HydrophobicContact CD2-CD2 3.95Å
80	S	85.9	Confident	84.9	Confident	51 Å²	51	57.3 Å²	57.3	36%	0.357	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-43	176	-179.4	0	0	0	0	111.6	K76 A77 N84	K76-S80 VanDerWaalsContact O-CB 3.26Å; K76-S80 WeakPolarHBondContact O-CB 3.45Å; K76-S80 PolarHBondContact O-N 2.93Å; A77-S80 PolarHBondContact O-N 3.47Å; S80-N84 VanDerWaalsContact O-CG 3.26Å; S80-N84 PolarHBondContact O-N 3.47Å; S80-N84 VanDerWaalsContact O-N 3.12Å; S80-N84 PolarHBondContact O-ND2 2.97Å
81	Y	87.3	Confident	84.6	Confident	61 Å²	61	58.9 Å²	58.9	24%	0.239	30%	0.298	C	S	.	.	H	α-helix	trans	-58.2	-53.2	173.3	168.2	-99.4	0	0	0	111.3	Y59 E62 A77 M78 L79 C83 N84 T85	Y59-Y81 AromaticContact CE2-CD1 3.84Å; Y59-Y81 HydrophobicContact CE2-CD1 3.84Å; Y59-Y81 HydrophobicContact CE2-CE1 4.04Å; E62-Y81 WeakPolarHBondContact CA-OH 3.47Å; E62-Y81 WeakPolarHBondContact CB-OH 3.23Å; E62-Y81 WeakPolarHBondContact CG-OH 3.22Å; E62-Y81 PolarHBondContact N-OH 2.97Å; E62-Y81 WeakPolarHBondContact OE1-CE2 3.29Å; A77-Y81 VanDerWaalsContact O-CB 3.28Å; A77-Y81 WeakPolarHBondContact O-CB 3.36Å; A77-Y81 PolarHBondContact O-N 3.16Å; M78-Y81 WeakPolarHBondContact O-CB 3.29Å; M78-Y81 PolarHBondContact O-N 3.36Å; L79-Y81 VanDerWaalsContact C-N 3.33Å; L79-Y81 PolarHBondContact O-N 3.2Å; Y81-C83 PolarHBondContact O-N 3.49Å; Y81-N84 WeakPolarHBondContact O-CB 3.36Å; Y81-N84 PolarHBondContact O-N 3.5Å; Y81-N84 VanDerWaalsContact O-N 3.12Å; Y81-T85 PolarHBondContact O-N 3.38Å; Y81-T85 PolarHBondContact O-OG1 3.45Å; Y81-T85 VanDerWaalsContact O-OG1 3.11Å
82	Y	87	Confident	84.4	Confident	20 Å²	20	63.2 Å²	63.2	8%	0.078	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-43.5	-179.8	177.9	-108.9	0	0	0	112.8	I15 M78 L79 N84 T85 M86 D97 P98 L99	I15-Y82 HydrophobicContact CB-CE1 4.04Å; I15-Y82 HydrophobicContact CG2-CD1 4.37Å; I15-Y82 HydrophobicContact CG2-CE1 4.02Å; M78-Y82 WeakPolarHBondContact O-CB 3.5Å; M78-Y82 PolarHBondContact O-N 3.28Å; L79-Y82 PolarHBondContact O-N 3.49Å; Y82-N84 VanDerWaalsContact C-N 3.29Å; Y82-N84 PolarHBondContact O-N 3.13Å; Y82-T85 PolarHBondContact O-N 3.33Å; Y82-M86 HydrophobicContact CD1-CG 4.1Å; Y82-M86 HydrophobicContact CD1-SD 3.84Å; Y82-M86 HydrophobicContact CD2-CG 4.3Å; Y82-M86 HydrophobicContact CE1-CE 4.45Å; Y82-M86 HydrophobicContact CE1-CG 3.68Å; Y82-M86 HydrophobicContact CE1-SD 3.12Å; Y82-M86 WeakPolarHBondContact CE1-SD 3.32Å; Y82-M86 HydrophobicContact CE2-CG 3.88Å; Y82-M86 HydrophobicContact CE2-SD 4.35Å; Y82-M86 HydrophobicContact CG-CG 4.4Å; Y82-M86 WeakPolarHBondContact O-CB 3.48Å; Y82-M86 WeakPolarHBondContact O-CG 3.38Å; Y82-M86 PolarHBondContact O-N 3.29Å; Y82-M86 PolarHBondContact OH-SD 3.32Å; Y82-D97 WeakPolarHBondContact CE2-O 3.34Å; Y82-D97 PolarHBondContact OH-O 3.36Å; Y82-P98 WeakPolarHBondContact OH-CA 3.4Å; Y82-L99 HydrophobicContact CD1-CB 3.91Å; Y82-L99 HydrophobicContact CD1-CD2 4.11Å; Y82-L99 HydrophobicContact CD1-CG 4.43Å; Y82-L99 HydrophobicContact CD2-CB 3.84Å; Y82-L99 HydrophobicContact CD2-CD1 3.75Å; Y82-L99 HydrophobicContact CD2-CG 4.27Å; Y82-L99 HydrophobicContact CE1-CB 3.74Å; Y82-L99 HydrophobicContact CE2-CB 3.69Å; Y82-L99 HydrophobicContact CE2-CD1 4.37Å; Y82-L99 HydrophobicContact CG-CB 3.95Å; Y82-L99 HydrophobicContact CG-CD1 3.88Å; Y82-L99 HydrophobicContact CG-CD2 4.1Å; Y82-L99 HydrophobicContact CG-CG 4.19Å; Y82-L99 PolarHBondContact OH-N 2.86Å; Y82-L99 VanDerWaalsContact OH-N 3.16Å
83	C	84.8	Confident	84.4	Confident	21 Å²	21	63.3 Å²	63.3	14%	0.142	34%	0.335	C	S	.	.	H	α-helix	trans	-60.3	-38	176.3	-72	0	0	0	0	112.3	L79 Y81 N87	L79-C83 WeakPolarHBondContact O-CB 3.44Å; L79-C83 PolarHBondContact O-N 3.45Å; L79-C83 PolarHBondContact O-SG 3.33Å; Y81-C83 PolarHBondContact O-N 3.49Å; C83-N87 PolarHBondContact O-N 2.81Å; C83-N87 VanDerWaalsContact O-N 3.15Å; C83-N87 PolarHBondContact O-ND2 2.93Å
84	N	83.4	Confident	84.2	Confident	67 Å²	67	61.6 Å²	61.6	36%	0.358	33%	0.329	S	S	.	.	H	α-helix	trans	-66.2	-47.7	175.2	-69.3	-25.8	0	0	0	111.1	S80 Y81 Y82 M86 N87 E88	S80-N84 VanDerWaalsContact O-CG 3.26Å; S80-N84 PolarHBondContact O-N 3.47Å; S80-N84 VanDerWaalsContact O-N 3.12Å; S80-N84 PolarHBondContact O-ND2 2.97Å; Y81-N84 WeakPolarHBondContact O-CB 3.36Å; Y81-N84 PolarHBondContact O-N 3.5Å; Y81-N84 VanDerWaalsContact O-N 3.12Å; Y82-N84 VanDerWaalsContact C-N 3.29Å; Y82-N84 PolarHBondContact O-N 3.13Å; N84-M86 VanDerWaalsContact C-N 3.35Å; N84-M86 PolarHBondContact O-N 3.46Å; N84-N87 PolarHBondContact O-N 3.01Å; N84-E88 PolarHBondContact O-N 3.36Å
85	T	83.3	Confident	83.7	Confident	25 Å²	25	65.9 Å²	65.9	15%	0.153	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-41.8	177.7	-47.8	0	0	0	0	112	Y81 Y82 N87 E88 Q89	Y81-T85 PolarHBondContact O-N 3.38Å; Y81-T85 PolarHBondContact O-OG1 3.45Å; Y81-T85 VanDerWaalsContact O-OG1 3.11Å; Y82-T85 PolarHBondContact O-N 3.33Å; T85-N87 VanDerWaalsContact C-N 3.33Å; T85-N87 PolarHBondContact O-N 3.21Å; T85-E88 PolarHBondContact O-N 3.01Å; T85-Q89 WeakPolarHBondContact O-CG 3.46Å; T85-Q89 PolarHBondContact O-N 3.37Å
86	M	84.3	Confident	83.4	Confident	20 Å²	20	67.1 Å²	67.1	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-59.1	-43.9	175.5	-76.3	-168.1	81.3	0	0	112	I15 Y82 N84 Q89 R90 P96	I15-M86 HydrophobicContact CG2-SD 4.1Å; Y82-M86 HydrophobicContact CD1-CG 4.1Å; Y82-M86 HydrophobicContact CD1-SD 3.84Å; Y82-M86 HydrophobicContact CD2-CG 4.3Å; Y82-M86 HydrophobicContact CE1-CE 4.45Å; Y82-M86 HydrophobicContact CE1-CG 3.68Å; Y82-M86 HydrophobicContact CE1-SD 3.12Å; Y82-M86 WeakPolarHBondContact CE1-SD 3.32Å; Y82-M86 HydrophobicContact CE2-CG 3.88Å; Y82-M86 HydrophobicContact CE2-SD 4.35Å; Y82-M86 HydrophobicContact CG-CG 4.4Å; Y82-M86 WeakPolarHBondContact O-CB 3.48Å; Y82-M86 WeakPolarHBondContact O-CG 3.38Å; Y82-M86 PolarHBondContact O-N 3.29Å; Y82-M86 PolarHBondContact OH-SD 3.32Å; N84-M86 VanDerWaalsContact C-N 3.35Å; N84-M86 PolarHBondContact O-N 3.46Å; M86-Q89 PolarHBondContact O-N 3.23Å; M86-R90 WeakPolarHBondContact O-CG 3.3Å; M86-R90 PolarHBondContact O-N 2.88Å; M86-P96 HydrophobicContact CB-CB 4.12Å; M86-P96 HydrophobicContact CE-CB 3.66Å; M86-P96 HydrophobicContact CE-CG 3.35Å; M86-P96 HydrophobicContact CG-CB 3.86Å
87	N	81.4	Confident	83.2	Confident	52 Å²	52	66.6 Å²	66.6	28%	0.278	36%	0.363	S	S	.	.	H	α-helix	trans	-65.2	-41.9	179.6	-78.3	-30.1	0	0	0	111.5	C83 N84 T85 R90 M91	C83-N87 PolarHBondContact O-N 2.81Å; C83-N87 VanDerWaalsContact O-N 3.15Å; C83-N87 PolarHBondContact O-ND2 2.93Å; N84-N87 PolarHBondContact O-N 3.01Å; T85-N87 VanDerWaalsContact C-N 3.33Å; T85-N87 PolarHBondContact O-N 3.21Å; N87-R90 PolarHBondContact O-N 3.22Å; N87-M91 VanDerWaalsContact O-CG 3.3Å; N87-M91 WeakPolarHBondContact O-CG 3.37Å; N87-M91 PolarHBondContact O-N 3.3Å
88	E	81.9	Confident	83.3	Confident	108 Å²	108	65 Å²	65	51%	0.505	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-43.9	175.7	-70.8	-177.8	-179.8	0	0	112.3	N84 T85 R90 M91 N92	N84-E88 PolarHBondContact O-N 3.36Å; T85-E88 PolarHBondContact O-N 3.01Å; E88-R90 VanDerWaalsContact C-N 3.32Å; E88-R90 PolarHBondContact O-N 2.89Å; E88-M91 PolarHBondContact O-N 3.44Å; E88-N92 PolarHBondContact O-N 3.2Å; E88-N92 VanDerWaalsContact O-N 3.16Å; E88-N92 PolarHBondContact O-ND2 2.9Å
89	Q	81.2	Confident	83.2	Confident	55 Å²	55	65.4 Å²	65.4	26%	0.257	35%	0.349	S	S	.	.	H	α-helix	trans	-60.1	-42.1	176.3	-73.3	177.3	-13.5	0	0	111.7	T85 M86 N92 G93 L94	T85-Q89 WeakPolarHBondContact O-CG 3.46Å; T85-Q89 PolarHBondContact O-N 3.37Å; M86-Q89 PolarHBondContact O-N 3.23Å; Q89-N92 CarbonylContact O-C 3.57Å; Q89-N92 PolarHBondContact O-N 2.99Å; Q89-G93 PolarHBondContact O-N 3.2Å; Q89-L94 HydrophobicContact CB-CB 4.33Å; Q89-L94 WeakPolarHBondContact O-CB 3.46Å; Q89-L94 PolarHBondContact O-N 2.63Å
90	R	79.9	Confident	83.4	Confident	100 Å²	100	68 Å²	68	38%	0.377	36%	0.362	S	S	.	.	H	α-helix	trans	-69	-39.4	177.5	-74.1	-176.7	178.6	-170.7	13.8	113.5	E13 M86 N87 E88 N92 G93 P96	E13-R90 VanDerWaalsContact CD-NH1 3.31Å; E13-R90 IonicContact OE1-NH1 3.17Å; E13-R90 PolarHBondContact OE1-NH1 3.38Å; E13-R90 IonicContact OE2-CZ 3.09Å; E13-R90 IonicContact OE2-NH1 2.64Å; E13-R90 PolarHBondContact OE2-NH1 3.43Å; E13-R90 IonicContact OE2-NH2 2.78Å; E13-R90 PolarHBondContact OE2-NH2 2.98Å; M86-R90 WeakPolarHBondContact O-CG 3.3Å; M86-R90 PolarHBondContact O-N 2.88Å; N87-R90 PolarHBondContact O-N 3.22Å; E88-R90 VanDerWaalsContact C-N 3.32Å; E88-R90 PolarHBondContact O-N 2.89Å; R90-N92 PolarHBondContact O-N 3.23Å; R90-G93 PolarHBondContact O-N 3.2Å; R90-P96 HydrophobicContact CG-CG 4.17Å
91	M	81.2	Confident	83.6	Confident	166 Å²	166	65.6 Å²	65.6	82%	0.818	35%	0.345	S	S	*	.	H	α-helix	trans	-59.9	-28.6	173.7	-72.4	-67.2	170.4	0	0	111.7	N87 E88 G93	N87-M91 VanDerWaalsContact O-CG 3.3Å; N87-M91 WeakPolarHBondContact O-CG 3.37Å; N87-M91 PolarHBondContact O-N 3.3Å; E88-M91 PolarHBondContact O-N 3.44Å; M91-G93 VanDerWaalsContact C-N 3.33Å
92	N	81.8	Confident	83.7	Confident	125 Å²	125	64.5 Å²	64.5	67%	0.668	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	7.1	174.4	-64.2	-30	0	0	0	113.9	E88 Q89 R90 L94	E88-N92 PolarHBondContact O-N 3.2Å; E88-N92 VanDerWaalsContact O-N 3.16Å; E88-N92 PolarHBondContact O-ND2 2.9Å; Q89-N92 CarbonylContact O-C 3.57Å; Q89-N92 PolarHBondContact O-N 2.99Å; R90-N92 PolarHBondContact O-N 3.23Å; N92-L94 VanDerWaalsContact C-N 3.33Å; N92-L94 PolarHBondContact O-N 3.18Å
93	G	79.7	Confident	83.7	Confident	68 Å²	68	64.7 Å²	64.7	70%	0.701	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	14.4	177.7	0	0	0	0	0	115.1	Q89 R90 M91	Q89-G93 PolarHBondContact O-N 3.2Å; R90-G93 PolarHBondContact O-N 3.2Å; M91-G93 VanDerWaalsContact C-N 3.33Å
94	L	80.4	Confident	83.3	Confident	102 Å²	102	69.8 Å²	69.8	53%	0.534	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-93.4	149.1	178.4	-62.3	167.7	0	0	0	111	Q89 N92	Q89-L94 HydrophobicContact CB-CB 4.33Å; Q89-L94 WeakPolarHBondContact O-CB 3.46Å; Q89-L94 PolarHBondContact O-N 2.63Å; N92-L94 VanDerWaalsContact C-N 3.33Å; N92-L94 PolarHBondContact O-N 3.18Å
95	M	77.3	Confident	82.1	Confident	165 Å²	165	69.5 Å²	69.5	81%	0.813	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-79.3	125.4	168.1	-72.6	-68.4	106.1	0	0	108.7
96	P	79.5	Confident	80.5	Confident	28 Å²	28	69.7 Å²	69.7	18%	0.182	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-72.6	137.8	-177.2	26.1	-31.8	0	0	0	112.3	M86 R90	M86-P96 HydrophobicContact CB-CB 4.12Å; M86-P96 HydrophobicContact CE-CB 3.66Å; M86-P96 HydrophobicContact CE-CG 3.35Å; M86-P96 HydrophobicContact CG-CB 3.86Å; R90-P96 HydrophobicContact CG-CG 4.17Å
97	D	83.4	Confident	78.2	Confident	105 Å²	105	78.5 Å²	78.5	56%	0.561	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-73.4	146.6	176.7	-76.8	-45.1	0	0	0	111.2	Y82	Y82-D97 WeakPolarHBondContact CE2-O 3.34Å; Y82-D97 PolarHBondContact OH-O 3.36Å
98	P	87.7	Confident	75.8	Confident	25 Å²	25	81.6 Å²	81.6	16%	0.162	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-57.3	144.9	173.7	-26.8	36.6	0	0	0	112.8	V16 R18 Y82 Q100	V16-P98 HydrophobicContact CB-CB 4.15Å; V16-P98 HydrophobicContact CB-CG 4.41Å; V16-P98 HydrophobicContact CG1-CB 4.01Å; V16-P98 HydrophobicContact CG1-CG 4.22Å; V16-P98 CarbonylContact O-C 3.56Å; V16-P98 WeakPolarHBondContact O-CA 3.08Å; R18-P98 HydrophobicContact CB-CB 3.92Å; Y82-P98 WeakPolarHBondContact OH-CA 3.4Å; P98-Q100 WeakPolarHBondContact O-CG 3.39Å; P98-Q100 PolarHBondContact O-N 2.91Å; P98-Q100 VanDerWaalsContact O-N 3.09Å
99	L	88.8	Confident	73.5	Confident	9 Å²	9	82.3 Å²	82.3	5%	0.047	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	110.9	175.8	176.6	54.8	0	0	0	109.7	V16 I17 R18 M78 L79 Y82 I101	V16-L99 PolarHBondContact O-N 2.81Å; I17-L99 CarbonylContact C-O 3.58Å; I17-L99 WeakPolarHBondContact CA-O 3.3Å; I17-L99 HydrophobicContact CG1-CD2 4.46Å; R18-L99 PolarHBondContact N-O 2.91Å; M78-L99 HydrophobicContact CE-CD2 3.74Å; M78-L99 HydrophobicContact CG-CD1 4.45Å; M78-L99 HydrophobicContact CG-CD2 4.49Å; M78-L99 HydrophobicContact SD-CD2 4.4Å; L79-L99 HydrophobicContact CD2-CD2 3.95Å; Y82-L99 HydrophobicContact CD1-CB 3.91Å; Y82-L99 HydrophobicContact CD1-CD2 4.11Å; Y82-L99 HydrophobicContact CD1-CG 4.43Å; Y82-L99 HydrophobicContact CD2-CB 3.84Å; Y82-L99 HydrophobicContact CD2-CD1 3.75Å; Y82-L99 HydrophobicContact CD2-CG 4.27Å; Y82-L99 HydrophobicContact CE1-CB 3.74Å; Y82-L99 HydrophobicContact CE2-CB 3.69Å; Y82-L99 HydrophobicContact CE2-CD1 4.37Å; Y82-L99 HydrophobicContact CG-CB 3.95Å; Y82-L99 HydrophobicContact CG-CD1 3.88Å; Y82-L99 HydrophobicContact CG-CD2 4.1Å; Y82-L99 HydrophobicContact CG-CG 4.19Å; Y82-L99 PolarHBondContact OH-N 2.86Å; Y82-L99 VanDerWaalsContact OH-N 3.16Å; L99-I101 HydrophobicContact CG-CG2 4.35Å
100	Q	90.3	Very high	71	Confident	56 Å²	56	82.4 Å²	82.4	26%	0.262	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.3	-177	-55.4	-171	14.2	0	0	110.8	R18 P98 F102	R18-Q100 WeakPolarHBondContact O-CA 3.5Å; P98-Q100 WeakPolarHBondContact O-CG 3.39Å; P98-Q100 PolarHBondContact O-N 2.91Å; P98-Q100 VanDerWaalsContact O-N 3.09Å; Q100-F102 HydrophobicContact CB-CE2 3.65Å; Q100-F102 HydrophobicContact CB-CZ 4.12Å
101	I	91.1	Very high	68.8	Low	0 Å²	0	85.1 Å²	85.1	0%	0	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	145.9	173.9	70	172.6	0	0	0	111.4	I17 R18 I19 K20 L41 I45 F57 E58 M78 L99	I17-I101 HydrophobicContact CG2-CD1 3.79Å; I17-I101 HydrophobicContact CG2-CG1 3.96Å; I17-I101 HydrophobicContact CG2-CG2 4.13Å; R18-I101 PolarHBondContact O-N 2.79Å; I19-I101 HydrophobicContact CB-CG1 4.34Å; I19-I101 HydrophobicContact CG1-CD1 3.98Å; I19-I101 HydrophobicContact CG1-CG1 4.07Å; I19-I101 HydrophobicContact CG2-CG1 4.41Å; K20-I101 WeakPolarHBondContact CB-O 3.09Å; K20-I101 PolarHBondContact N-O 2.85Å; L41-I101 HydrophobicContact CD1-CD1 3.83Å; L41-I101 HydrophobicContact CD2-CD1 3.9Å; L41-I101 HydrophobicContact CG-CD1 3.93Å; I45-I101 HydrophobicContact CD1-CD1 3.86Å; I45-I101 HydrophobicContact CG1-CD1 4.07Å; F57-I101 HydrophobicContact CD2-CB 3.94Å; F57-I101 HydrophobicContact CD2-CD1 4.4Å; F57-I101 HydrophobicContact CD2-CG2 4.03Å; F57-I101 HydrophobicContact CE2-CB 4.49Å; F57-I101 HydrophobicContact CE2-CG2 4.11Å; E58-I101 CarbonylContact O-C 3.57Å; E58-I101 WeakPolarHBondContact O-CA 3.45Å; M78-I101 HydrophobicContact CE-CG2 4.39Å; M78-I101 HydrophobicContact SD-CG2 4.37Å; L99-I101 HydrophobicContact CG-CG2 4.35Å
102	F	89.4	Confident	66.4	Low	37 Å²	37	88 Å²	88	16%	0.162	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	101	-170	-62.2	-104	0	0	0	108.4	K20 F57 E58 E60 Q100 R104	K20-F102 HydrophobicContact CB-CD1 3.7Å; K20-F102 HydrophobicContact CB-CE1 3.92Å; K20-F102 HydrophobicContact CB-CG 4.21Å; K20-F102 HydrophobicContact CD-CE1 4.26Å; K20-F102 HydrophobicContact CD-CZ 4.41Å; K20-F102 HydrophobicContact CG-CD1 3.76Å; K20-F102 HydrophobicContact CG-CD2 4.37Å; K20-F102 HydrophobicContact CG-CE1 3.5Å; K20-F102 VanDerWaalsContact CG-CE1 3.5Å; K20-F102 HydrophobicContact CG-CE2 4.12Å; K20-F102 HydrophobicContact CG-CG 4.22Å; K20-F102 HydrophobicContact CG-CZ 3.69Å; F57-F102 CarbonylContact C-O 3.59Å; F57-F102 WeakPolarHBondContact CA-O 3.49Å; E58-F102 HydrophobicContact CB-CB 4.35Å; E58-F102 PolarHBondContact N-O 3.36Å; E58-F102 WeakPolarHBondContact O-CD2 3.47Å; E58-F102 PolarHBondContact O-N 2.95Å; E60-F102 HydrophobicContact CG-CE2 4.24Å; Q100-F102 HydrophobicContact CB-CE2 3.65Å; Q100-F102 HydrophobicContact CB-CZ 4.12Å; F102-R104 PolarHBondContact O-N 3.17Å
103	P	85.9	Confident	63.8	Low	25 Å²	25	89 Å²	89	16%	0.162	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	131.9	179.5	-27.4	37.8	0	0	0	112.1	I19 K20 I45 M49 V54	I19-P103 HydrophobicContact CG2-CG 3.72Å; K20-P103 WeakPolarHBondContact O-CD 3.43Å; I45-P103 HydrophobicContact CG1-CG 4.44Å; I45-P103 HydrophobicContact CG2-CB 3.68Å; I45-P103 HydrophobicContact CG2-CG 3.6Å; M49-P103 HydrophobicContact SD-CB 3.79Å; M49-P103 HydrophobicContact SD-CG 3.78Å; V54-P103 HydrophobicContact CG1-CB 4.3Å; V54-P103 HydrophobicContact CG2-CB 4.15Å
104	R	77.2	Confident	61.6	Low	127 Å²	127	93.3 Å²	93.3	48%	0.479	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	103.5	173.9	-159.2	171	179.5	162.6	-3.8	109.2	A56 E58 F102 G106	A56-R104 WeakPolarHBondContact O-CB 3.3Å; A56-R104 PolarHBondContact O-N 2.95Å; A56-R104 VanDerWaalsContact O-N 3.09Å; E58-R104 IonicContact OE1-CZ 2.87Å; E58-R104 IonicContact OE1-NE 2.72Å; E58-R104 IonicContact OE1-NH1 3.49Å; E58-R104 PolarHBondContact OE1-NH1 3.27Å; F102-R104 PolarHBondContact O-N 3.17Å; R104-G106 PolarHBondContact O-N 2.87Å; R104-G106 VanDerWaalsContact O-N 3.16Å
105	A	58.8	Low	59.2	Low	62 Å²	62	97.4 Å²	97.4	51%	0.512	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	117.1	171.6	0	0	0	0	0	109.1	A52 K107	A52-A105 HydrophobicContact CB-CB 4.43Å; A105-K107 PolarHBondContact O-N 2.87Å
106	G	49.2	Very low	56.7	Low	29 Å²	29	93 Å²	93	30%	0.299	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-55	130.1	165.4	0	0	0	0	0	108.6	T53 R104 T108	T53-G106 PolarHBondContact O-N 3.38Å; R104-G106 PolarHBondContact O-N 2.87Å; R104-G106 VanDerWaalsContact O-N 3.16Å; G106-T108 PolarHBondContact O-N 2.83Å; G106-T108 VanDerWaalsContact O-N 3.07Å
107	K	35.3	Very low	54.3	Low	205 Å²	205	99.3 Å²	99.3	89%	0.891	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-55	122.1	165.8	-74.4	179.9	178.7	176.9	0	106.2	A105	A105-K107 PolarHBondContact O-N 2.87Å
108	T	32.5	Very low	51.6	Low	116 Å²	116	104.2 Å²	104.2	71%	0.712	56%	0.558	S	S	*	*			trans	-45.5	136.6	165.3	24.4	0	0	0	0	107.7	G106 G110	G106-T108 PolarHBondContact O-N 2.83Å; G106-T108 VanDerWaalsContact O-N 3.07Å; T108-G110 PolarHBondContact O-N 2.98Å
109	P	32.3	Very low	48.7	Very low	124 Å²	124	108.3 Å²	108.3	81%	0.805	58%	0.582	S	S	*	*			trans	-61.8	96	173.5	-8.8	21.2	0	0	0	106.5	I111	P109-I111 PolarHBondContact O-N 2.79Å; P109-I111 VanDerWaalsContact O-N 3.09Å
110	G	29.1	Very low	45.7	Very low	57 Å²	57	115.5 Å²	115.5	59%	0.588	62%	0.62	S	S	*	*			trans	-54.3	122.9	169.4	0	0	0	0	0	105.9	T108 R112	T108-G110 PolarHBondContact O-N 2.98Å; G110-R112 VanDerWaalsContact C-N 3.27Å; G110-R112 PolarHBondContact O-N 3.36Å
111	I	33.2	Very low	42.7	Very low	157 Å²	157	119 Å²	119	81%	0.805	65%	0.646	S	S	*	*			trans	-52.5	97.4	175.9	-62.9	167.9	0	0	0	106.5	P109 N113	P109-I111 PolarHBondContact O-N 2.79Å; P109-I111 VanDerWaalsContact O-N 3.09Å; I111-N113 PolarHBondContact O-N 3.48Å; I111-N113 VanDerWaalsContact O-N 3.14Å
112	R	30.7	Very low	39.4	Very low	225 Å²	225	130.7 Å²	130.7	85%	0.849	69%	0.69	S	S	*	*			trans	-77.6	101.6	171.9	-75.2	-175.1	179.9	178.3	0.5	105.2	G110 I114	G110-R112 VanDerWaalsContact C-N 3.27Å; G110-R112 PolarHBondContact O-N 3.36Å; R112-I114 WeakPolarHBondContact O-CG1 3.4Å; R112-I114 PolarHBondContact O-N 2.86Å
113	N	27.1	Very low	36.6	Very low	148 Å²	148	134.2 Å²	134.2	79%	0.791	72%	0.716	S	S	*	*			trans	-55.1	104.8	161.3	-77.2	-23.8	0	0	0	108	I111 H115	I111-N113 PolarHBondContact O-N 3.48Å; I111-N113 VanDerWaalsContact O-N 3.14Å; N113-H115 VanDerWaalsContact C-N 3.28Å; N113-H115 PolarHBondContact O-N 2.92Å
114	I	33.7	Very low	33.6	Very low	157 Å²	157	138.4 Å²	138.4	81%	0.805	75%	0.747	S	S	*	*			trans	-95.9	49	178.5	-20.3	176.8	0	0	0	110.5	R112	R112-I114 WeakPolarHBondContact O-CG1 3.4Å; R112-I114 PolarHBondContact O-N 2.86Å
115	H	31.5	Very low	31.4	Very low	188 Å²	188	138 Å²	138	87%	0.87	76%	0.761	S	S	*	*			trans	-139.6	118.7	158.8	-85.5	-7.4	0	0	0	108.5	N113	N113-H115 VanDerWaalsContact C-N 3.28Å; N113-H115 PolarHBondContact O-N 2.92Å
116	G	25	Very low	29.9	Very low	74 Å²	74	139.5 Å²	139.5	76%	0.763	77%	0.772	S	S	*	*			trans	128.9	100.3	161.5	0	0	0	0	0	115.2
117	L	28	Very low	28.8	Very low	160 Å²	160	145.7 Å²	145.7	84%	0.838	80%	0.799	S	S	*	*			trans	-38.6	139.4	146.1	-81	75.5	0	0	0	110.4	V119	L117-V119 HydrophobicContact CD2-CG2 4.48Å
118	K	26.8	Very low	28.2	Very low	208 Å²	208	143.4 Å²	143.4	90%	0.904	80%	0.796	S	S	*	*			trans	-103.3	99.7	155.4	-90.3	-174.5	175.3	178.9	0	109.2
119	V	26.9	Very low	27.8	Very low	111 Å²	111	143.5 Å²	143.5	67%	0.673	80%	0.8	S	S	*	*			trans	-73.8	130.9	157	174.2	0	0	0	0	107.2	L117	L117-V119 HydrophobicContact CD2-CG2 4.48Å
120	N	26.3	Very low	27.5	Very low	160 Å²	160	143.4 Å²	143.4	86%	0.856	80%	0.797	S	S	*	*			trans	-73.7	121.3	172.7	-91.6	-32.5	0	0	0	110.4
121	T	26.3	Very low	27.3	Very low	130 Å²	130	149.7 Å²	149.7	80%	0.798	81%	0.812	S	S	*	*			trans	-149.1	117.4	153	51.1	0	0	0	0	109.7
122	R	21.9	Very low	27.2	Very low	244 Å²	244	149 Å²	149	92%	0.921	81%	0.814	S	S	*	*			trans	-89.7	170.4	157.3	-71.3	-174.2	-175.5	179.2	1.7	108.6
123	P	31.8	Very low	27.1	Very low	111 Å²	111	144.6 Å²	144.6	72%	0.721	81%	0.812	S	S	*	*			cis	-136.1	160.5	-2.3	27.3	-4.3	0	0	0	117.5
124	S	22.5	Very low	27.2	Very low	114 Å²	114	142.9 Å²	142.9	80%	0.797	81%	0.809	S	S	*	*			trans	53	167.7	142	-55.7	0	0	0	0	123.3
125	P	31.5	Very low	27.1	Very low	119 Å²	119	143.5 Å²	143.5	77%	0.773	81%	0.814	S	S	*	*			cis	-134.4	171.2	-46.9	38	-20.7	0	0	0	115.3
126	A	25.3	Very low	27.2	Very low	92 Å²	92	139.6 Å²	139.6	76%	0.76	81%	0.808	S	S	*	*			trans	80.2	142.7	150.4	0	0	0	0	0	123.2
127	N	26.2	Very low	27.5	Very low	159 Å²	159	143.7 Å²	143.7	85%	0.85	81%	0.812	S	S	*	*			trans	101.4	122.7	156.6	-71.3	-0.6	0	0	0	121.9
128	D	24.5	Very low	27.7	Very low	157 Å²	157	139.8 Å²	139.8	84%	0.84	80%	0.802	S	S	*	*			trans	-12	137.9	154.5	-81.3	-29.8	0	0	0	118
129	C	22.6	Very low	27.9	Very low	118 Å²	118	136 Å²	136	80%	0.797	79%	0.792	S	S	*	*				177.1	152.6	89.1	-145.3	0	0	0	0	111.2
130	T	26.6	Very low	28.1	Very low	122 Å²	122	136.6 Å²	136.6	75%	0.748	79%	0.791	S	S	*	*			trans	-54.2	149.7	172.9	35.5	0	0	0	0	114
131	Q	25.8	Very low	28.4	Very low	190 Å²	190	133.4 Å²	133.4	89%	0.888	78%	0.781	S	S	*	*			trans	-169.6	144	130.3	-77.3	-135.8	-19	0	0	112.1
132	V	30.3	Very low	28.9	Very low	142 Å²	142	133.4 Å²	133.4	86%	0.861	78%	0.776	S	S	*	*			trans	-104.3	131.5	-173.2	173	0	0	0	0	109.5
133	V	28.1	Very low	29.4	Very low	132 Å²	132	129.6 Å²	129.6	80%	0.8	77%	0.766	S	S	*	*			trans	-150.9	142.8	164.7	-167.9	0	0	0	0	109.7
134	P	30	Very low	29.4	Very low	112 Å²	112	131.4 Å²	131.4	73%	0.727	76%	0.763	S	S	*	*			trans	-97.1	155.5	-148.6	20.6	-6.8	0	0	0	117.9
135	D	31.8	Very low	30.4	Very low	170 Å²	170	128.7 Å²	128.7	91%	0.909	74%	0.744	S	S	*	*			trans	-56.4	118.3	170.5	-76.6	-43.7	0	0	0	113.8
136	S	33.8	Very low	30.8	Very low	107 Å²	107	126.1 Å²	126.1	75%	0.748	73%	0.728	S	S	*	*			trans	-165.4	23.1	159	53.4	0	0	0	0	117.2
137	L	31.7	Very low	31.5	Very low	160 Å²	160	124.3 Å²	124.3	84%	0.838	71%	0.713	S	S	*	*	S	Bend	trans	-128	-0.4	-177	-80.7	159.9	0	0	0	117.3
138	A	32	Very low	32.3	Very low	77 Å²	77	122.7 Å²	122.7	64%	0.636	70%	0.701	S	S	*	*	S	Bend	trans	-92.4	-17.5	-174.5	0	0	0	0	0	115.9
139	N	30.3	Very low	33.1	Very low	128 Å²	128	117.1 Å²	117.1	68%	0.684	67%	0.671	S	S	*	*	S	Bend	trans	-91	-7.2	-170.2	-83.5	-15.9	0	0	0	116
140	N	31.3	Very low	34	Very low	124 Å²	124	118.3 Å²	118.3	66%	0.663	66%	0.662	S	S	*	*	S	Bend	trans	-92.3	-19.9	-178.6	-79	-18.7	0	0	0	114.1	K144	N140-K144 PolarHBondContact O-N 2.88Å
141	S	32.8	Very low	34.4	Very low	93 Å²	93	115.7 Å²	115.7	65%	0.65	65%	0.646	S	S	*	*	H	α-helix	trans	-81.3	-29	-177.9	-62.8	0	0	0	0	113.6
142	L	35.6	Very low	35.2	Very low	130 Å²	130	111.1 Å²	111.1	68%	0.681	63%	0.627	S	S	*	*	H	α-helix	trans	-80	-27.4	178.8	-74.7	158.1	0	0	0	113.2	S145	L142-S145 PolarHBondContact O-OG 2.84Å
143	K	33.5	Very low	35.8	Very low	164 Å²	164	107.2 Å²	107.2	71%	0.713	60%	0.601	S	S	*	*	H	α-helix	trans	-80.7	-28.5	175.7	-70.3	-175.8	179.4	179.2	0	112.8	A147	K143-A147 PolarHBondContact O-N 2.84Å
144	K	31.5	Very low	36.5	Very low	150 Å²	150	104.8 Å²	104.8	65%	0.652	59%	0.587	S	S	*	*	H	α-helix	trans	-66.1	-41.2	176.1	-102.8	-177.6	171.9	-175.5	0	112.7	N140 S146 A147 E148	N140-K144 PolarHBondContact O-N 2.88Å; K144-S146 PolarHBondContact O-N 2.81Å; K144-A147 PolarHBondContact O-N 2.68Å; K144-E148 PolarHBondContact O-N 3.32Å
145	S	43	Very low	37	Very low	57 Å²	57	105.4 Å²	105.4	40%	0.399	58%	0.584	S	S	.	*	H	α-helix	trans	-66.8	-38.5	180	71.2	0	0	0	0	112.6	L142 A147 L149	L142-S145 PolarHBondContact O-OG 2.84Å; S145-A147 PolarHBondContact O-N 3.23Å; S145-L149 WeakPolarHBondContact O-CB 3.46Å; S145-L149 VanDerWaalsContact O-CD1 3.29Å; S145-L149 WeakPolarHBondContact O-CD1 3.32Å; S145-L149 WeakPolarHBondContact O-CG 3.35Å; S145-L149 PolarHBondContact O-N 2.93Å
146	S	40	Very low	37.8	Very low	64 Å²	64	99 Å²	99	45%	0.448	56%	0.558	S	S	.	*	H	α-helix	trans	-65.6	-36.7	177.8	179	0	0	0	0	113.1	K144 K150	K144-S146 PolarHBondContact O-N 2.81Å; S146-K150 WeakPolarHBondContact O-CG 3.32Å; S146-K150 PolarHBondContact O-N 3.24Å
147	A	40.9	Very low	39.2	Very low	54 Å²	54	99.4 Å²	99.4	45%	0.446	55%	0.548	S	S	.	.	H	α-helix	trans	-73.2	-45.7	177.4	0	0	0	0	0	111.4	K143 K144 S145 L149 K150 T151	K143-A147 PolarHBondContact O-N 2.84Å; K144-A147 PolarHBondContact O-N 2.68Å; S145-A147 PolarHBondContact O-N 3.23Å; A147-L149 VanDerWaalsContact C-N 3.3Å; A147-L149 PolarHBondContact O-N 2.94Å; A147-K150 PolarHBondContact O-N 3.45Å; A147-T151 PolarHBondContact O-N 3.5Å; A147-T151 PolarHBondContact O-OG1 3.15Å
148	E	42	Very low	41	Very low	125 Å²	125	92.4 Å²	92.4	58%	0.584	51%	0.511	S	S	*	.	H	α-helix	trans	-63	-34.8	173.9	-79.5	174.5	163.7	0	0	112.2	K144 T151 I152	K144-E148 PolarHBondContact O-N 3.32Å; E148-T151 CarbonylContact O-C 3.44Å; E148-T151 WeakPolarHBondContact O-CA 3.34Å; E148-T151 WeakPolarHBondContact O-CB 3.48Å; E148-T151 PolarHBondContact O-N 2.99Å; E148-I152 VanDerWaalsContact O-CG1 3.26Å; E148-I152 WeakPolarHBondContact O-CG1 3.26Å; E148-I152 PolarHBondContact O-N 3.41Å
149	L	40.8	Very low	43.2	Very low	40 Å²	40	92.1 Å²	92.1	21%	0.209	50%	0.499	C	S	.	.	H	α-helix	trans	-69.8	-39.4	173.7	-79.2	162.5	0	0	0	112.6	S145 A147 T151 I152 L153 E211	S145-L149 WeakPolarHBondContact O-CB 3.46Å; S145-L149 VanDerWaalsContact O-CD1 3.29Å; S145-L149 WeakPolarHBondContact O-CD1 3.32Å; S145-L149 WeakPolarHBondContact O-CG 3.35Å; S145-L149 PolarHBondContact O-N 2.93Å; A147-L149 VanDerWaalsContact C-N 3.3Å; A147-L149 PolarHBondContact O-N 2.94Å; L149-T151 PolarHBondContact O-N 3.46Å; L149-I152 HydrophobicContact CD2-CD1 4.49Å; L149-I152 PolarHBondContact O-N 3.32Å; L149-L153 VanDerWaalsContact O-CB 3.31Å; L149-L153 WeakPolarHBondContact O-CB 3.34Å; L149-L153 WeakPolarHBondContact O-CG 3.48Å; L149-L153 PolarHBondContact O-N 2.9Å; L149-E211 WeakPolarHBondContact CD1-OE1 3.41Å; L149-E211 HydrophobicContact CD2-CG 3.97Å
150	K	41.6	Very low	45.5	Very low	143 Å²	143	87.8 Å²	87.8	62%	0.622	48%	0.481	S	S	*	.	H	α-helix	trans	-61.1	-36.9	168.4	-82	-178.4	178.8	-177.1	0	111.1	S146 A147 T154	S146-K150 WeakPolarHBondContact O-CG 3.32Å; S146-K150 PolarHBondContact O-N 3.24Å; A147-K150 PolarHBondContact O-N 3.45Å; K150-T154 WeakPolarHBondContact O-CB 3.39Å; K150-T154 WeakPolarHBondContact O-CG2 3.49Å; K150-T154 PolarHBondContact O-N 3.2Å; K150-T154 PolarHBondContact O-OG1 3.06Å
151	T	36.7	Very low	48.1	Very low	67 Å²	67	90.5 Å²	90.5	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-67.9	-37.2	174	-54	0	0	0	0	112.3	A147 E148 L149 T154 N155	A147-T151 PolarHBondContact O-N 3.5Å; A147-T151 PolarHBondContact O-OG1 3.15Å; E148-T151 CarbonylContact O-C 3.44Å; E148-T151 WeakPolarHBondContact O-CA 3.34Å; E148-T151 WeakPolarHBondContact O-CB 3.48Å; E148-T151 PolarHBondContact O-N 2.99Å; L149-T151 PolarHBondContact O-N 3.46Å; T151-T154 WeakPolarHBondContact CA-OG1 3.44Å; T151-T154 CarbonylContact O-C 3.32Å; T151-T154 PolarHBondContact O-N 2.97Å; T151-T154 PolarHBondContact O-OG1 3.39Å; T151-N155 WeakPolarHBondContact CG2-ND2 3.42Å; T151-N155 WeakPolarHBondContact O-CB 3.33Å; T151-N155 PolarHBondContact O-N 3.41Å; T151-N155 PolarHBondContact O-OD1 2.87Å
152	I	40.9	Very low	50.6	Low	94 Å²	94	87.8 Å²	87.8	48%	0.482	47%	0.468	S	S	.	.	H	α-helix	trans	-69	-42.8	173.5	-69.3	161.7	0	0	0	110.9	E148 L149 T154 N155 G156	E148-I152 VanDerWaalsContact O-CG1 3.26Å; E148-I152 WeakPolarHBondContact O-CG1 3.26Å; E148-I152 PolarHBondContact O-N 3.41Å; L149-I152 HydrophobicContact CD2-CD1 4.49Å; L149-I152 PolarHBondContact O-N 3.32Å; I152-T154 PolarHBondContact O-N 2.88Å; I152-N155 PolarHBondContact O-N 3.33Å; I152-G156 PolarHBondContact O-N 3.17Å
153	L	42.9	Very low	53.3	Low	60 Å²	60	82 Å²	82	31%	0.314	44%	0.438	S	S	.	.	H	α-helix	trans	-63.7	-24	172.4	-70.8	168.8	0	0	0	112.8	L149 M207 Y214	L149-L153 VanDerWaalsContact O-CB 3.31Å; L149-L153 WeakPolarHBondContact O-CB 3.34Å; L149-L153 WeakPolarHBondContact O-CG 3.48Å; L149-L153 PolarHBondContact O-N 2.9Å; L153-M207 HydrophobicContact CD1-CE 4.38Å; L153-M207 HydrophobicContact CD2-CE 3.76Å; L153-Y214 HydrophobicContact CD2-CD2 4.18Å; L153-Y214 HydrophobicContact CD2-CE2 3.3Å
154	T	43.1	Very low	56.2	Low	82 Å²	82	79.7 Å²	79.7	50%	0.503	43%	0.429	S	S	.	.	H	α-helix	trans	-99	-15.8	176.4	44.6	0	0	0	0	114.1	K150 T151 I152 Q157	K150-T154 WeakPolarHBondContact O-CB 3.39Å; K150-T154 WeakPolarHBondContact O-CG2 3.49Å; K150-T154 PolarHBondContact O-N 3.2Å; K150-T154 PolarHBondContact O-OG1 3.06Å; T151-T154 WeakPolarHBondContact CA-OG1 3.44Å; T151-T154 CarbonylContact O-C 3.32Å; T151-T154 PolarHBondContact O-N 2.97Å; T151-T154 PolarHBondContact O-OG1 3.39Å; I152-T154 PolarHBondContact O-N 2.88Å; T154-Q157 WeakPolarHBondContact O-CG 3.31Å; T154-Q157 PolarHBondContact O-NE2 3.35Å
155	N	40.4	Very low	59.1	Low	124 Å²	124	77.3 Å²	77.3	66%	0.663	42%	0.417	S	S	*	.	H	α-helix	trans	-95.5	-12	-179.2	-76.6	-3.5	0	0	0	114	T151 I152 Q157	T151-N155 WeakPolarHBondContact CG2-ND2 3.42Å; T151-N155 WeakPolarHBondContact O-CB 3.33Å; T151-N155 PolarHBondContact O-N 3.41Å; T151-N155 PolarHBondContact O-OD1 2.87Å; I152-N155 PolarHBondContact O-N 3.33Å; N155-Q157 VanDerWaalsContact C-N 3.35Å; N155-Q157 PolarHBondContact O-N 2.99Å
156	G	48.8	Very low	61.6	Low	35 Å²	35	79.1 Å²	79.1	36%	0.361	42%	0.419	S	S	.	.	S	Bend	trans	-92.4	36	175.5	0	0	0	0	0	114.6	I152 I158	I152-G156 PolarHBondContact O-N 3.17Å; G156-I158 PolarHBondContact O-N 3.42Å
157	Q	62.4	Low	64.1	Low	116 Å²	116	81.2 Å²	81.2	54%	0.542	42%	0.422	S	S	.	.			trans	-52.8	88.3	-166.1	-62.4	-169.7	-0.6	0	0	114.3	T154 N155 H182	T154-Q157 WeakPolarHBondContact O-CG 3.31Å; T154-Q157 PolarHBondContact O-NE2 3.35Å; N155-Q157 VanDerWaalsContact C-N 3.35Å; N155-Q157 PolarHBondContact O-N 2.99Å; Q157-H182 PolarHBondContact O-CE1 2.97Å
158	I	71.2	Confident	66.7	Low	13 Å²	13	83.9 Å²	83.9	7%	0.067	43%	0.425	C	S	.	.			trans	-100.4	98.5	149.5	-61.7	166.8	0	0	0	104.8	G156 L163 L189 F225 F228 C237	G156-I158 PolarHBondContact O-N 3.42Å; I158-L163 HydrophobicContact CG2-CD1 3.73Å; I158-L163 HydrophobicContact CG2-CD2 3.65Å; I158-L163 HydrophobicContact CG2-CG 3.72Å; I158-L189 HydrophobicContact CD1-CD1 3.63Å; I158-L189 HydrophobicContact CG1-CD1 4.42Å; I158-L189 HydrophobicContact CG2-CD1 4.25Å; I158-F225 HydrophobicContact CD1-CB 3.48Å; I158-F225 VanDerWaalsContact CD1-CB 3.48Å; I158-F225 HydrophobicContact CD1-CD2 4.42Å; I158-F225 HydrophobicContact CD1-CG 4.23Å; I158-F228 HydrophobicContact CG2-CE1 4.47Å; I158-F228 WeakPolarHBondContact O-CD1 3.27Å; I158-C237 HydrophobicContact CD1-CB 4.19Å
159	N	76.4	Confident	69	Low	72 Å²	72	81.6 Å²	81.6	39%	0.385	42%	0.416	S	S	.	.			trans	-89.2	156.5	172	-55.1	-59.3	0	0	0	109.7	Q161 D162	N159-Q161 PolarHBondContact O-N 3.46Å; N159-Q161 VanDerWaalsContact O-N 3.13Å; N159-D162 WeakPolarHBondContact CB-OD2 3.49Å; N159-D162 PolarHBondContact ND2-OD2 2.96Å; N159-D162 PolarHBondContact O-N 3.48Å; N159-D162 VanDerWaalsContact O-N 3.07Å
160	A	80.3	Confident	71	Confident	37 Å²	37	81.1 Å²	81.1	31%	0.306	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-55	-32.9	176.6	0	0	0	0	0	113.3	D162 L163 F228 V230	A160-D162 VanDerWaalsContact C-N 3.32Å; A160-D162 PolarHBondContact O-N 3.48Å; A160-L163 PolarHBondContact O-N 3.37Å; A160-F228 HydrophobicContact CB-CD2 4.13Å; A160-F228 HydrophobicContact CB-CE2 3.57Å; A160-F228 HydrophobicContact CB-CZ 4.01Å; A160-V230 HydrophobicContact CB-CG2 3.82Å
161	Q	84.1	Confident	72.9	Confident	180 Å²	180	81 Å²	81	84%	0.841	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-72.8	-24.3	-178	-63	175.5	12.1	0	0	113.1	N159 L163	N159-Q161 PolarHBondContact O-N 3.46Å; N159-Q161 VanDerWaalsContact O-N 3.13Å; Q161-L163 VanDerWaalsContact C-N 3.3Å
162	D	86.8	Confident	74.5	Confident	36 Å²	36	79.5 Å²	79.5	19%	0.193	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-89.8	0.2	-177.8	-57.9	-53.1	0	0	0	112.3	N159 A160 H182 V183 L184	N159-D162 WeakPolarHBondContact CB-OD2 3.49Å; N159-D162 PolarHBondContact ND2-OD2 2.96Å; N159-D162 PolarHBondContact O-N 3.48Å; N159-D162 VanDerWaalsContact O-N 3.07Å; A160-D162 VanDerWaalsContact C-N 3.32Å; A160-D162 PolarHBondContact O-N 3.48Å; D162-H182 PolarHBondContact O-CD2 2.87Å; D162-V183 PolarHBondContact O-N 3.42Å; D162-L184 HydrophobicContact CB-CD1 4.28Å; D162-L184 HydrophobicContact CB-CG 4.33Å
163	L	91.3	Very high	75.5	Confident	10 Å²	10	79.7 Å²	79.7	5%	0.052	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	118.7	-177.5	-71.7	173.2	0	0	0	111.5	I158 A160 Q161 Y165 A180 H182 L189 V191 F228	I158-L163 HydrophobicContact CG2-CD1 3.73Å; I158-L163 HydrophobicContact CG2-CD2 3.65Å; I158-L163 HydrophobicContact CG2-CG 3.72Å; A160-L163 PolarHBondContact O-N 3.37Å; Q161-L163 VanDerWaalsContact C-N 3.3Å; L163-Y165 HydrophobicContact CB-CE2 4.25Å; L163-A180 HydrophobicContact CD2-CB 4.11Å; L163-H182 HydrophobicContact CD2-CB 3.91Å; L163-L189 HydrophobicContact CD2-CD1 3.86Å; L163-V191 HydrophobicContact CD1-CG2 4.29Å; L163-F228 HydrophobicContact CD1-CE1 3.65Å; L163-F228 HydrophobicContact CD1-CZ 3.59Å
164	H	94.3	Very high	76.7	Confident	115 Å²	115	77.8 Å²	77.8	53%	0.532	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	102.3	169.2	-68.7	-168.9	0	0	0	108.9	A180 Y181	H164-A180 CarbonylContact O-C 3.52Å; H164-A180 WeakPolarHBondContact O-CA 3.45Å; H164-Y181 PolarHBondContact N-O 3.49Å; H164-Y181 PolarHBondContact O-N 2.83Å
165	Y	93.9	Very high	78.5	Confident	99 Å²	99	74.2 Å²	74.2	39%	0.388	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	138.3	176.1	-69.9	-91.3	0	0	0	110.9	L163 Y178 A180 V191 V193	L163-Y165 HydrophobicContact CB-CE2 4.25Å; Y165-Y178 HydrophobicContact CD1-CD2 4.24Å; Y165-Y178 AromaticContact CD1-CG 3.93Å; Y165-Y178 HydrophobicContact CD1-CG 3.93Å; Y165-Y178 HydrophobicContact CE1-CD2 4.28Å; Y165-Y178 HydrophobicContact CE1-CG 4.39Å; Y165-A180 HydrophobicContact CD1-CB 4.44Å; Y165-V191 HydrophobicContact CE1-CB 4.12Å; Y165-V191 HydrophobicContact CE1-CG1 3.98Å; Y165-V193 HydrophobicContact CE1-CG2 4.41Å
166	Q	94.6	Very high	80.8	Confident	96 Å²	96	69.4 Å²	69.4	45%	0.449	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	-138.8	178	-57.7	-174.6	-38.7	0	0	108.8	K179	Q166-K179 WeakPolarHBondContact CA-O 3.41Å; Q166-K179 HydrophobicContact CB-CB 4.26Å; Q166-K179 HydrophobicContact CB-CG 4.49Å; Q166-K179 WeakPolarHBondContact CB-O 3.44Å; Q166-K179 PolarHBondContact N-O 3.36Å; Q166-K179 VanDerWaalsContact OE1-CD 3.24Å; Q166-K179 VanDerWaalsContact OE1-CE 3.31Å
167	E	93.1	Very high	82.8	Confident	108 Å²	108	69.6 Å²	69.6	51%	0.505	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	147.6	178.5	66.3	-158.1	158.6	0	0	113.2	L169 K179	E167-L169 HydrophobicContact CG-CD2 4.26Å; E167-K179 HydrophobicContact CG-CB 4.05Å; E167-K179 HydrophobicContact CG-CD 3.99Å; E167-K179 PolarHBondContact O-N 3.14Å; E167-K179 WeakPolarHBondContact OE1-CD 3.42Å; E167-K179 IonicContact OE1-NZ 2.86Å; E167-K179 PolarHBondContact OE1-NZ 2.73Å
168	Q	94.7	Very high	84.4	Confident	110 Å²	110	67.4 Å²	67.4	51%	0.514	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.6	167.7	-179.3	179.2	-36.1	0	0	109.1	T176 Y178	Q168-T176 HydrophobicContact CG-CG2 3.62Å; Q168-Y178 HydrophobicContact CB-CD1 4.1Å; Q168-Y178 HydrophobicContact CB-CE1 4.06Å; Q168-Y178 HydrophobicContact CG-CE1 4.33Å
169	L	89.9	Confident	85.6	Confident	76 Å²	76	68.9 Å²	68.9	40%	0.398	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-32.9	-179.8	-63	173.8	0	0	0	112.2	E167 V177 K179 A190 F240	E167-L169 HydrophobicContact CG-CD2 4.26Å; L169-V177 HydrophobicContact CB-CB 4.41Å; L169-V177 HydrophobicContact CB-CG1 4.26Å; L169-V177 HydrophobicContact CD1-CG1 4.16Å; L169-V177 PolarHBondContact N-O 2.98Å; L169-K179 HydrophobicContact CD1-CB 3.97Å; L169-K179 HydrophobicContact CD2-CB 4.05Å; L169-K179 HydrophobicContact CG-CB 3.98Å; L169-A190 HydrophobicContact CD1-CB 4.34Å; L169-F240 HydrophobicContact CD1-CD2 3.88Å; L169-F240 HydrophobicContact CD1-CE2 3.58Å; L169-F240 HydrophobicContact CD2-CE2 3.82Å; L169-F240 HydrophobicContact CD2-CZ 4.39Å; L169-F240 HydrophobicContact CG-CE2 4.36Å
170	G	84.6	Confident	86.5	Confident	30 Å²	30	65.4 Å²	65.4	31%	0.309	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	162.7	-179	0	0	0	0	0	112.8	T176 V177	G170-T176 WeakPolarHBondContact O-CG2 3.47Å; G170-V177 PolarHBondContact N-O 2.9Å; G170-V177 PolarHBondContact O-N 3.28Å
171	H	81.4	Confident	87.2	Confident	141 Å²	141	67.4 Å²	67.4	65%	0.653	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	139.2	175.8	173.6	78.2	0	0	0	109.8	T176	H171-T176 HydrophobicContact CB-CG2 4.47Å; H171-T176 PolarHBondContact ND1-OG1 3.17Å
172	G	69.3	Low	87.7	Confident	35 Å²	35	59.2 Å²	59.2	36%	0.361	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	-170.2	173.3	0	0	0	0	0	111.4	G174 G175	G172-G174 PolarHBondContact O-N 3.04Å; G172-G174 VanDerWaalsContact O-N 3.08Å; G172-G175 PolarHBondContact N-O 3.44Å; G172-G175 PolarHBondContact O-N 3.46Å
173	N	61.9	Low	87.8	Confident	98 Å²	98	60.3 Å²	60.3	52%	0.524	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-33.5	-177.5	-64.5	-0.2	0	0	0	112.2	G175 I309 T312	N173-G175 PolarHBondContact O-N 3.12Å; N173-I309 HydrophobicContact CB-CG2 4.42Å; N173-I309 VanDerWaalsContact O-CG2 3.31Å; N173-I309 WeakPolarHBondContact O-CG2 3.38Å; N173-T312 PolarHBondContact ND2-OG1 3.26Å
174	G	68.3	Low	87.6	Confident	20 Å²	20	65.2 Å²	65.2	21%	0.206	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	17.7	178.4	0	0	0	0	0	116	G172 K192 I194	G172-G174 PolarHBondContact O-N 3.04Å; G172-G174 VanDerWaalsContact O-N 3.08Å; G174-K192 WeakPolarHBondContact O-CE 3.45Å; G174-I194 WeakPolarHBondContact O-CD1 3.34Å; G174-I194 VanDerWaalsContact O-CG1 3.29Å; G174-I194 WeakPolarHBondContact O-CG1 3.5Å
175	G	80.5	Confident	87.3	Confident	8 Å²	8	62.1 Å²	62.1	8%	0.082	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	103.4	-168.8	178.2	0	0	0	0	0	114.4	G172 N173 V193	G172-G175 PolarHBondContact N-O 3.44Å; G172-G175 PolarHBondContact O-N 3.46Å; N173-G175 PolarHBondContact O-N 3.12Å; G175-V193 CarbonylContact C-O 3.59Å; G175-V193 VanDerWaalsContact CA-O 3.29Å; G175-V193 WeakPolarHBondContact CA-O 3.39Å
176	T	88.9	Confident	87.1	Confident	22 Å²	22	65.1 Å²	65.1	14%	0.135	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.8	-177.7	-54.7	0	0	0	0	110.2	Q168 G170 H171 Y178 V193	Q168-T176 HydrophobicContact CG-CG2 3.62Å; G170-T176 WeakPolarHBondContact O-CG2 3.47Å; H171-T176 HydrophobicContact CB-CG2 4.47Å; H171-T176 PolarHBondContact ND1-OG1 3.17Å; T176-Y178 HydrophobicContact CG2-CD2 4.15Å; T176-Y178 HydrophobicContact CG2-CE1 4.05Å; T176-Y178 HydrophobicContact CG2-CE2 3.48Å; T176-Y178 VanDerWaalsContact CG2-CE2 3.48Å; T176-Y178 VanDerWaalsContact CG2-CZ 3.43Å; T176-V193 PolarHBondContact N-O 2.91Å; T176-V193 PolarHBondContact O-N 3.23Å
177	V	92.3	Very high	86.9	Confident	40 Å²	40	67.2 Å²	67.2	24%	0.242	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.4	177.1	-171.6	0	0	0	0	109.2	L169 G170 A190 V191 K192	L169-V177 HydrophobicContact CB-CB 4.41Å; L169-V177 HydrophobicContact CB-CG1 4.26Å; L169-V177 HydrophobicContact CD1-CG1 4.16Å; L169-V177 PolarHBondContact N-O 2.98Å; G170-V177 PolarHBondContact N-O 2.9Å; G170-V177 PolarHBondContact O-N 3.28Å; V177-A190 HydrophobicContact CG1-CB 4.28Å; V177-V191 WeakPolarHBondContact CA-O 3.37Å; V177-K192 HydrophobicContact CG2-CB 4.12Å; V177-K192 HydrophobicContact CG2-CD 4.32Å; V177-K192 HydrophobicContact CG2-CG 3.99Å
178	Y	95.1	Very high	87	Confident	70 Å²	70	64.8 Å²	64.8	28%	0.275	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	147.7	176.3	-62.2	-87.3	0	0	0	110.8	Y165 Q168 T176 A190 V191 V193	Y165-Y178 HydrophobicContact CD1-CD2 4.24Å; Y165-Y178 AromaticContact CD1-CG 3.93Å; Y165-Y178 HydrophobicContact CD1-CG 3.93Å; Y165-Y178 HydrophobicContact CE1-CD2 4.28Å; Y165-Y178 HydrophobicContact CE1-CG 4.39Å; Q168-Y178 HydrophobicContact CB-CD1 4.1Å; Q168-Y178 HydrophobicContact CB-CE1 4.06Å; Q168-Y178 HydrophobicContact CG-CE1 4.33Å; T176-Y178 HydrophobicContact CG2-CD2 4.15Å; T176-Y178 HydrophobicContact CG2-CE1 4.05Å; T176-Y178 HydrophobicContact CG2-CE2 3.48Å; T176-Y178 VanDerWaalsContact CG2-CE2 3.48Å; T176-Y178 VanDerWaalsContact CG2-CZ 3.43Å; Y178-A190 CarbonylContact O-C 3.57Å; Y178-A190 WeakPolarHBondContact O-CA 3.06Å; Y178-V191 PolarHBondContact N-O 3.28Å; Y178-V191 PolarHBondContact O-N 3.01Å; Y178-V193 HydrophobicContact CD2-CG2 3.93Å; Y178-V193 HydrophobicContact CE2-CB 4.36Å; Y178-V193 HydrophobicContact CE2-CG2 4.08Å
179	K	96.4	Very high	87	Confident	43 Å²	43	59.6 Å²	59.6	19%	0.187	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	135.7	160.1	-170.6	-178.2	-177.3	-176.7	0	107.9	Q166 E167 L169 V188 L189 F240	Q166-K179 WeakPolarHBondContact CA-O 3.41Å; Q166-K179 HydrophobicContact CB-CB 4.26Å; Q166-K179 HydrophobicContact CB-CG 4.49Å; Q166-K179 WeakPolarHBondContact CB-O 3.44Å; Q166-K179 PolarHBondContact N-O 3.36Å; Q166-K179 VanDerWaalsContact OE1-CD 3.24Å; Q166-K179 VanDerWaalsContact OE1-CE 3.31Å; E167-K179 HydrophobicContact CG-CB 4.05Å; E167-K179 HydrophobicContact CG-CD 3.99Å; E167-K179 PolarHBondContact O-N 3.14Å; E167-K179 WeakPolarHBondContact OE1-CD 3.42Å; E167-K179 IonicContact OE1-NZ 2.86Å; E167-K179 PolarHBondContact OE1-NZ 2.73Å; L169-K179 HydrophobicContact CD1-CB 3.97Å; L169-K179 HydrophobicContact CD2-CB 4.05Å; L169-K179 HydrophobicContact CG-CB 3.98Å; K179-V188 HydrophobicContact CD-CG1 4.27Å; K179-V188 HydrophobicContact CG-CG1 3.68Å; K179-L189 WeakPolarHBondContact CA-O 3.11Å; K179-F240 HydrophobicContact CD-CE1 4.48Å; K179-F240 HydrophobicContact CD-CE2 4.34Å; K179-F240 HydrophobicContact CD-CZ 4.11Å; K179-F240 HydrophobicContact CG-CD2 4.37Å; K179-F240 HydrophobicContact CG-CE2 4.22Å; K179-F240 HydrophobicContact CG-CZ 4.43Å
180	A	95.8	Very high	87.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.6	176.5	0	0	0	0	0	110.7	L163 H164 Y165 V188 L189 V191	L163-A180 HydrophobicContact CD2-CB 4.11Å; H164-A180 CarbonylContact O-C 3.52Å; H164-A180 WeakPolarHBondContact O-CA 3.45Å; Y165-A180 HydrophobicContact CD1-CB 4.44Å; A180-V188 CarbonylContact O-C 3.37Å; A180-V188 WeakPolarHBondContact O-CA 3.39Å; A180-L189 PolarHBondContact N-O 3.28Å; A180-L189 PolarHBondContact O-N 2.99Å; A180-V191 HydrophobicContact CB-CG2 3.63Å
181	Y	95.4	Very high	87.7	Confident	79 Å²	79	55.2 Å²	55.2	31%	0.31	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	119.7	170.7	-175.9	-102.2	0	0	0	109.5	H164 V183 K186 V188	H164-Y181 PolarHBondContact N-O 3.49Å; H164-Y181 PolarHBondContact O-N 2.83Å; Y181-V183 HydrophobicContact CD1-CG2 4.3Å; Y181-K186 WeakPolarHBondContact OH-CA 3.44Å; Y181-K186 WeakPolarHBondContact OH-CB 3.3Å; Y181-V188 HydrophobicContact CD2-CG2 4.13Å
182	H	93.1	Very high	88.2	Confident	7 Å²	7	50.1 Å²	50.1	3%	0.032	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	109.8	174.9	-178.2	-132.5	0	0	0	110	Q157 D162 L163 L184 S185 K186 R187 L189	Q157-H182 PolarHBondContact O-CE1 2.97Å; D162-H182 PolarHBondContact O-CD2 2.87Å; L163-H182 HydrophobicContact CD2-CB 3.91Å; H182-L184 PolarHBondContact O-N 3.16Å; H182-S185 VanDerWaalsContact ND1-CB 3.34Å; H182-S185 WeakPolarHBondContact ND1-CB 3.32Å; H182-S185 PolarHBondContact ND1-OG 3.45Å; H182-K186 WeakPolarHBondContact O-CA 3.49Å; H182-K186 PolarHBondContact O-N 3.33Å; H182-R187 PolarHBondContact N-O 3.08Å; H182-R187 PolarHBondContact O-N 3.47Å; H182-L189 HydrophobicContact CB-CD1 3.72Å; H182-L189 HydrophobicContact CB-CG 4.17Å
183	V	89.8	Confident	89.1	Confident	60 Å²	60	49.3 Å²	49.3	36%	0.364	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-46.1	-167.8	178.4	0	0	0	0	112.1	D162 Y181 K186	D162-V183 PolarHBondContact O-N 3.42Å; Y181-V183 HydrophobicContact CD1-CG2 4.3Å; V183-K186 PolarHBondContact O-N 3.03Å
184	L	87.7	Confident	90.3	Very high	113 Å²	113	44.8 Å²	44.8	59%	0.592	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-45.8	-175.1	-61.7	178.5	0	0	0	112.2	D162 H182 K186	D162-L184 HydrophobicContact CB-CD1 4.28Å; D162-L184 HydrophobicContact CB-CG 4.33Å; H182-L184 PolarHBondContact O-N 3.16Å; L184-K186 VanDerWaalsContact C-N 3.35Å
185	S	86.2	Confident	90.9	Very high	49 Å²	49	48.3 Å²	48.3	34%	0.343	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-11.9	-179.6	72.5	0	0	0	0	114.1	H182 R187	H182-S185 VanDerWaalsContact ND1-CB 3.34Å; H182-S185 WeakPolarHBondContact ND1-CB 3.32Å; H182-S185 PolarHBondContact ND1-OG 3.45Å; S185-R187 VanDerWaalsContact C-N 3.31Å; S185-R187 PolarHBondContact O-N 3.42Å; S185-R187 WeakPolarHBondContact OG-CB 3.48Å
186	K	90.4	Very high	90.7	Very high	163 Å²	163	48.6 Å²	48.6	71%	0.709	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	42.8	-171.5	-56.1	-179.1	-179.5	178.3	0	113.1	Y181 H182 V183 L184	Y181-K186 WeakPolarHBondContact OH-CA 3.44Å; Y181-K186 WeakPolarHBondContact OH-CB 3.3Å; H182-K186 WeakPolarHBondContact O-CA 3.49Å; H182-K186 PolarHBondContact O-N 3.33Å; V183-K186 PolarHBondContact O-N 3.03Å; L184-K186 VanDerWaalsContact C-N 3.35Å
187	R	90.5	Very high	90	Very high	139 Å²	139	54.2 Å²	54.2	53%	0.525	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.6	-176.9	-66.3	177.2	-179.1	-165.8	-1.4	111.4	H182 S185 L189	H182-R187 PolarHBondContact N-O 3.08Å; H182-R187 PolarHBondContact O-N 3.47Å; S185-R187 VanDerWaalsContact C-N 3.31Å; S185-R187 PolarHBondContact O-N 3.42Å; S185-R187 WeakPolarHBondContact OG-CB 3.48Å; R187-L189 HydrophobicContact CB-CD2 4.17Å
188	V	94.9	Very high	88.9	Confident	58 Å²	58	53.7 Å²	53.7	35%	0.352	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	132	167.6	-175.6	0	0	0	0	108.5	K179 A180 Y181 F240	K179-V188 HydrophobicContact CD-CG1 4.27Å; K179-V188 HydrophobicContact CG-CG1 3.68Å; A180-V188 CarbonylContact O-C 3.37Å; A180-V188 WeakPolarHBondContact O-CA 3.39Å; Y181-V188 HydrophobicContact CD2-CG2 4.13Å; V188-F240 HydrophobicContact CB-CB 4.42Å; V188-F240 HydrophobicContact CB-CD1 4.43Å; V188-F240 HydrophobicContact CG1-CB 3.95Å; V188-F240 HydrophobicContact CG1-CD1 3.7Å; V188-F240 HydrophobicContact CG1-CE1 4.38Å; V188-F240 HydrophobicContact CG1-CG 3.83Å
189	L	95.3	Very high	88.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	157.8	-175.4	-54.2	-173.8	0	0	0	110.7	I158 L163 K179 A180 H182 R187 V191 F225 C237 T238	I158-L189 HydrophobicContact CD1-CD1 3.63Å; I158-L189 HydrophobicContact CG1-CD1 4.42Å; I158-L189 HydrophobicContact CG2-CD1 4.25Å; L163-L189 HydrophobicContact CD2-CD1 3.86Å; K179-L189 WeakPolarHBondContact CA-O 3.11Å; A180-L189 PolarHBondContact N-O 3.28Å; A180-L189 PolarHBondContact O-N 2.99Å; H182-L189 HydrophobicContact CB-CD1 3.72Å; H182-L189 HydrophobicContact CB-CG 4.17Å; R187-L189 HydrophobicContact CB-CD2 4.17Å; L189-V191 HydrophobicContact CB-CG2 4.37Å; L189-F225 HydrophobicContact CD2-CD2 3.46Å; L189-F225 VanDerWaalsContact CD2-CD2 3.46Å; L189-F225 HydrophobicContact CD2-CE2 3.35Å; L189-C237 HydrophobicContact CD1-CB 4.39Å; L189-T238 WeakPolarHBondContact CA-O 3.42Å
190	A	95.6	Very high	87.2	Confident	13 Å²	13	55.6 Å²	55.6	11%	0.107	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.6	159.5	0	0	0	0	0	108.5	L169 V177 Y178 C237 T238 F240	L169-A190 HydrophobicContact CD1-CB 4.34Å; V177-A190 HydrophobicContact CG1-CB 4.28Å; Y178-A190 CarbonylContact O-C 3.57Å; Y178-A190 WeakPolarHBondContact O-CA 3.06Å; A190-C237 WeakPolarHBondContact O-CA 3.47Å; A190-T238 PolarHBondContact N-O 3.48Å; A190-T238 PolarHBondContact O-N 2.97Å; A190-F240 HydrophobicContact CB-CD2 4.49Å
191	V	93.9	Very high	86.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	107.6	-178.8	-173.6	0	0	0	0	108.8	L163 Y165 V177 Y178 A180 L189 V193 I236	L163-V191 HydrophobicContact CD1-CG2 4.29Å; Y165-V191 HydrophobicContact CE1-CB 4.12Å; Y165-V191 HydrophobicContact CE1-CG1 3.98Å; V177-V191 WeakPolarHBondContact CA-O 3.37Å; Y178-V191 PolarHBondContact N-O 3.28Å; Y178-V191 PolarHBondContact O-N 3.01Å; A180-V191 HydrophobicContact CB-CG2 3.63Å; L189-V191 HydrophobicContact CB-CG2 4.37Å; V191-V193 HydrophobicContact CG1-CG2 4.14Å; V191-I236 CarbonylContact C-O 3.57Å; V191-I236 WeakPolarHBondContact CA-O 3.49Å
192	K	91	Very high	85.5	Confident	34 Å²	34	58.8 Å²	58.8	15%	0.148	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	115	175.6	-175.6	170.7	-177.3	176.4	0	109.3	G174 V177 I194 S235 I236 D298	G174-K192 WeakPolarHBondContact O-CE 3.45Å; V177-K192 HydrophobicContact CG2-CB 4.12Å; V177-K192 HydrophobicContact CG2-CD 4.32Å; V177-K192 HydrophobicContact CG2-CG 3.99Å; K192-I194 HydrophobicContact CD-CD1 4.36Å; K192-I194 HydrophobicContact CG-CD1 4.25Å; K192-I194 HydrophobicContact CG-CG1 4.06Å; K192-S235 CarbonylContact O-C 3.58Å; K192-S235 WeakPolarHBondContact O-CA 3.14Å; K192-I236 HydrophobicContact CB-CB 4.43Å; K192-I236 PolarHBondContact N-O 3.28Å; K192-I236 PolarHBondContact O-N 3.43Å; K192-D298 IonicContact NZ-OD1 3.56Å; K192-D298 PolarHBondContact NZ-OD1 3.09Å; K192-D298 IonicContact NZ-OD2 3.13Å; K192-D298 PolarHBondContact NZ-OD2 3.5Å
193	V	89.4	Confident	84.7	Confident	19 Å²	19	61.9 Å²	61.9	12%	0.115	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.3	-178.8	-176.1	0	0	0	0	108.9	Y165 G175 T176 Y178 V191 R233 I234	Y165-V193 HydrophobicContact CE1-CG2 4.41Å; G175-V193 CarbonylContact C-O 3.59Å; G175-V193 VanDerWaalsContact CA-O 3.29Å; G175-V193 WeakPolarHBondContact CA-O 3.39Å; T176-V193 PolarHBondContact N-O 2.91Å; T176-V193 PolarHBondContact O-N 3.23Å; Y178-V193 HydrophobicContact CD2-CG2 3.93Å; Y178-V193 HydrophobicContact CE2-CB 4.36Å; Y178-V193 HydrophobicContact CE2-CG2 4.08Å; V191-V193 HydrophobicContact CG1-CG2 4.14Å; V193-R233 HydrophobicContact CG1-CB 4.07Å; V193-R233 HydrophobicContact CG1-CG 4.43Å; V193-I234 WeakPolarHBondContact CA-O 3.4Å
194	I	85.8	Confident	84.1	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.6	-175.9	-43.6	-175.8	0	0	0	108.5	G174 K192 L196 R233 I234 I236 L305 I309	G174-I194 WeakPolarHBondContact O-CD1 3.34Å; G174-I194 VanDerWaalsContact O-CG1 3.29Å; G174-I194 WeakPolarHBondContact O-CG1 3.5Å; K192-I194 HydrophobicContact CD-CD1 4.36Å; K192-I194 HydrophobicContact CG-CD1 4.25Å; K192-I194 HydrophobicContact CG-CG1 4.06Å; I194-L196 HydrophobicContact CG2-CD2 4.27Å; I194-L196 HydrophobicContact CG2-CG 4.15Å; I194-R233 CarbonylContact O-C 3.55Å; I194-R233 VanDerWaalsContact O-CA 3.27Å; I194-R233 WeakPolarHBondContact O-CA 3.44Å; I194-I234 HydrophobicContact CB-CG2 3.71Å; I194-I234 HydrophobicContact CD1-CG2 4.35Å; I194-I234 HydrophobicContact CG1-CG2 4.17Å; I194-I234 PolarHBondContact N-O 3.38Å; I194-I234 PolarHBondContact O-N 3.47Å; I194-I236 HydrophobicContact CD1-CD1 4.24Å; I194-L305 HydrophobicContact CD1-CD1 3.97Å; I194-L305 HydrophobicContact CD1-CD2 3.72Å; I194-L305 HydrophobicContact CD1-CG 4.18Å; I194-L305 HydrophobicContact CG2-CD1 4.15Å; I194-I309 HydrophobicContact CD1-CD1 4.14Å; I194-I309 HydrophobicContact CG2-CD1 3.79Å; I194-I309 HydrophobicContact CG2-CG1 3.87Å
195	P	82	Confident	83.5	Confident	93 Å²	93	64.7 Å²	64.7	60%	0.604	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.6	173	29.9	-32.2	0	0	0	110.4	R233	P195-R233 HydrophobicContact CB-CG 4.43Å
196	L	75.8	Confident	83.2	Confident	14 Å²	14	62.4 Å²	62.4	7%	0.073	31%	0.312	C	S	.	.			trans	-146.4	135.5	-176.5	-68.3	172.1	0	0	0	109.1	I194 I198 I206 N232 I234 L305 S308	I194-L196 HydrophobicContact CG2-CD2 4.27Å; I194-L196 HydrophobicContact CG2-CG 4.15Å; L196-I198 HydrophobicContact CB-CD1 3.78Å; L196-I198 HydrophobicContact CB-CG1 3.49Å; L196-I198 VanDerWaalsContact CB-CG1 3.49Å; L196-I198 HydrophobicContact CD1-CG1 4.42Å; L196-I198 WeakPolarHBondContact O-CG1 3.22Å; L196-I198 PolarHBondContact O-N 3.27Å; L196-I198 VanDerWaalsContact O-N 3.09Å; L196-I206 HydrophobicContact CD1-CD1 4.01Å; L196-N232 CarbonylContact C-O 3.55Å; L196-N232 PolarHBondContact N-O 3.1Å; L196-N232 CarbonylContact O-C 3.56Å; L196-N232 WeakPolarHBondContact O-CB 3.34Å; L196-I234 HydrophobicContact CD1-CB 4.22Å; L196-I234 HydrophobicContact CD1-CG2 3.44Å; L196-I234 VanDerWaalsContact CD1-CG2 3.44Å; L196-I234 HydrophobicContact CG-CG2 4.4Å; L196-L305 HydrophobicContact CD1-CD1 3.51Å; L196-L305 HydrophobicContact CD2-CD1 4.04Å; L196-L305 HydrophobicContact CG-CD1 4.26Å; L196-S308 WeakPolarHBondContact CD2-OG 3.48Å
197	D	74.5	Confident	82.5	Confident	140 Å²	140	56.7 Å²	56.7	75%	0.749	29%	0.289	S	S	*	.			trans	-76.9	98.7	167.2	-160.1	3.9	0	0	0	108.3
198	I	68.7	Low	81.7	Confident	29 Å²	29	53.7 Å²	53.7	15%	0.149	29%	0.289	C	S	.	.			trans	-98.7	117	-163.6	-68.3	153.3	0	0	0	110.2	L196 Q203 F229	L196-I198 HydrophobicContact CB-CD1 3.78Å; L196-I198 HydrophobicContact CB-CG1 3.49Å; L196-I198 VanDerWaalsContact CB-CG1 3.49Å; L196-I198 HydrophobicContact CD1-CG1 4.42Å; L196-I198 WeakPolarHBondContact O-CG1 3.22Å; L196-I198 PolarHBondContact O-N 3.27Å; L196-I198 VanDerWaalsContact O-N 3.09Å; I198-Q203 HydrophobicContact CG2-CB 3.86Å; I198-Q203 HydrophobicContact CG2-CG 4.38Å; I198-F229 HydrophobicContact CD1-CD1 3.55Å; I198-F229 HydrophobicContact CD1-CE1 3.97Å; I198-F229 HydrophobicContact CG1-CD1 4.4Å; I198-F229 HydrophobicContact CG1-CE1 4.45Å; I198-F229 HydrophobicContact CG2-CD1 4.39Å; I198-F229 HydrophobicContact CG2-CE1 4.45Å
199	T	78.8	Confident	80.7	Confident	75 Å²	75	53.7 Å²	53.7	46%	0.46	29%	0.285	S	S	.	.			trans	-86.7	157.7	160.3	67.3	0	0	0	0	110.5	E201 L202 Q203	T199-E201 PolarHBondContact O-N 3.43Å; T199-L202 PolarHBondContact O-N 3.18Å; T199-L202 VanDerWaalsContact OG1-CB 3.31Å; T199-L202 WeakPolarHBondContact OG1-CB 3.49Å; T199-L202 PolarHBondContact OG1-N 3.02Å; T199-Q203 WeakPolarHBondContact O-CB 3.05Å; T199-Q203 PolarHBondContact O-N 2.95Å
200	V	75.9	Confident	79.9	Confident	79 Å²	79	53.9 Å²	53.9	48%	0.479	29%	0.286	S	S	.	.	H	α-helix	trans	-61.7	-32.8	178.3	176.1	0	0	0	0	111	K204	V200-K204 WeakPolarHBondContact O-CG 3.36Å; V200-K204 PolarHBondContact O-N 3.28Å; V200-K204 VanDerWaalsContact O-N 3.12Å
201	E	79.6	Confident	78.9	Confident	119 Å²	119	55.3 Å²	55.3	56%	0.556	29%	0.291	S	S	*	.	H	α-helix	trans	-66.9	-48.7	176.7	-64.4	64.2	-135.7	0	0	110.7	T199 Q203 K204 Q205	T199-E201 PolarHBondContact O-N 3.43Å; E201-Q203 VanDerWaalsContact C-N 3.31Å; E201-Q203 PolarHBondContact O-N 2.57Å; E201-K204 PolarHBondContact O-N 3.29Å; E201-Q205 WeakPolarHBondContact O-CG 3.33Å; E201-Q205 PolarHBondContact O-N 3.07Å
202	L	75.9	Confident	78	Confident	27 Å²	27	59.1 Å²	59.1	14%	0.141	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-40.1	176.6	178.3	60.4	0	0	0	111	T199 K204 Q205 I206 Q304	T199-L202 PolarHBondContact O-N 3.18Å; T199-L202 VanDerWaalsContact OG1-CB 3.31Å; T199-L202 WeakPolarHBondContact OG1-CB 3.49Å; T199-L202 PolarHBondContact OG1-N 3.02Å; L202-K204 PolarHBondContact O-N 3.38Å; L202-Q205 PolarHBondContact O-N 3.33Å; L202-I206 HydrophobicContact CD1-CD1 3.89Å; L202-I206 HydrophobicContact CD1-CG1 4.06Å; L202-I206 HydrophobicContact CD2-CD1 4.46Å; L202-I206 HydrophobicContact CG-CD1 3.8Å; L202-I206 HydrophobicContact CG-CG1 4.39Å; L202-I206 VanDerWaalsContact O-CG1 3.32Å; L202-I206 WeakPolarHBondContact O-CG1 3.36Å; L202-I206 PolarHBondContact O-N 3.01Å; L202-Q304 HydrophobicContact CD1-CB 3.78Å; L202-Q304 HydrophobicContact CD1-CG 4.35Å
203	Q	76.9	Confident	77.3	Confident	71 Å²	71	58.6 Å²	58.6	33%	0.332	31%	0.309	S	S	.	.	H	α-helix	trans	-58.1	-48	175.7	-166.5	-174.6	-5.7	0	0	111.9	I198 T199 E201 Q205 I206 M207 F229	I198-Q203 HydrophobicContact CG2-CB 3.86Å; I198-Q203 HydrophobicContact CG2-CG 4.38Å; T199-Q203 WeakPolarHBondContact O-CB 3.05Å; T199-Q203 PolarHBondContact O-N 2.95Å; E201-Q203 VanDerWaalsContact C-N 3.31Å; E201-Q203 PolarHBondContact O-N 2.57Å; Q203-Q205 VanDerWaalsContact C-N 3.34Å; Q203-Q205 PolarHBondContact O-N 2.79Å; Q203-I206 PolarHBondContact O-N 3.07Å; Q203-M207 WeakPolarHBondContact O-CB 3.47Å; Q203-M207 VanDerWaalsContact O-CG 3.29Å; Q203-M207 WeakPolarHBondContact O-CG 3.32Å; Q203-M207 PolarHBondContact O-N 2.51Å; Q203-F229 HydrophobicContact CB-CZ 4.32Å; Q203-F229 HydrophobicContact CG-CD1 4.07Å; Q203-F229 HydrophobicContact CG-CD2 3.59Å; Q203-F229 HydrophobicContact CG-CE1 3.84Å; Q203-F229 HydrophobicContact CG-CE2 3.33Å; Q203-F229 HydrophobicContact CG-CG 3.93Å; Q203-F229 HydrophobicContact CG-CZ 3.47Å; Q203-F229 VanDerWaalsContact CG-CZ 3.47Å
204	K	77.8	Confident	76.7	Confident	141 Å²	141	60.6 Å²	60.6	61%	0.613	32%	0.315	S	S	*	.	H	α-helix	trans	-63.1	-40.7	178.4	-73.7	170.8	-176	166.7	0	111.8	V200 E201 L202 S208	V200-K204 WeakPolarHBondContact O-CG 3.36Å; V200-K204 PolarHBondContact O-N 3.28Å; V200-K204 VanDerWaalsContact O-N 3.12Å; E201-K204 PolarHBondContact O-N 3.29Å; L202-K204 PolarHBondContact O-N 3.38Å; K204-S208 WeakPolarHBondContact O-CB 3.26Å; K204-S208 PolarHBondContact O-N 3.25Å
205	Q	75.9	Confident	76.4	Confident	92 Å²	92	66.6 Å²	66.6	43%	0.43	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-51	177.2	-72.9	176.1	-14.5	0	0	111.4	E201 L202 Q203 M207 S208 E209	E201-Q205 WeakPolarHBondContact O-CG 3.33Å; E201-Q205 PolarHBondContact O-N 3.07Å; L202-Q205 PolarHBondContact O-N 3.33Å; Q203-Q205 VanDerWaalsContact C-N 3.34Å; Q203-Q205 PolarHBondContact O-N 2.79Å; Q205-M207 VanDerWaalsContact C-N 3.3Å; Q205-M207 PolarHBondContact O-N 3.31Å; Q205-S208 WeakPolarHBondContact O-CB 3.49Å; Q205-S208 PolarHBondContact O-N 3.17Å; Q205-S208 VanDerWaalsContact O-N 3.13Å; Q205-E209 PolarHBondContact O-N 3.45Å
206	I	78.1	Confident	76.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-45	178.4	-67.6	168.5	0	0	0	110.5	L196 L202 Q203 S208 E209 L210 F229 I234	L196-I206 HydrophobicContact CD1-CD1 4.01Å; L202-I206 HydrophobicContact CD1-CD1 3.89Å; L202-I206 HydrophobicContact CD1-CG1 4.06Å; L202-I206 HydrophobicContact CD2-CD1 4.46Å; L202-I206 HydrophobicContact CG-CD1 3.8Å; L202-I206 HydrophobicContact CG-CG1 4.39Å; L202-I206 VanDerWaalsContact O-CG1 3.32Å; L202-I206 WeakPolarHBondContact O-CG1 3.36Å; L202-I206 PolarHBondContact O-N 3.01Å; Q203-I206 PolarHBondContact O-N 3.07Å; I206-S208 VanDerWaalsContact C-N 3.34Å; I206-S208 PolarHBondContact O-N 2.92Å; I206-E209 PolarHBondContact O-N 3.43Å; I206-E209 VanDerWaalsContact O-N 3.17Å; I206-L210 HydrophobicContact CG2-CD1 3.76Å; I206-L210 HydrophobicContact CG2-CG 4.12Å; I206-L210 VanDerWaalsContact O-CG 3.3Å; I206-L210 WeakPolarHBondContact O-CG 3.27Å; I206-L210 PolarHBondContact O-N 3.34Å; I206-F229 HydrophobicContact CB-CZ 4.37Å; I206-F229 HydrophobicContact CG2-CZ 4.23Å; I206-I234 HydrophobicContact CG2-CD1 3.52Å
207	M	76.8	Confident	77.2	Confident	44 Å²	44	68.8 Å²	68.8	22%	0.217	35%	0.349	C	S	.	.	H	α-helix	trans	-62.9	-38.8	178.2	-72.4	-61.8	-75.1	0	0	113	L153 Q203 Q205 E209 L210 E211 F229	L153-M207 HydrophobicContact CD1-CE 4.38Å; L153-M207 HydrophobicContact CD2-CE 3.76Å; Q203-M207 WeakPolarHBondContact O-CB 3.47Å; Q203-M207 VanDerWaalsContact O-CG 3.29Å; Q203-M207 WeakPolarHBondContact O-CG 3.32Å; Q203-M207 PolarHBondContact O-N 2.51Å; Q205-M207 VanDerWaalsContact C-N 3.3Å; Q205-M207 PolarHBondContact O-N 3.31Å; M207-E209 VanDerWaalsContact C-N 3.31Å; M207-E209 PolarHBondContact O-N 2.79Å; M207-L210 PolarHBondContact O-N 2.85Å; M207-L210 HydrophobicContact SD-CD1 4.49Å; M207-E211 PolarHBondContact O-N 3.43Å; M207-F229 HydrophobicContact CG-CE2 3.64Å; M207-F229 HydrophobicContact CG-CZ 4.23Å; M207-F229 HydrophobicContact SD-CE2 3.62Å; M207-F229 HydrophobicContact SD-CZ 4.39Å
208	S	73.1	Confident	78.2	Confident	75 Å²	75	62.7 Å²	62.7	52%	0.524	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-34.7	175.2	-171	0	0	0	0	112.1	K204 Q205 I206 E211	K204-S208 WeakPolarHBondContact O-CB 3.26Å; K204-S208 PolarHBondContact O-N 3.25Å; Q205-S208 WeakPolarHBondContact O-CB 3.49Å; Q205-S208 PolarHBondContact O-N 3.17Å; Q205-S208 VanDerWaalsContact O-N 3.13Å; I206-S208 VanDerWaalsContact C-N 3.34Å; I206-S208 PolarHBondContact O-N 2.92Å; S208-E211 VanDerWaalsContact O-CB 3.22Å; S208-E211 WeakPolarHBondContact O-CB 3.46Å
209	E	74.1	Confident	79.5	Confident	58 Å²	58	65.1 Å²	65.1	27%	0.271	33%	0.334	S	S	.	.	H	α-helix	trans	-76.4	-36.6	178.3	-70.4	-178.3	-151.6	0	0	111.9	Q205 I206 M207 E211 I212 S302 T303	Q205-E209 PolarHBondContact O-N 3.45Å; I206-E209 PolarHBondContact O-N 3.43Å; I206-E209 VanDerWaalsContact O-N 3.17Å; M207-E209 VanDerWaalsContact C-N 3.31Å; M207-E209 PolarHBondContact O-N 2.79Å; E209-E211 PolarHBondContact O-N 3.12Å; E209-I212 PolarHBondContact O-N 3.07Å; E209-S302 VanDerWaalsContact CD-OG 3.26Å; E209-S302 VanDerWaalsContact OE2-C 3.23Å; E209-S302 WeakPolarHBondContact OE2-CA 3.23Å; E209-S302 WeakPolarHBondContact OE2-CB 3.43Å; E209-S302 PolarHBondContact OE2-OG 3.31Å; E209-T303 PolarHBondContact OE2-N 3.36Å
210	L	78.3	Confident	80.4	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-17	173.4	-67.5	175.3	0	0	0	113	I206 M207 I212 L213 Y214 A227 I234 I236	I206-L210 HydrophobicContact CG2-CD1 3.76Å; I206-L210 HydrophobicContact CG2-CG 4.12Å; I206-L210 VanDerWaalsContact O-CG 3.3Å; I206-L210 WeakPolarHBondContact O-CG 3.27Å; I206-L210 PolarHBondContact O-N 3.34Å; M207-L210 PolarHBondContact O-N 2.85Å; M207-L210 HydrophobicContact SD-CD1 4.49Å; L210-I212 PolarHBondContact O-N 3.45Å; L210-I212 VanDerWaalsContact O-N 3.16Å; L210-L213 HydrophobicContact CD2-CD1 3.48Å; L210-L213 VanDerWaalsContact CD2-CD1 3.48Å; L210-L213 HydrophobicContact CD2-CG 4.38Å; L210-L213 WeakPolarHBondContact O-CB 3.5Å; L210-L213 PolarHBondContact O-N 3.38Å; L210-Y214 PolarHBondContact O-N 3.2Å; L210-A227 HydrophobicContact CD1-CB 3.66Å; L210-I234 HydrophobicContact CD1-CD1 3.74Å; L210-I236 HydrophobicContact CD2-CD1 4.39Å
211	E	74.4	Confident	81.3	Confident	43 Å²	43	60.9 Å²	60.9	20%	0.201	30%	0.302	C	S	.	.	H	α-helix	trans	-55.9	-31.2	174.4	-160.5	-165	135.7	0	0	112.3	L149 M207 S208 E209 L213 Y214 K215	L149-E211 WeakPolarHBondContact CD1-OE1 3.41Å; L149-E211 HydrophobicContact CD2-CG 3.97Å; M207-E211 PolarHBondContact O-N 3.43Å; S208-E211 VanDerWaalsContact O-CB 3.22Å; S208-E211 WeakPolarHBondContact O-CB 3.46Å; E209-E211 PolarHBondContact O-N 3.12Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 2.75Å; E211-Y214 PolarHBondContact O-N 3.43Å; E211-K215 PolarHBondContact O-N 2.91Å; E211-K215 VanDerWaalsContact OE1-CE 3.23Å; E211-K215 WeakPolarHBondContact OE1-CE 3.24Å; E211-K215 IonicContact OE1-NZ 2.69Å; E211-K215 PolarHBondContact OE1-NZ 2.93Å
212	I	74.6	Confident	82.1	Confident	81 Å²	81	55.7 Å²	55.7	42%	0.415	28%	0.278	S	S	.	.	H	α-helix	trans	-65.2	-37.1	177.2	-62.7	174.9	0	0	0	110.9	E209 L210 Y214 K215 C216 I276	E209-I212 PolarHBondContact O-N 3.07Å; L210-I212 PolarHBondContact O-N 3.45Å; L210-I212 VanDerWaalsContact O-N 3.16Å; I212-Y214 VanDerWaalsContact C-N 3.31Å; I212-Y214 PolarHBondContact O-N 3.45Å; I212-K215 PolarHBondContact O-N 2.79Å; I212-K215 VanDerWaalsContact O-N 3.17Å; I212-C216 PolarHBondContact O-N 3.07Å; I212-C216 PolarHBondContact O-SG 2.91Å; I212-I276 HydrophobicContact CG2-CD1 3.23Å; I212-I276 HydrophobicContact CG2-CG1 3.88Å
213	L	77.8	Confident	82.8	Confident	23 Å²	23	56.7 Å²	56.7	12%	0.12	29%	0.285	C	S	.	.	H	α-helix	trans	-65.7	-35.3	178.5	-56.7	-176.8	0	0	0	111.6	L210 E211 K215 C216 F224 F299	L210-L213 HydrophobicContact CD2-CD1 3.48Å; L210-L213 VanDerWaalsContact CD2-CD1 3.48Å; L210-L213 HydrophobicContact CD2-CG 4.38Å; L210-L213 WeakPolarHBondContact O-CB 3.5Å; L210-L213 PolarHBondContact O-N 3.38Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 2.75Å; L213-K215 PolarHBondContact O-N 2.93Å; L213-C216 WeakPolarHBondContact O-CB 3.25Å; L213-C216 PolarHBondContact O-N 3.19Å; L213-F224 HydrophobicContact CB-CB 4.08Å; L213-F224 HydrophobicContact CB-CD1 4.09Å; L213-F224 HydrophobicContact CB-CD2 4.24Å; L213-F224 HydrophobicContact CB-CG 3.88Å; L213-F224 HydrophobicContact CD1-CD2 3.99Å; L213-F224 HydrophobicContact CD1-CE2 4.19Å; L213-F224 HydrophobicContact CD1-CG 4.46Å; L213-F299 HydrophobicContact CD2-CD2 3.97Å; L213-F299 HydrophobicContact CD2-CE1 4.03Å; L213-F299 HydrophobicContact CD2-CE2 3.3Å; L213-F299 HydrophobicContact CD2-CZ 3.34Å
214	Y	77	Confident	83.4	Confident	61 Å²	61	54.2 Å²	54.2	24%	0.239	27%	0.274	C	S	.	.	H	α-helix	trans	-64	-27.4	174.8	-82.6	-74.3	0	0	0	113.5	L153 L210 E211 I212 C216 F224 F225 S226	L153-Y214 HydrophobicContact CD2-CD2 4.18Å; L153-Y214 HydrophobicContact CD2-CE2 3.3Å; L210-Y214 PolarHBondContact O-N 3.2Å; E211-Y214 PolarHBondContact O-N 3.43Å; I212-Y214 VanDerWaalsContact C-N 3.31Å; I212-Y214 PolarHBondContact O-N 3.45Å; Y214-C216 VanDerWaalsContact C-N 3.3Å; Y214-F224 AromaticContact CD1-CD1 3.96Å; Y214-F224 HydrophobicContact CD1-CD1 3.96Å; Y214-F224 AromaticContact CD1-CE1 3.96Å; Y214-F224 HydrophobicContact CD1-CE1 3.96Å; Y214-F224 HydrophobicContact CD2-CD1 4.15Å; Y214-F224 AromaticContact CD2-CE1 3.61Å; Y214-F224 HydrophobicContact CD2-CE1 3.61Å; Y214-F224 HydrophobicContact CE1-CD1 4.04Å; Y214-F224 AromaticContact CE1-CE1 3.71Å; Y214-F224 HydrophobicContact CE1-CE1 3.71Å; Y214-F224 HydrophobicContact CE2-CD1 4.27Å; Y214-F224 AromaticContact CE2-CE1 3.38Å; Y214-F224 HydrophobicContact CE2-CE1 3.38Å; Y214-F224 HydrophobicContact CE2-CZ 4.16Å; Y214-F224 HydrophobicContact CG-CD1 4.02Å; Y214-F224 AromaticContact CG-CE1 3.93Å; Y214-F224 HydrophobicContact CG-CE1 3.93Å; Y214-F224 AromaticContact CZ-CE1 3.42Å; Y214-F224 VanDerWaalsContact CZ-CE1 3.42Å; Y214-F225 WeakPolarHBondContact CE1-O 3.13Å; Y214-S226 WeakPolarHBondContact OH-CA 3.45Å
215	K	77.6	Confident	83.9	Confident	129 Å²	129	49.9 Å²	49.9	56%	0.561	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-9.9	179.6	-65.2	174	-173.2	167.3	0	112.6	E211 I212 L213 D217	E211-K215 PolarHBondContact O-N 2.91Å; E211-K215 VanDerWaalsContact OE1-CE 3.23Å; E211-K215 WeakPolarHBondContact OE1-CE 3.24Å; E211-K215 IonicContact OE1-NZ 2.69Å; E211-K215 PolarHBondContact OE1-NZ 2.93Å; I212-K215 PolarHBondContact O-N 2.79Å; I212-K215 VanDerWaalsContact O-N 3.17Å; L213-K215 PolarHBondContact O-N 2.93Å; K215-D217 PolarHBondContact O-N 2.89Å
216	C	85.4	Confident	84.4	Confident	15 Å²	15	46 Å²	46	10%	0.101	24%	0.237	C	C	.	.			trans	-80.6	110.6	-179.9	-67.1	0	0	0	0	110.2	I212 L213 Y214 I221 Y270 F299	I212-C216 PolarHBondContact O-N 3.07Å; I212-C216 PolarHBondContact O-SG 2.91Å; L213-C216 WeakPolarHBondContact O-CB 3.25Å; L213-C216 PolarHBondContact O-N 3.19Å; Y214-C216 VanDerWaalsContact C-N 3.3Å; C216-I221 HydrophobicContact CB-CG2 4.22Å; C216-Y270 WeakPolarHBondContact CA-OH 3.4Å; C216-Y270 HydrophobicContact CB-CE1 4.24Å; C216-F299 HydrophobicContact CB-CZ 4.17Å
217	D	89.8	Confident	84.8	Confident	138 Å²	138	46.3 Å²	46.3	74%	0.738	24%	0.24	S	C	*	.			trans	-124.9	100.2	171	-175.6	17	0	0	0	109	K215 Y270	K215-D217 PolarHBondContact O-N 2.89Å; D217-Y270 PolarHBondContact N-OH 3.12Å; D217-Y270 WeakPolarHBondContact O-CE2 3.25Å; D217-Y270 VanDerWaalsContact O-CZ 3.31Å; D217-Y270 PolarHBondContact O-OH 2.86Å; D217-Y270 VanDerWaalsContact O-OH 3.1Å
218	S	95.2	Very high	85.2	Confident	11 Å²	11	45.5 Å²	45.5	8%	0.077	24%	0.235	C	C	.	.			trans	-155.4	140.5	179.9	173.1	0	0	0	0	110.3	Y220 I221	S218-Y220 PolarHBondContact O-N 3.18Å; S218-Y220 VanDerWaalsContact O-N 3.1Å; S218-Y220 PolarHBondContact OG-N 3.32Å; S218-I221 PolarHBondContact O-N 2.9Å; S218-I221 VanDerWaalsContact O-O 3.14Å
219	P	96.6	Very high	85.8	Confident	80 Å²	80	44 Å²	44	52%	0.519	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-8.6	176.5	29.1	-35.4	0	0	0	113.5	K295	P219-K295 VanDerWaalsContact O-CE 3.24Å; P219-K295 WeakPolarHBondContact O-CE 3.44Å; P219-K295 WeakPolarHBondContact O-CG 3.31Å
220	Y	97.6	Very high	86.1	Confident	65 Å²	65	43.7 Å²	43.7	26%	0.255	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	2	-178.6	-51.7	-64.5	0	0	0	113.5	S218 A263 K266 K295 L296	S218-Y220 PolarHBondContact O-N 3.18Å; S218-Y220 VanDerWaalsContact O-N 3.1Å; S218-Y220 PolarHBondContact OG-N 3.32Å; Y220-A263 HydrophobicContact CD1-CB 3.7Å; Y220-A263 HydrophobicContact CE1-CB 4.05Å; Y220-K266 HydrophobicContact CD1-CB 4.39Å; Y220-K266 HydrophobicContact CD2-CB 3.45Å; Y220-K266 VanDerWaalsContact CD2-CB 3.45Å; Y220-K266 HydrophobicContact CD2-CD 4.2Å; Y220-K266 HydrophobicContact CD2-CG 4.45Å; Y220-K266 HydrophobicContact CE1-CB 4.47Å; Y220-K266 HydrophobicContact CE1-CD 4.07Å; Y220-K266 HydrophobicContact CE2-CB 3.54Å; Y220-K266 HydrophobicContact CE2-CD 3.39Å; Y220-K266 HydrophobicContact CE2-CG 4.07Å; Y220-K266 HydrophobicContact CG-CB 3.89Å; Y220-K266 VanDerWaalsContact OH-CD 3.27Å; Y220-K266 WeakPolarHBondContact OH-CD 3.41Å; Y220-K266 PolarHBondContact OH-NZ 3.04Å; Y220-K295 WeakPolarHBondContact O-CA 3.18Å; Y220-L296 PolarHBondContact O-N 3.45Å
221	I	95.7	Very high	86.2	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-120.4	138.9	178.2	-58.9	-58.7	0	0	0	108.4	C216 S218 T223 Y270 L271 L296 F299	C216-I221 HydrophobicContact CB-CG2 4.22Å; S218-I221 PolarHBondContact O-N 2.9Å; S218-I221 VanDerWaalsContact O-O 3.14Å; I221-T223 PolarHBondContact O-N 3.26Å; I221-Y270 HydrophobicContact CG1-CD1 3.7Å; I221-Y270 HydrophobicContact CG1-CE1 4.21Å; I221-L271 HydrophobicContact CD1-CD1 3.92Å; I221-L271 HydrophobicContact CD1-CD2 4Å; I221-L271 HydrophobicContact CD1-CG 3.75Å; I221-L271 HydrophobicContact CG1-CD2 4.36Å; I221-L271 HydrophobicContact CG1-CG 4.49Å; I221-L296 HydrophobicContact CD1-CB 4.07Å; I221-L296 HydrophobicContact CD1-CD1 4.41Å; I221-F299 HydrophobicContact CG2-CD1 4.03Å; I221-F299 HydrophobicContact CG2-CE1 3.15Å; I221-F299 HydrophobicContact CG2-CE2 4.4Å; I221-F299 HydrophobicContact CG2-CZ 3.36Å
222	I	94.6	Very high	86.6	Confident	9 Å²	9	52.6 Å²	52.6	5%	0.046	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-59.3	129	178.4	-162	70.3	0	0	0	110.1	F224 T238 E239 M241 L287 K295 L296 C297 F299	I222-F224 PolarHBondContact O-N 3.19Å; I222-T238 HydrophobicContact CG1-CG2 4.37Å; I222-T238 HydrophobicContact CG2-CG2 4.47Å; I222-E239 HydrophobicContact CD1-CG 3.31Å; I222-E239 HydrophobicContact CG1-CG 3.98Å; I222-M241 HydrophobicContact CD1-CG 3.59Å; I222-M241 HydrophobicContact CD1-SD 4.28Å; I222-L287 HydrophobicContact CD1-CD1 3.8Å; I222-L287 HydrophobicContact CG1-CD1 4.38Å; I222-K295 HydrophobicContact CD1-CD 4.44Å; I222-L296 WeakPolarHBondContact CB-O 3.43Å; I222-L296 PolarHBondContact N-O 3.28Å; I222-C297 HydrophobicContact CB-CB 3.94Å; I222-C297 HydrophobicContact CG1-CB 4.4Å; I222-C297 HydrophobicContact CG2-CB 3.66Å; I222-F299 HydrophobicContact CG2-CE1 4.32Å
223	T	92.1	Very high	87	Confident	49 Å²	49	53.2 Å²	53.2	30%	0.301	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-71.5	117.5	176.7	-57	0	0	0	0	108.7	I221 F225 T238 E239	I221-T223 PolarHBondContact O-N 3.26Å; T223-F225 HydrophobicContact CG2-CD1 3.98Å; T223-F225 HydrophobicContact CG2-CE1 3.5Å; T223-F225 HydrophobicContact CG2-CZ 4.12Å; T223-T238 CarbonylContact O-C 3.59Å; T223-T238 VanDerWaalsContact O-CA 3.28Å; T223-T238 WeakPolarHBondContact O-CA 3.22Å; T223-T238 WeakPolarHBondContact O-CB 3.46Å; T223-E239 WeakPolarHBondContact CB-OE1 3.44Å; T223-E239 PolarHBondContact N-OE1 2.86Å; T223-E239 PolarHBondContact O-N 3.1Å; T223-E239 PolarHBondContact OG1-OE1 3.32Å; T223-E239 VanDerWaalsContact OG1-OE1 3.14Å
224	F	90.1	Very high	87.4	Confident	19 Å²	19	52.1 Å²	52.1	8%	0.083	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.2	173.8	175.8	-91.7	0	0	0	109.5	L213 Y214 I222 S226 A227 I236 T238	L213-F224 HydrophobicContact CB-CB 4.08Å; L213-F224 HydrophobicContact CB-CD1 4.09Å; L213-F224 HydrophobicContact CB-CD2 4.24Å; L213-F224 HydrophobicContact CB-CG 3.88Å; L213-F224 HydrophobicContact CD1-CD2 3.99Å; L213-F224 HydrophobicContact CD1-CE2 4.19Å; L213-F224 HydrophobicContact CD1-CG 4.46Å; Y214-F224 AromaticContact CD1-CD1 3.96Å; Y214-F224 HydrophobicContact CD1-CD1 3.96Å; Y214-F224 AromaticContact CD1-CE1 3.96Å; Y214-F224 HydrophobicContact CD1-CE1 3.96Å; Y214-F224 HydrophobicContact CD2-CD1 4.15Å; Y214-F224 AromaticContact CD2-CE1 3.61Å; Y214-F224 HydrophobicContact CD2-CE1 3.61Å; Y214-F224 HydrophobicContact CE1-CD1 4.04Å; Y214-F224 AromaticContact CE1-CE1 3.71Å; Y214-F224 HydrophobicContact CE1-CE1 3.71Å; Y214-F224 HydrophobicContact CE2-CD1 4.27Å; Y214-F224 AromaticContact CE2-CE1 3.38Å; Y214-F224 HydrophobicContact CE2-CE1 3.38Å; Y214-F224 HydrophobicContact CE2-CZ 4.16Å; Y214-F224 HydrophobicContact CG-CD1 4.02Å; Y214-F224 AromaticContact CG-CE1 3.93Å; Y214-F224 HydrophobicContact CG-CE1 3.93Å; Y214-F224 AromaticContact CZ-CE1 3.42Å; Y214-F224 VanDerWaalsContact CZ-CE1 3.42Å; I222-F224 PolarHBondContact O-N 3.19Å; F224-S226 VanDerWaalsContact CZ-C 3.41Å; F224-S226 WeakPolarHBondContact CZ-O 3.29Å; F224-A227 HydrophobicContact CE2-CB 4.15Å; F224-A227 HydrophobicContact CZ-CB 3.73Å; F224-I236 HydrophobicContact CD2-CG2 3.88Å; F224-I236 HydrophobicContact CE2-CG2 3.57Å; F224-T238 HydrophobicContact CD2-CG2 4.27Å
225	F	87.8	Confident	88	Confident	50 Å²	50	49.4 Å²	49.4	22%	0.219	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	-47.8	-178.3	-63.2	-50.4	0	0	0	113.1	I158 L189 Y214 T223 C237 E239	I158-F225 HydrophobicContact CD1-CB 3.48Å; I158-F225 VanDerWaalsContact CD1-CB 3.48Å; I158-F225 HydrophobicContact CD1-CD2 4.42Å; I158-F225 HydrophobicContact CD1-CG 4.23Å; L189-F225 HydrophobicContact CD2-CD2 3.46Å; L189-F225 VanDerWaalsContact CD2-CD2 3.46Å; L189-F225 HydrophobicContact CD2-CE2 3.35Å; Y214-F225 WeakPolarHBondContact CE1-O 3.13Å; T223-F225 HydrophobicContact CG2-CD1 3.98Å; T223-F225 HydrophobicContact CG2-CE1 3.5Å; T223-F225 HydrophobicContact CG2-CZ 4.12Å; F225-C237 PolarHBondContact N-O 3.02Å; F225-E239 HydrophobicContact CE2-CB 3.94Å; F225-E239 HydrophobicContact CZ-CB 3.98Å
226	S	86.2	Confident	88.5	Confident	9 Å²	9	44 Å²	44	6%	0.063	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	159.3	-176.5	-176.3	0	0	0	0	111.5	Y214 F224 C237	Y214-S226 WeakPolarHBondContact OH-CA 3.45Å; F224-S226 VanDerWaalsContact CZ-C 3.41Å; F224-S226 WeakPolarHBondContact CZ-O 3.29Å; S226-C237 PolarHBondContact N-O 2.71Å; S226-C237 WeakPolarHBondContact O-CB 3.2Å; S226-C237 PolarHBondContact O-N 3.22Å
227	A	86.6	Confident	88.8	Confident	7 Å²	7	43.3 Å²	43.3	6%	0.058	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142.4	161.9	0	0	0	0	0	110.2	L210 F224 I234 S235 I236	L210-A227 HydrophobicContact CD1-CB 3.66Å; F224-A227 HydrophobicContact CE2-CB 4.15Å; F224-A227 HydrophobicContact CZ-CB 3.73Å; A227-I234 HydrophobicContact CB-CD1 4.5Å; A227-S235 CarbonylContact C-O 3.53Å; A227-S235 WeakPolarHBondContact CA-O 3.34Å; A227-I236 HydrophobicContact CB-CG1 4.17Å
228	F	85.3	Confident	89	Confident	27 Å²	27	37.9 Å²	37.9	12%	0.118	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	160.7	-179.8	60.3	-99.5	0	0	0	111.4	I158 A160 L163 V230 S235 C237	I158-F228 HydrophobicContact CG2-CE1 4.47Å; I158-F228 WeakPolarHBondContact O-CD1 3.27Å; A160-F228 HydrophobicContact CB-CD2 4.13Å; A160-F228 HydrophobicContact CB-CE2 3.57Å; A160-F228 HydrophobicContact CB-CZ 4.01Å; L163-F228 HydrophobicContact CD1-CE1 3.65Å; L163-F228 HydrophobicContact CD1-CZ 3.59Å; F228-V230 HydrophobicContact CD2-CG2 3.78Å; F228-V230 HydrophobicContact CE2-CG2 3.88Å; F228-S235 WeakPolarHBondContact CE2-OG 3.39Å; F228-S235 PolarHBondContact N-O 3.23Å; F228-S235 PolarHBondContact O-N 3.11Å; F228-C237 VanDerWaalsContact CE1-SG 3.59Å
229	F	84.3	Confident	88.9	Confident	45 Å²	45	38.5 Å²	38.5	20%	0.197	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.8	-178	-64.5	-92.4	0	0	0	110.7	I198 Q203 I206 M207 R233 I234	I198-F229 HydrophobicContact CD1-CD1 3.55Å; I198-F229 HydrophobicContact CD1-CE1 3.97Å; I198-F229 HydrophobicContact CG1-CD1 4.4Å; I198-F229 HydrophobicContact CG1-CE1 4.45Å; I198-F229 HydrophobicContact CG2-CD1 4.39Å; I198-F229 HydrophobicContact CG2-CE1 4.45Å; Q203-F229 HydrophobicContact CB-CZ 4.32Å; Q203-F229 HydrophobicContact CG-CD1 4.07Å; Q203-F229 HydrophobicContact CG-CD2 3.59Å; Q203-F229 HydrophobicContact CG-CE1 3.84Å; Q203-F229 HydrophobicContact CG-CE2 3.33Å; Q203-F229 HydrophobicContact CG-CG 3.93Å; Q203-F229 HydrophobicContact CG-CZ 3.47Å; Q203-F229 VanDerWaalsContact CG-CZ 3.47Å; I206-F229 HydrophobicContact CB-CZ 4.37Å; I206-F229 HydrophobicContact CG2-CZ 4.23Å; M207-F229 HydrophobicContact CG-CE2 3.64Å; M207-F229 HydrophobicContact CG-CZ 4.23Å; M207-F229 HydrophobicContact SD-CE2 3.62Å; M207-F229 HydrophobicContact SD-CZ 4.39Å; F229-R233 CarbonylContact C-O 3.59Å; F229-R233 VanDerWaalsContact CA-O 3.29Å; F229-R233 WeakPolarHBondContact CA-O 3.29Å; F229-I234 HydrophobicContact CD1-CB 3.93Å; F229-I234 HydrophobicContact CD1-CG1 4.24Å; F229-I234 HydrophobicContact CE1-CB 3.74Å; F229-I234 HydrophobicContact CE1-CD1 3.83Å; F229-I234 HydrophobicContact CE1-CG1 3.9Å; F229-I234 HydrophobicContact CE2-CD1 4.32Å; F229-I234 HydrophobicContact CZ-CB 4.41Å; F229-I234 HydrophobicContact CZ-CD1 3.64Å; F229-I234 HydrophobicContact CZ-CG1 4.07Å
230	V	81.6	Confident	88.9	Confident	50 Å²	50	36.8 Å²	36.8	30%	0.303	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	125.1	175.3	178.2	0	0	0	0	108.4	A160 F228 N232 R233	A160-V230 HydrophobicContact CB-CG2 3.82Å; F228-V230 HydrophobicContact CD2-CG2 3.78Å; F228-V230 HydrophobicContact CE2-CG2 3.88Å; V230-N232 PolarHBondContact O-N 2.95Å; V230-R233 PolarHBondContact N-O 2.87Å; V230-R233 WeakPolarHBondContact O-CA 3.43Å; V230-R233 VanDerWaalsContact O-CB 3.31Å; V230-R233 WeakPolarHBondContact O-CB 3.23Å; V230-R233 PolarHBondContact O-N 3.08Å
231	E	80.5	Confident	88.9	Confident	144 Å²	144	34 Å²	34	67%	0.673	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.2	58.2	170.3	-63	176.2	-175.2	0	0	114.2	R233	E231-R233 PolarHBondContact O-N 3.32Å; E231-R233 IonicContact OE2-CZ 3.29Å; E231-R233 IonicContact OE2-NH1 3.23Å; E231-R233 IonicContact OE2-NH2 2.63Å; E231-R233 PolarHBondContact OE2-NH2 3.31Å
232	N	81.8	Confident	88.9	Confident	92 Å²	92	36.9 Å²	36.9	49%	0.492	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	34.4	-178.4	-69.9	14.7	0	0	0	113.5	L196 V230	L196-N232 CarbonylContact C-O 3.55Å; L196-N232 PolarHBondContact N-O 3.1Å; L196-N232 CarbonylContact O-C 3.56Å; L196-N232 WeakPolarHBondContact O-CB 3.34Å; V230-N232 PolarHBondContact O-N 2.95Å
233	R	84.3	Confident	89	Confident	93 Å²	93	36.6 Å²	36.6	35%	0.351	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.1	170.9	-56.8	179.7	-78.5	-92.1	5	109.4	V193 I194 P195 F229 V230 E231	V193-R233 HydrophobicContact CG1-CB 4.07Å; V193-R233 HydrophobicContact CG1-CG 4.43Å; I194-R233 CarbonylContact O-C 3.55Å; I194-R233 VanDerWaalsContact O-CA 3.27Å; I194-R233 WeakPolarHBondContact O-CA 3.44Å; P195-R233 HydrophobicContact CB-CG 4.43Å; F229-R233 CarbonylContact C-O 3.59Å; F229-R233 VanDerWaalsContact CA-O 3.29Å; F229-R233 WeakPolarHBondContact CA-O 3.29Å; V230-R233 PolarHBondContact N-O 2.87Å; V230-R233 WeakPolarHBondContact O-CA 3.43Å; V230-R233 VanDerWaalsContact O-CB 3.31Å; V230-R233 WeakPolarHBondContact O-CB 3.23Å; V230-R233 PolarHBondContact O-N 3.08Å; E231-R233 PolarHBondContact O-N 3.32Å; E231-R233 IonicContact OE2-CZ 3.29Å; E231-R233 IonicContact OE2-NH1 3.23Å; E231-R233 IonicContact OE2-NH2 2.63Å; E231-R233 PolarHBondContact OE2-NH2 3.31Å
234	I	86.3	Confident	89.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135	163.6	-173.2	172.5	0	0	0	108.9	V193 I194 L196 I206 L210 A227 F229 I236 L305	V193-I234 WeakPolarHBondContact CA-O 3.4Å; I194-I234 HydrophobicContact CB-CG2 3.71Å; I194-I234 HydrophobicContact CD1-CG2 4.35Å; I194-I234 HydrophobicContact CG1-CG2 4.17Å; I194-I234 PolarHBondContact N-O 3.38Å; I194-I234 PolarHBondContact O-N 3.47Å; L196-I234 HydrophobicContact CD1-CB 4.22Å; L196-I234 HydrophobicContact CD1-CG2 3.44Å; L196-I234 VanDerWaalsContact CD1-CG2 3.44Å; L196-I234 HydrophobicContact CG-CG2 4.4Å; I206-I234 HydrophobicContact CG2-CD1 3.52Å; L210-I234 HydrophobicContact CD1-CD1 3.74Å; A227-I234 HydrophobicContact CB-CD1 4.5Å; F229-I234 HydrophobicContact CD1-CB 3.93Å; F229-I234 HydrophobicContact CD1-CG1 4.24Å; F229-I234 HydrophobicContact CE1-CB 3.74Å; F229-I234 HydrophobicContact CE1-CD1 3.83Å; F229-I234 HydrophobicContact CE1-CG1 3.9Å; F229-I234 HydrophobicContact CE2-CD1 4.32Å; F229-I234 HydrophobicContact CZ-CB 4.41Å; F229-I234 HydrophobicContact CZ-CD1 3.64Å; F229-I234 HydrophobicContact CZ-CG1 4.07Å; I234-I236 HydrophobicContact CD1-CG1 4.36Å; I234-I236 HydrophobicContact CG1-CG1 4.33Å; I234-L305 HydrophobicContact CG2-CD1 4.22Å
235	S	88.7	Confident	89.4	Confident	4 Å²	4	35.8 Å²	35.8	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.7	172.4	-59.1	0	0	0	0	108.8	K192 A227 F228	K192-S235 CarbonylContact O-C 3.58Å; K192-S235 WeakPolarHBondContact O-CA 3.14Å; A227-S235 CarbonylContact C-O 3.53Å; A227-S235 WeakPolarHBondContact CA-O 3.34Å; F228-S235 WeakPolarHBondContact CE2-OG 3.39Å; F228-S235 PolarHBondContact N-O 3.23Å; F228-S235 PolarHBondContact O-N 3.11Å
236	I	89	Confident	89.9	Confident	16 Å²	16	33.4 Å²	33.4	8%	0.082	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.6	178.2	-66.9	166.5	0	0	0	108.1	V191 K192 I194 L210 F224 A227 I234 T238 L305	V191-I236 CarbonylContact C-O 3.57Å; V191-I236 WeakPolarHBondContact CA-O 3.49Å; K192-I236 HydrophobicContact CB-CB 4.43Å; K192-I236 PolarHBondContact N-O 3.28Å; K192-I236 PolarHBondContact O-N 3.43Å; I194-I236 HydrophobicContact CD1-CD1 4.24Å; L210-I236 HydrophobicContact CD2-CD1 4.39Å; F224-I236 HydrophobicContact CD2-CG2 3.88Å; F224-I236 HydrophobicContact CE2-CG2 3.57Å; A227-I236 HydrophobicContact CB-CG1 4.17Å; I234-I236 HydrophobicContact CD1-CG1 4.36Å; I234-I236 HydrophobicContact CG1-CG1 4.33Å; I236-T238 HydrophobicContact CG2-CG2 4.17Å; I236-L305 HydrophobicContact CD1-CD2 4.13Å
237	C	91.4	Very high	90.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.9	-177.2	-60	0	0	0	0	110.8	I158 L189 A190 F225 S226 F228	I158-C237 HydrophobicContact CD1-CB 4.19Å; L189-C237 HydrophobicContact CD1-CB 4.39Å; A190-C237 WeakPolarHBondContact O-CA 3.47Å; F225-C237 PolarHBondContact N-O 3.02Å; S226-C237 PolarHBondContact N-O 2.71Å; S226-C237 WeakPolarHBondContact O-CB 3.2Å; S226-C237 PolarHBondContact O-N 3.22Å; F228-C237 VanDerWaalsContact CE1-SG 3.59Å
238	T	93	Very high	90.4	Very high	25 Å²	25	40 Å²	40	15%	0.153	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	170.2	178	59	0	0	0	0	111.2	L189 A190 I222 T223 F224 I236	L189-T238 WeakPolarHBondContact CA-O 3.42Å; A190-T238 PolarHBondContact N-O 3.48Å; A190-T238 PolarHBondContact O-N 2.97Å; I222-T238 HydrophobicContact CG1-CG2 4.37Å; I222-T238 HydrophobicContact CG2-CG2 4.47Å; T223-T238 CarbonylContact O-C 3.59Å; T223-T238 VanDerWaalsContact O-CA 3.28Å; T223-T238 WeakPolarHBondContact O-CA 3.22Å; T223-T238 WeakPolarHBondContact O-CB 3.46Å; F224-T238 HydrophobicContact CD2-CG2 4.27Å; I236-T238 HydrophobicContact CG2-CG2 4.17Å
239	E	94.1	Very high	90.8	Very high	24 Å²	24	39.4 Å²	39.4	11%	0.112	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	144.3	169.3	74.5	-173.9	126.3	0	0	111.6	I222 T223 F225 M241 K295	I222-E239 HydrophobicContact CD1-CG 3.31Å; I222-E239 HydrophobicContact CG1-CG 3.98Å; T223-E239 WeakPolarHBondContact CB-OE1 3.44Å; T223-E239 PolarHBondContact N-OE1 2.86Å; T223-E239 PolarHBondContact O-N 3.1Å; T223-E239 PolarHBondContact OG1-OE1 3.32Å; T223-E239 VanDerWaalsContact OG1-OE1 3.14Å; F225-E239 HydrophobicContact CE2-CB 3.94Å; F225-E239 HydrophobicContact CZ-CB 3.98Å; E239-M241 HydrophobicContact CG-CG 4.48Å; E239-M241 HydrophobicContact CG-SD 4.34Å; E239-K295 WeakPolarHBondContact OE1-CD 3.24Å; E239-K295 WeakPolarHBondContact OE1-CE 3.49Å; E239-K295 IonicContact OE1-NZ 2.6Å; E239-K295 PolarHBondContact OE1-NZ 3.35Å; E239-K295 IonicContact OE2-NZ 2.88Å; E239-K295 PolarHBondContact OE2-NZ 2.94Å
240	F	96.7	Very high	90.9	Very high	44 Å²	44	45.2 Å²	45.2	19%	0.193	23%	0.233	C	C	.	.			trans	-84.2	125.4	175.6	178.8	-115.2	0	0	0	110.9	L169 K179 V188 A190 D242	L169-F240 HydrophobicContact CD1-CD2 3.88Å; L169-F240 HydrophobicContact CD1-CE2 3.58Å; L169-F240 HydrophobicContact CD2-CE2 3.82Å; L169-F240 HydrophobicContact CD2-CZ 4.39Å; L169-F240 HydrophobicContact CG-CE2 4.36Å; K179-F240 HydrophobicContact CD-CE1 4.48Å; K179-F240 HydrophobicContact CD-CE2 4.34Å; K179-F240 HydrophobicContact CD-CZ 4.11Å; K179-F240 HydrophobicContact CG-CD2 4.37Å; K179-F240 HydrophobicContact CG-CE2 4.22Å; K179-F240 HydrophobicContact CG-CZ 4.43Å; V188-F240 HydrophobicContact CB-CB 4.42Å; V188-F240 HydrophobicContact CB-CD1 4.43Å; V188-F240 HydrophobicContact CG1-CB 3.95Å; V188-F240 HydrophobicContact CG1-CD1 3.7Å; V188-F240 HydrophobicContact CG1-CE1 4.38Å; V188-F240 HydrophobicContact CG1-CG 3.83Å; A190-F240 HydrophobicContact CB-CD2 4.49Å; F240-D242 HydrophobicContact CD1-CB 4.23Å; F240-D242 HydrophobicContact CE1-CB 3.59Å; F240-D242 HydrophobicContact CZ-CB 4.17Å
241	M	97.4	Very high	91.6	Very high	7 Å²	7	48.8 Å²	48.8	3%	0.034	24%	0.241	C	C	.	.			trans	-105.5	101.6	175.6	-63.3	-67.5	-76.5	0	0	108.4	I222 E239 G243 G244 L287 N289 Q293 K295	I222-M241 HydrophobicContact CD1-CG 3.59Å; I222-M241 HydrophobicContact CD1-SD 4.28Å; E239-M241 HydrophobicContact CG-CG 4.48Å; E239-M241 HydrophobicContact CG-SD 4.34Å; M241-G243 PolarHBondContact O-N 3.33Å; M241-G244 PolarHBondContact O-N 2.91Å; M241-L287 HydrophobicContact CB-CB 3.88Å; M241-L287 HydrophobicContact CB-CD1 4.32Å; M241-L287 HydrophobicContact CE-CB 4.27Å; M241-L287 HydrophobicContact CG-CB 3.79Å; M241-L287 HydrophobicContact CG-CD1 4.03Å; M241-N289 HydrophobicContact CE-CB 3.95Å; M241-N289 HydrophobicContact SD-CB 4.13Å; M241-N289 PolarHBondContact SD-ND2 2.86Å; M241-N289 VanDerWaalsContact SD-ND2 3.43Å; M241-Q293 HydrophobicContact CE-CB 4.34Å; M241-K295 HydrophobicContact CE-CB 4.18Å; M241-K295 HydrophobicContact CE-CD 4.18Å; M241-K295 HydrophobicContact CE-CG 4.02Å; M241-K295 HydrophobicContact SD-CD 4.18Å
242	D	95.9	Very high	92.4	Very high	60 Å²	60	42 Å²	42	32%	0.321	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.3	-169.4	66.4	-14.1	0	0	0	115.1	F240 N289 T290	F240-D242 HydrophobicContact CD1-CB 4.23Å; F240-D242 HydrophobicContact CE1-CB 3.59Å; F240-D242 HydrophobicContact CZ-CB 4.17Å; D242-N289 WeakPolarHBondContact OD1-CA 2.98Å; D242-N289 WeakPolarHBondContact OD1-CB 2.89Å; D242-T290 PolarHBondContact OD1-N 3.2Å; D242-T290 PolarHBondContact OD1-OG1 3.41Å; D242-T290 WeakPolarHBondContact OD2-CB 3.39Å; D242-T290 VanDerWaalsContact OD2-CG2 3.23Å; D242-T290 WeakPolarHBondContact OD2-CG2 3.24Å; D242-T290 PolarHBondContact OD2-OG1 3.02Å
243	G	96.4	Very high	93.1	Very high	3 Å²	3	40.1 Å²	40.1	3%	0.031	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.7	167.8	0	0	0	0	0	113.4	M241 Y249 V288	M241-G243 PolarHBondContact O-N 3.33Å; G243-Y249 WeakPolarHBondContact O-CE2 3.36Å; G243-Y249 PolarHBondContact O-OH 3.09Å; G243-V288 CarbonylContact C-O 3.46Å; G243-V288 WeakPolarHBondContact CA-O 3.35Å; G243-V288 PolarHBondContact N-O 3.37Å
244	G	95.6	Very high	93.8	Very high	28 Å²	28	37.1 Å²	37.1	29%	0.289	19%	0.192	S	C	.	.			trans	63.6	-158.5	-178.2	0	0	0	0	0	113.2	M241 L287 V288	M241-G244 PolarHBondContact O-N 2.91Å; G244-L287 CarbonylContact O-C 3.58Å; G244-L287 WeakPolarHBondContact O-CA 3.31Å; G244-V288 PolarHBondContact N-O 2.94Å; G244-V288 PolarHBondContact O-N 2.99Å
245	S	95.7	Very high	94.3	Very high	24 Å²	24	41.6 Å²	41.6	17%	0.168	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-87.2	158.3	-178.6	49.2	0	0	0	0	113.2	D247 V248 Y249 S284 M286	S245-D247 VanDerWaalsContact C-N 3.33Å; S245-D247 WeakPolarHBondContact CB-OD1 3.47Å; S245-D247 PolarHBondContact O-N 2.93Å; S245-D247 PolarHBondContact OG-OD1 3.09Å; S245-V248 WeakPolarHBondContact O-CG2 3.18Å; S245-Y249 VanDerWaalsContact O-CD2 3.28Å; S245-Y249 WeakPolarHBondContact O-CD2 3.44Å; S245-Y249 VanDerWaalsContact O-CE2 3.22Å; S245-Y249 WeakPolarHBondContact O-CE2 3.34Å; S245-S284 WeakPolarHBondContact CB-O 3.46Å; S245-M286 CarbonylContact C-O 3.58Å; S245-M286 WeakPolarHBondContact CA-O 3.32Å
246	L	96.8	Very high	94.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-73.5	-20.8	-175.5	-72.3	179.4	0	0	0	114.1	V248 Y249 I252 I260 P283 M286 V288 L346 W430	L246-V248 PolarHBondContact O-N 3.32Å; L246-Y249 HydrophobicContact CD2-CD2 4.24Å; L246-Y249 HydrophobicContact CD2-CE2 4.47Å; L246-Y249 WeakPolarHBondContact O-CB 3.24Å; L246-Y249 PolarHBondContact O-N 3.32Å; L246-Y249 VanDerWaalsContact O-N 3.1Å; L246-I252 HydrophobicContact CD2-CD1 4Å; L246-I260 HydrophobicContact CD1-CD1 4.17Å; L246-I260 HydrophobicContact CD1-CG2 3.53Å; L246-I260 HydrophobicContact CD2-CD1 4.09Å; L246-P283 HydrophobicContact CB-CB 4.2Å; L246-P283 PolarHBondContact N-O 2.95Å; L246-M286 HydrophobicContact CB-CB 4.36Å; L246-M286 HydrophobicContact CD1-CB 3.67Å; L246-M286 HydrophobicContact CD1-SD 4.12Å; L246-M286 HydrophobicContact CG-CB 4.05Å; L246-M286 WeakPolarHBondContact CG-O 3.28Å; L246-M286 PolarHBondContact N-O 3.12Å; L246-V288 HydrophobicContact CD2-CB 4.48Å; L246-V288 HydrophobicContact CD2-CG1 3.59Å; L246-V288 HydrophobicContact CD2-CG2 4.03Å; L246-V288 HydrophobicContact CG-CG1 4.1Å; L246-L346 HydrophobicContact CB-CD1 4.21Å; L246-L346 HydrophobicContact CB-CD2 4.07Å; L246-L346 HydrophobicContact CD1-CD1 3.91Å; L246-W430 HydrophobicContact CD2-CH2 4.39Å; L246-W430 HydrophobicContact CD2-CZ3 4.3Å
247	D	93	Very high	95.2	Very high	78 Å²	78	40.7 Å²	40.7	42%	0.417	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-64	-25	178.4	65.8	-46.4	0	0	0	113.8	S245 Y249 P283 S284	S245-D247 VanDerWaalsContact C-N 3.33Å; S245-D247 WeakPolarHBondContact CB-OD1 3.47Å; S245-D247 PolarHBondContact O-N 2.93Å; S245-D247 PolarHBondContact OG-OD1 3.09Å; D247-Y249 PolarHBondContact O-N 3.25Å; D247-P283 HydrophobicContact CB-CB 3.93Å; D247-P283 PolarHBondContact N-O 2.83Å; D247-S284 WeakPolarHBondContact OD1-CA 3.16Å
248	V	91.3	Very high	95.5	Very high	75 Å²	75	40.7 Å²	40.7	46%	0.455	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-76.1	-12.6	176.6	-59.3	0	0	0	0	112.5	S245 L246 R438	S245-V248 WeakPolarHBondContact O-CG2 3.18Å; L246-V248 PolarHBondContact O-N 3.32Å; V248-R438 PolarHBondContact O-NH2 3.16Å
249	Y	92.3	Very high	95.7	Very high	16 Å²	16	41.5 Å²	41.5	6%	0.063	21%	0.208	C	C	.	.	S	Bend	trans	-88.4	146.3	179.4	-62.3	-95.7	0	0	0	110.5	G243 S245 L246 D247 V288 W430 C434 R438	G243-Y249 WeakPolarHBondContact O-CE2 3.36Å; G243-Y249 PolarHBondContact O-OH 3.09Å; S245-Y249 VanDerWaalsContact O-CD2 3.28Å; S245-Y249 WeakPolarHBondContact O-CD2 3.44Å; S245-Y249 VanDerWaalsContact O-CE2 3.22Å; S245-Y249 WeakPolarHBondContact O-CE2 3.34Å; L246-Y249 HydrophobicContact CD2-CD2 4.24Å; L246-Y249 HydrophobicContact CD2-CE2 4.47Å; L246-Y249 WeakPolarHBondContact O-CB 3.24Å; L246-Y249 PolarHBondContact O-N 3.32Å; L246-Y249 VanDerWaalsContact O-N 3.1Å; D247-Y249 PolarHBondContact O-N 3.25Å; Y249-V288 HydrophobicContact CE2-CG2 3.94Å; Y249-W430 AromaticContact CD1-CH2 3.31Å; Y249-W430 HydrophobicContact CD1-CH2 3.31Å; Y249-W430 AromaticContact CD1-CZ2 3.7Å; Y249-W430 HydrophobicContact CD1-CZ2 3.7Å; Y249-W430 HydrophobicContact CD1-CZ3 4.05Å; Y249-W430 HydrophobicContact CD2-CH2 4.24Å; Y249-W430 AromaticContact CE1-CH2 3.85Å; Y249-W430 HydrophobicContact CE1-CH2 3.85Å; Y249-W430 HydrophobicContact CE1-CZ2 4.43Å; Y249-W430 HydrophobicContact CE1-CZ3 4.12Å; Y249-W430 AromaticContact CG-CH2 3.53Å; Y249-W430 HydrophobicContact CG-CH2 3.53Å; Y249-W430 HydrophobicContact CG-CZ2 4.13Å; Y249-W430 HydrophobicContact CG-CZ3 4.41Å; Y249-C434 HydrophobicContact CD1-CB 3.93Å; Y249-C434 HydrophobicContact CE1-CB 3.69Å; Y249-R438 VanDerWaalsContact CG-NH2 3.26Å
250	K	88	Confident	96	Very high	166 Å²	166	40.4 Å²	40.4	72%	0.722	20%	0.203	S	C	*	.			trans	-76	-156.9	171.4	-62.5	-176.6	179.5	176.5	0	109	I252	K250-I252 WeakPolarHBondContact O-CG1 3.36Å; K250-I252 PolarHBondContact O-N 2.56Å
251	R	94.7	Very high	96	Very high	125 Å²	125	38.3 Å²	38.3	47%	0.472	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-48	121.8	173.4	-162.5	175.6	-161	174	5.5	112.1	A347	R251-A347 WeakPolarHBondContact CG-O 3.31Å; R251-A347 PolarHBondContact NE-O 2.86Å
252	I	97.4	Very high	96.1	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-98.3	130.2	177.4	-50.6	-170.8	0	0	0	109	L246 K250 V256 L257 I260 L346 W430	L246-I252 HydrophobicContact CD2-CD1 4Å; K250-I252 WeakPolarHBondContact O-CG1 3.36Å; K250-I252 PolarHBondContact O-N 2.56Å; I252-V256 HydrophobicContact CG2-CB 3.88Å; I252-V256 HydrophobicContact CG2-CG1 3.94Å; I252-L257 HydrophobicContact CB-CD1 4.18Å; I252-L257 HydrophobicContact CB-CD2 3.76Å; I252-L257 HydrophobicContact CB-CG 3.73Å; I252-L257 HydrophobicContact CD1-CD2 4.07Å; I252-L257 HydrophobicContact CG1-CD2 4.39Å; I252-L257 HydrophobicContact CG2-CD2 3.81Å; I252-L257 HydrophobicContact CG2-CG 3.66Å; I252-L257 WeakPolarHBondContact O-CD1 3.12Å; I252-I260 HydrophobicContact CD1-CD1 4.34Å; I252-I260 HydrophobicContact CG2-CD1 4.41Å; I252-L346 HydrophobicContact CD1-CB 4.18Å; I252-L346 HydrophobicContact CD1-CD1 4.3Å; I252-L346 HydrophobicContact CD1-CD2 3.8Å; I252-L346 HydrophobicContact CD1-CG 4.32Å; I252-L346 HydrophobicContact CG1-CB 4.33Å; I252-L346 HydrophobicContact CG1-CD2 4.37Å; I252-L346 PolarHBondContact N-O 3.22Å; I252-W430 HydrophobicContact CB-CZ2 4.15Å; I252-W430 HydrophobicContact CD1-CH2 3.49Å; I252-W430 VanDerWaalsContact CD1-CH2 3.49Å; I252-W430 HydrophobicContact CD1-CZ2 3.92Å; I252-W430 HydrophobicContact CD1-CZ3 4.33Å; I252-W430 HydrophobicContact CG1-CH2 3.79Å; I252-W430 HydrophobicContact CG1-CZ2 3.65Å; I252-W430 HydrophobicContact CG2-CH2 4.11Å; I252-W430 HydrophobicContact CG2-CZ2 3.81Å
253	P	97.6	Very high	96.2	Very high	52 Å²	52	35.9 Å²	35.9	34%	0.338	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-60.1	141.9	176	-24	34.3	0	0	0	112.6	H255 V256 L257	P253-H255 VanDerWaalsContact C-N 3.26Å; P253-H255 VanDerWaalsContact CB-CE1 3.47Å; P253-H255 WeakPolarHBondContact CB-CE1 3.49Å; P253-H255 PolarHBondContact O-N 2.79Å; P253-H255 VanDerWaalsContact O-N 3.14Å; P253-V256 HydrophobicContact CB-CG2 4.33Å; P253-V256 HydrophobicContact CG-CG2 4.5Å; P253-V256 WeakPolarHBondContact O-CB 3.49Å; P253-V256 PolarHBondContact O-N 2.9Å; P253-L257 PolarHBondContact O-N 2.7Å
254	E	97.9	Very high	96.3	Very high	31 Å²	31	35.8 Å²	35.8	15%	0.145	18%	0.181	C	C	.	.	H	α-helix	trans	-54.1	-39.8	-175.9	-170	-171.5	126.3	0	0	113.1	V256 L257 G258 F385 S386 F389 F415	E254-V256 VanDerWaalsContact C-N 3.27Å; E254-V256 PolarHBondContact O-N 3.49Å; E254-L257 CarbonylContact O-C 3.52Å; E254-L257 PolarHBondContact O-N 3.14Å; E254-G258 PolarHBondContact O-N 2.96Å; E254-F385 WeakPolarHBondContact OE2-CA 3.4Å; E254-S386 WeakPolarHBondContact OE1-CB 3.34Å; E254-S386 PolarHBondContact OE1-OG 3.09Å; E254-S386 PolarHBondContact OE2-N 3.3Å; E254-F389 HydrophobicContact CG-CB 4.1Å; E254-F389 HydrophobicContact CG-CD1 3.9Å; E254-F389 HydrophobicContact CG-CG 3.95Å; E254-F415 HydrophobicContact CG-CE2 4.02Å; E254-F415 HydrophobicContact CG-CZ 4.41Å
255	H	97.1	Very high	96.5	Very high	93 Å²	93	34.5 Å²	34.5	43%	0.431	17%	0.168	S	C	.	.	H	α-helix	trans	-66.5	-28	-179.7	72	-84.5	0	0	0	113.5	P253 R259 Y419	P253-H255 VanDerWaalsContact C-N 3.26Å; P253-H255 VanDerWaalsContact CB-CE1 3.47Å; P253-H255 WeakPolarHBondContact CB-CE1 3.49Å; P253-H255 PolarHBondContact O-N 2.79Å; P253-H255 VanDerWaalsContact O-N 3.14Å; H255-R259 PolarHBondContact O-NH1 2.55Å; H255-Y419 HydrophobicContact CB-CE1 3.98Å
256	V	98.3	Very high	96.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-78.8	-45.4	172.3	-176.9	0	0	0	0	109	I252 P253 E254 G258 R259 I260 V426 V427 W430	I252-V256 HydrophobicContact CG2-CB 3.88Å; I252-V256 HydrophobicContact CG2-CG1 3.94Å; P253-V256 HydrophobicContact CB-CG2 4.33Å; P253-V256 HydrophobicContact CG-CG2 4.5Å; P253-V256 WeakPolarHBondContact O-CB 3.49Å; P253-V256 PolarHBondContact O-N 2.9Å; E254-V256 VanDerWaalsContact C-N 3.27Å; E254-V256 PolarHBondContact O-N 3.49Å; V256-G258 VanDerWaalsContact C-N 3.27Å; V256-G258 PolarHBondContact O-N 3.1Å; V256-R259 PolarHBondContact O-N 3.38Å; V256-R259 VanDerWaalsContact O-N 3.07Å; V256-I260 HydrophobicContact CG1-CD1 3.97Å; V256-I260 HydrophobicContact CG1-CG1 4.45Å; V256-I260 WeakPolarHBondContact O-CG1 3.18Å; V256-I260 PolarHBondContact O-N 2.97Å; V256-I260 VanDerWaalsContact O-N 3.07Å; V256-V426 HydrophobicContact CG2-CG1 4.17Å; V256-V427 HydrophobicContact CG1-CG2 4.36Å; V256-W430 HydrophobicContact CB-CG 4.5Å; V256-W430 HydrophobicContact CG1-CB 4.2Å; V256-W430 HydrophobicContact CG1-CD2 3.8Å; V256-W430 HydrophobicContact CG1-CE3 3.78Å; V256-W430 HydrophobicContact CG1-CG 3.97Å; V256-W430 HydrophobicContact CG1-CZ3 4.49Å; V256-W430 HydrophobicContact CG2-CB 4.01Å; V256-W430 HydrophobicContact CG2-CG 3.92Å
257	L	98	Very high	96.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.1	-40	176.1	-77.6	177	0	0	0	112.8	I252 P253 E254 R259 I260 A261 F343 L346 A347 F389	I252-L257 HydrophobicContact CB-CD1 4.18Å; I252-L257 HydrophobicContact CB-CD2 3.76Å; I252-L257 HydrophobicContact CB-CG 3.73Å; I252-L257 HydrophobicContact CD1-CD2 4.07Å; I252-L257 HydrophobicContact CG1-CD2 4.39Å; I252-L257 HydrophobicContact CG2-CD2 3.81Å; I252-L257 HydrophobicContact CG2-CG 3.66Å; I252-L257 WeakPolarHBondContact O-CD1 3.12Å; P253-L257 PolarHBondContact O-N 2.7Å; E254-L257 CarbonylContact O-C 3.52Å; E254-L257 PolarHBondContact O-N 3.14Å; L257-R259 VanDerWaalsContact C-N 3.26Å; L257-R259 PolarHBondContact O-N 3.1Å; L257-I260 CarbonylContact O-C 3.19Å; L257-I260 PolarHBondContact O-N 2.79Å; L257-A261 WeakPolarHBondContact O-CB 3.32Å; L257-A261 PolarHBondContact O-N 3.3Å; L257-F343 HydrophobicContact CB-CD1 4.33Å; L257-F343 HydrophobicContact CB-CE1 4.48Å; L257-F343 HydrophobicContact CD2-CD1 3.98Å; L257-F343 HydrophobicContact CD2-CE1 4.09Å; L257-F343 WeakPolarHBondContact O-CE1 3.45Å; L257-L346 HydrophobicContact CD1-CB 4.42Å; L257-L346 HydrophobicContact CD2-CB 3.72Å; L257-L346 HydrophobicContact CD2-CD1 4.09Å; L257-A347 HydrophobicContact CD1-CB 3.61Å; L257-F389 HydrophobicContact CD1-CZ 4.29Å
258	G	98.3	Very high	96.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.9	-41.3	176.6	0	0	0	0	0	112.9	E254 V256 A261 V262 F415 Y419	E254-G258 PolarHBondContact O-N 2.96Å; V256-G258 VanDerWaalsContact C-N 3.27Å; V256-G258 PolarHBondContact O-N 3.1Å; G258-A261 WeakPolarHBondContact O-CB 3.41Å; G258-A261 PolarHBondContact O-N 2.71Å; G258-V262 VanDerWaalsContact O-CG2 3.27Å; G258-V262 WeakPolarHBondContact O-CG2 3.42Å; G258-V262 PolarHBondContact O-N 3.49Å; G258-F415 VanDerWaalsContact CA-CZ 3.49Å; G258-Y419 VanDerWaalsContact C-CB 3.44Å; G258-Y419 VanDerWaalsContact CA-CD2 3.48Å
259	R	98.4	Very high	97.1	Very high	43 Å²	43	29.8 Å²	29.8	16%	0.162	14%	0.136	C	C	.	.	H	α-helix	trans	-74.7	-35.8	178.5	-69.3	176.3	178.4	84.3	-6.7	112.5	H255 V256 L257 A261 V262 A263 D421 N423 V427	H255-R259 PolarHBondContact O-NH1 2.55Å; V256-R259 PolarHBondContact O-N 3.38Å; V256-R259 VanDerWaalsContact O-N 3.07Å; L257-R259 VanDerWaalsContact C-N 3.26Å; L257-R259 PolarHBondContact O-N 3.1Å; R259-A261 VanDerWaalsContact C-N 3.33Å; R259-V262 PolarHBondContact O-N 3.28Å; R259-A263 PolarHBondContact O-N 2.97Å; R259-D421 IonicContact CZ-OD1 3.84Å; R259-D421 IonicContact CZ-OD2 3.5Å; R259-D421 VanDerWaalsContact CZ-OD2 3.29Å; R259-D421 IonicContact NE-OD1 2.61Å; R259-D421 PolarHBondContact NE-OD1 3.42Å; R259-D421 IonicContact NE-OD2 3.76Å; R259-D421 PolarHBondContact NE-OD2 3.23Å; R259-D421 IonicContact NH2-OD1 2.86Å; R259-D421 IonicContact NH2-OD2 2.81Å; R259-D421 PolarHBondContact NH2-OD2 3.12Å; R259-N423 WeakPolarHBondContact CD-O 3.08Å; R259-V427 HydrophobicContact CB-CG2 3.83Å
260	I	98.6	Very high	97.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-42.4	170.7	-63.2	173.1	0	0	0	110	L246 I252 V256 L257 V262 A263 V264 V294 F343 V427	L246-I260 HydrophobicContact CD1-CD1 4.17Å; L246-I260 HydrophobicContact CD1-CG2 3.53Å; L246-I260 HydrophobicContact CD2-CD1 4.09Å; I252-I260 HydrophobicContact CD1-CD1 4.34Å; I252-I260 HydrophobicContact CG2-CD1 4.41Å; V256-I260 HydrophobicContact CG1-CD1 3.97Å; V256-I260 HydrophobicContact CG1-CG1 4.45Å; V256-I260 WeakPolarHBondContact O-CG1 3.18Å; V256-I260 PolarHBondContact O-N 2.97Å; V256-I260 VanDerWaalsContact O-N 3.07Å; L257-I260 CarbonylContact O-C 3.19Å; L257-I260 PolarHBondContact O-N 2.79Å; I260-V262 PolarHBondContact O-N 2.93Å; I260-A263 PolarHBondContact O-N 3.08Å; I260-A263 VanDerWaalsContact O-N 3.17Å; I260-V264 HydrophobicContact CG2-CG2 4.34Å; I260-V264 WeakPolarHBondContact O-CG2 3.39Å; I260-V264 PolarHBondContact O-N 3.21Å; I260-V294 HydrophobicContact CG1-CG2 4.03Å; I260-V294 HydrophobicContact CG2-CG1 3.92Å; I260-F343 HydrophobicContact CB-CE1 4.25Å; I260-F343 HydrophobicContact CB-CZ 4.39Å; I260-F343 HydrophobicContact CG2-CE1 4.08Å; I260-F343 HydrophobicContact CG2-CZ 3.83Å; I260-V427 HydrophobicContact CG1-CG2 4.42Å
261	A	98.6	Very high	97.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.2	-43.4	178.4	0	0	0	0	0	111.5	L257 G258 R259 A263 V264 V265 F343 F392 F415 I416	L257-A261 WeakPolarHBondContact O-CB 3.32Å; L257-A261 PolarHBondContact O-N 3.3Å; G258-A261 WeakPolarHBondContact O-CB 3.41Å; G258-A261 PolarHBondContact O-N 2.71Å; R259-A261 VanDerWaalsContact C-N 3.33Å; A261-A263 VanDerWaalsContact C-N 3.31Å; A261-A263 PolarHBondContact O-N 3.17Å; A261-V264 PolarHBondContact O-N 3.3Å; A261-V265 WeakPolarHBondContact O-CB 3.21Å; A261-V265 VanDerWaalsContact O-CG2 3.25Å; A261-V265 WeakPolarHBondContact O-CG2 3.31Å; A261-V265 PolarHBondContact O-N 2.89Å; A261-F343 VanDerWaalsContact CA-CE1 3.49Å; A261-F343 HydrophobicContact CB-CD1 4.04Å; A261-F343 HydrophobicContact CB-CE1 3.43Å; A261-F343 VanDerWaalsContact CB-CE1 3.43Å; A261-F343 HydrophobicContact CB-CZ 3.72Å; A261-F392 HydrophobicContact CB-CE1 4.49Å; A261-F392 HydrophobicContact CB-CZ 4.46Å; A261-F415 HydrophobicContact CB-CE1 3.99Å; A261-I416 HydrophobicContact CB-CD1 3.63Å
262	V	98.7	Very high	97.4	Very high	9 Å²	9	20.8 Å²	20.8	6%	0.055	10%	0.098	C	C	.	.	H	α-helix	trans	-54.8	-48.4	174.1	171.4	0	0	0	0	110.9	G258 R259 I260 K266 I416 N420	G258-V262 VanDerWaalsContact O-CG2 3.27Å; G258-V262 WeakPolarHBondContact O-CG2 3.42Å; G258-V262 PolarHBondContact O-N 3.49Å; R259-V262 PolarHBondContact O-N 3.28Å; I260-V262 PolarHBondContact O-N 2.93Å; V262-K266 HydrophobicContact CG1-CD 4.07Å; V262-K266 WeakPolarHBondContact O-CB 3.47Å; V262-K266 VanDerWaalsContact O-CG 3.26Å; V262-K266 WeakPolarHBondContact O-CG 3.49Å; V262-K266 PolarHBondContact O-N 3.16Å; V262-I416 HydrophobicContact CG2-CG2 3.94Å; V262-I416 WeakPolarHBondContact CG2-O 3.26Å; V262-N420 HydrophobicContact CG1-CB 4.08Å; V262-N420 HydrophobicContact CG2-CB 4.02Å
263	A	98.5	Very high	97.1	Very high	7 Å²	7	24.4 Å²	24.4	6%	0.058	12%	0.124	C	C	.	.	H	α-helix	trans	-65.8	-44.4	-179.6	0	0	0	0	0	112.5	Y220 R259 I260 A261 K266 G267 V294	Y220-A263 HydrophobicContact CD1-CB 3.7Å; Y220-A263 HydrophobicContact CE1-CB 4.05Å; R259-A263 PolarHBondContact O-N 2.97Å; I260-A263 PolarHBondContact O-N 3.08Å; I260-A263 VanDerWaalsContact O-N 3.17Å; A261-A263 VanDerWaalsContact C-N 3.31Å; A261-A263 PolarHBondContact O-N 3.17Å; A263-K266 PolarHBondContact O-N 2.72Å; A263-G267 PolarHBondContact O-N 3.47Å; A263-V294 HydrophobicContact CB-CB 3.53Å; A263-V294 HydrophobicContact CB-CG1 3.81Å; A263-V294 HydrophobicContact CB-CG2 4.28Å
264	V	98.6	Very high	96.7	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-46.7	177.8	169.9	0	0	0	0	111.2	I260 A261 K266 G267 L268 M286 V294 L296 V339 F343	I260-V264 HydrophobicContact CG2-CG2 4.34Å; I260-V264 WeakPolarHBondContact O-CG2 3.39Å; I260-V264 PolarHBondContact O-N 3.21Å; A261-V264 PolarHBondContact O-N 3.3Å; V264-K266 PolarHBondContact O-N 2.84Å; V264-G267 PolarHBondContact O-N 3.37Å; V264-L268 HydrophobicContact CG1-CD1 4.42Å; V264-L268 PolarHBondContact O-N 2.75Å; V264-M286 HydrophobicContact CG1-CE 4.2Å; V264-M286 HydrophobicContact CG2-CE 4.32Å; V264-M286 HydrophobicContact CG2-CG 4.16Å; V264-M286 HydrophobicContact CG2-SD 3.89Å; V264-V294 HydrophobicContact CG2-CG1 4.41Å; V264-L296 HydrophobicContact CG1-CD1 4.46Å; V264-L296 HydrophobicContact CG1-CD2 4.24Å; V264-L296 HydrophobicContact CG2-CD2 4.28Å; V264-V339 HydrophobicContact CG1-CG2 3.97Å; V264-F343 HydrophobicContact CB-CE2 4.27Å; V264-F343 HydrophobicContact CB-CZ 4.3Å; V264-F343 HydrophobicContact CG1-CE2 4.26Å; V264-F343 HydrophobicContact CG2-CE2 4.22Å; V264-F343 HydrophobicContact CG2-CZ 4.09Å
265	V	98.5	Very high	96.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-63.9	-42	178.4	176.2	0	0	0	0	110.6	A261 G267 L268 T269 F392 P407 L410 L411 I416	A261-V265 WeakPolarHBondContact O-CB 3.21Å; A261-V265 VanDerWaalsContact O-CG2 3.25Å; A261-V265 WeakPolarHBondContact O-CG2 3.31Å; A261-V265 PolarHBondContact O-N 2.89Å; V265-G267 VanDerWaalsContact C-N 3.33Å; V265-G267 PolarHBondContact O-N 3.12Å; V265-L268 PolarHBondContact O-N 3.26Å; V265-T269 WeakPolarHBondContact O-CB 3.42Å; V265-T269 PolarHBondContact O-N 3.43Å; V265-T269 PolarHBondContact O-OG1 3.29Å; V265-T269 VanDerWaalsContact O-OG1 3.1Å; V265-F392 HydrophobicContact CG2-CZ 4.28Å; V265-P407 WeakPolarHBondContact CG1-O 3.26Å; V265-L410 HydrophobicContact CG1-CB 3.67Å; V265-L410 HydrophobicContact CG2-CB 4.29Å; V265-L410 HydrophobicContact CG2-CD1 4.36Å; V265-L411 HydrophobicContact CB-CD2 4.25Å; V265-L411 HydrophobicContact CG1-CD2 3.58Å; V265-L411 HydrophobicContact CG1-CG 3.82Å; V265-I416 HydrophobicContact CG2-CD1 4.13Å
266	K	98.4	Very high	95.6	Very high	50 Å²	50	28.7 Å²	28.7	22%	0.217	14%	0.139	C	C	.	.	H	α-helix	trans	-62.7	-38.2	173.8	-73.4	178.9	-177.6	174.6	0	112.4	Y220 V262 A263 V264 T269 Y270 L411 N420	Y220-K266 HydrophobicContact CD1-CB 4.39Å; Y220-K266 HydrophobicContact CD2-CB 3.45Å; Y220-K266 VanDerWaalsContact CD2-CB 3.45Å; Y220-K266 HydrophobicContact CD2-CD 4.2Å; Y220-K266 HydrophobicContact CD2-CG 4.45Å; Y220-K266 HydrophobicContact CE1-CB 4.47Å; Y220-K266 HydrophobicContact CE1-CD 4.07Å; Y220-K266 HydrophobicContact CE2-CB 3.54Å; Y220-K266 HydrophobicContact CE2-CD 3.39Å; Y220-K266 HydrophobicContact CE2-CG 4.07Å; Y220-K266 HydrophobicContact CG-CB 3.89Å; Y220-K266 VanDerWaalsContact OH-CD 3.27Å; Y220-K266 WeakPolarHBondContact OH-CD 3.41Å; Y220-K266 PolarHBondContact OH-NZ 3.04Å; V262-K266 HydrophobicContact CG1-CD 4.07Å; V262-K266 WeakPolarHBondContact O-CB 3.47Å; V262-K266 VanDerWaalsContact O-CG 3.26Å; V262-K266 WeakPolarHBondContact O-CG 3.49Å; V262-K266 PolarHBondContact O-N 3.16Å; A263-K266 PolarHBondContact O-N 2.72Å; V264-K266 PolarHBondContact O-N 2.84Å; K266-T269 PolarHBondContact O-N 3.27Å; K266-Y270 WeakPolarHBondContact O-CB 3.46Å; K266-Y270 PolarHBondContact O-N 3.21Å; K266-L411 HydrophobicContact CG-CD2 3.71Å; K266-N420 WeakPolarHBondContact CE-OD1 3.44Å; K266-N420 PolarHBondContact NZ-OD1 3.48Å
267	G	97.4	Very high	95	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-48.2	173.3	0	0	0	0	0	112.5	A263 V264 V265 Y270 L271	A263-G267 PolarHBondContact O-N 3.47Å; V264-G267 PolarHBondContact O-N 3.37Å; V265-G267 VanDerWaalsContact C-N 3.33Å; V265-G267 PolarHBondContact O-N 3.12Å; G267-Y270 WeakPolarHBondContact O-CB 3.18Å; G267-Y270 PolarHBondContact O-N 2.7Å; G267-L271 WeakPolarHBondContact O-CG 3.27Å; G267-L271 PolarHBondContact O-N 3.18Å
268	L	96.9	Very high	94.6	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-64.3	-41	176.3	-69.6	-179.8	0	0	0	112.5	V264 V265 Y270 L271 W272 H278 V281 L296 D335 V339 P407	V264-L268 HydrophobicContact CG1-CD1 4.42Å; V264-L268 PolarHBondContact O-N 2.75Å; V265-L268 PolarHBondContact O-N 3.26Å; L268-Y270 VanDerWaalsContact C-N 3.32Å; L268-Y270 PolarHBondContact O-N 3.45Å; L268-L271 PolarHBondContact O-N 3.27Å; L268-W272 VanDerWaalsContact O-CB 3.22Å; L268-W272 WeakPolarHBondContact O-CB 3.39Å; L268-W272 PolarHBondContact O-N 3.12Å; L268-H278 HydrophobicContact CD2-CB 3.93Å; L268-V281 HydrophobicContact CD2-CG2 3.92Å; L268-L296 HydrophobicContact CD2-CD1 3.97Å; L268-L296 HydrophobicContact CG-CD1 4.03Å; L268-D335 HydrophobicContact CD1-CB 4.41Å; L268-D335 HydrophobicContact CD2-CB 4.23Å; L268-V339 HydrophobicContact CD1-CG2 3.46Å; L268-V339 VanDerWaalsContact CD1-CG2 3.46Å; L268-P407 HydrophobicContact CB-CB 4.25Å; L268-P407 HydrophobicContact CB-CG 4.15Å
269	T	97.2	Very high	94.1	Very high	25 Å²	25	35.1 Å²	35.1	15%	0.153	17%	0.166	C	C	.	.	H	α-helix	trans	-58.4	-44.2	173.2	-70.4	0	0	0	0	111.5	V265 K266 W272 S273 P407 N408 L411	V265-T269 WeakPolarHBondContact O-CB 3.42Å; V265-T269 PolarHBondContact O-N 3.43Å; V265-T269 PolarHBondContact O-OG1 3.29Å; V265-T269 VanDerWaalsContact O-OG1 3.1Å; K266-T269 PolarHBondContact O-N 3.27Å; T269-W272 PolarHBondContact O-N 2.79Å; T269-S273 PolarHBondContact O-N 2.85Å; T269-P407 VanDerWaalsContact OG1-CB 3.23Å; T269-P407 WeakPolarHBondContact OG1-CB 3.38Å; T269-P407 PolarHBondContact OG1-O 2.93Å; T269-N408 WeakPolarHBondContact CG2-OD1 3.3Å; T269-L411 HydrophobicContact CG2-CD1 4.03Å
270	Y	95.8	Very high	93.5	Very high	51 Å²	51	35 Å²	35	20%	0.2	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-52.9	176.6	175.8	-95.7	0	0	0	111.8	C216 D217 I221 K266 G267 L268 W272 S273 L274	C216-Y270 WeakPolarHBondContact CA-OH 3.4Å; C216-Y270 HydrophobicContact CB-CE1 4.24Å; D217-Y270 PolarHBondContact N-OH 3.12Å; D217-Y270 WeakPolarHBondContact O-CE2 3.25Å; D217-Y270 VanDerWaalsContact O-CZ 3.31Å; D217-Y270 PolarHBondContact O-OH 2.86Å; D217-Y270 VanDerWaalsContact O-OH 3.1Å; I221-Y270 HydrophobicContact CG1-CD1 3.7Å; I221-Y270 HydrophobicContact CG1-CE1 4.21Å; K266-Y270 WeakPolarHBondContact O-CB 3.46Å; K266-Y270 PolarHBondContact O-N 3.21Å; G267-Y270 WeakPolarHBondContact O-CB 3.18Å; G267-Y270 PolarHBondContact O-N 2.7Å; L268-Y270 VanDerWaalsContact C-N 3.32Å; L268-Y270 PolarHBondContact O-N 3.45Å; Y270-W272 VanDerWaalsContact C-N 3.28Å; Y270-W272 PolarHBondContact O-N 3.5Å; Y270-S273 WeakPolarHBondContact O-CB 3.31Å; Y270-S273 PolarHBondContact O-N 3.34Å; Y270-S273 VanDerWaalsContact O-N 3.15Å; Y270-S273 PolarHBondContact O-OG 2.75Å; Y270-L274 HydrophobicContact CD1-CD1 4.36Å; Y270-L274 HydrophobicContact CE1-CD1 3.62Å; Y270-L274 PolarHBondContact O-N 3.03Å
271	L	92.4	Very high	93.3	Very high	1 Å²	1	35 Å²	35	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-58.2	-42.2	177.7	-67.7	177.5	0	0	0	111.8	I221 G267 L268 S273 L274 K275 I276 H278 F299	I221-L271 HydrophobicContact CD1-CD1 3.92Å; I221-L271 HydrophobicContact CD1-CD2 4Å; I221-L271 HydrophobicContact CD1-CG 3.75Å; I221-L271 HydrophobicContact CG1-CD2 4.36Å; I221-L271 HydrophobicContact CG1-CG 4.49Å; G267-L271 WeakPolarHBondContact O-CG 3.27Å; G267-L271 PolarHBondContact O-N 3.18Å; L268-L271 PolarHBondContact O-N 3.27Å; L271-S273 VanDerWaalsContact C-N 3.31Å; L271-S273 PolarHBondContact O-N 3.4Å; L271-L274 CarbonylContact O-C 3.56Å; L271-L274 WeakPolarHBondContact O-CA 3.09Å; L271-L274 WeakPolarHBondContact O-CB 3.33Å; L271-L274 PolarHBondContact O-N 2.96Å; L271-K275 PolarHBondContact O-N 3.11Å; L271-I276 CarbonylContact C-O 3.59Å; L271-I276 HydrophobicContact CB-CB 4.23Å; L271-I276 HydrophobicContact CD2-CB 4.42Å; L271-I276 HydrophobicContact CD2-CD1 4.35Å; L271-I276 HydrophobicContact CD2-CG2 4.26Å; L271-I276 PolarHBondContact O-N 3.24Å; L271-H278 HydrophobicContact CD1-CB 4.29Å; L271-F299 HydrophobicContact CD1-CB 3.86Å; L271-F299 HydrophobicContact CD1-CD2 4Å; L271-F299 HydrophobicContact CD1-CG 3.91Å; L271-F299 HydrophobicContact CD2-CD2 3.5Å; L271-F299 HydrophobicContact CD2-CE2 3.52Å; L271-F299 HydrophobicContact CD2-CG 4.14Å; L271-F299 HydrophobicContact CD2-CZ 4.2Å; L271-F299 HydrophobicContact CG-CD2 4.42Å
272	W	92.2	Very high	93.1	Very high	66 Å²	66	36 Å²	36	25%	0.25	17%	0.173	C	C	.	.	H	α-helix	trans	-66	-33.3	-180	-172.5	43.3	0	0	0	112.8	L268 T269 Y270 L274 K275 I332 V406 P407 N408	L268-W272 VanDerWaalsContact O-CB 3.22Å; L268-W272 WeakPolarHBondContact O-CB 3.39Å; L268-W272 PolarHBondContact O-N 3.12Å; T269-W272 PolarHBondContact O-N 2.79Å; Y270-W272 VanDerWaalsContact C-N 3.28Å; Y270-W272 PolarHBondContact O-N 3.5Å; W272-L274 PolarHBondContact O-N 3.01Å; W272-K275 WeakPolarHBondContact O-CA 3.05Å; W272-K275 PolarHBondContact O-N 3.29Å; W272-I332 HydrophobicContact CB-CD1 4.03Å; W272-I332 HydrophobicContact CB-CG1 4.29Å; W272-I332 HydrophobicContact CD2-CG1 4.13Å; W272-I332 HydrophobicContact CD2-CG2 4.44Å; W272-I332 HydrophobicContact CG-CB 4.36Å; W272-I332 HydrophobicContact CG-CD1 4.09Å; W272-I332 HydrophobicContact CG-CG1 3.88Å; W272-I332 HydrophobicContact CZ2-CG2 4.09Å; W272-V406 HydrophobicContact CH2-CB 3.48Å; W272-V406 VanDerWaalsContact CH2-CB 3.48Å; W272-V406 HydrophobicContact CH2-CG1 3.69Å; W272-V406 HydrophobicContact CH2-CG2 3.69Å; W272-V406 HydrophobicContact CZ2-CB 4.22Å; W272-V406 HydrophobicContact CZ2-CG1 4.04Å; W272-V406 HydrophobicContact CZ3-CB 3.67Å; W272-V406 HydrophobicContact CZ3-CG1 4.37Å; W272-V406 HydrophobicContact CZ3-CG2 3.82Å; W272-P407 HydrophobicContact CE3-CB 4.44Å; W272-P407 HydrophobicContact CE3-CG 4.32Å; W272-N408 HydrophobicContact CZ3-CB 4.23Å
273	S	92.1	Very high	92.9	Very high	79 Å²	79	35.6 Å²	35.6	55%	0.552	17%	0.17	S	C	*	.	H	α-helix	trans	-62.1	-32.9	172.9	81.4	0	0	0	0	112.1	T269 Y270 L271 K275	T269-S273 PolarHBondContact O-N 2.85Å; Y270-S273 WeakPolarHBondContact O-CB 3.31Å; Y270-S273 PolarHBondContact O-N 3.34Å; Y270-S273 VanDerWaalsContact O-N 3.15Å; Y270-S273 PolarHBondContact O-OG 2.75Å; L271-S273 VanDerWaalsContact C-N 3.31Å; L271-S273 PolarHBondContact O-N 3.4Å; S273-K275 VanDerWaalsContact C-N 3.27Å; S273-K275 PolarHBondContact O-N 3.25Å
274	L	88.8	Confident	92.6	Very high	75 Å²	75	37.1 Å²	37.1	39%	0.393	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	4.6	173.5	-59.7	-179.3	0	0	0	113.4	Y270 L271 W272 I276	Y270-L274 HydrophobicContact CD1-CD1 4.36Å; Y270-L274 HydrophobicContact CE1-CD1 3.62Å; Y270-L274 PolarHBondContact O-N 3.03Å; L271-L274 CarbonylContact O-C 3.56Å; L271-L274 WeakPolarHBondContact O-CA 3.09Å; L271-L274 WeakPolarHBondContact O-CB 3.33Å; L271-L274 PolarHBondContact O-N 2.96Å; W272-L274 PolarHBondContact O-N 3.01Å; L274-I276 HydrophobicContact CB-CD1 3.7Å; L274-I276 HydrophobicContact CB-CG1 4.07Å; L274-I276 HydrophobicContact CD1-CD1 4.04Å; L274-I276 PolarHBondContact O-N 2.85Å
275	K	86.6	Confident	92.4	Very high	170 Å²	170	37.3 Å²	37.3	74%	0.739	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	28.4	-175.2	-50.9	-58.5	178.1	-167.9	0	114	L271 W272 S273	L271-K275 PolarHBondContact O-N 3.11Å; W272-K275 WeakPolarHBondContact O-CA 3.05Å; W272-K275 PolarHBondContact O-N 3.29Å; S273-K275 VanDerWaalsContact C-N 3.27Å; S273-K275 PolarHBondContact O-N 3.25Å
276	I	85.5	Confident	92.3	Very high	20 Å²	20	37.3 Å²	37.3	10%	0.103	18%	0.182	C	C	.	.			trans	-98.9	133.7	175.3	-58.2	161.7	0	0	0	108.5	I212 L271 L274 F299	I212-I276 HydrophobicContact CG2-CD1 3.23Å; I212-I276 HydrophobicContact CG2-CG1 3.88Å; L271-I276 CarbonylContact C-O 3.59Å; L271-I276 HydrophobicContact CB-CB 4.23Å; L271-I276 HydrophobicContact CD2-CB 4.42Å; L271-I276 HydrophobicContact CD2-CD1 4.35Å; L271-I276 HydrophobicContact CD2-CG2 4.26Å; L271-I276 PolarHBondContact O-N 3.24Å; L274-I276 HydrophobicContact CB-CD1 3.7Å; L274-I276 HydrophobicContact CB-CG1 4.07Å; L274-I276 HydrophobicContact CD1-CD1 4.04Å; L274-I276 PolarHBondContact O-N 2.85Å; I276-F299 HydrophobicContact CG2-CD2 4.24Å
277	L	86.3	Confident	92.3	Very high	38 Å²	38	36.3 Å²	36.3	20%	0.199	18%	0.179	C	C	.	.			trans	-98.1	142.1	167.9	-59.5	179.7	0	0	0	108.7	R279 Y330 I332	L277-R279 HydrophobicContact CB-CG 3.91Å; L277-Y330 HydrophobicContact CD1-CE2 4.35Å; L277-I332 HydrophobicContact CD2-CB 3.99Å; L277-I332 HydrophobicContact CD2-CD1 4.07Å
278	H	89.6	Confident	92.3	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.014	18%	0.179	C	C	.	.			trans	-74.7	-46.7	179.1	-171.5	-47	0	0	0	111.5	L268 L271 D280 V281 C297 F299 G300 D335	L268-H278 HydrophobicContact CD2-CB 3.93Å; L271-H278 HydrophobicContact CD1-CB 4.29Å; H278-D280 PolarHBondContact CE1-O 2.87Å; H278-D280 PolarHBondContact ND1-N 3.16Å; H278-D280 PolarHBondContact O-N 3.16Å; H278-V281 HydrophobicContact CB-CG2 3.71Å; H278-C297 PolarHBondContact CE1-O 3.07Å; H278-C297 VanDerWaalsContact CE1-O 3.26Å; H278-C297 PolarHBondContact NE2-O 3.38Å; H278-F299 HydrophobicContact CB-CB 4.24Å; H278-G300 PolarHBondContact O-N 3.14Å; H278-D335 PolarHBondContact N-OD2 3.05Å
279	R	87.3	Confident	92.4	Very high	95 Å²	95	36.2 Å²	36.2	36%	0.358	18%	0.178	S	C	.	.	S	Bend	trans	67.7	0.2	177.5	-53	177.4	173.3	176.1	-2.8	117	L277 R324 Y330 D335	L277-R279 HydrophobicContact CB-CG 3.91Å; R279-R324 PolarHBondContact O-NH1 2.86Å; R279-R324 PolarHBondContact O-NH2 3.2Å; R279-Y330 HydrophobicContact CG-CE2 4.43Å; R279-D335 WeakPolarHBondContact CA-OD1 3.07Å; R279-D335 PolarHBondContact N-OD1 3.42Å
280	D	86.4	Confident	92.4	Very high	40 Å²	40	37 Å²	37	21%	0.214	18%	0.183	C	C	.	.			trans	-154.2	46.6	-178.5	-165.1	27.5	0	0	0	110.6	H278 K282 N285 T316	H278-D280 PolarHBondContact CE1-O 2.87Å; H278-D280 PolarHBondContact ND1-N 3.16Å; H278-D280 PolarHBondContact O-N 3.16Å; D280-K282 PolarHBondContact O-N 3.03Å; D280-K282 IonicContact OD1-NZ 2.68Å; D280-K282 PolarHBondContact OD1-NZ 3.3Å; D280-K282 WeakPolarHBondContact OD2-CE 3.19Å; D280-K282 IonicContact OD2-NZ 3.67Å; D280-K282 PolarHBondContact OD2-NZ 2.98Å; D280-N285 VanDerWaalsContact CG-ND2 3.31Å; D280-N285 PolarHBondContact O-ND2 3.27Å; D280-N285 PolarHBondContact OD2-ND2 3.15Å; D280-T316 WeakPolarHBondContact OD1-CG2 3.4Å
281	V	93.5	Very high	92.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.2	C	C	.	.			trans	-72.8	118.3	177.7	-179	0	0	0	0	108.6	L268 H278 M286 D335 S338 V339	L268-V281 HydrophobicContact CD2-CG2 3.92Å; H278-V281 HydrophobicContact CB-CG2 3.71Å; V281-M286 HydrophobicContact CG1-CE 3.37Å; V281-D335 HydrophobicContact CG2-CB 4.07Å; V281-S338 VanDerWaalsContact O-CB 3.32Å; V281-S338 WeakPolarHBondContact O-CB 3.18Å; V281-V339 HydrophobicContact CG1-CG2 3.9Å
282	K	93.4	Very high	92.7	Very high	22 Å²	22	41.7 Å²	41.7	10%	0.096	20%	0.202	C	C	.	.	S	Bend	trans	-160.8	163.9	178.2	60.7	-174.6	177.3	-142.9	0	110.1	D280 S284 N285 M286 Y319 S342	D280-K282 PolarHBondContact O-N 3.03Å; D280-K282 IonicContact OD1-NZ 2.68Å; D280-K282 PolarHBondContact OD1-NZ 3.3Å; D280-K282 WeakPolarHBondContact OD2-CE 3.19Å; D280-K282 IonicContact OD2-NZ 3.67Å; D280-K282 PolarHBondContact OD2-NZ 2.98Å; K282-S284 WeakPolarHBondContact CD-OG 3.42Å; K282-S284 WeakPolarHBondContact CE-OG 3.46Å; K282-S284 WeakPolarHBondContact CG-OG 3.41Å; K282-S284 PolarHBondContact O-N 3.35Å; K282-S284 VanDerWaalsContact O-N 3.16Å; K282-N285 WeakPolarHBondContact CE-ND2 3.45Å; K282-N285 HydrophobicContact CG-CB 4.2Å; K282-N285 PolarHBondContact O-N 2.75Å; K282-M286 WeakPolarHBondContact O-CG 3.15Å; K282-M286 PolarHBondContact O-N 3.5Å; K282-Y319 HydrophobicContact CB-CD1 3.96Å; K282-Y319 HydrophobicContact CB-CD2 3.81Å; K282-Y319 HydrophobicContact CB-CE1 4.01Å; K282-Y319 HydrophobicContact CB-CE2 3.89Å; K282-Y319 HydrophobicContact CB-CG 3.85Å; K282-Y319 HydrophobicContact CD-CD2 4.26Å; K282-Y319 HydrophobicContact CD-CE2 4.28Å; K282-S342 WeakPolarHBondContact CA-OG 3.39Å
283	P	95.8	Very high	93	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-54	-35.6	-179.7	-30.7	39.2	0	0	0	114.6	L246 D247 N285 M286 Y319 L346	L246-P283 HydrophobicContact CB-CB 4.2Å; L246-P283 PolarHBondContact N-O 2.95Å; D247-P283 HydrophobicContact CB-CB 3.93Å; D247-P283 PolarHBondContact N-O 2.83Å; P283-N285 PolarHBondContact O-N 3.19Å; P283-M286 PolarHBondContact O-N 2.96Å; P283-Y319 HydrophobicContact CG-CE1 4.38Å; P283-L346 HydrophobicContact CB-CD1 4.5Å; P283-L346 HydrophobicContact CB-CD2 4Å; P283-L346 HydrophobicContact CB-CG 4.36Å; P283-L346 HydrophobicContact CG-CD1 4.32Å; P283-L346 HydrophobicContact CG-CD2 4.12Å; P283-L346 HydrophobicContact CG-CG 4.03Å
284	S	91.8	Very high	93.3	Very high	39 Å²	39	38.4 Å²	38.4	27%	0.273	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-69.4	-16.5	177.7	47.5	0	0	0	0	114.6	S245 D247 K282	S245-S284 WeakPolarHBondContact CB-O 3.46Å; D247-S284 WeakPolarHBondContact OD1-CA 3.16Å; K282-S284 WeakPolarHBondContact CD-OG 3.42Å; K282-S284 WeakPolarHBondContact CE-OG 3.46Å; K282-S284 WeakPolarHBondContact CG-OG 3.41Å; K282-S284 PolarHBondContact O-N 3.35Å; K282-S284 VanDerWaalsContact O-N 3.16Å
285	N	93.6	Very high	93.8	Very high	7 Å²	7	35.4 Å²	35.4	4%	0.037	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-104.7	11.1	176.1	-70.3	-10.9	0	0	0	112.9	D280 K282 P283 C297	D280-N285 VanDerWaalsContact CG-ND2 3.31Å; D280-N285 PolarHBondContact O-ND2 3.27Å; D280-N285 PolarHBondContact OD2-ND2 3.15Å; K282-N285 WeakPolarHBondContact CE-ND2 3.45Å; K282-N285 HydrophobicContact CG-CB 4.2Å; K282-N285 PolarHBondContact O-N 2.75Å; P283-N285 PolarHBondContact O-N 3.19Å; N285-C297 PolarHBondContact O-N 3.31Å
286	M	97.3	Very high	94.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	108.8	173.7	-63.3	173.3	-168.3	0	0	108.5	S245 L246 V264 V281 K282 P283 L296 F343	S245-M286 CarbonylContact C-O 3.58Å; S245-M286 WeakPolarHBondContact CA-O 3.32Å; L246-M286 HydrophobicContact CB-CB 4.36Å; L246-M286 HydrophobicContact CD1-CB 3.67Å; L246-M286 HydrophobicContact CD1-SD 4.12Å; L246-M286 HydrophobicContact CG-CB 4.05Å; L246-M286 WeakPolarHBondContact CG-O 3.28Å; L246-M286 PolarHBondContact N-O 3.12Å; V264-M286 HydrophobicContact CG1-CE 4.2Å; V264-M286 HydrophobicContact CG2-CE 4.32Å; V264-M286 HydrophobicContact CG2-CG 4.16Å; V264-M286 HydrophobicContact CG2-SD 3.89Å; V281-M286 HydrophobicContact CG1-CE 3.37Å; K282-M286 WeakPolarHBondContact O-CG 3.15Å; K282-M286 PolarHBondContact O-N 3.5Å; P283-M286 PolarHBondContact O-N 2.96Å; M286-L296 HydrophobicContact CG-CD2 3.84Å; M286-F343 HydrophobicContact CE-CE2 4.21Å; M286-F343 HydrophobicContact SD-CE2 4.26Å
287	L	97.9	Very high	94.5	Very high	30 Å²	30	26.9 Å²	26.9	16%	0.157	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	143.3	-175.9	-60	179.4	0	0	0	111.6	I222 M241 G244 V294 K295 C297	I222-L287 HydrophobicContact CD1-CD1 3.8Å; I222-L287 HydrophobicContact CG1-CD1 4.38Å; M241-L287 HydrophobicContact CB-CB 3.88Å; M241-L287 HydrophobicContact CB-CD1 4.32Å; M241-L287 HydrophobicContact CE-CB 4.27Å; M241-L287 HydrophobicContact CG-CB 3.79Å; M241-L287 HydrophobicContact CG-CD1 4.03Å; G244-L287 CarbonylContact O-C 3.58Å; G244-L287 WeakPolarHBondContact O-CA 3.31Å; L287-V294 CarbonylContact O-C 3.59Å; L287-V294 VanDerWaalsContact O-CA 3.32Å; L287-V294 WeakPolarHBondContact O-CA 3.48Å; L287-K295 PolarHBondContact N-O 3.41Å; L287-K295 PolarHBondContact O-N 2.83Å; L287-C297 HydrophobicContact CD1-CB 3.83Å; L287-C297 HydrophobicContact CG-CB 4.29Å
288	V	98.4	Very high	94.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	158	176.7	-62.5	0	0	0	0	111.9	G243 G244 L246 Y249 Q293 V294 V431	G243-V288 CarbonylContact C-O 3.46Å; G243-V288 WeakPolarHBondContact CA-O 3.35Å; G243-V288 PolarHBondContact N-O 3.37Å; G244-V288 PolarHBondContact N-O 2.94Å; G244-V288 PolarHBondContact O-N 2.99Å; L246-V288 HydrophobicContact CD2-CB 4.48Å; L246-V288 HydrophobicContact CD2-CG1 3.59Å; L246-V288 HydrophobicContact CD2-CG2 4.03Å; L246-V288 HydrophobicContact CG-CG1 4.1Å; Y249-V288 HydrophobicContact CE2-CG2 3.94Å; V288-Q293 VanDerWaalsContact CA-O 3.32Å; V288-Q293 WeakPolarHBondContact CA-O 3.45Å; V288-V294 HydrophobicContact CG1-CB 4.47Å; V288-V294 HydrophobicContact CG1-CG1 4.39Å; V288-V294 HydrophobicContact CG1-CG2 3.97Å; V288-V431 HydrophobicContact CB-CG2 4.09Å; V288-V431 HydrophobicContact CG2-CG2 3.79Å
289	N	97.9	Very high	93.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.133	C	C	.	.			trans	-137.7	167.2	175.9	70.3	23.6	0	0	0	112.5	M241 D242 R291 G292 Q293	M241-N289 HydrophobicContact CE-CB 3.95Å; M241-N289 HydrophobicContact SD-CB 4.13Å; M241-N289 PolarHBondContact SD-ND2 2.86Å; M241-N289 VanDerWaalsContact SD-ND2 3.43Å; D242-N289 WeakPolarHBondContact OD1-CA 2.98Å; D242-N289 WeakPolarHBondContact OD1-CB 2.89Å; N289-R291 PolarHBondContact ND2-NH2 3.03Å; N289-R291 PolarHBondContact O-N 3.29Å; N289-R291 VanDerWaalsContact O-N 3.1Å; N289-R291 WeakPolarHBondContact OD1-CA 3.45Å; N289-R291 WeakPolarHBondContact OD1-CB 3.42Å; N289-R291 PolarHBondContact OD1-N 3.49Å; N289-R291 VanDerWaalsContact OD1-N 3.11Å; N289-G292 PolarHBondContact O-N 3.42Å; N289-G292 PolarHBondContact OD1-N 3.43Å; N289-Q293 PolarHBondContact N-O 3.4Å; N289-Q293 PolarHBondContact ND2-OE1 2.92Å; N289-Q293 WeakPolarHBondContact OD1-CB 3.49Å; N289-Q293 PolarHBondContact OD1-N 2.75Å
290	T	97.8	Very high	92.6	Very high	42 Å²	42	24.8 Å²	24.8	26%	0.258	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-11.8	-179.4	56.2	0	0	0	0	113.4	D242 G292 S428 V431 L435	D242-T290 PolarHBondContact OD1-N 3.2Å; D242-T290 PolarHBondContact OD1-OG1 3.41Å; D242-T290 WeakPolarHBondContact OD2-CB 3.39Å; D242-T290 VanDerWaalsContact OD2-CG2 3.23Å; D242-T290 WeakPolarHBondContact OD2-CG2 3.24Å; D242-T290 PolarHBondContact OD2-OG1 3.02Å; T290-G292 VanDerWaalsContact C-N 3.31Å; T290-S428 VanDerWaalsContact O-CB 3.31Å; T290-S428 WeakPolarHBondContact O-CB 3.4Å; T290-S428 PolarHBondContact O-OG 3.16Å; T290-V431 HydrophobicContact CG2-CG1 4.38Å; T290-L435 HydrophobicContact CG2-CD1 3.88Å
291	R	97.7	Very high	91.2	Very high	144 Å²	144	24.3 Å²	24.3	54%	0.543	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	0.3	171.3	-58	-176.4	-64.1	-85.2	2.9	113	N289 Q293	N289-R291 PolarHBondContact ND2-NH2 3.03Å; N289-R291 PolarHBondContact O-N 3.29Å; N289-R291 VanDerWaalsContact O-N 3.1Å; N289-R291 WeakPolarHBondContact OD1-CA 3.45Å; N289-R291 WeakPolarHBondContact OD1-CB 3.42Å; N289-R291 PolarHBondContact OD1-N 3.49Å; N289-R291 VanDerWaalsContact OD1-N 3.11Å; R291-Q293 VanDerWaalsContact C-N 3.31Å; R291-Q293 HydrophobicContact CB-CG 4.35Å; R291-Q293 VanDerWaalsContact NE-OE1 3.16Å; R291-Q293 PolarHBondContact O-N 2.95Å
292	G	97.7	Very high	89.5	Confident	6 Å²	6	24.4 Å²	24.4	6%	0.062	13%	0.131	C	C	.	.			trans	77.9	13.1	-179.2	0	0	0	0	0	114.4	N289 T290 A424	N289-G292 PolarHBondContact O-N 3.42Å; N289-G292 PolarHBondContact OD1-N 3.43Å; T290-G292 VanDerWaalsContact C-N 3.31Å; G292-A424 WeakPolarHBondContact CA-O 3.39Å
293	Q	98.3	Very high	87.8	Confident	68 Å²	68	26.5 Å²	26.5	32%	0.318	15%	0.146	S	C	.	.			trans	-77.9	141.8	174.3	-53.9	176.2	-62.7	0	0	109.5	M241 V288 N289 R291	M241-Q293 HydrophobicContact CE-CB 4.34Å; V288-Q293 VanDerWaalsContact CA-O 3.32Å; V288-Q293 WeakPolarHBondContact CA-O 3.45Å; N289-Q293 PolarHBondContact N-O 3.4Å; N289-Q293 PolarHBondContact ND2-OE1 2.92Å; N289-Q293 WeakPolarHBondContact OD1-CB 3.49Å; N289-Q293 PolarHBondContact OD1-N 2.75Å; R291-Q293 VanDerWaalsContact C-N 3.31Å; R291-Q293 HydrophobicContact CB-CG 4.35Å; R291-Q293 VanDerWaalsContact NE-OE1 3.16Å; R291-Q293 PolarHBondContact O-N 2.95Å
294	V	98.4	Very high	85.7	Confident	8 Å²	8	29.7 Å²	29.7	5%	0.048	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.9	178	179.1	0	0	0	0	107.3	I260 A263 V264 L287 V288 V427	I260-V294 HydrophobicContact CG1-CG2 4.03Å; I260-V294 HydrophobicContact CG2-CG1 3.92Å; A263-V294 HydrophobicContact CB-CB 3.53Å; A263-V294 HydrophobicContact CB-CG1 3.81Å; A263-V294 HydrophobicContact CB-CG2 4.28Å; V264-V294 HydrophobicContact CG2-CG1 4.41Å; L287-V294 CarbonylContact O-C 3.59Å; L287-V294 VanDerWaalsContact O-CA 3.32Å; L287-V294 WeakPolarHBondContact O-CA 3.48Å; V288-V294 HydrophobicContact CG1-CB 4.47Å; V288-V294 HydrophobicContact CG1-CG1 4.39Å; V288-V294 HydrophobicContact CG1-CG2 3.97Å; V294-V427 HydrophobicContact CG2-CG1 4.11Å
295	K	98	Very high	84	Confident	11 Å²	11	27.8 Å²	27.8	5%	0.048	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	138.7	-174.2	-63.9	-172.2	172.5	-164.9	0	111.9	P219 Y220 I222 E239 M241 L287	P219-K295 VanDerWaalsContact O-CE 3.24Å; P219-K295 WeakPolarHBondContact O-CE 3.44Å; P219-K295 WeakPolarHBondContact O-CG 3.31Å; Y220-K295 WeakPolarHBondContact O-CA 3.18Å; I222-K295 HydrophobicContact CD1-CD 4.44Å; E239-K295 WeakPolarHBondContact OE1-CD 3.24Å; E239-K295 WeakPolarHBondContact OE1-CE 3.49Å; E239-K295 IonicContact OE1-NZ 2.6Å; E239-K295 PolarHBondContact OE1-NZ 3.35Å; E239-K295 IonicContact OE2-NZ 2.88Å; E239-K295 PolarHBondContact OE2-NZ 2.94Å; M241-K295 HydrophobicContact CE-CB 4.18Å; M241-K295 HydrophobicContact CE-CD 4.18Å; M241-K295 HydrophobicContact CE-CG 4.02Å; M241-K295 HydrophobicContact SD-CD 4.18Å; L287-K295 PolarHBondContact N-O 3.41Å; L287-K295 PolarHBondContact O-N 2.83Å
296	L	96.1	Very high	82.3	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	138.4	170.1	-66.6	169.6	0	0	0	110.2	Y220 I221 I222 V264 L268 M286	Y220-L296 PolarHBondContact O-N 3.45Å; I221-L296 HydrophobicContact CD1-CB 4.07Å; I221-L296 HydrophobicContact CD1-CD1 4.41Å; I222-L296 WeakPolarHBondContact CB-O 3.43Å; I222-L296 PolarHBondContact N-O 3.28Å; V264-L296 HydrophobicContact CG1-CD1 4.46Å; V264-L296 HydrophobicContact CG1-CD2 4.24Å; V264-L296 HydrophobicContact CG2-CD2 4.28Å; L268-L296 HydrophobicContact CD2-CD1 3.97Å; L268-L296 HydrophobicContact CG-CD1 4.03Å; M286-L296 HydrophobicContact CG-CD2 3.84Å
297	C	91.4	Very high	80.3	Confident	11 Å²	11	35.3 Å²	35.3	7%	0.074	19%	0.191	C	C	.	.			trans	-128.7	173.9	174.4	69.1	0	0	0	0	111.2	I222 H278 N285 L287 F299	I222-C297 HydrophobicContact CB-CB 3.94Å; I222-C297 HydrophobicContact CG1-CB 4.4Å; I222-C297 HydrophobicContact CG2-CB 3.66Å; H278-C297 PolarHBondContact CE1-O 3.07Å; H278-C297 VanDerWaalsContact CE1-O 3.26Å; H278-C297 PolarHBondContact NE2-O 3.38Å; N285-C297 PolarHBondContact O-N 3.31Å; L287-C297 HydrophobicContact CD1-CB 3.83Å; L287-C297 HydrophobicContact CG-CB 4.29Å; C297-F299 PolarHBondContact O-N 3.43Å
298	D	82.9	Confident	78	Confident	52 Å²	52	36 Å²	36	28%	0.278	20%	0.198	S	C	.	.	S	Bend	trans	52.4	32.4	177.8	-72.6	-28.5	0	0	0	113.4	K192 V301	K192-D298 IonicContact NZ-OD1 3.56Å; K192-D298 PolarHBondContact NZ-OD1 3.09Å; K192-D298 IonicContact NZ-OD2 3.13Å; K192-D298 PolarHBondContact NZ-OD2 3.5Å; D298-V301 HydrophobicContact CB-CG2 4.12Å; D298-V301 WeakPolarHBondContact O-CG2 3.32Å
299	F	78.1	Confident	75.8	Confident	6 Å²	6	37.8 Å²	37.8	3%	0.026	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	145.3	172.8	64.5	-85.7	0	0	0	110.3	L213 C216 I221 I222 L271 I276 H278 C297 V301	L213-F299 HydrophobicContact CD2-CD2 3.97Å; L213-F299 HydrophobicContact CD2-CE1 4.03Å; L213-F299 HydrophobicContact CD2-CE2 3.3Å; L213-F299 HydrophobicContact CD2-CZ 3.34Å; C216-F299 HydrophobicContact CB-CZ 4.17Å; I221-F299 HydrophobicContact CG2-CD1 4.03Å; I221-F299 HydrophobicContact CG2-CE1 3.15Å; I221-F299 HydrophobicContact CG2-CE2 4.4Å; I221-F299 HydrophobicContact CG2-CZ 3.36Å; I222-F299 HydrophobicContact CG2-CE1 4.32Å; L271-F299 HydrophobicContact CD1-CB 3.86Å; L271-F299 HydrophobicContact CD1-CD2 4Å; L271-F299 HydrophobicContact CD1-CG 3.91Å; L271-F299 HydrophobicContact CD2-CD2 3.5Å; L271-F299 HydrophobicContact CD2-CE2 3.52Å; L271-F299 HydrophobicContact CD2-CG 4.14Å; L271-F299 HydrophobicContact CD2-CZ 4.2Å; L271-F299 HydrophobicContact CG-CD2 4.42Å; I276-F299 HydrophobicContact CG2-CD2 4.24Å; H278-F299 HydrophobicContact CB-CB 4.24Å; C297-F299 PolarHBondContact O-N 3.43Å; F299-V301 PolarHBondContact O-N 2.95Å
300	G	62.6	Low	73.4	Confident	33 Å²	33	40 Å²	40	34%	0.34	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	24.9	172.1	0	0	0	0	0	113.8	H278 S302	H278-G300 PolarHBondContact O-N 3.14Å; G300-S302 PolarHBondContact O-N 3.27Å
301	V	57.2	Low	70.5	Confident	31 Å²	31	47.3 Å²	47.3	19%	0.188	25%	0.253	C	S	.	.			trans	-55.7	133.7	179	-178.7	0	0	0	0	107.3	D298 F299 T303 L305 V306	D298-V301 HydrophobicContact CB-CG2 4.12Å; D298-V301 WeakPolarHBondContact O-CG2 3.32Å; F299-V301 PolarHBondContact O-N 2.95Å; V301-T303 PolarHBondContact O-N 2.67Å; V301-L305 HydrophobicContact CG1-CB 3.99Å; V301-L305 HydrophobicContact CG1-CD2 3.34Å; V301-L305 HydrophobicContact CG1-CG 3.83Å; V301-V306 HydrophobicContact CB-CG2 4.18Å; V301-V306 HydrophobicContact CG1-CG2 4.25Å
302	S	57.3	Low	67.7	Low	1 Å²	1	44.4 Å²	44.4	1%	0.007	25%	0.252	C	S	.	.			trans	-40.2	131.3	-170.5	161.7	0	0	0	0	111	E209 G300 Q304 L305 V306	E209-S302 VanDerWaalsContact CD-OG 3.26Å; E209-S302 VanDerWaalsContact OE2-C 3.23Å; E209-S302 WeakPolarHBondContact OE2-CA 3.23Å; E209-S302 WeakPolarHBondContact OE2-CB 3.43Å; E209-S302 PolarHBondContact OE2-OG 3.31Å; G300-S302 PolarHBondContact O-N 3.27Å; S302-Q304 PolarHBondContact O-N 3.05Å; S302-Q304 VanDerWaalsContact O-N 3.09Å; S302-Q304 PolarHBondContact OG-N 3.4Å; S302-L305 CarbonylContact O-C 3.55Å; S302-L305 WeakPolarHBondContact O-CA 3.46Å; S302-L305 WeakPolarHBondContact O-CB 3.38Å; S302-L305 PolarHBondContact O-N 3Å; S302-L305 PolarHBondContact OG-N 3.3Å; S302-V306 WeakPolarHBondContact O-CG2 3.44Å; S302-V306 PolarHBondContact O-N 2.99Å
303	T	57.4	Low	65.1	Low	66 Å²	66	53.2 Å²	53.2	41%	0.405	28%	0.284	S	S	.	.	H	α-helix	trans	-58.2	-31.2	-179.7	-51.9	0	0	0	0	109.4	E209 V301 N307	E209-T303 PolarHBondContact OE2-N 3.36Å; V301-T303 PolarHBondContact O-N 2.67Å; T303-N307 VanDerWaalsContact O-CB 3.31Å; T303-N307 WeakPolarHBondContact O-CB 3.48Å; T303-N307 PolarHBondContact O-N 3.19Å; T303-N307 PolarHBondContact O-ND2 3.45Å; T303-N307 PolarHBondContact O-OD1 3.21Å
304	Q	52.5	Low	62.4	Low	67 Å²	67	54.4 Å²	54.4	31%	0.313	30%	0.296	S	S	.	.	H	α-helix	trans	-71.8	-40.3	172.8	-56.9	-60	-11.8	0	0	113.5	L202 S302 V306 N307 S308	L202-Q304 HydrophobicContact CD1-CB 3.78Å; L202-Q304 HydrophobicContact CD1-CG 4.35Å; S302-Q304 PolarHBondContact O-N 3.05Å; S302-Q304 VanDerWaalsContact O-N 3.09Å; S302-Q304 PolarHBondContact OG-N 3.4Å; Q304-V306 VanDerWaalsContact C-N 3.32Å; Q304-N307 PolarHBondContact O-N 2.65Å; Q304-S308 WeakPolarHBondContact O-CB 3.34Å; Q304-S308 PolarHBondContact O-N 3.02Å; Q304-S308 PolarHBondContact O-OG 2.84Å
305	L	56.3	Low	59.9	Low	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.6	-41.1	173.6	-172.7	62	0	0	0	110.7	I194 L196 I234 I236 V301 S302 S308 I309	I194-L305 HydrophobicContact CD1-CD1 3.97Å; I194-L305 HydrophobicContact CD1-CD2 3.72Å; I194-L305 HydrophobicContact CD1-CG 4.18Å; I194-L305 HydrophobicContact CG2-CD1 4.15Å; L196-L305 HydrophobicContact CD1-CD1 3.51Å; L196-L305 HydrophobicContact CD2-CD1 4.04Å; L196-L305 HydrophobicContact CG-CD1 4.26Å; I234-L305 HydrophobicContact CG2-CD1 4.22Å; I236-L305 HydrophobicContact CD1-CD2 4.13Å; V301-L305 HydrophobicContact CG1-CB 3.99Å; V301-L305 HydrophobicContact CG1-CD2 3.34Å; V301-L305 HydrophobicContact CG1-CG 3.83Å; S302-L305 CarbonylContact O-C 3.55Å; S302-L305 WeakPolarHBondContact O-CA 3.46Å; S302-L305 WeakPolarHBondContact O-CB 3.38Å; S302-L305 PolarHBondContact O-N 3Å; S302-L305 PolarHBondContact OG-N 3.3Å; L305-S308 WeakPolarHBondContact CA-OG 3.39Å; L305-S308 PolarHBondContact O-OG 3.04Å; L305-I309 HydrophobicContact CD1-CD1 3.89Å; L305-I309 HydrophobicContact CD1-CG1 4.47Å; L305-I309 HydrophobicContact CG-CD1 3.72Å; L305-I309 VanDerWaalsContact O-CB 3.27Å; L305-I309 WeakPolarHBondContact O-CB 3.24Å; L305-I309 WeakPolarHBondContact O-CD1 3.45Å; L305-I309 WeakPolarHBondContact O-CG1 3.49Å; L305-I309 PolarHBondContact O-N 3.46Å
306	V	57.7	Low	57.8	Low	72 Å²	72	59.4 Å²	59.4	44%	0.436	34%	0.34	S	S	.	.	H	α-helix	trans	-62.7	-49.4	172.6	176.1	0	0	0	0	110.4	V301 S302 Q304 S308 I309 A310	V301-V306 HydrophobicContact CB-CG2 4.18Å; V301-V306 HydrophobicContact CG1-CG2 4.25Å; S302-V306 WeakPolarHBondContact O-CG2 3.44Å; S302-V306 PolarHBondContact O-N 2.99Å; Q304-V306 VanDerWaalsContact C-N 3.32Å; V306-S308 VanDerWaalsContact C-N 3.35Å; V306-S308 PolarHBondContact O-N 3.32Å; V306-I309 CarbonylContact O-C 3.55Å; V306-I309 PolarHBondContact O-N 2.78Å; V306-A310 WeakPolarHBondContact O-CA 3.49Å; V306-A310 WeakPolarHBondContact O-CB 3.43Å; V306-A310 PolarHBondContact O-N 3.24Å
307	N	54.2	Low	56.4	Low	93 Å²	93	61 Å²	61	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-36.7	-179.8	-70.3	-13.8	0	0	0	113.3	T303 Q304 A310	T303-N307 VanDerWaalsContact O-CB 3.31Å; T303-N307 WeakPolarHBondContact O-CB 3.48Å; T303-N307 PolarHBondContact O-N 3.19Å; T303-N307 PolarHBondContact O-ND2 3.45Å; T303-N307 PolarHBondContact O-OD1 3.21Å; Q304-N307 PolarHBondContact O-N 2.65Å; N307-A310 PolarHBondContact O-N 3.35Å
308	S	51.1	Low	56	Low	44 Å²	44	61.2 Å²	61.2	31%	0.308	35%	0.35	S	S	.	.	H	α-helix	trans	-73.6	-32.2	177.6	52	0	0	0	0	112.8	L196 Q304 L305 V306	L196-S308 WeakPolarHBondContact CD2-OG 3.48Å; Q304-S308 WeakPolarHBondContact O-CB 3.34Å; Q304-S308 PolarHBondContact O-N 3.02Å; Q304-S308 PolarHBondContact O-OG 2.84Å; L305-S308 WeakPolarHBondContact CA-OG 3.39Å; L305-S308 PolarHBondContact O-OG 3.04Å; V306-S308 VanDerWaalsContact C-N 3.35Å; V306-S308 PolarHBondContact O-N 3.32Å
309	I	50.5	Low	56.3	Low	38 Å²	38	60.1 Å²	60.1	20%	0.195	34%	0.343	C	S	.	.	H	α-helix	trans	-78.4	-27.2	172.5	-67.3	164.3	0	0	0	111.8	N173 I194 L305 V306 K311	N173-I309 HydrophobicContact CB-CG2 4.42Å; N173-I309 VanDerWaalsContact O-CG2 3.31Å; N173-I309 WeakPolarHBondContact O-CG2 3.38Å; I194-I309 HydrophobicContact CD1-CD1 4.14Å; I194-I309 HydrophobicContact CG2-CD1 3.79Å; I194-I309 HydrophobicContact CG2-CG1 3.87Å; L305-I309 HydrophobicContact CD1-CD1 3.89Å; L305-I309 HydrophobicContact CD1-CG1 4.47Å; L305-I309 HydrophobicContact CG-CD1 3.72Å; L305-I309 VanDerWaalsContact O-CB 3.27Å; L305-I309 WeakPolarHBondContact O-CB 3.24Å; L305-I309 WeakPolarHBondContact O-CD1 3.45Å; L305-I309 WeakPolarHBondContact O-CG1 3.49Å; L305-I309 PolarHBondContact O-N 3.46Å; V306-I309 CarbonylContact O-C 3.55Å; V306-I309 PolarHBondContact O-N 2.78Å; I309-K311 PolarHBondContact O-N 2.71Å
310	A	47.4	Very low	56.8	Low	45 Å²	45	60.9 Å²	60.9	37%	0.372	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	17.3	-168.5	0	0	0	0	0	116.1	V306 N307 T312	V306-A310 WeakPolarHBondContact O-CA 3.49Å; V306-A310 WeakPolarHBondContact O-CB 3.43Å; V306-A310 PolarHBondContact O-N 3.24Å; N307-A310 PolarHBondContact O-N 3.35Å; A310-T312 PolarHBondContact O-N 3.48Å
311	K	38.4	Very low	58.2	Low	196 Å²	196	59.4 Å²	59.4	85%	0.852	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-3.5	174.8	-71.8	-171.2	177.1	-177.8	0	114.3	I309	I309-K311 PolarHBondContact O-N 2.71Å
312	T	37.9	Very low	59.9	Low	84 Å²	84	58.4 Å²	58.4	52%	0.515	33%	0.325	S	S	.	.			trans	-133.5	95.5	174.1	19.3	0	0	0	0	111.3	N173 A310 V314	N173-T312 PolarHBondContact ND2-OG1 3.26Å; A310-T312 PolarHBondContact O-N 3.48Å; T312-V314 PolarHBondContact O-N 2.75Å
313	Y	43.3	Very low	61.4	Low	190 Å²	190	58.6 Å²	58.6	75%	0.745	33%	0.326	S	S	*	.			trans	-66.9	9.2	-176.6	-129	-103.1	0	0	0	115.4
314	V	41.5	Very low	62.8	Low	94 Å²	94	58.6 Å²	58.6	57%	0.57	32%	0.318	S	S	*	.	S	Bend	trans	-123.4	88.4	-160.3	178.7	0	0	0	0	109.8	T312 P365	T312-V314 PolarHBondContact O-N 2.75Å; V314-P365 HydrophobicContact CB-CG 4.35Å; V314-P365 HydrophobicContact CG1-CB 4.3Å; V314-P365 HydrophobicContact CG1-CG 3.41Å; V314-P365 VanDerWaalsContact CG1-CG 3.41Å; V314-P365 HydrophobicContact CG2-CG 4.3Å
315	G	45.7	Very low	64.3	Low	58 Å²	58	57.6 Å²	57.6	60%	0.598	32%	0.315	S	S	*	.	S	Bend	trans	155	-39.5	168.4	0	0	0	0	0	116.2
316	T	54	Low	65.4	Low	66 Å²	66	60.7 Å²	60.7	41%	0.405	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-82.9	-14.8	-172.6	-57.2	0	0	0	0	114.4	D280 A318	D280-T316 WeakPolarHBondContact OD1-CG2 3.4Å; T316-A318 VanDerWaalsContact C-N 3.34Å; T316-A318 PolarHBondContact O-N 3.14Å
317	N	66.8	Low	66.3	Low	33 Å²	33	60.5 Å²	60.5	18%	0.176	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-82.9	-4.4	-169.3	-60.8	-21	0	0	0	114.7	Y319 M320 L369	N317-Y319 PolarHBondContact O-N 3.14Å; N317-M320 HydrophobicContact CB-CE 3.97Å; N317-M320 WeakPolarHBondContact O-CB 3.45Å; N317-M320 PolarHBondContact O-N 3.45Å; N317-M320 WeakPolarHBondContact OD1-CE 3.45Å; N317-L369 HydrophobicContact CB-CD1 4.26Å; N317-L369 HydrophobicContact CB-CD2 3.61Å; N317-L369 WeakPolarHBondContact O-CD2 3.46Å
318	A	82.6	Confident	67.4	Low	16 Å²	16	61.4 Å²	61.4	13%	0.132	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-65.4	-25.7	-175.2	0	0	0	0	0	113.9	T316 F351 L368 I372	T316-A318 VanDerWaalsContact C-N 3.34Å; T316-A318 PolarHBondContact O-N 3.14Å; A318-F351 HydrophobicContact CB-CE1 4.29Å; A318-F351 HydrophobicContact CB-CE2 4.02Å; A318-F351 HydrophobicContact CB-CZ 3.59Å; A318-F351 WeakPolarHBondContact O-CZ 3.11Å; A318-L368 HydrophobicContact CB-CD2 3.74Å; A318-I372 WeakPolarHBondContact O-CD1 3.27Å
319	Y	90.4	Very high	68.5	Low	29 Å²	29	68.7 Å²	68.7	11%	0.114	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-93.6	1.7	177.8	-55.7	-95.1	0	0	0	112.4	K282 P283 N317 S338 I341 E345 F351	K282-Y319 HydrophobicContact CB-CD1 3.96Å; K282-Y319 HydrophobicContact CB-CD2 3.81Å; K282-Y319 HydrophobicContact CB-CE1 4.01Å; K282-Y319 HydrophobicContact CB-CE2 3.89Å; K282-Y319 HydrophobicContact CB-CG 3.85Å; K282-Y319 HydrophobicContact CD-CD2 4.26Å; K282-Y319 HydrophobicContact CD-CE2 4.28Å; P283-Y319 HydrophobicContact CG-CE1 4.38Å; N317-Y319 PolarHBondContact O-N 3.14Å; Y319-S338 WeakPolarHBondContact O-CB 3.14Å; Y319-S338 PolarHBondContact O-OG 3.18Å; Y319-I341 HydrophobicContact CD1-CB 4.24Å; Y319-I341 HydrophobicContact CD1-CG2 3.62Å; Y319-I341 HydrophobicContact CE1-CG2 4.06Å; Y319-I341 HydrophobicContact CG-CG2 4.47Å; Y319-E345 WeakPolarHBondContact CE1-OE2 3.44Å; Y319-E345 PolarHBondContact OH-OE2 2.85Å; Y319-F351 HydrophobicContact CD1-CE2 4.21Å; Y319-F351 HydrophobicContact CE1-CD2 4.23Å; Y319-F351 AromaticContact CE1-CE2 3.83Å; Y319-F351 HydrophobicContact CE1-CE2 3.83Å; Y319-F351 HydrophobicContact CE2-CE2 4.25Å; Y319-F351 AromaticContact CZ-CE2 3.85Å
320	M	88.9	Confident	69.8	Low	23 Å²	23	70.8 Å²	70.8	11%	0.113	39%	0.386	C	S	.	.			trans	-71.5	140.1	-174.9	-165.7	176.3	-65.3	0	0	110.6	N317 R324 I325 W337	N317-M320 HydrophobicContact CB-CE 3.97Å; N317-M320 WeakPolarHBondContact O-CB 3.45Å; N317-M320 PolarHBondContact O-N 3.45Å; N317-M320 WeakPolarHBondContact OD1-CE 3.45Å; M320-R324 HydrophobicContact CG-CB 3.78Å; M320-R324 HydrophobicContact CG-CG 3.74Å; M320-R324 HydrophobicContact SD-CB 4.1Å; M320-R324 HydrophobicContact SD-CG 3.62Å; M320-I325 HydrophobicContact CB-CD1 4.21Å; M320-I325 HydrophobicContact CB-CG1 3.89Å; M320-I325 HydrophobicContact CG-CG1 3.77Å; M320-I325 HydrophobicContact SD-CG1 3.7Å; M320-W337 PolarHBondContact O-NE1 2.93Å
321	A	91.5	Very high	71.6	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.008	38%	0.38	C	S	.	.			trans	-71.4	147.8	176.6	0	0	0	0	0	111.6	E323 R324 I325 A334 W337	A321-E323 VanDerWaalsContact C-N 3.32Å; A321-E323 VanDerWaalsContact CB-CD 3.48Å; A321-E323 WeakPolarHBondContact CB-OE1 3.37Å; A321-E323 WeakPolarHBondContact CB-OE2 3.48Å; A321-E323 PolarHBondContact O-N 3.41Å; A321-R324 WeakPolarHBondContact O-CB 3.36Å; A321-R324 PolarHBondContact O-N 3.05Å; A321-I325 PolarHBondContact O-N 3.37Å; A321-I325 VanDerWaalsContact O-N 3.11Å; A321-A334 HydrophobicContact CB-CB 3.87Å; A321-W337 VanDerWaalsContact CA-CD1 3.44Å; A321-W337 HydrophobicContact CB-CB 3.67Å; A321-W337 HydrophobicContact CB-CD2 4.36Å; A321-W337 HydrophobicContact CB-CG 3.69Å
322	P	92	Very high	74.1	Confident	10 Å²	10	61 Å²	61	7%	0.065	34%	0.342	C	S	.	.	H	α-helix	trans	-52.8	-45.7	-176.6	-26.3	33	0	0	0	113.4	R324 I325 S326 W337 I372 V373 K399	P322-R324 PolarHBondContact O-N 3.31Å; P322-I325 WeakPolarHBondContact O-CB 3.32Å; P322-I325 PolarHBondContact O-N 3.16Å; P322-I325 VanDerWaalsContact O-N 3.08Å; P322-S326 PolarHBondContact O-N 2.9Å; P322-S326 PolarHBondContact O-OG 3.28Å; P322-W337 HydrophobicContact CG-CD2 4.44Å; P322-W337 HydrophobicContact CG-CE3 4.22Å; P322-W337 HydrophobicContact CG-CH2 3.65Å; P322-W337 HydrophobicContact CG-CZ2 3.9Å; P322-W337 HydrophobicContact CG-CZ3 3.81Å; P322-I372 HydrophobicContact CG-CG2 3.95Å; P322-V373 HydrophobicContact CB-CG2 4.49Å; P322-K399 HydrophobicContact CG-CG 4.36Å
323	E	89.6	Confident	76.8	Confident	5 Å²	5	59.3 Å²	59.3	2%	0.023	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-31.6	-179.9	74.6	-79.8	-162.9	0	0	112.3	A321 G327 E328 P401 R404	A321-E323 VanDerWaalsContact C-N 3.32Å; A321-E323 VanDerWaalsContact CB-CD 3.48Å; A321-E323 WeakPolarHBondContact CB-OE1 3.37Å; A321-E323 WeakPolarHBondContact CB-OE2 3.48Å; A321-E323 PolarHBondContact O-N 3.41Å; E323-G327 PolarHBondContact O-N 2.92Å; E323-E328 HydrophobicContact CB-CB 4.14Å; E323-E328 WeakPolarHBondContact O-CA 3.5Å; E323-E328 VanDerWaalsContact O-CB 3.31Å; E323-E328 WeakPolarHBondContact O-CB 3.39Å; E323-E328 PolarHBondContact O-N 2.98Å; E323-P401 HydrophobicContact CB-CG 4.4Å; E323-P401 HydrophobicContact CG-CB 4.39Å; E323-P401 HydrophobicContact CG-CG 4.3Å; E323-R404 IonicContact OE1-CZ 3.51Å; E323-R404 IonicContact OE1-NH1 3.64Å; E323-R404 PolarHBondContact OE1-NH1 2.97Å; E323-R404 IonicContact OE1-NH2 3.54Å; E323-R404 PolarHBondContact OE1-NH2 3.23Å; E323-R404 VanDerWaalsContact OE1-NH2 3.14Å; E323-R404 IonicContact OE2-CZ 2.87Å; E323-R404 IonicContact OE2-NH1 3.9Å; E323-R404 PolarHBondContact OE2-NH1 2.8Å; E323-R404 IonicContact OE2-NH2 2.71Å; E323-R404 PolarHBondContact OE2-NH2 2.97Å
324	R	86.6	Confident	79.1	Confident	66 Å²	66	50.5 Å²	50.5	25%	0.249	30%	0.295	C	S	.	.	H	α-helix	trans	-78.3	-33.6	177.7	-176.6	178.6	161.2	-163	3	111.3	R279 M320 A321 P322 G327 Y330	R279-R324 PolarHBondContact O-NH1 2.86Å; R279-R324 PolarHBondContact O-NH2 3.2Å; M320-R324 HydrophobicContact CG-CB 3.78Å; M320-R324 HydrophobicContact CG-CG 3.74Å; M320-R324 HydrophobicContact SD-CB 4.1Å; M320-R324 HydrophobicContact SD-CG 3.62Å; A321-R324 WeakPolarHBondContact O-CB 3.36Å; A321-R324 PolarHBondContact O-N 3.05Å; P322-R324 PolarHBondContact O-N 3.31Å; R324-G327 PolarHBondContact O-N 3.07Å; R324-Y330 HydrophobicContact CB-CD1 4.3Å; R324-Y330 HydrophobicContact CB-CG 4.25Å; R324-Y330 HydrophobicContact CG-CD1 3.93Å; R324-Y330 HydrophobicContact CG-CE1 4.18Å; R324-Y330 HydrophobicContact CG-CG 4.16Å
325	I	83.4	Confident	81.7	Confident	46 Å²	46	46.2 Å²	46.2	24%	0.236	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-42.4	173.3	-62.4	170.2	0	0	0	109.9	M320 A321 P322 G327 L369 I372 V373	M320-I325 HydrophobicContact CB-CD1 4.21Å; M320-I325 HydrophobicContact CB-CG1 3.89Å; M320-I325 HydrophobicContact CG-CG1 3.77Å; M320-I325 HydrophobicContact SD-CG1 3.7Å; A321-I325 PolarHBondContact O-N 3.37Å; A321-I325 VanDerWaalsContact O-N 3.11Å; P322-I325 WeakPolarHBondContact O-CB 3.32Å; P322-I325 PolarHBondContact O-N 3.16Å; P322-I325 VanDerWaalsContact O-N 3.08Å; I325-G327 PolarHBondContact O-N 3.04Å; I325-L369 HydrophobicContact CD1-CB 4.36Å; I325-L369 HydrophobicContact CD1-CD2 3.75Å; I325-L369 HydrophobicContact CG1-CD2 4.16Å; I325-L369 HydrophobicContact CG2-CB 3.96Å; I325-I372 HydrophobicContact CD1-CB 3.88Å; I325-I372 HydrophobicContact CD1-CD1 4.17Å; I325-I372 HydrophobicContact CD1-CG2 3.54Å; I325-V373 HydrophobicContact CB-CG2 3.76Å; I325-V373 HydrophobicContact CD1-CG2 4.22Å; I325-V373 HydrophobicContact CG2-CG2 3.56Å
326	S	80	Confident	84.1	Confident	65 Å²	65	43.4 Å²	43.4	46%	0.455	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	0.4	177.9	-56.7	0	0	0	0	114.4	P322 E328	P322-S326 PolarHBondContact O-N 2.9Å; P322-S326 PolarHBondContact O-OG 3.28Å; S326-E328 VanDerWaalsContact C-N 3.27Å; S326-E328 PolarHBondContact O-N 3Å
327	G	76.7	Confident	86.2	Confident	69 Å²	69	40.3 Å²	40.3	71%	0.711	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	14.4	179.4	0	0	0	0	0	114.7	E323 R324 I325	E323-G327 PolarHBondContact O-N 2.92Å; R324-G327 PolarHBondContact O-N 3.07Å; I325-G327 PolarHBondContact O-N 3.04Å
328	E	77.2	Confident	87.6	Confident	112 Å²	112	38.9 Å²	38.9	52%	0.523	21%	0.214	S	C	.	.			trans	-73.4	167	177	-57.1	-173.8	173.2	0	0	111.9	E323 S326 Y330	E323-E328 HydrophobicContact CB-CB 4.14Å; E323-E328 WeakPolarHBondContact O-CA 3.5Å; E323-E328 VanDerWaalsContact O-CB 3.31Å; E323-E328 WeakPolarHBondContact O-CB 3.39Å; E323-E328 PolarHBondContact O-N 2.98Å; S326-E328 VanDerWaalsContact C-N 3.27Å; S326-E328 PolarHBondContact O-N 3Å; E328-Y330 PolarHBondContact O-N 3.48Å
329	Q	73.8	Confident	88.4	Confident	197 Å²	197	38.1 Å²	38.1	92%	0.921	21%	0.208	S	C	*	.			trans	-67.2	111	174.5	-173.8	163.5	37.1	0	0	110.4
330	Y	78.6	Confident	88.7	Confident	81 Å²	81	36.8 Å²	36.8	32%	0.318	20%	0.202	S	C	.	.			trans	-102.4	158.4	178.3	69.4	-87.6	0	0	0	111.8	L277 R279 R324 E328 A334	L277-Y330 HydrophobicContact CD1-CE2 4.35Å; R279-Y330 HydrophobicContact CG-CE2 4.43Å; R324-Y330 HydrophobicContact CB-CD1 4.3Å; R324-Y330 HydrophobicContact CB-CG 4.25Å; R324-Y330 HydrophobicContact CG-CD1 3.93Å; R324-Y330 HydrophobicContact CG-CE1 4.18Å; R324-Y330 HydrophobicContact CG-CG 4.16Å; E328-Y330 PolarHBondContact O-N 3.48Å; Y330-A334 HydrophobicContact CD2-CB 4.27Å
331	G	85.1	Confident	89.1	Confident	25 Å²	25	35.7 Å²	35.7	26%	0.258	20%	0.197	S	C	.	.			trans	-148	-150.7	177.6	0	0	0	0	0	110.5	H333 A334	G331-H333 PolarHBondContact O-N 2.81Å; G331-H333 VanDerWaalsContact O-N 3.11Å; G331-A334 WeakPolarHBondContact O-CB 3.21Å; G331-A334 PolarHBondContact O-N 2.9Å
332	I	90.4	Very high	89.4	Confident	10 Å²	10	35.6 Å²	35.6	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-27.2	-177.6	-168	60	0	0	0	113.7	W272 L277 A334 D335 V336 V406 P407	W272-I332 HydrophobicContact CB-CD1 4.03Å; W272-I332 HydrophobicContact CB-CG1 4.29Å; W272-I332 HydrophobicContact CD2-CG1 4.13Å; W272-I332 HydrophobicContact CD2-CG2 4.44Å; W272-I332 HydrophobicContact CG-CB 4.36Å; W272-I332 HydrophobicContact CG-CD1 4.09Å; W272-I332 HydrophobicContact CG-CG1 3.88Å; W272-I332 HydrophobicContact CZ2-CG2 4.09Å; L277-I332 HydrophobicContact CD2-CB 3.99Å; L277-I332 HydrophobicContact CD2-CD1 4.07Å; I332-A334 PolarHBondContact O-N 3.3Å; I332-D335 HydrophobicContact CD1-CB 4.31Å; I332-D335 PolarHBondContact O-N 3.34Å; I332-D335 VanDerWaalsContact O-N 3.12Å; I332-V336 PolarHBondContact O-N 2.81Å; I332-V406 HydrophobicContact CG2-CG1 4.08Å; I332-P407 HydrophobicContact CD1-CG 3.84Å; I332-P407 HydrophobicContact CG1-CG 3.41Å; I332-P407 VanDerWaalsContact CG1-CG 3.41Å
333	H	94.3	Very high	89.7	Confident	50 Å²	50	35.1 Å²	35.1	23%	0.231	19%	0.193	C	C	.	.	H	α-helix	trans	-59.4	-31.5	176.4	-54.3	100.8	0	0	0	112.1	G331 D335 V336 W337 P401 R404 V406	G331-H333 PolarHBondContact O-N 2.81Å; G331-H333 VanDerWaalsContact O-N 3.11Å; H333-D335 PolarHBondContact O-N 3.32Å; H333-V336 WeakPolarHBondContact O-CB 3.46Å; H333-V336 PolarHBondContact O-N 3.3Å; H333-W337 PolarHBondContact O-N 2.95Å; H333-P401 HydrophobicContact CB-CB 4Å; H333-P401 PolarHBondContact CD2-O 3.44Å; H333-R404 HydrophobicContact CB-CB 4.31Å; H333-R404 PolarHBondContact CD2-O 3.02Å; H333-R404 VanDerWaalsContact CD2-O 3.24Å; H333-R404 WeakPolarHBondContact O-CD 3.43Å; H333-R404 PolarHBondContact O-NH1 2.87Å; H333-V406 WeakPolarHBondContact NE2-CG1 3.47Å
334	A	92.9	Very high	90	Very high	4 Å²	4	35 Å²	35	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-40	177	0	0	0	0	0	111.8	A321 Y330 G331 I332 V336 W337 S338	A321-A334 HydrophobicContact CB-CB 3.87Å; Y330-A334 HydrophobicContact CD2-CB 4.27Å; G331-A334 WeakPolarHBondContact O-CB 3.21Å; G331-A334 PolarHBondContact O-N 2.9Å; I332-A334 PolarHBondContact O-N 3.3Å; A334-V336 VanDerWaalsContact C-N 3.28Å; A334-V336 PolarHBondContact O-N 3.44Å; A334-W337 WeakPolarHBondContact O-CB 3.28Å; A334-W337 PolarHBondContact O-N 2.95Å; A334-S338 PolarHBondContact O-N 2.98Å; A334-S338 PolarHBondContact O-OG 3.37Å
335	D	94.3	Very high	90.5	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-65.4	-34.4	174.8	-68	-28	0	0	0	111.2	L268 H278 R279 V281 I332 H333 S338 V339	L268-D335 HydrophobicContact CD1-CB 4.41Å; L268-D335 HydrophobicContact CD2-CB 4.23Å; H278-D335 PolarHBondContact N-OD2 3.05Å; R279-D335 WeakPolarHBondContact CA-OD1 3.07Å; R279-D335 PolarHBondContact N-OD1 3.42Å; V281-D335 HydrophobicContact CG2-CB 4.07Å; I332-D335 HydrophobicContact CD1-CB 4.31Å; I332-D335 PolarHBondContact O-N 3.34Å; I332-D335 VanDerWaalsContact O-N 3.12Å; H333-D335 PolarHBondContact O-N 3.32Å; D335-S338 WeakPolarHBondContact O-CB 3.5Å; D335-S338 PolarHBondContact O-N 3.29Å; D335-V339 WeakPolarHBondContact O-CG2 3.31Å; D335-V339 PolarHBondContact O-N 3.24Å
336	V	97.9	Very high	91.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-38.5	176.6	171.1	0	0	0	0	112.1	I332 H333 A334 S338 V339 G340 C396 R404 P405 P407 L410	I332-V336 PolarHBondContact O-N 2.81Å; H333-V336 WeakPolarHBondContact O-CB 3.46Å; H333-V336 PolarHBondContact O-N 3.3Å; A334-V336 VanDerWaalsContact C-N 3.28Å; A334-V336 PolarHBondContact O-N 3.44Å; V336-S338 VanDerWaalsContact C-N 3.34Å; V336-V339 WeakPolarHBondContact O-CB 3.49Å; V336-V339 PolarHBondContact O-N 2.97Å; V336-G340 PolarHBondContact O-N 3.33Å; V336-G340 VanDerWaalsContact O-N 3.14Å; V336-C396 HydrophobicContact CG1-CB 4.11Å; V336-C396 WeakPolarHBondContact O-CB 3Å; V336-R404 HydrophobicContact CG1-CB 4.34Å; V336-P405 WeakPolarHBondContact CG2-O 3.14Å; V336-P407 HydrophobicContact CG2-CG 4.28Å; V336-L410 HydrophobicContact CG1-CD1 3.91Å; V336-L410 HydrophobicContact CG2-CD1 3.97Å
337	W	97.6	Very high	92	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-48.5	171	172.1	-81.7	0	0	0	111.4	M320 A321 P322 H333 A334 V339 G340 I341 I372 P377 C396 M397 K399	M320-W337 PolarHBondContact O-NE1 2.93Å; A321-W337 VanDerWaalsContact CA-CD1 3.44Å; A321-W337 HydrophobicContact CB-CB 3.67Å; A321-W337 HydrophobicContact CB-CD2 4.36Å; A321-W337 HydrophobicContact CB-CG 3.69Å; P322-W337 HydrophobicContact CG-CD2 4.44Å; P322-W337 HydrophobicContact CG-CE3 4.22Å; P322-W337 HydrophobicContact CG-CH2 3.65Å; P322-W337 HydrophobicContact CG-CZ2 3.9Å; P322-W337 HydrophobicContact CG-CZ3 3.81Å; H333-W337 PolarHBondContact O-N 2.95Å; A334-W337 WeakPolarHBondContact O-CB 3.28Å; A334-W337 PolarHBondContact O-N 2.95Å; W337-V339 VanDerWaalsContact C-N 3.25Å; W337-V339 PolarHBondContact O-N 3.42Å; W337-G340 WeakPolarHBondContact O-CA 3.46Å; W337-G340 PolarHBondContact O-N 3.22Å; W337-I341 HydrophobicContact CZ2-CD1 4.37Å; W337-I341 PolarHBondContact O-N 3.07Å; W337-I341 VanDerWaalsContact O-N 3.09Å; W337-I372 HydrophobicContact CZ2-CG2 3.89Å; W337-P377 HydrophobicContact CH2-CB 4.14Å; W337-C396 VanDerWaalsContact CA-O 3.32Å; W337-C396 WeakPolarHBondContact CA-O 3.28Å; W337-M397 HydrophobicContact CE3-CB 4.4Å; W337-M397 HydrophobicContact CZ3-CB 4.29Å; W337-M397 WeakPolarHBondContact CZ3-O 3.36Å; W337-K399 HydrophobicContact CH2-CG 4.41Å; W337-K399 HydrophobicContact CZ3-CG 4.28Å
338	S	96.3	Very high	92.9	Very high	4 Å²	4	27.1 Å²	27.1	3%	0.028	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-34	179.4	-57.7	0	0	0	0	112.4	V281 Y319 A334 D335 V336 S342	V281-S338 VanDerWaalsContact O-CB 3.32Å; V281-S338 WeakPolarHBondContact O-CB 3.18Å; Y319-S338 WeakPolarHBondContact O-CB 3.14Å; Y319-S338 PolarHBondContact O-OG 3.18Å; A334-S338 PolarHBondContact O-N 2.98Å; A334-S338 PolarHBondContact O-OG 3.37Å; D335-S338 WeakPolarHBondContact O-CB 3.5Å; D335-S338 PolarHBondContact O-N 3.29Å; V336-S338 VanDerWaalsContact C-N 3.34Å; S338-S342 VanDerWaalsContact O-CB 3.31Å; S338-S342 WeakPolarHBondContact O-CB 3.4Å; S338-S342 PolarHBondContact O-N 2.99Å; S338-S342 PolarHBondContact O-OG 2.67Å
339	V	98.1	Very high	93.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.2	-48.8	168.4	171.1	0	0	0	0	111	V264 L268 V281 D335 V336 W337 I341 S342 F343 F392	V264-V339 HydrophobicContact CG1-CG2 3.97Å; L268-V339 HydrophobicContact CD1-CG2 3.46Å; L268-V339 VanDerWaalsContact CD1-CG2 3.46Å; V281-V339 HydrophobicContact CG1-CG2 3.9Å; D335-V339 WeakPolarHBondContact O-CG2 3.31Å; D335-V339 PolarHBondContact O-N 3.24Å; V336-V339 WeakPolarHBondContact O-CB 3.49Å; V336-V339 PolarHBondContact O-N 2.97Å; W337-V339 VanDerWaalsContact C-N 3.25Å; W337-V339 PolarHBondContact O-N 3.42Å; V339-I341 PolarHBondContact O-N 3.14Å; V339-S342 PolarHBondContact O-N 3.37Å; V339-F343 HydrophobicContact CG1-CD2 3.76Å; V339-F343 HydrophobicContact CG1-CE2 4.03Å; V339-F343 VanDerWaalsContact O-CD2 3.31Å; V339-F343 WeakPolarHBondContact O-CD2 3.41Å; V339-F343 PolarHBondContact O-N 2.82Å; V339-F392 HydrophobicContact CG1-CE1 4.33Å; V339-F392 HydrophobicContact CG1-CZ 4.16Å
340	G	98	Very high	94.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-55.4	-50.8	179.8	0	0	0	0	0	112.8	V336 W337 S342 F343 M344 M397	V336-G340 PolarHBondContact O-N 3.33Å; V336-G340 VanDerWaalsContact O-N 3.14Å; W337-G340 WeakPolarHBondContact O-CA 3.46Å; W337-G340 PolarHBondContact O-N 3.22Å; G340-S342 PolarHBondContact O-N 3.05Å; G340-F343 PolarHBondContact O-N 3.45Å; G340-M344 WeakPolarHBondContact O-CB 3.31Å; G340-M344 PolarHBondContact O-N 3.11Å; G340-M397 VanDerWaalsContact C-SD 3.52Å
341	I	96.4	Very high	95.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.8	-47.6	177.4	-61.5	-66.8	0	0	0	111.5	Y319 W337 V339 F343 M344 E345 F351 P352 Y353 M397	Y319-I341 HydrophobicContact CD1-CB 4.24Å; Y319-I341 HydrophobicContact CD1-CG2 3.62Å; Y319-I341 HydrophobicContact CE1-CG2 4.06Å; Y319-I341 HydrophobicContact CG-CG2 4.47Å; W337-I341 HydrophobicContact CZ2-CD1 4.37Å; W337-I341 PolarHBondContact O-N 3.07Å; W337-I341 VanDerWaalsContact O-N 3.09Å; V339-I341 PolarHBondContact O-N 3.14Å; I341-F343 PolarHBondContact O-N 3.26Å; I341-M344 PolarHBondContact O-N 2.98Å; I341-E345 PolarHBondContact O-N 3.08Å; I341-F351 HydrophobicContact CG2-CE2 3.68Å; I341-F351 HydrophobicContact CG2-CZ 4.04Å; I341-P352 HydrophobicContact CD1-CG 4.45Å; I341-P352 HydrophobicContact CG2-CG 4.22Å; I341-Y353 HydrophobicContact CD1-CD2 4.33Å; I341-Y353 HydrophobicContact CD1-CE2 3.62Å; I341-M397 HydrophobicContact CD1-CE 3.25Å; I341-M397 HydrophobicContact CD1-SD 3.84Å; I341-M397 HydrophobicContact CG1-CE 4.29Å; I341-M397 HydrophobicContact CG1-SD 4.39Å
342	S	97.3	Very high	95.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.2	-45.8	-177.8	-58.3	0	0	0	0	112	K282 S338 V339 G340 E345 L346	K282-S342 WeakPolarHBondContact CA-OG 3.39Å; S338-S342 VanDerWaalsContact O-CB 3.31Å; S338-S342 WeakPolarHBondContact O-CB 3.4Å; S338-S342 PolarHBondContact O-N 2.99Å; S338-S342 PolarHBondContact O-OG 2.67Å; V339-S342 PolarHBondContact O-N 3.37Å; G340-S342 PolarHBondContact O-N 3.05Å; S342-E345 PolarHBondContact O-N 3.34Å; S342-L346 WeakPolarHBondContact O-CB 3.48Å; S342-L346 VanDerWaalsContact O-CG 3.24Å; S342-L346 WeakPolarHBondContact O-CG 3.45Å; S342-L346 PolarHBondContact O-N 3.39Å
343	F	98.3	Very high	95.1	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-74.2	-30	-178.5	-83.5	-96.8	0	0	0	112.4	L257 I260 A261 V264 M286 V339 G340 I341 A347 F389 I393	L257-F343 HydrophobicContact CB-CD1 4.33Å; L257-F343 HydrophobicContact CB-CE1 4.48Å; L257-F343 HydrophobicContact CD2-CD1 3.98Å; L257-F343 HydrophobicContact CD2-CE1 4.09Å; L257-F343 WeakPolarHBondContact O-CE1 3.45Å; I260-F343 HydrophobicContact CB-CE1 4.25Å; I260-F343 HydrophobicContact CB-CZ 4.39Å; I260-F343 HydrophobicContact CG2-CE1 4.08Å; I260-F343 HydrophobicContact CG2-CZ 3.83Å; A261-F343 VanDerWaalsContact CA-CE1 3.49Å; A261-F343 HydrophobicContact CB-CD1 4.04Å; A261-F343 HydrophobicContact CB-CE1 3.43Å; A261-F343 VanDerWaalsContact CB-CE1 3.43Å; A261-F343 HydrophobicContact CB-CZ 3.72Å; V264-F343 HydrophobicContact CB-CE2 4.27Å; V264-F343 HydrophobicContact CB-CZ 4.3Å; V264-F343 HydrophobicContact CG1-CE2 4.26Å; V264-F343 HydrophobicContact CG2-CE2 4.22Å; V264-F343 HydrophobicContact CG2-CZ 4.09Å; M286-F343 HydrophobicContact CE-CE2 4.21Å; M286-F343 HydrophobicContact SD-CE2 4.26Å; V339-F343 HydrophobicContact CG1-CD2 3.76Å; V339-F343 HydrophobicContact CG1-CE2 4.03Å; V339-F343 VanDerWaalsContact O-CD2 3.31Å; V339-F343 WeakPolarHBondContact O-CD2 3.41Å; V339-F343 PolarHBondContact O-N 2.82Å; G340-F343 PolarHBondContact O-N 3.45Å; I341-F343 PolarHBondContact O-N 3.26Å; F343-A347 WeakPolarHBondContact O-CB 3.48Å; F343-A347 PolarHBondContact O-N 3.36Å; F343-F389 HydrophobicContact CB-CE2 4.39Å; F343-F389 HydrophobicContact CB-CZ 4.44Å; F343-I393 HydrophobicContact CB-CD1 3.52Å
344	M	97.4	Very high	94	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-64.1	-47.5	169.8	-179	174	-98.5	0	0	111.2	G340 I341 A347 L348 P352 P378 L380 I393 M397	G340-M344 WeakPolarHBondContact O-CB 3.31Å; G340-M344 PolarHBondContact O-N 3.11Å; I341-M344 PolarHBondContact O-N 2.98Å; M344-A347 PolarHBondContact O-N 3.19Å; M344-L348 HydrophobicContact CG-CD1 3.74Å; M344-L348 HydrophobicContact CG-CG 4.39Å; M344-L348 WeakPolarHBondContact O-CB 3.33Å; M344-L348 VanDerWaalsContact O-CG 3.27Å; M344-L348 WeakPolarHBondContact O-CG 3.2Å; M344-L348 PolarHBondContact O-N 2.73Å; M344-P352 HydrophobicContact CB-CG 4.4Å; M344-P352 HydrophobicContact CG-CB 3.68Å; M344-P352 HydrophobicContact CG-CG 4.06Å; M344-P352 HydrophobicContact SD-CB 3.32Å; M344-P352 WeakPolarHBondContact SD-CB 3.33Å; M344-P352 HydrophobicContact SD-CG 3.86Å; M344-P378 WeakPolarHBondContact CE-O 3.41Å; M344-P378 HydrophobicContact SD-CB 3.95Å; M344-P378 HydrophobicContact SD-CG 3.84Å; M344-L380 HydrophobicContact CE-CB 4.28Å; M344-L380 HydrophobicContact CE-CD2 3.82Å; M344-L380 HydrophobicContact CE-CG 3.62Å; M344-L380 VanDerWaalsContact CE-N 3.26Å; M344-L380 HydrophobicContact CG-CD2 3.86Å; M344-I393 HydrophobicContact CB-CG2 4.23Å; M344-I393 HydrophobicContact CE-CG2 3.98Å; M344-M397 HydrophobicContact SD-CE 4.48Å; M344-M397 HydrophobicContact SD-SD 4.43Å
345	E	96.4	Very high	92.4	Very high	36 Å²	36	23.3 Å²	23.3	17%	0.168	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-50.7	176.4	172.7	175.8	-170	0	0	112	Y319 I341 S342 A347 L348 G349 M350 F351	Y319-E345 WeakPolarHBondContact CE1-OE2 3.44Å; Y319-E345 PolarHBondContact OH-OE2 2.85Å; I341-E345 PolarHBondContact O-N 3.08Å; S342-E345 PolarHBondContact O-N 3.34Å; E345-A347 PolarHBondContact O-N 2.69Å; E345-L348 PolarHBondContact O-N 3.23Å; E345-G349 WeakPolarHBondContact O-CA 3.44Å; E345-G349 PolarHBondContact O-N 2.9Å; E345-M350 WeakPolarHBondContact CA-O 3.19Å; E345-M350 PolarHBondContact O-N 3.12Å; E345-F351 WeakPolarHBondContact OE2-CD2 3.49Å
346	L	97.8	Very high	90.3	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-33.2	-179.5	-68	172.4	0	0	0	112	L246 I252 L257 P283 S342	L246-L346 HydrophobicContact CB-CD1 4.21Å; L246-L346 HydrophobicContact CB-CD2 4.07Å; L246-L346 HydrophobicContact CD1-CD1 3.91Å; I252-L346 HydrophobicContact CD1-CB 4.18Å; I252-L346 HydrophobicContact CD1-CD1 4.3Å; I252-L346 HydrophobicContact CD1-CD2 3.8Å; I252-L346 HydrophobicContact CD1-CG 4.32Å; I252-L346 HydrophobicContact CG1-CB 4.33Å; I252-L346 HydrophobicContact CG1-CD2 4.37Å; I252-L346 PolarHBondContact N-O 3.22Å; L257-L346 HydrophobicContact CD1-CB 4.42Å; L257-L346 HydrophobicContact CD2-CB 3.72Å; L257-L346 HydrophobicContact CD2-CD1 4.09Å; P283-L346 HydrophobicContact CB-CD1 4.5Å; P283-L346 HydrophobicContact CB-CD2 4Å; P283-L346 HydrophobicContact CB-CG 4.36Å; P283-L346 HydrophobicContact CG-CD1 4.32Å; P283-L346 HydrophobicContact CG-CD2 4.12Å; P283-L346 HydrophobicContact CG-CG 4.03Å; S342-L346 WeakPolarHBondContact O-CB 3.48Å; S342-L346 VanDerWaalsContact O-CG 3.24Å; S342-L346 WeakPolarHBondContact O-CG 3.45Å; S342-L346 PolarHBondContact O-N 3.39Å
347	A	97.6	Very high	87.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-73.9	-33.2	176.9	0	0	0	0	0	113.5	R251 L257 F343 M344 E345 F385 F389	R251-A347 WeakPolarHBondContact CG-O 3.31Å; R251-A347 PolarHBondContact NE-O 2.86Å; L257-A347 HydrophobicContact CD1-CB 3.61Å; F343-A347 WeakPolarHBondContact O-CB 3.48Å; F343-A347 PolarHBondContact O-N 3.36Å; M344-A347 PolarHBondContact O-N 3.19Å; E345-A347 PolarHBondContact O-N 2.69Å; A347-F385 HydrophobicContact CB-CE1 3.73Å; A347-F385 HydrophobicContact CB-CZ 3.88Å; A347-F385 WeakPolarHBondContact O-CZ 3.38Å; A347-F389 HydrophobicContact CB-CE1 3.55Å; A347-F389 HydrophobicContact CB-CZ 3.78Å
348	L	95.4	Very high	85	Confident	41 Å²	41	43.8 Å²	43.8	22%	0.215	23%	0.225	C	C	.	.	H	α-helix	trans	-85.9	-25.3	177.8	-64.8	174.9	0	0	0	112	M344 E345 M350 P352 L380 P381 F385	M344-L348 HydrophobicContact CG-CD1 3.74Å; M344-L348 HydrophobicContact CG-CG 4.39Å; M344-L348 WeakPolarHBondContact O-CB 3.33Å; M344-L348 VanDerWaalsContact O-CG 3.27Å; M344-L348 WeakPolarHBondContact O-CG 3.2Å; M344-L348 PolarHBondContact O-N 2.73Å; E345-L348 PolarHBondContact O-N 3.23Å; L348-M350 HydrophobicContact CB-CG 4.2Å; L348-P352 HydrophobicContact CD1-CB 4.25Å; L348-L380 HydrophobicContact CD2-CD2 4.16Å; L348-L380 HydrophobicContact CG-CD2 4.21Å; L348-P381 HydrophobicContact CD2-CG 3.96Å; L348-F385 HydrophobicContact CD2-CE2 4.05Å; L348-F385 HydrophobicContact CD2-CZ 4.22Å
349	G	94	Very high	82.4	Confident	40 Å²	40	51 Å²	51	41%	0.412	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	12.5	-169.2	0	0	0	0	0	113.3	E345	E345-G349 WeakPolarHBondContact O-CA 3.44Å; E345-G349 PolarHBondContact O-N 2.9Å
350	M	91.5	Very high	79.6	Confident	125 Å²	125	59.3 Å²	59.3	62%	0.616	30%	0.303	S	S	*	.	S	Bend	trans	-153.9	148.8	177.3	68.7	-172.3	-49.7	0	0	110.1	E345 L348	E345-M350 WeakPolarHBondContact CA-O 3.19Å; E345-M350 PolarHBondContact O-N 3.12Å; L348-M350 HydrophobicContact CB-CG 4.2Å
351	F	91	Very high	77.1	Confident	20 Å²	20	62.8 Å²	62.8	9%	0.088	34%	0.338	C	S	.	.			trans	-62.5	135.4	179.9	-171.3	-93.4	0	0	0	111.1	A318 Y319 I341 E345 Y353 Q355 L368	A318-F351 HydrophobicContact CB-CE1 4.29Å; A318-F351 HydrophobicContact CB-CE2 4.02Å; A318-F351 HydrophobicContact CB-CZ 3.59Å; A318-F351 WeakPolarHBondContact O-CZ 3.11Å; Y319-F351 HydrophobicContact CD1-CE2 4.21Å; Y319-F351 HydrophobicContact CE1-CD2 4.23Å; Y319-F351 AromaticContact CE1-CE2 3.83Å; Y319-F351 HydrophobicContact CE1-CE2 3.83Å; Y319-F351 HydrophobicContact CE2-CE2 4.25Å; Y319-F351 AromaticContact CZ-CE2 3.85Å; I341-F351 HydrophobicContact CG2-CE2 3.68Å; I341-F351 HydrophobicContact CG2-CZ 4.04Å; E345-F351 WeakPolarHBondContact OE2-CD2 3.49Å; F351-Y353 AromaticContact CE1-CD2 3.92Å; F351-Y353 HydrophobicContact CE1-CD2 3.92Å; F351-Y353 HydrophobicContact CE1-CG 4.32Å; F351-Y353 HydrophobicContact CZ-CD2 4.27Å; F351-Q355 HydrophobicContact CB-CG 3.71Å; F351-Q355 HydrophobicContact CD1-CG 4.08Å; F351-Q355 HydrophobicContact CG-CG 4.34Å; F351-L368 HydrophobicContact CE1-CD1 4.36Å; F351-L368 HydrophobicContact CE1-CD2 4.43Å
352	P	89.4	Confident	74.7	Confident	22 Å²	22	66.9 Å²	66.9	14%	0.143	37%	0.367	C	S	.	.	S	Bend	trans	-80.2	-24	-162.2	28.8	-36.5	0	0	0	115.5	I341 M344 L348 P378	I341-P352 HydrophobicContact CD1-CG 4.45Å; I341-P352 HydrophobicContact CG2-CG 4.22Å; M344-P352 HydrophobicContact CB-CG 4.4Å; M344-P352 HydrophobicContact CG-CB 3.68Å; M344-P352 HydrophobicContact CG-CG 4.06Å; M344-P352 HydrophobicContact SD-CB 3.32Å; M344-P352 WeakPolarHBondContact SD-CB 3.33Å; M344-P352 HydrophobicContact SD-CG 3.86Å; L348-P352 HydrophobicContact CD1-CB 4.25Å; P352-P378 HydrophobicContact CB-CB 4.13Å; P352-P378 HydrophobicContact CB-CG 3.85Å; P352-P378 HydrophobicContact CG-CG 4.2Å
353	Y	85.6	Confident	72.5	Confident	6 Å²	6	70.1 Å²	70.1	2%	0.024	38%	0.384	C	S	.	.	S	Bend	trans	-80.5	149.3	170.2	-72.4	-89.8	0	0	0	110.1	I341 F351 Q355 L368 I372 P378	I341-Y353 HydrophobicContact CD1-CD2 4.33Å; I341-Y353 HydrophobicContact CD1-CE2 3.62Å; F351-Y353 AromaticContact CE1-CD2 3.92Å; F351-Y353 HydrophobicContact CE1-CD2 3.92Å; F351-Y353 HydrophobicContact CE1-CG 4.32Å; F351-Y353 HydrophobicContact CZ-CD2 4.27Å; Y353-Q355 PolarHBondContact O-N 3.01Å; Y353-Q355 PolarHBondContact O-NE2 3.29Å; Y353-Q355 VanDerWaalsContact O-NE2 3.14Å; Y353-L368 HydrophobicContact CD1-CD1 4.48Å; Y353-L368 HydrophobicContact CG-CD1 4Å; Y353-I372 HydrophobicContact CD2-CG1 4.29Å; Y353-I372 HydrophobicContact CE1-CG1 4.1Å; Y353-I372 HydrophobicContact CE2-CG1 3.81Å; Y353-P378 HydrophobicContact CD2-CG 4.19Å; Y353-P378 HydrophobicContact CE1-CG 4.41Å; Y353-P378 HydrophobicContact CE2-CG 3.92Å; Y353-P378 WeakPolarHBondContact OH-CD 3.49Å
354	P	71.4	Confident	70.8	Confident	87 Å²	87	76 Å²	76	57%	0.565	41%	0.413	S	S	*	.			trans	-43.8	103.1	-178.8	-29.7	35.1	0	0	0	112.6	L363	P354-L363 HydrophobicContact CB-CD1 4.32Å
355	Q	59.3	Low	69.4	Low	99 Å²	99	78.4 Å²	78.4	46%	0.463	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-88.9	122.5	169.8	-64.3	-54.8	-72.8	0	0	106.9	F351 Y353 Q357	F351-Q355 HydrophobicContact CB-CG 3.71Å; F351-Q355 HydrophobicContact CD1-CG 4.08Å; F351-Q355 HydrophobicContact CG-CG 4.34Å; Y353-Q355 PolarHBondContact O-N 3.01Å; Y353-Q355 PolarHBondContact O-NE2 3.29Å; Y353-Q355 VanDerWaalsContact O-NE2 3.14Å; Q355-Q357 PolarHBondContact O-N 2.89Å; Q355-Q357 VanDerWaalsContact O-N 3.11Å
356	I	50.7	Low	68.3	Low	53 Å²	53	83.3 Å²	83.3	27%	0.272	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-63.8	118.7	-174.7	-52	107.2	0	0	0	109.1	K358 Q360 G361 S362 L363	I356-K358 PolarHBondContact O-N 3.14Å; I356-Q360 WeakPolarHBondContact CG2-O 3.38Å; I356-G361 VanDerWaalsContact CG2-C 3.44Å; I356-G361 VanDerWaalsContact CG2-O 3.28Å; I356-G361 WeakPolarHBondContact CG2-O 3.39Å; I356-S362 VanDerWaalsContact CD1-CA 3.46Å; I356-S362 VanDerWaalsContact CG1-CA 3.46Å; I356-L363 HydrophobicContact CD1-CB 3.8Å; I356-L363 HydrophobicContact CD1-CG 4.4Å; I356-L363 HydrophobicContact CG1-CB 4.17Å; I356-L363 HydrophobicContact CG1-CG 4.26Å
357	Q	40.8	Very low	67.3	Low	168 Å²	168	87.3 Å²	87.3	79%	0.785	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-65.6	131.1	165.6	-64.6	-178.5	20.6	0	0	107.7	Q355 N359 Q360	Q355-Q357 PolarHBondContact O-N 2.89Å; Q355-Q357 VanDerWaalsContact O-N 3.11Å; Q357-N359 PolarHBondContact O-N 2.77Å; Q357-Q360 PolarHBondContact O-N 3.3Å; Q357-Q360 VanDerWaalsContact O-N 3.14Å
358	K	43.2	Very low	66.6	Low	213 Å²	213	88.6 Å²	88.6	93%	0.926	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-2.7	-171.7	-69.8	179.2	174.5	178.9	0	117.7	I356	I356-K358 PolarHBondContact O-N 3.14Å
359	N	40.1	Very low	66	Low	156 Å²	156	88 Å²	88	83%	0.834	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-0.7	-175.9	-64.5	-9.8	0	0	0	115.2	Q357	Q357-N359 PolarHBondContact O-N 2.77Å
360	Q	41.2	Very low	65.5	Low	175 Å²	175	91.4 Å²	91.4	82%	0.818	48%	0.483	S	S	*	.	S	Bend	trans	-140.9	87.7	171.3	-68.2	-172.3	21.8	0	0	110.5	I356 Q357	I356-Q360 WeakPolarHBondContact CG2-O 3.38Å; Q357-Q360 PolarHBondContact O-N 3.3Å; Q357-Q360 VanDerWaalsContact O-N 3.14Å
361	G	45	Very low	65.2	Low	72 Å²	72	86.9 Å²	86.9	74%	0.742	46%	0.463	S	S	*	.			trans	40.2	108	162.6	0	0	0	0	0	118.2	I356 L363	I356-G361 VanDerWaalsContact CG2-C 3.44Å; I356-G361 VanDerWaalsContact CG2-O 3.28Å; I356-G361 WeakPolarHBondContact CG2-O 3.39Å; G361-L363 PolarHBondContact O-N 3.19Å
362	S	45.2	Very low	65.1	Low	87 Å²	87	86 Å²	86	61%	0.608	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-56.1	129	176.9	-62.7	0	0	0	0	113.1	I356 M364	I356-S362 VanDerWaalsContact CD1-CA 3.46Å; I356-S362 VanDerWaalsContact CG1-CA 3.46Å; S362-M364 PolarHBondContact O-N 3.36Å
363	L	51.9	Low	65.1	Low	68 Å²	68	86.8 Å²	86.8	36%	0.356	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-56.6	121.6	157.6	-69	159.6	0	0	0	105.8	P354 I356 G361 Q367	P354-L363 HydrophobicContact CB-CD1 4.32Å; I356-L363 HydrophobicContact CD1-CB 3.8Å; I356-L363 HydrophobicContact CD1-CG 4.4Å; I356-L363 HydrophobicContact CG1-CB 4.17Å; I356-L363 HydrophobicContact CG1-CG 4.26Å; G361-L363 PolarHBondContact O-N 3.19Å; L363-Q367 HydrophobicContact CB-CB 4.07Å; L363-Q367 HydrophobicContact CD2-CB 3.73Å; L363-Q367 HydrophobicContact CD2-CG 4.37Å; L363-Q367 HydrophobicContact CG-CB 4.5Å
364	M	61.7	Low	65.1	Low	123 Å²	123	90.9 Å²	90.9	61%	0.606	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-61.8	149.8	174.8	-65.1	-62.2	-72.8	0	0	108.4	S362 L366 Q367 L368	S362-M364 PolarHBondContact O-N 3.36Å; M364-L366 PolarHBondContact O-N 3.4Å; M364-Q367 WeakPolarHBondContact O-CB 2.89Å; M364-Q367 PolarHBondContact O-N 2.81Å; M364-L368 PolarHBondContact O-N 3.05Å
365	P	69.1	Low	65.9	Low	52 Å²	52	92.4 Å²	92.4	34%	0.338	49%	0.485	S	S	.	.	H	α-helix	trans	-46.4	-36.2	-179.5	-29.9	33.9	0	0	0	113.9	V314 L368 L369	V314-P365 HydrophobicContact CB-CG 4.35Å; V314-P365 HydrophobicContact CG1-CB 4.3Å; V314-P365 HydrophobicContact CG1-CG 3.41Å; V314-P365 VanDerWaalsContact CG1-CG 3.41Å; V314-P365 HydrophobicContact CG2-CG 4.3Å; P365-L368 PolarHBondContact O-N 3.47Å; P365-L369 WeakPolarHBondContact O-CG 3.34Å; P365-L369 PolarHBondContact O-N 3.09Å
366	L	72.7	Confident	67.4	Low	138 Å²	138	94.5 Å²	94.5	72%	0.723	50%	0.499	S	S	*	.	H	α-helix	trans	-63.4	-38.4	175.7	-65.3	174.9	0	0	0	113.7	M364 L369 Q370	M364-L366 PolarHBondContact O-N 3.4Å; L366-L369 PolarHBondContact O-N 2.93Å; L366-Q370 WeakPolarHBondContact O-CB 3.38Å; L366-Q370 PolarHBondContact O-N 3.39Å
367	Q	75.7	Confident	69.4	Low	88 Å²	88	93.5 Å²	93.5	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-70.8	-32.9	-179.9	-65.6	173.5	-50.5	0	0	112	L363 M364 Q370 C371	L363-Q367 HydrophobicContact CB-CB 4.07Å; L363-Q367 HydrophobicContact CD2-CB 3.73Å; L363-Q367 HydrophobicContact CD2-CG 4.37Å; L363-Q367 HydrophobicContact CG-CB 4.5Å; M364-Q367 WeakPolarHBondContact O-CB 2.89Å; M364-Q367 PolarHBondContact O-N 2.81Å; Q367-Q370 PolarHBondContact O-N 3.19Å; Q367-C371 WeakPolarHBondContact O-CB 3.38Å; Q367-C371 PolarHBondContact O-N 3.3Å
368	L	82.9	Confident	71.9	Confident	28 Å²	28	87 Å²	87	15%	0.147	47%	0.469	C	S	.	.	H	α-helix	trans	-64.5	-45.4	171.5	174.7	61.4	0	0	0	110.9	A318 F351 Y353 M364 P365 Q370 C371 I372	A318-L368 HydrophobicContact CB-CD2 3.74Å; F351-L368 HydrophobicContact CE1-CD1 4.36Å; F351-L368 HydrophobicContact CE1-CD2 4.43Å; Y353-L368 HydrophobicContact CD1-CD1 4.48Å; Y353-L368 HydrophobicContact CG-CD1 4Å; M364-L368 PolarHBondContact O-N 3.05Å; P365-L368 PolarHBondContact O-N 3.47Å; L368-Q370 VanDerWaalsContact C-N 3.3Å; L368-Q370 PolarHBondContact O-N 2.98Å; L368-C371 WeakPolarHBondContact O-CB 3.46Å; L368-C371 PolarHBondContact O-N 3.42Å; L368-I372 HydrophobicContact CD1-CD1 4.35Å; L368-I372 HydrophobicContact CD1-CG1 4.5Å; L368-I372 HydrophobicContact CG-CD1 4.2Å; L368-I372 WeakPolarHBondContact O-CG1 3.25Å; L368-I372 PolarHBondContact O-N 3.24Å
369	L	84.2	Confident	74.3	Confident	28 Å²	28	82.4 Å²	82.4	15%	0.147	46%	0.458	C	S	.	.	H	α-helix	trans	-62.4	-41.3	177.1	-62.9	180	0	0	0	111.5	N317 I325 P365 L366 I372 V373	N317-L369 HydrophobicContact CB-CD1 4.26Å; N317-L369 HydrophobicContact CB-CD2 3.61Å; N317-L369 WeakPolarHBondContact O-CD2 3.46Å; I325-L369 HydrophobicContact CD1-CB 4.36Å; I325-L369 HydrophobicContact CD1-CD2 3.75Å; I325-L369 HydrophobicContact CG1-CD2 4.16Å; I325-L369 HydrophobicContact CG2-CB 3.96Å; P365-L369 WeakPolarHBondContact O-CG 3.34Å; P365-L369 PolarHBondContact O-N 3.09Å; L366-L369 PolarHBondContact O-N 2.93Å; L369-I372 HydrophobicContact CD2-CD1 4.45Å; L369-I372 PolarHBondContact O-N 3.2Å; L369-V373 WeakPolarHBondContact O-CG2 3.48Å; L369-V373 PolarHBondContact O-N 3.4Å; L369-V373 VanDerWaalsContact O-N 3.09Å
370	Q	82.8	Confident	76.8	Confident	112 Å²	112	75.4 Å²	75.4	52%	0.523	42%	0.421	S	S	.	.	H	α-helix	trans	-60.7	-45.5	173.8	-171.7	174.6	1.6	0	0	111.4	L366 Q367 L368 I372 V373 D374	L366-Q370 WeakPolarHBondContact O-CB 3.38Å; L366-Q370 PolarHBondContact O-N 3.39Å; Q367-Q370 PolarHBondContact O-N 3.19Å; L368-Q370 VanDerWaalsContact C-N 3.3Å; L368-Q370 PolarHBondContact O-N 2.98Å; Q370-I372 VanDerWaalsContact C-N 3.32Å; Q370-I372 PolarHBondContact O-N 3.48Å; Q370-V373 PolarHBondContact O-N 3.14Å; Q370-V373 VanDerWaalsContact O-N 3.08Å; Q370-D374 WeakPolarHBondContact CG-OD2 3.38Å; Q370-D374 PolarHBondContact NE2-OD2 2.62Å; Q370-D374 VanDerWaalsContact NE2-OD2 3.1Å; Q370-D374 WeakPolarHBondContact O-CB 3.44Å; Q370-D374 PolarHBondContact O-N 3.38Å
371	C	85.8	Confident	79.2	Confident	30 Å²	30	69.2 Å²	69.2	20%	0.203	40%	0.396	C	S	.	.	H	α-helix	trans	-59.3	-41.4	176	-177.9	0	0	0	0	112.1	Q367 L368 V373 E375	Q367-C371 WeakPolarHBondContact O-CB 3.38Å; Q367-C371 PolarHBondContact O-N 3.3Å; L368-C371 WeakPolarHBondContact O-CB 3.46Å; L368-C371 PolarHBondContact O-N 3.42Å; C371-V373 VanDerWaalsContact C-N 3.28Å; C371-V373 PolarHBondContact O-N 2.82Å; C371-E375 HydrophobicContact CB-CG 4.46Å; C371-E375 VanDerWaalsContact O-CB 3.3Å; C371-E375 WeakPolarHBondContact O-CB 3.3Å; C371-E375 PolarHBondContact O-N 3.08Å
372	I	89	Confident	81.3	Confident	0 Å²	0	73 Å²	73	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-60.8	-39.1	175.5	-68.5	164.9	0	0	0	111.5	A318 P322 I325 W337 Y353 L368 L369 Q370 K399	A318-I372 WeakPolarHBondContact O-CD1 3.27Å; P322-I372 HydrophobicContact CG-CG2 3.95Å; I325-I372 HydrophobicContact CD1-CB 3.88Å; I325-I372 HydrophobicContact CD1-CD1 4.17Å; I325-I372 HydrophobicContact CD1-CG2 3.54Å; W337-I372 HydrophobicContact CZ2-CG2 3.89Å; Y353-I372 HydrophobicContact CD2-CG1 4.29Å; Y353-I372 HydrophobicContact CE1-CG1 4.1Å; Y353-I372 HydrophobicContact CE2-CG1 3.81Å; L368-I372 HydrophobicContact CD1-CD1 4.35Å; L368-I372 HydrophobicContact CD1-CG1 4.5Å; L368-I372 HydrophobicContact CG-CD1 4.2Å; L368-I372 WeakPolarHBondContact O-CG1 3.25Å; L368-I372 PolarHBondContact O-N 3.24Å; L369-I372 HydrophobicContact CD2-CD1 4.45Å; L369-I372 PolarHBondContact O-N 3.2Å; Q370-I372 VanDerWaalsContact C-N 3.32Å; Q370-I372 PolarHBondContact O-N 3.48Å; I372-K399 WeakPolarHBondContact O-CE 3.36Å
373	V	88	Confident	83.6	Confident	40 Å²	40	72.6 Å²	72.6	24%	0.242	41%	0.414	C	S	.	.	H	α-helix	trans	-78.7	-42.1	-177.7	175.3	0	0	0	0	112.4	P322 I325 L369 Q370 C371 K399	P322-V373 HydrophobicContact CB-CG2 4.49Å; I325-V373 HydrophobicContact CB-CG2 3.76Å; I325-V373 HydrophobicContact CD1-CG2 4.22Å; I325-V373 HydrophobicContact CG2-CG2 3.56Å; L369-V373 WeakPolarHBondContact O-CG2 3.48Å; L369-V373 PolarHBondContact O-N 3.4Å; L369-V373 VanDerWaalsContact O-N 3.09Å; Q370-V373 PolarHBondContact O-N 3.14Å; Q370-V373 VanDerWaalsContact O-N 3.08Å; C371-V373 VanDerWaalsContact C-N 3.28Å; C371-V373 PolarHBondContact O-N 2.82Å; V373-K399 VanDerWaalsContact C-NZ 3.27Å; V373-K399 WeakPolarHBondContact O-CE 3.02Å; V373-K399 PolarHBondContact O-NZ 3.14Å
374	D	86.4	Confident	85.6	Confident	92 Å²	92	74.8 Å²	74.8	49%	0.492	42%	0.422	S	S	.	.	H	α-helix	trans	-96.1	-40.7	-167.6	-65.1	-16.8	0	0	0	112.2	Q370 K399	Q370-D374 WeakPolarHBondContact CG-OD2 3.38Å; Q370-D374 PolarHBondContact NE2-OD2 2.62Å; Q370-D374 VanDerWaalsContact NE2-OD2 3.1Å; Q370-D374 WeakPolarHBondContact O-CB 3.44Å; Q370-D374 PolarHBondContact O-N 3.38Å; D374-K399 PolarHBondContact O-NZ 3.36Å
375	E	88.8	Confident	87.3	Confident	118 Å²	118	70.3 Å²	70.3	55%	0.551	40%	0.4	S	S	*	.	S	Bend	trans	-91.8	154.9	-172	-58.4	-62.9	158.5	0	0	113.5	C371 K399	C371-E375 HydrophobicContact CB-CG 4.46Å; C371-E375 VanDerWaalsContact O-CB 3.3Å; C371-E375 WeakPolarHBondContact O-CB 3.3Å; C371-E375 PolarHBondContact O-N 3.08Å; E375-K399 VanDerWaalsContact C-NZ 3.3Å; E375-K399 WeakPolarHBondContact O-CE 3.41Å; E375-K399 PolarHBondContact O-NZ 3.2Å
376	D	90.4	Very high	88.7	Confident	143 Å²	143	69.6 Å²	69.6	77%	0.765	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-57.4	142.9	175.1	-80.3	-33.4	0	0	0	111.9
377	P	93.2	Very high	89.9	Confident	33 Å²	33	71.4 Å²	71.4	21%	0.214	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-61.4	143.9	178.4	25.9	-33.4	0	0	0	110.8	W337 M397	W337-P377 HydrophobicContact CH2-CB 4.14Å; P377-M397 HydrophobicContact CB-CB 4.25Å; P377-M397 HydrophobicContact CB-CE 3.84Å; P377-M397 WeakPolarHBondContact CG-O 3.45Å
378	P	92.9	Very high	90.9	Very high	31 Å²	31	71.3 Å²	71.3	20%	0.201	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-60.5	151.4	177.5	24.8	-33	0	0	0	110.6	M344 P352 Y353 M397	M344-P378 WeakPolarHBondContact CE-O 3.41Å; M344-P378 HydrophobicContact SD-CB 3.95Å; M344-P378 HydrophobicContact SD-CG 3.84Å; P352-P378 HydrophobicContact CB-CB 4.13Å; P352-P378 HydrophobicContact CB-CG 3.85Å; P352-P378 HydrophobicContact CG-CG 4.2Å; Y353-P378 HydrophobicContact CD2-CG 4.19Å; Y353-P378 HydrophobicContact CE1-CG 4.41Å; Y353-P378 HydrophobicContact CE2-CG 3.92Å; Y353-P378 WeakPolarHBondContact OH-CD 3.49Å; P378-M397 HydrophobicContact CG-CE 3.78Å
379	V	92.9	Very high	91.7	Very high	116 Å²	116	70 Å²	70	70%	0.703	39%	0.392	S	S	*	.			trans	-118.6	148.2	-179	-64	0	0	0	0	110.6
380	L	93.4	Very high	92.3	Very high	10 Å²	10	70.9 Å²	70.9	5%	0.052	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-67.9	143.8	176.4	-76.3	174.8	0	0	0	110.2	M344 L348 V382 F385 F389 V390 I393	M344-L380 HydrophobicContact CE-CB 4.28Å; M344-L380 HydrophobicContact CE-CD2 3.82Å; M344-L380 HydrophobicContact CE-CG 3.62Å; M344-L380 VanDerWaalsContact CE-N 3.26Å; M344-L380 HydrophobicContact CG-CD2 3.86Å; L348-L380 HydrophobicContact CD2-CD2 4.16Å; L348-L380 HydrophobicContact CG-CD2 4.21Å; L380-V382 PolarHBondContact O-N 3.09Å; L380-F385 HydrophobicContact CB-CD2 4.02Å; L380-F385 HydrophobicContact CB-CE2 4.48Å; L380-F385 HydrophobicContact CD1-CB 4.39Å; L380-F385 HydrophobicContact CD1-CD2 4.13Å; L380-F385 HydrophobicContact CD1-CG 4.2Å; L380-F385 HydrophobicContact CD2-CD2 4.01Å; L380-F385 HydrophobicContact CD2-CE2 3.78Å; L380-F385 HydrophobicContact CD2-CZ 4.28Å; L380-F385 HydrophobicContact CG-CD2 4.28Å; L380-F389 HydrophobicContact CD1-CD1 3.72Å; L380-F389 HydrophobicContact CD1-CE1 3.67Å; L380-F389 HydrophobicContact CD1-CG 4.49Å; L380-F389 HydrophobicContact CD1-CZ 4.44Å; L380-V390 HydrophobicContact CB-CG2 4.22Å; L380-V390 HydrophobicContact CD1-CG2 4.13Å; L380-I393 HydrophobicContact CD1-CB 4.41Å; L380-I393 HydrophobicContact CD1-CG1 4.06Å
381	P	91.8	Very high	93	Very high	45 Å²	45	69.9 Å²	69.9	29%	0.292	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-55.3	132.6	175.2	-25.7	32.5	0	0	0	112.7	L348 G383 Q384	L348-P381 HydrophobicContact CD2-CG 3.96Å; P381-G383 PolarHBondContact O-N 3.37Å; P381-Q384 HydrophobicContact CB-CB 4.38Å; P381-Q384 HydrophobicContact CB-CG 4.03Å; P381-Q384 PolarHBondContact O-N 3.28Å
382	V	89.4	Confident	93.6	Very high	150 Å²	150	68.4 Å²	68.4	91%	0.909	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	135.1	-179.8	-175.8	0	0	0	0	110.3	L380 Q384	L380-V382 PolarHBondContact O-N 3.09Å; V382-Q384 VanDerWaalsContact C-N 3.27Å; V382-Q384 PolarHBondContact O-N 2.96Å
383	G	91.6	Very high	94.1	Very high	80 Å²	80	68.6 Å²	68.6	83%	0.825	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	-0.5	174.6	0	0	0	0	0	115.9	P381	P381-G383 PolarHBondContact O-N 3.37Å
384	Q	95.2	Very high	94.5	Very high	113 Å²	113	69.3 Å²	69.3	53%	0.528	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-21.6	177.8	-67.4	-168.2	29.3	0	0	114.3	P381 V382	P381-Q384 HydrophobicContact CB-CB 4.38Å; P381-Q384 HydrophobicContact CB-CG 4.03Å; P381-Q384 PolarHBondContact O-N 3.28Å; V382-Q384 VanDerWaalsContact C-N 3.27Å; V382-Q384 PolarHBondContact O-N 2.96Å
385	F	97.3	Very high	95	Very high	29 Å²	29	67 Å²	67	13%	0.127	38%	0.376	C	S	.	.	S	Bend	trans	-132.7	158.1	-171.7	-63.9	-77.4	0	0	0	111	E254 A347 L348 L380 F389 V390	E254-F385 WeakPolarHBondContact OE2-CA 3.4Å; A347-F385 HydrophobicContact CB-CE1 3.73Å; A347-F385 HydrophobicContact CB-CZ 3.88Å; A347-F385 WeakPolarHBondContact O-CZ 3.38Å; L348-F385 HydrophobicContact CD2-CE2 4.05Å; L348-F385 HydrophobicContact CD2-CZ 4.22Å; L380-F385 HydrophobicContact CB-CD2 4.02Å; L380-F385 HydrophobicContact CB-CE2 4.48Å; L380-F385 HydrophobicContact CD1-CB 4.39Å; L380-F385 HydrophobicContact CD1-CD2 4.13Å; L380-F385 HydrophobicContact CD1-CG 4.2Å; L380-F385 HydrophobicContact CD2-CD2 4.01Å; L380-F385 HydrophobicContact CD2-CE2 3.78Å; L380-F385 HydrophobicContact CD2-CZ 4.28Å; L380-F385 HydrophobicContact CG-CD2 4.28Å; F385-F389 HydrophobicContact CB-CD1 3.98Å; F385-F389 AromaticContact CD1-CD1 3.67Å; F385-F389 HydrophobicContact CD1-CD1 3.67Å; F385-F389 AromaticContact CD1-CE1 3.83Å; F385-F389 HydrophobicContact CD1-CE1 3.83Å; F385-F389 HydrophobicContact CE1-CD1 4.43Å; F385-F389 HydrophobicContact CE1-CE1 4.15Å; F385-F389 AromaticContact CG-CD1 3.99Å; F385-F389 HydrophobicContact CG-CD1 3.99Å; F385-F389 HydrophobicContact CG-CE1 4.35Å; F385-V390 HydrophobicContact CB-CG2 4.04Å
386	S	98.1	Very high	95.5	Very high	37 Å²	37	61.4 Å²	61.4	26%	0.259	35%	0.349	S	S	.	.			trans	-65.5	146.8	176.8	77.1	0	0	0	0	111.5	E254 K388 F389 V390	E254-S386 WeakPolarHBondContact OE1-CB 3.34Å; E254-S386 PolarHBondContact OE1-OG 3.09Å; E254-S386 PolarHBondContact OE2-N 3.3Å; S386-K388 PolarHBondContact O-N 3.47Å; S386-K388 VanDerWaalsContact O-N 3.15Å; S386-F389 PolarHBondContact O-N 3.22Å; S386-F389 PolarHBondContact OG-N 3.24Å; S386-F389 VanDerWaalsContact OG-N 3.16Å; S386-V390 WeakPolarHBondContact O-CG2 3.44Å; S386-V390 PolarHBondContact O-N 2.93Å
387	E	97.4	Very high	95.8	Very high	177 Å²	177	54.8 Å²	54.8	83%	0.827	31%	0.314	S	S	*	.	H	α-helix	trans	-55.7	-34.8	176.4	-65.2	-177.8	170.5	0	0	112.1	V390 H391	E387-V390 PolarHBondContact O-N 3.45Å; E387-H391 VanDerWaalsContact O-CB 3.24Å; E387-H391 WeakPolarHBondContact O-CB 3.49Å; E387-H391 PolarHBondContact O-N 3.22Å
388	K	98.1	Very high	96	Very high	86 Å²	86	58 Å²	58	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-65.4	-41.7	176.7	-64.6	-179	-176	177.8	0	111.6	S386 F392 H413 F415	S386-K388 PolarHBondContact O-N 3.47Å; S386-K388 VanDerWaalsContact O-N 3.15Å; K388-F392 WeakPolarHBondContact O-CB 3.34Å; K388-F392 PolarHBondContact O-N 3.2Å; K388-H413 PolarHBondContact O-CE1 2.94Å; K388-F415 HydrophobicContact CB-CB 4.09Å; K388-F415 HydrophobicContact CB-CD2 4.34Å
389	F	98.4	Very high	96	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-69	-44.5	177.5	-175	-132.9	0	0	0	111.5	E254 L257 F343 A347 L380 F385 S386 H391 F392 I393 F415	E254-F389 HydrophobicContact CG-CB 4.1Å; E254-F389 HydrophobicContact CG-CD1 3.9Å; E254-F389 HydrophobicContact CG-CG 3.95Å; L257-F389 HydrophobicContact CD1-CZ 4.29Å; F343-F389 HydrophobicContact CB-CE2 4.39Å; F343-F389 HydrophobicContact CB-CZ 4.44Å; A347-F389 HydrophobicContact CB-CE1 3.55Å; A347-F389 HydrophobicContact CB-CZ 3.78Å; L380-F389 HydrophobicContact CD1-CD1 3.72Å; L380-F389 HydrophobicContact CD1-CE1 3.67Å; L380-F389 HydrophobicContact CD1-CG 4.49Å; L380-F389 HydrophobicContact CD1-CZ 4.44Å; F385-F389 HydrophobicContact CB-CD1 3.98Å; F385-F389 AromaticContact CD1-CD1 3.67Å; F385-F389 HydrophobicContact CD1-CD1 3.67Å; F385-F389 AromaticContact CD1-CE1 3.83Å; F385-F389 HydrophobicContact CD1-CE1 3.83Å; F385-F389 HydrophobicContact CE1-CD1 4.43Å; F385-F389 HydrophobicContact CE1-CE1 4.15Å; F385-F389 AromaticContact CG-CD1 3.99Å; F385-F389 HydrophobicContact CG-CD1 3.99Å; F385-F389 HydrophobicContact CG-CE1 4.35Å; S386-F389 PolarHBondContact O-N 3.22Å; S386-F389 PolarHBondContact OG-N 3.24Å; S386-F389 VanDerWaalsContact OG-N 3.16Å; F389-H391 VanDerWaalsContact C-N 3.32Å; F389-H391 PolarHBondContact O-N 3.33Å; F389-F392 HydrophobicContact CD2-CD1 4.4Å; F389-F392 HydrophobicContact CE2-CD1 4.44Å; F389-F392 WeakPolarHBondContact O-CB 3.48Å; F389-F392 PolarHBondContact O-N 3.49Å; F389-I393 HydrophobicContact CD2-CD1 4.49Å; F389-I393 HydrophobicContact CD2-CG1 4.1Å; F389-I393 HydrophobicContact CE1-CG1 4.48Å; F389-I393 HydrophobicContact CE2-CD1 3.72Å; F389-I393 HydrophobicContact CE2-CG1 3.72Å; F389-I393 HydrophobicContact CZ-CD1 4Å; F389-I393 HydrophobicContact CZ-CG1 3.92Å; F389-I393 WeakPolarHBondContact O-CG1 3.44Å; F389-I393 PolarHBondContact O-N 3Å; F389-F415 HydrophobicContact CB-CD2 3.73Å; F389-F415 HydrophobicContact CB-CE2 3.49Å; F389-F415 VanDerWaalsContact CB-CE2 3.49Å; F389-F415 HydrophobicContact CB-CZ 4.19Å; F389-F415 HydrophobicContact CD2-CD1 4.2Å; F389-F415 HydrophobicContact CD2-CD2 4.08Å; F389-F415 AromaticContact CD2-CE1 3.61Å; F389-F415 HydrophobicContact CD2-CE1 3.61Å; F389-F415 AromaticContact CD2-CE2 3.46Å; F389-F415 HydrophobicContact CD2-CE2 3.46Å; F389-F415 VanDerWaalsContact CD2-CE2 3.46Å; F389-F415 HydrophobicContact CD2-CG 4.42Å; F389-F415 AromaticContact CD2-CZ 3.2Å; F389-F415 HydrophobicContact CD2-CZ 3.2Å; F389-F415 HydrophobicContact CE2-CE1 4.06Å; F389-F415 HydrophobicContact CE2-CE2 4.46Å; F389-F415 AromaticContact CE2-CZ 3.81Å; F389-F415 HydrophobicContact CE2-CZ 3.81Å; F389-F415 HydrophobicContact CG-CD2 4.33Å; F389-F415 AromaticContact CG-CE2 3.73Å; F389-F415 HydrophobicContact CG-CE2 3.73Å; F389-F415 AromaticContact CG-CZ 3.92Å; F389-F415 HydrophobicContact CG-CZ 3.92Å
390	V	98.2	Very high	96	Very high	46 Å²	46	56.8 Å²	56.8	28%	0.279	31%	0.307	S	S	.	.	H	α-helix	trans	-55.7	-50.2	174.4	178.7	0	0	0	0	110.3	L380 F385 S386 E387 F392 I393 T394	L380-V390 HydrophobicContact CB-CG2 4.22Å; L380-V390 HydrophobicContact CD1-CG2 4.13Å; F385-V390 HydrophobicContact CB-CG2 4.04Å; S386-V390 WeakPolarHBondContact O-CG2 3.44Å; S386-V390 PolarHBondContact O-N 2.93Å; E387-V390 PolarHBondContact O-N 3.45Å; V390-F392 PolarHBondContact O-N 3.29Å; V390-I393 PolarHBondContact O-N 2.89Å; V390-T394 PolarHBondContact O-N 2.98Å; V390-T394 PolarHBondContact O-OG1 3.19Å
391	H	97.7	Very high	96.1	Very high	91 Å²	91	57.7 Å²	57.7	42%	0.421	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-42	178.4	-173.7	-100	0	0	0	112.5	E387 F389 I393 T394 Q395 H413	E387-H391 VanDerWaalsContact O-CB 3.24Å; E387-H391 WeakPolarHBondContact O-CB 3.49Å; E387-H391 PolarHBondContact O-N 3.22Å; F389-H391 VanDerWaalsContact C-N 3.32Å; F389-H391 PolarHBondContact O-N 3.33Å; H391-I393 PolarHBondContact O-N 3.31Å; H391-T394 PolarHBondContact O-N 3.4Å; H391-Q395 PolarHBondContact NE2-NE2 3.4Å; H391-Q395 VanDerWaalsContact O-CG 3.24Å; H391-Q395 WeakPolarHBondContact O-CG 3.39Å; H391-Q395 PolarHBondContact O-N 3.23Å; H391-H413 AromaticContact CE1-NE2 3.63Å; H391-H413 AromaticContact CG-NE2 3.88Å; H391-H413 AromaticContact ND1-CD2 3.87Å; H391-H413 AromaticContact ND1-CE1 3.69Å; H391-H413 AromaticContact ND1-NE2 2.83Å; H391-H413 PolarHBondContact ND1-NE2 2.89Å
392	F	98.4	Very high	96.2	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-56.5	-49.8	175.9	175.1	-102.9	0	0	0	111.7	A261 V265 V339 K388 F389 V390 Q395 C396 L410 H413 F415 I416	A261-F392 HydrophobicContact CB-CE1 4.49Å; A261-F392 HydrophobicContact CB-CZ 4.46Å; V265-F392 HydrophobicContact CG2-CZ 4.28Å; V339-F392 HydrophobicContact CG1-CE1 4.33Å; V339-F392 HydrophobicContact CG1-CZ 4.16Å; K388-F392 WeakPolarHBondContact O-CB 3.34Å; K388-F392 PolarHBondContact O-N 3.2Å; F389-F392 HydrophobicContact CD2-CD1 4.4Å; F389-F392 HydrophobicContact CE2-CD1 4.44Å; F389-F392 WeakPolarHBondContact O-CB 3.48Å; F389-F392 PolarHBondContact O-N 3.49Å; V390-F392 PolarHBondContact O-N 3.29Å; F392-Q395 PolarHBondContact O-N 2.77Å; F392-C396 PolarHBondContact O-N 2.85Å; F392-C396 VanDerWaalsContact O-N 3.07Å; F392-C396 PolarHBondContact O-SG 2.77Å; F392-L410 HydrophobicContact CD2-CD2 4.2Å; F392-L410 HydrophobicContact CE2-CD2 3.82Å; F392-H413 VanDerWaalsContact CA-CE1 3.49Å; F392-H413 WeakPolarHBondContact CA-CE1 3.08Å; F392-H413 VanDerWaalsContact CB-CE1 3.49Å; F392-H413 WeakPolarHBondContact CB-CE1 3.16Å; F392-H413 HydrophobicContact CD2-CB 4.43Å; F392-H413 AromaticContact CD2-ND1 3.79Å; F392-H413 PolarHBondContact N-CE1 3.16Å; F392-F415 HydrophobicContact CB-CB 3.92Å; F392-F415 HydrophobicContact CB-CD1 4.01Å; F392-F415 HydrophobicContact CB-CG 4.1Å; F392-F415 AromaticContact CD1-CD1 3.89Å; F392-F415 HydrophobicContact CD1-CD1 3.89Å; F392-F415 HydrophobicContact CD1-CE1 4.16Å; F392-F415 HydrophobicContact CD2-CD1 4.18Å; F392-F415 HydrophobicContact CE1-CD1 4.42Å; F392-F415 HydrophobicContact CE1-CE1 4.5Å; F392-F415 HydrophobicContact CG-CB 4.36Å; F392-F415 AromaticContact CG-CD1 3.76Å; F392-F415 HydrophobicContact CG-CD1 3.76Å; F392-F415 HydrophobicContact CG-CE1 4.48Å; F392-F415 HydrophobicContact CG-CG 4.34Å; F392-I416 HydrophobicContact CD2-CD1 4.33Å; F392-I416 HydrophobicContact CD2-CG1 4.07Å; F392-I416 HydrophobicContact CE2-CD1 3.67Å; F392-I416 HydrophobicContact CE2-CG1 3.65Å; F392-I416 HydrophobicContact CZ-CD1 3.93Å; F392-I416 HydrophobicContact CZ-CG1 4.4Å
393	I	98.1	Very high	96.5	Very high	3 Å²	3	62.1 Å²	62.1	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-44.4	179.6	-61.7	-62.4	0	0	0	111.2	F343 M344 L380 F389 V390 H391 Q395 C396 M397	F343-I393 HydrophobicContact CB-CD1 3.52Å; M344-I393 HydrophobicContact CB-CG2 4.23Å; M344-I393 HydrophobicContact CE-CG2 3.98Å; L380-I393 HydrophobicContact CD1-CB 4.41Å; L380-I393 HydrophobicContact CD1-CG1 4.06Å; F389-I393 HydrophobicContact CD2-CD1 4.49Å; F389-I393 HydrophobicContact CD2-CG1 4.1Å; F389-I393 HydrophobicContact CE1-CG1 4.48Å; F389-I393 HydrophobicContact CE2-CD1 3.72Å; F389-I393 HydrophobicContact CE2-CG1 3.72Å; F389-I393 HydrophobicContact CZ-CD1 4Å; F389-I393 HydrophobicContact CZ-CG1 3.92Å; F389-I393 WeakPolarHBondContact O-CG1 3.44Å; F389-I393 PolarHBondContact O-N 3Å; V390-I393 PolarHBondContact O-N 2.89Å; H391-I393 PolarHBondContact O-N 3.31Å; I393-Q395 VanDerWaalsContact C-N 3.32Å; I393-Q395 PolarHBondContact O-N 2.98Å; I393-C396 PolarHBondContact O-N 2.77Å; I393-M397 HydrophobicContact CG2-CG 4.45Å; I393-M397 HydrophobicContact CG2-SD 3.65Å; I393-M397 WeakPolarHBondContact O-CG 3.49Å; I393-M397 PolarHBondContact O-N 2.86Å
394	T	97	Very high	96.7	Very high	55 Å²	55	58.5 Å²	58.5	34%	0.337	28%	0.279	S	S	.	.	H	α-helix	trans	-59.5	-40.7	177.5	-55.8	0	0	0	0	112.2	V390 H391 M397 R398	V390-T394 PolarHBondContact O-N 2.98Å; V390-T394 PolarHBondContact O-OG1 3.19Å; H391-T394 PolarHBondContact O-N 3.4Å; T394-M397 PolarHBondContact O-N 2.64Å; T394-R398 PolarHBondContact O-N 3.11Å
395	Q	97.7	Very high	96.8	Very high	44 Å²	44	54.3 Å²	54.3	21%	0.206	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-40.6	176.7	-68.4	-63.7	-29	0	0	111.8	H391 F392 I393 M397 P405	H391-Q395 PolarHBondContact NE2-NE2 3.4Å; H391-Q395 VanDerWaalsContact O-CG 3.24Å; H391-Q395 WeakPolarHBondContact O-CG 3.39Å; H391-Q395 PolarHBondContact O-N 3.23Å; F392-Q395 PolarHBondContact O-N 2.77Å; I393-Q395 VanDerWaalsContact C-N 3.32Å; I393-Q395 PolarHBondContact O-N 2.98Å; Q395-M397 VanDerWaalsContact C-N 3.27Å; Q395-M397 PolarHBondContact O-N 3.34Å; Q395-P405 HydrophobicContact CB-CG 4.39Å; Q395-P405 WeakPolarHBondContact O-CD 3.43Å
396	C	98.1	Very high	96.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-31	175.8	-70.6	0	0	0	0	112.7	V336 W337 F392 I393 R404	V336-C396 HydrophobicContact CG1-CB 4.11Å; V336-C396 WeakPolarHBondContact O-CB 3Å; W337-C396 VanDerWaalsContact CA-O 3.32Å; W337-C396 WeakPolarHBondContact CA-O 3.28Å; F392-C396 PolarHBondContact O-N 2.85Å; F392-C396 VanDerWaalsContact O-N 3.07Å; F392-C396 PolarHBondContact O-SG 2.77Å; I393-C396 PolarHBondContact O-N 2.77Å; C396-R404 VanDerWaalsContact O-CD 3.23Å; C396-R404 WeakPolarHBondContact O-CD 3.46Å
397	M	97	Very high	96.5	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.02	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	24.9	-173.5	-63.4	179	50.9	0	0	114	W337 G340 I341 M344 P377 P378 I393 T394 Q395 K399	W337-M397 HydrophobicContact CE3-CB 4.4Å; W337-M397 HydrophobicContact CZ3-CB 4.29Å; W337-M397 WeakPolarHBondContact CZ3-O 3.36Å; G340-M397 VanDerWaalsContact C-SD 3.52Å; I341-M397 HydrophobicContact CD1-CE 3.25Å; I341-M397 HydrophobicContact CD1-SD 3.84Å; I341-M397 HydrophobicContact CG1-CE 4.29Å; I341-M397 HydrophobicContact CG1-SD 4.39Å; M344-M397 HydrophobicContact SD-CE 4.48Å; M344-M397 HydrophobicContact SD-SD 4.43Å; P377-M397 HydrophobicContact CB-CB 4.25Å; P377-M397 HydrophobicContact CB-CE 3.84Å; P377-M397 WeakPolarHBondContact CG-O 3.45Å; P378-M397 HydrophobicContact CG-CE 3.78Å; I393-M397 HydrophobicContact CG2-CG 4.45Å; I393-M397 HydrophobicContact CG2-SD 3.65Å; I393-M397 WeakPolarHBondContact O-CG 3.49Å; I393-M397 PolarHBondContact O-N 2.86Å; T394-M397 PolarHBondContact O-N 2.64Å; Q395-M397 VanDerWaalsContact C-N 3.27Å; Q395-M397 PolarHBondContact O-N 3.34Å; M397-K399 PolarHBondContact O-N 3.44Å
398	R	97	Very high	96.4	Very high	100 Å²	100	47.7 Å²	47.7	38%	0.377	23%	0.231	S	C	.	.			trans	-65.1	124.5	168.6	-65.7	-69.5	-177.7	176.9	-2.4	109.6	T394 N400 E403 R404	T394-R398 PolarHBondContact O-N 3.11Å; R398-N400 PolarHBondContact O-N 3.44Å; R398-E403 HydrophobicContact CB-CB 3.95Å; R398-E403 HydrophobicContact CG-CB 4.14Å; R398-R404 HydrophobicContact CB-CG 3.99Å; R398-R404 PolarHBondContact O-NE 2.7Å
399	K	92.9	Very high	96.3	Very high	57 Å²	57	48.2 Å²	48.2	25%	0.248	24%	0.238	C	C	.	.	S	Bend	trans	-55.7	-51.8	178.9	-84.7	-163.4	163.7	-179.4	0	111.7	P322 W337 I372 V373 D374 E375 M397 P401 R404	P322-K399 HydrophobicContact CG-CG 4.36Å; W337-K399 HydrophobicContact CH2-CG 4.41Å; W337-K399 HydrophobicContact CZ3-CG 4.28Å; I372-K399 WeakPolarHBondContact O-CE 3.36Å; V373-K399 VanDerWaalsContact C-NZ 3.27Å; V373-K399 WeakPolarHBondContact O-CE 3.02Å; V373-K399 PolarHBondContact O-NZ 3.14Å; D374-K399 PolarHBondContact O-NZ 3.36Å; E375-K399 VanDerWaalsContact C-NZ 3.3Å; E375-K399 WeakPolarHBondContact O-CE 3.41Å; E375-K399 PolarHBondContact O-NZ 3.2Å; M397-K399 PolarHBondContact O-N 3.44Å; K399-P401 VanDerWaalsContact O-CD 3.28Å; K399-P401 WeakPolarHBondContact O-CD 3.3Å; K399-P401 VanDerWaalsContact O-N 3.16Å; K399-R404 PolarHBondContact O-NH2 3.32Å
400	N	94.3	Very high	96.2	Very high	65 Å²	65	48.3 Å²	48.3	35%	0.348	24%	0.239	S	C	.	.	S	Bend	trans	-62.8	115.2	175.1	-178.3	-2.7	0	0	0	110.2	R398 K402 E403	R398-N400 PolarHBondContact O-N 3.44Å; N400-K402 PolarHBondContact O-N 3.4Å; N400-K402 VanDerWaalsContact O-N 3.14Å; N400-K402 PolarHBondContact OD1-N 2.79Å; N400-K402 VanDerWaalsContact OD1-N 3.12Å; N400-E403 HydrophobicContact CB-CB 4.37Å; N400-E403 HydrophobicContact CB-CG 4.13Å; N400-E403 PolarHBondContact ND2-OE1 2.95Å; N400-E403 PolarHBondContact O-N 2.88Å; N400-E403 VanDerWaalsContact O-N 3.07Å
401	P	94.3	Very high	96.2	Very high	30 Å²	30	48.2 Å²	48.2	20%	0.195	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-61.6	-25.6	-177.1	23.2	-32.8	0	0	0	113.3	E323 H333 K399 E403 R404	E323-P401 HydrophobicContact CB-CG 4.4Å; E323-P401 HydrophobicContact CG-CB 4.39Å; E323-P401 HydrophobicContact CG-CG 4.3Å; H333-P401 HydrophobicContact CB-CB 4Å; H333-P401 PolarHBondContact CD2-O 3.44Å; K399-P401 VanDerWaalsContact O-CD 3.28Å; K399-P401 WeakPolarHBondContact O-CD 3.3Å; K399-P401 VanDerWaalsContact O-N 3.16Å; P401-E403 VanDerWaalsContact C-N 3.28Å; P401-E403 PolarHBondContact O-N 3.48Å; P401-R404 PolarHBondContact O-N 2.66Å
402	K	93.3	Very high	96.2	Very high	184 Å²	184	49.7 Å²	49.7	80%	0.8	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-74.4	-18.9	179.4	-60.6	-179.4	-177.2	171.9	0	113.4	N400	N400-K402 PolarHBondContact O-N 3.4Å; N400-K402 VanDerWaalsContact O-N 3.14Å; N400-K402 PolarHBondContact OD1-N 2.79Å; N400-K402 VanDerWaalsContact OD1-N 3.12Å
403	E	95.8	Very high	96.1	Very high	103 Å²	103	50.7 Å²	50.7	48%	0.481	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-89.2	-14.2	176.3	-70.5	169.3	-149.9	0	0	112.1	R398 N400 P401	R398-E403 HydrophobicContact CB-CB 3.95Å; R398-E403 HydrophobicContact CG-CB 4.14Å; N400-E403 HydrophobicContact CB-CB 4.37Å; N400-E403 HydrophobicContact CB-CG 4.13Å; N400-E403 PolarHBondContact ND2-OE1 2.95Å; N400-E403 PolarHBondContact O-N 2.88Å; N400-E403 VanDerWaalsContact O-N 3.07Å; P401-E403 VanDerWaalsContact C-N 3.28Å; P401-E403 PolarHBondContact O-N 3.48Å
404	R	97.1	Very high	96.1	Very high	5 Å²	5	53.1 Å²	53.1	2%	0.019	27%	0.269	C	S	.	.	S	Bend	trans	-72.9	136.9	172.4	-77.5	176.8	-108.9	157.2	0.2	109.8	E323 H333 V336 C396 R398 K399 P401	E323-R404 IonicContact OE1-CZ 3.51Å; E323-R404 IonicContact OE1-NH1 3.64Å; E323-R404 PolarHBondContact OE1-NH1 2.97Å; E323-R404 IonicContact OE1-NH2 3.54Å; E323-R404 PolarHBondContact OE1-NH2 3.23Å; E323-R404 VanDerWaalsContact OE1-NH2 3.14Å; E323-R404 IonicContact OE2-CZ 2.87Å; E323-R404 IonicContact OE2-NH1 3.9Å; E323-R404 PolarHBondContact OE2-NH1 2.8Å; E323-R404 IonicContact OE2-NH2 2.71Å; E323-R404 PolarHBondContact OE2-NH2 2.97Å; H333-R404 HydrophobicContact CB-CB 4.31Å; H333-R404 PolarHBondContact CD2-O 3.02Å; H333-R404 VanDerWaalsContact CD2-O 3.24Å; H333-R404 WeakPolarHBondContact O-CD 3.43Å; H333-R404 PolarHBondContact O-NH1 2.87Å; V336-R404 HydrophobicContact CG1-CB 4.34Å; C396-R404 VanDerWaalsContact O-CD 3.23Å; C396-R404 WeakPolarHBondContact O-CD 3.46Å; R398-R404 HydrophobicContact CB-CG 3.99Å; R398-R404 PolarHBondContact O-NE 2.7Å; K399-R404 PolarHBondContact O-NH2 3.32Å; P401-R404 PolarHBondContact O-N 2.66Å
405	P	96.6	Very high	96.2	Very high	25 Å²	25	50.5 Å²	50.5	16%	0.162	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-67.2	146.9	171.7	29.4	-35.2	0	0	0	110.5	V336 Q395 N409 L410	V336-P405 WeakPolarHBondContact CG2-O 3.14Å; Q395-P405 HydrophobicContact CB-CG 4.39Å; Q395-P405 WeakPolarHBondContact O-CD 3.43Å; P405-N409 HydrophobicContact CB-CB 3.95Å; P405-L410 HydrophobicContact CB-CD2 4.07Å; P405-L410 HydrophobicContact CB-CG 4.12Å; P405-L410 HydrophobicContact CG-CD2 3.29Å; P405-L410 HydrophobicContact CG-CG 3.74Å
406	V	95.3	Very high	96.2	Very high	29 Å²	29	48.4 Å²	48.4	18%	0.176	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-72.8	159.7	164.9	-65.9	0	0	0	0	110.6	W272 I332 H333 N408 N409 L410	W272-V406 HydrophobicContact CH2-CB 3.48Å; W272-V406 VanDerWaalsContact CH2-CB 3.48Å; W272-V406 HydrophobicContact CH2-CG1 3.69Å; W272-V406 HydrophobicContact CH2-CG2 3.69Å; W272-V406 HydrophobicContact CZ2-CB 4.22Å; W272-V406 HydrophobicContact CZ2-CG1 4.04Å; W272-V406 HydrophobicContact CZ3-CB 3.67Å; W272-V406 HydrophobicContact CZ3-CG1 4.37Å; W272-V406 HydrophobicContact CZ3-CG2 3.82Å; I332-V406 HydrophobicContact CG2-CG1 4.08Å; H333-V406 WeakPolarHBondContact NE2-CG1 3.47Å; V406-N408 PolarHBondContact O-N 2.86Å; V406-N408 VanDerWaalsContact O-N 3.12Å; V406-N409 HydrophobicContact CG2-CB 4.23Å; V406-N409 WeakPolarHBondContact CG2-OD1 3.49Å; V406-N409 PolarHBondContact O-N 2.87Å; V406-L410 PolarHBondContact O-N 2.46Å; V406-L410 VanDerWaalsContact O-N 3.12Å
407	P	93.9	Very high	96.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-53.2	-35.9	-177.3	-30.4	36.3	0	0	0	115.1	V265 L268 T269 W272 I332 V336 N409 L410 L411	V265-P407 WeakPolarHBondContact CG1-O 3.26Å; L268-P407 HydrophobicContact CB-CB 4.25Å; L268-P407 HydrophobicContact CB-CG 4.15Å; T269-P407 VanDerWaalsContact OG1-CB 3.23Å; T269-P407 WeakPolarHBondContact OG1-CB 3.38Å; T269-P407 PolarHBondContact OG1-O 2.93Å; W272-P407 HydrophobicContact CE3-CB 4.44Å; W272-P407 HydrophobicContact CE3-CG 4.32Å; I332-P407 HydrophobicContact CD1-CG 3.84Å; I332-P407 HydrophobicContact CG1-CG 3.41Å; I332-P407 VanDerWaalsContact CG1-CG 3.41Å; V336-P407 HydrophobicContact CG2-CG 4.28Å; P407-N409 PolarHBondContact O-N 3.4Å; P407-L410 WeakPolarHBondContact O-CB 3.47Å; P407-L410 PolarHBondContact O-N 3.45Å; P407-L411 PolarHBondContact O-N 3.21Å
408	N	94.8	Very high	96.3	Very high	74 Å²	74	57.1 Å²	57.1	40%	0.396	29%	0.286	S	S	.	.	H	α-helix	trans	-61.3	-45.1	175.4	-71.8	-5.1	0	0	0	112	T269 W272 V406 L410 L411	T269-N408 WeakPolarHBondContact CG2-OD1 3.3Å; W272-N408 HydrophobicContact CZ3-CB 4.23Å; V406-N408 PolarHBondContact O-N 2.86Å; V406-N408 VanDerWaalsContact O-N 3.12Å; N408-L410 VanDerWaalsContact C-N 3.26Å; N408-L410 PolarHBondContact O-N 3.24Å; N408-L411 WeakPolarHBondContact O-CB 3.42Å; N408-L411 PolarHBondContact O-N 3.44Å; N408-L411 VanDerWaalsContact O-N 3.11Å
409	N	96.9	Very high	96.3	Very high	98 Å²	98	53.6 Å²	53.6	52%	0.524	27%	0.273	S	S	.	.	H	α-helix	trans	-68.8	-27.2	178.6	-67.1	44	0	0	0	111.9	P405 V406 P407 L411 D412	P405-N409 HydrophobicContact CB-CB 3.95Å; V406-N409 HydrophobicContact CG2-CB 4.23Å; V406-N409 WeakPolarHBondContact CG2-OD1 3.49Å; V406-N409 PolarHBondContact O-N 2.87Å; P407-N409 PolarHBondContact O-N 3.4Å; N409-L411 VanDerWaalsContact C-N 3.3Å; N409-D412 PolarHBondContact O-N 2.91Å
410	L	96.6	Very high	96.5	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-31.1	172.3	-72.9	176.2	0	0	0	112.3	V265 V336 F392 P405 V406 P407 N408 D412 H413 I416	V265-L410 HydrophobicContact CG1-CB 3.67Å; V265-L410 HydrophobicContact CG2-CB 4.29Å; V265-L410 HydrophobicContact CG2-CD1 4.36Å; V336-L410 HydrophobicContact CG1-CD1 3.91Å; V336-L410 HydrophobicContact CG2-CD1 3.97Å; F392-L410 HydrophobicContact CD2-CD2 4.2Å; F392-L410 HydrophobicContact CE2-CD2 3.82Å; P405-L410 HydrophobicContact CB-CD2 4.07Å; P405-L410 HydrophobicContact CB-CG 4.12Å; P405-L410 HydrophobicContact CG-CD2 3.29Å; P405-L410 HydrophobicContact CG-CG 3.74Å; V406-L410 PolarHBondContact O-N 2.46Å; V406-L410 VanDerWaalsContact O-N 3.12Å; P407-L410 WeakPolarHBondContact O-CB 3.47Å; P407-L410 PolarHBondContact O-N 3.45Å; N408-L410 VanDerWaalsContact C-N 3.26Å; N408-L410 PolarHBondContact O-N 3.24Å; L410-D412 PolarHBondContact O-N 3.3Å; L410-H413 WeakPolarHBondContact O-CB 3.46Å; L410-H413 PolarHBondContact O-N 2.87Å; L410-H413 VanDerWaalsContact O-N 3.08Å; L410-I416 WeakPolarHBondContact O-CB 3.48Å; L410-I416 VanDerWaalsContact O-CG1 3.25Å; L410-I416 WeakPolarHBondContact O-CG1 3.47Å
411	L	96.8	Very high	96.5	Very high	45 Å²	45	55 Å²	55	24%	0.236	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-30.2	175.1	-66.9	172.6	0	0	0	112.2	V265 K266 T269 P407 N408 N409 H413 I416	V265-L411 HydrophobicContact CB-CD2 4.25Å; V265-L411 HydrophobicContact CG1-CD2 3.58Å; V265-L411 HydrophobicContact CG1-CG 3.82Å; K266-L411 HydrophobicContact CG-CD2 3.71Å; T269-L411 HydrophobicContact CG2-CD1 4.03Å; P407-L411 PolarHBondContact O-N 3.21Å; N408-L411 WeakPolarHBondContact O-CB 3.42Å; N408-L411 PolarHBondContact O-N 3.44Å; N408-L411 VanDerWaalsContact O-N 3.11Å; N409-L411 VanDerWaalsContact C-N 3.3Å; L411-H413 VanDerWaalsContact C-N 3.31Å; L411-I416 HydrophobicContact CD2-CG2 4.43Å
412	D	97.4	Very high	96.3	Very high	121 Å²	121	57.2 Å²	57.2	65%	0.647	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-1.3	177.8	-59.1	-40.1	0	0	0	113.1	N409 L410 I417	N409-D412 PolarHBondContact O-N 2.91Å; L410-D412 PolarHBondContact O-N 3.3Å; D412-I417 VanDerWaalsContact O-CD1 3.24Å; D412-I417 WeakPolarHBondContact O-CD1 3.37Å
413	H	98.4	Very high	96.3	Very high	22 Å²	22	51.2 Å²	51.2	10%	0.102	29%	0.288	C	S	.	.	S	Bend	trans	-69.2	138.4	179.9	-170.7	-85.2	0	0	0	111.2	K388 H391 F392 L410 L411 F415 I416 I417	K388-H413 PolarHBondContact O-CE1 2.94Å; H391-H413 AromaticContact CE1-NE2 3.63Å; H391-H413 AromaticContact CG-NE2 3.88Å; H391-H413 AromaticContact ND1-CD2 3.87Å; H391-H413 AromaticContact ND1-CE1 3.69Å; H391-H413 AromaticContact ND1-NE2 2.83Å; H391-H413 PolarHBondContact ND1-NE2 2.89Å; F392-H413 VanDerWaalsContact CA-CE1 3.49Å; F392-H413 WeakPolarHBondContact CA-CE1 3.08Å; F392-H413 VanDerWaalsContact CB-CE1 3.49Å; F392-H413 WeakPolarHBondContact CB-CE1 3.16Å; F392-H413 HydrophobicContact CD2-CB 4.43Å; F392-H413 AromaticContact CD2-ND1 3.79Å; F392-H413 PolarHBondContact N-CE1 3.16Å; L410-H413 WeakPolarHBondContact O-CB 3.46Å; L410-H413 PolarHBondContact O-N 2.87Å; L410-H413 VanDerWaalsContact O-N 3.08Å; L411-H413 VanDerWaalsContact C-N 3.31Å; H413-F415 WeakPolarHBondContact ND1-CB 3.46Å; H413-F415 PolarHBondContact ND1-N 3.09Å; H413-F415 VanDerWaalsContact ND1-N 3.17Å; H413-F415 PolarHBondContact O-N 2.94Å; H413-F415 VanDerWaalsContact O-N 3.12Å; H413-I416 HydrophobicContact CB-CG1 4.33Å; H413-I416 PolarHBondContact O-N 2.78Å; H413-I417 PolarHBondContact O-N 2.84Å
414	S	98	Very high	96.2	Very high	53 Å²	53	48.5 Å²	48.5	37%	0.371	28%	0.283	S	S	.	.	H	α-helix	trans	-55.6	-35.1	-175	63.2	0	0	0	0	114.4	Q418	S414-Q418 VanDerWaalsContact O-CB 3.32Å; S414-Q418 WeakPolarHBondContact O-CB 3.47Å; S414-Q418 PolarHBondContact O-N 2.89Å; S414-Q418 VanDerWaalsContact O-N 3.12Å
415	F	98.4	Very high	96.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.7	-46.4	171.9	-178	-107.8	0	0	0	112.4	E254 G258 A261 K388 F389 F392 H413 Q418 Y419	E254-F415 HydrophobicContact CG-CE2 4.02Å; E254-F415 HydrophobicContact CG-CZ 4.41Å; G258-F415 VanDerWaalsContact CA-CZ 3.49Å; A261-F415 HydrophobicContact CB-CE1 3.99Å; K388-F415 HydrophobicContact CB-CB 4.09Å; K388-F415 HydrophobicContact CB-CD2 4.34Å; F389-F415 HydrophobicContact CB-CD2 3.73Å; F389-F415 HydrophobicContact CB-CE2 3.49Å; F389-F415 VanDerWaalsContact CB-CE2 3.49Å; F389-F415 HydrophobicContact CB-CZ 4.19Å; F389-F415 HydrophobicContact CD2-CD1 4.2Å; F389-F415 HydrophobicContact CD2-CD2 4.08Å; F389-F415 AromaticContact CD2-CE1 3.61Å; F389-F415 HydrophobicContact CD2-CE1 3.61Å; F389-F415 AromaticContact CD2-CE2 3.46Å; F389-F415 HydrophobicContact CD2-CE2 3.46Å; F389-F415 VanDerWaalsContact CD2-CE2 3.46Å; F389-F415 HydrophobicContact CD2-CG 4.42Å; F389-F415 AromaticContact CD2-CZ 3.2Å; F389-F415 HydrophobicContact CD2-CZ 3.2Å; F389-F415 HydrophobicContact CE2-CE1 4.06Å; F389-F415 HydrophobicContact CE2-CE2 4.46Å; F389-F415 AromaticContact CE2-CZ 3.81Å; F389-F415 HydrophobicContact CE2-CZ 3.81Å; F389-F415 HydrophobicContact CG-CD2 4.33Å; F389-F415 AromaticContact CG-CE2 3.73Å; F389-F415 HydrophobicContact CG-CE2 3.73Å; F389-F415 AromaticContact CG-CZ 3.92Å; F389-F415 HydrophobicContact CG-CZ 3.92Å; F392-F415 HydrophobicContact CB-CB 3.92Å; F392-F415 HydrophobicContact CB-CD1 4.01Å; F392-F415 HydrophobicContact CB-CG 4.1Å; F392-F415 AromaticContact CD1-CD1 3.89Å; F392-F415 HydrophobicContact CD1-CD1 3.89Å; F392-F415 HydrophobicContact CD1-CE1 4.16Å; F392-F415 HydrophobicContact CD2-CD1 4.18Å; F392-F415 HydrophobicContact CE1-CD1 4.42Å; F392-F415 HydrophobicContact CE1-CE1 4.5Å; F392-F415 HydrophobicContact CG-CB 4.36Å; F392-F415 AromaticContact CG-CD1 3.76Å; F392-F415 HydrophobicContact CG-CD1 3.76Å; F392-F415 HydrophobicContact CG-CE1 4.48Å; F392-F415 HydrophobicContact CG-CG 4.34Å; H413-F415 WeakPolarHBondContact ND1-CB 3.46Å; H413-F415 PolarHBondContact ND1-N 3.09Å; H413-F415 VanDerWaalsContact ND1-N 3.17Å; H413-F415 PolarHBondContact O-N 2.94Å; H413-F415 VanDerWaalsContact O-N 3.12Å; F415-Q418 PolarHBondContact O-N 2.83Å; F415-Y419 HydrophobicContact CD2-CD2 4.05Å; F415-Y419 AromaticContact CD2-CE2 3.75Å; F415-Y419 HydrophobicContact CD2-CE2 3.75Å; F415-Y419 AromaticContact CE2-CD2 3.82Å; F415-Y419 HydrophobicContact CE2-CD2 3.82Å; F415-Y419 AromaticContact CE2-CE2 3.36Å; F415-Y419 HydrophobicContact CE2-CE2 3.36Å; F415-Y419 HydrophobicContact CZ-CD2 4.09Å; F415-Y419 AromaticContact CZ-CE2 3.98Å; F415-Y419 HydrophobicContact CZ-CE2 3.98Å; F415-Y419 VanDerWaalsContact O-CD2 3.26Å; F415-Y419 WeakPolarHBondContact O-CD2 3.48Å; F415-Y419 PolarHBondContact O-N 3.13Å
416	I	98.3	Very high	96.2	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-69.5	-44.7	-178.6	-63.1	-61.1	0	0	0	110.4	A261 V262 V265 F392 L410 L411 H413 Q418 Y419 N420	A261-I416 HydrophobicContact CB-CD1 3.63Å; V262-I416 HydrophobicContact CG2-CG2 3.94Å; V262-I416 WeakPolarHBondContact CG2-O 3.26Å; V265-I416 HydrophobicContact CG2-CD1 4.13Å; F392-I416 HydrophobicContact CD2-CD1 4.33Å; F392-I416 HydrophobicContact CD2-CG1 4.07Å; F392-I416 HydrophobicContact CE2-CD1 3.67Å; F392-I416 HydrophobicContact CE2-CG1 3.65Å; F392-I416 HydrophobicContact CZ-CD1 3.93Å; F392-I416 HydrophobicContact CZ-CG1 4.4Å; L410-I416 WeakPolarHBondContact O-CB 3.48Å; L410-I416 VanDerWaalsContact O-CG1 3.25Å; L410-I416 WeakPolarHBondContact O-CG1 3.47Å; L411-I416 HydrophobicContact CD2-CG2 4.43Å; H413-I416 HydrophobicContact CB-CG1 4.33Å; H413-I416 PolarHBondContact O-N 2.78Å; I416-Q418 VanDerWaalsContact C-N 3.28Å; I416-Q418 PolarHBondContact O-N 2.61Å; I416-Y419 PolarHBondContact O-N 2.72Å; I416-N420 WeakPolarHBondContact O-CB 3.4Å; I416-N420 PolarHBondContact O-N 2.73Å
417	I	98.1	Very high	96.3	Very high	104 Å²	104	53.4 Å²	53.4	53%	0.533	30%	0.304	S	S	.	.	H	α-helix	trans	-56.4	-44.2	175.4	-67.3	175.5	0	0	0	111	D412 H413 Y419 N420	D412-I417 VanDerWaalsContact O-CD1 3.24Å; D412-I417 WeakPolarHBondContact O-CD1 3.37Å; H413-I417 PolarHBondContact O-N 2.84Å; I417-Y419 PolarHBondContact O-N 2.68Å; I417-N420 PolarHBondContact O-N 3.1Å
418	Q	97.6	Very high	96.5	Very high	84 Å²	84	54.7 Å²	54.7	39%	0.393	31%	0.313	S	S	.	.	H	α-helix	trans	-58.5	-34.7	-179.4	171.8	172.2	-32.6	0	0	113.3	S414 F415 I416	S414-Q418 VanDerWaalsContact O-CB 3.32Å; S414-Q418 WeakPolarHBondContact O-CB 3.47Å; S414-Q418 PolarHBondContact O-N 2.89Å; S414-Q418 VanDerWaalsContact O-N 3.12Å; F415-Q418 PolarHBondContact O-N 2.83Å; I416-Q418 VanDerWaalsContact C-N 3.28Å; I416-Q418 PolarHBondContact O-N 2.61Å
419	Y	97.8	Very high	96.7	Very high	25 Å²	25	56.8 Å²	56.8	10%	0.098	32%	0.322	C	S	.	.	H	α-helix	trans	-106	0.8	-175.7	-66.8	-69.5	0	0	0	113.8	H255 G258 F415 I416 I417 D421	H255-Y419 HydrophobicContact CB-CE1 3.98Å; G258-Y419 VanDerWaalsContact C-CB 3.44Å; G258-Y419 VanDerWaalsContact CA-CD2 3.48Å; F415-Y419 HydrophobicContact CD2-CD2 4.05Å; F415-Y419 AromaticContact CD2-CE2 3.75Å; F415-Y419 HydrophobicContact CD2-CE2 3.75Å; F415-Y419 AromaticContact CE2-CD2 3.82Å; F415-Y419 HydrophobicContact CE2-CD2 3.82Å; F415-Y419 AromaticContact CE2-CE2 3.36Å; F415-Y419 HydrophobicContact CE2-CE2 3.36Å; F415-Y419 HydrophobicContact CZ-CD2 4.09Å; F415-Y419 AromaticContact CZ-CE2 3.98Å; F415-Y419 HydrophobicContact CZ-CE2 3.98Å; F415-Y419 VanDerWaalsContact O-CD2 3.26Å; F415-Y419 WeakPolarHBondContact O-CD2 3.48Å; F415-Y419 PolarHBondContact O-N 3.13Å; I416-Y419 PolarHBondContact O-N 2.72Å; I417-Y419 PolarHBondContact O-N 2.68Å; Y419-D421 PolarHBondContact O-N 3.47Å
420	N	96.8	Very high	96.7	Very high	75 Å²	75	53.5 Å²	53.5	40%	0.401	30%	0.302	S	S	.	.			trans	-81.1	57.4	174.4	-173	26.4	0	0	0	111	V262 K266 I416 I417	V262-N420 HydrophobicContact CG1-CB 4.08Å; V262-N420 HydrophobicContact CG2-CB 4.02Å; K266-N420 WeakPolarHBondContact CE-OD1 3.44Å; K266-N420 PolarHBondContact NZ-OD1 3.48Å; I416-N420 WeakPolarHBondContact O-CB 3.4Å; I416-N420 PolarHBondContact O-N 2.73Å; I417-N420 PolarHBondContact O-N 3.1Å
421	D	94.1	Very high	96.8	Very high	78 Å²	78	53.5 Å²	53.5	42%	0.417	30%	0.302	S	S	.	.	S	Bend	trans	-98.1	-2.1	-175.5	66.9	-6.6	0	0	0	113.7	R259 Y419 N423	R259-D421 IonicContact CZ-OD1 3.84Å; R259-D421 IonicContact CZ-OD2 3.5Å; R259-D421 VanDerWaalsContact CZ-OD2 3.29Å; R259-D421 IonicContact NE-OD1 2.61Å; R259-D421 PolarHBondContact NE-OD1 3.42Å; R259-D421 IonicContact NE-OD2 3.76Å; R259-D421 PolarHBondContact NE-OD2 3.23Å; R259-D421 IonicContact NH2-OD1 2.86Å; R259-D421 IonicContact NH2-OD2 2.81Å; R259-D421 PolarHBondContact NH2-OD2 3.12Å; Y419-D421 PolarHBondContact O-N 3.47Å; D421-N423 PolarHBondContact O-N 2.93Å; D421-N423 VanDerWaalsContact OD1-CB 3.3Å; D421-N423 WeakPolarHBondContact OD1-CB 3.47Å; D421-N423 PolarHBondContact OD1-N 3.46Å; D421-N423 WeakPolarHBondContact OD2-CB 3.34Å
422	G	91.4	Very high	96.8	Very high	75 Å²	75	53.3 Å²	53.3	77%	0.773	30%	0.304	S	S	*	.			trans	70.5	7.8	-176.9	0	0	0	0	0	114.2	A424	G422-A424 PolarHBondContact O-N 3.31Å; G422-A424 VanDerWaalsContact O-N 3.1Å
423	N	92	Very high	96.8	Very high	59 Å²	59	55.1 Å²	55.1	32%	0.316	30%	0.302	S	S	.	.			trans	-86	84.7	-175.5	-169.8	-19.7	0	0	0	111.5	R259 D421 E425 V426	R259-N423 WeakPolarHBondContact CD-O 3.08Å; D421-N423 PolarHBondContact O-N 2.93Å; D421-N423 VanDerWaalsContact OD1-CB 3.3Å; D421-N423 WeakPolarHBondContact OD1-CB 3.47Å; D421-N423 PolarHBondContact OD1-N 3.46Å; D421-N423 WeakPolarHBondContact OD2-CB 3.34Å; N423-E425 PolarHBondContact O-N 3.24Å; N423-E425 VanDerWaalsContact OD1-CB 3.29Å; N423-E425 WeakPolarHBondContact OD1-CB 3.21Å; N423-E425 PolarHBondContact OD1-N 2.87Å; N423-E425 VanDerWaalsContact OD1-N 3.07Å; N423-V426 PolarHBondContact OD1-N 2.86Å
424	A	93.4	Very high	96.7	Very high	45 Å²	45	55.2 Å²	55.2	37%	0.372	30%	0.304	S	S	.	.	H	α-helix	trans	-67.1	-20.4	174.3	0	0	0	0	0	113.1	G292 G422 V426 V427 S428	G292-A424 WeakPolarHBondContact CA-O 3.39Å; G422-A424 PolarHBondContact O-N 3.31Å; G422-A424 VanDerWaalsContact O-N 3.1Å; A424-V426 VanDerWaalsContact C-N 3.28Å; A424-V426 PolarHBondContact O-N 2.94Å; A424-V427 PolarHBondContact O-N 2.88Å; A424-S428 WeakPolarHBondContact O-CB 3.46Å; A424-S428 PolarHBondContact O-N 2.91Å
425	E	96.8	Very high	96.5	Very high	136 Å²	136	53.9 Å²	53.9	64%	0.636	29%	0.293	S	S	*	.	H	α-helix	trans	-62.8	-34.5	-177.6	-58	-179.9	169.2	0	0	112	N423 V427 S428 M429	N423-E425 PolarHBondContact O-N 3.24Å; N423-E425 VanDerWaalsContact OD1-CB 3.29Å; N423-E425 WeakPolarHBondContact OD1-CB 3.21Å; N423-E425 PolarHBondContact OD1-N 2.87Å; N423-E425 VanDerWaalsContact OD1-N 3.07Å; E425-V427 VanDerWaalsContact C-N 3.35Å; E425-V427 PolarHBondContact O-N 3.02Å; E425-S428 WeakPolarHBondContact O-CB 3.41Å; E425-S428 PolarHBondContact O-N 3.04Å; E425-M429 HydrophobicContact CB-CE 4.32Å; E425-M429 WeakPolarHBondContact O-CB 3.33Å; E425-M429 WeakPolarHBondContact O-CE 3.46Å; E425-M429 VanDerWaalsContact O-CG 3.3Å; E425-M429 WeakPolarHBondContact O-CG 3.43Å; E425-M429 PolarHBondContact O-N 2.61Å
426	V	97.5	Very high	96.3	Very high	23 Å²	23	59.6 Å²	59.6	14%	0.139	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-45.2	176.8	173.5	0	0	0	0	111.4	V256 N423 A424 W430	V256-V426 HydrophobicContact CG2-CG1 4.17Å; N423-V426 PolarHBondContact OD1-N 2.86Å; A424-V426 VanDerWaalsContact C-N 3.28Å; A424-V426 PolarHBondContact O-N 2.94Å; V426-W430 WeakPolarHBondContact O-CB 3.23Å; V426-W430 PolarHBondContact O-N 3.23Å
427	V	97.9	Very high	96.1	Very high	3 Å²	3	63.4 Å²	63.4	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-69.8	-43.5	177.1	-178.3	0	0	0	0	110	V256 R259 I260 V294 A424 E425 W430 V431	V256-V427 HydrophobicContact CG1-CG2 4.36Å; R259-V427 HydrophobicContact CB-CG2 3.83Å; I260-V427 HydrophobicContact CG1-CG2 4.42Å; V294-V427 HydrophobicContact CG2-CG1 4.11Å; A424-V427 PolarHBondContact O-N 2.88Å; E425-V427 VanDerWaalsContact C-N 3.35Å; E425-V427 PolarHBondContact O-N 3.02Å; V427-W430 PolarHBondContact O-N 3.37Å; V427-V431 HydrophobicContact CG1-CG2 4.21Å; V427-V431 WeakPolarHBondContact O-CB 3.49Å; V427-V431 VanDerWaalsContact O-CG2 3.3Å; V427-V431 WeakPolarHBondContact O-CG2 3.28Å; V427-V431 PolarHBondContact O-N 3.39Å
428	S	98.3	Very high	95.7	Very high	28 Å²	28	61.7 Å²	61.7	20%	0.196	32%	0.324	C	S	.	.	H	α-helix	trans	-55.1	-54.8	177.1	168.9	0	0	0	0	112.1	T290 A424 E425 W430 V431 C432	T290-S428 VanDerWaalsContact O-CB 3.31Å; T290-S428 WeakPolarHBondContact O-CB 3.4Å; T290-S428 PolarHBondContact O-OG 3.16Å; A424-S428 WeakPolarHBondContact O-CB 3.46Å; A424-S428 PolarHBondContact O-N 2.91Å; E425-S428 WeakPolarHBondContact O-CB 3.41Å; E425-S428 PolarHBondContact O-N 3.04Å; S428-W430 VanDerWaalsContact C-N 3.31Å; S428-W430 PolarHBondContact O-N 3.12Å; S428-V431 PolarHBondContact O-N 3.19Å; S428-C432 WeakPolarHBondContact O-CB 3.48Å; S428-C432 PolarHBondContact O-N 2.78Å; S428-C432 PolarHBondContact O-SG 3.11Å
429	M	97.9	Very high	95.3	Very high	117 Å²	117	65.8 Å²	65.8	58%	0.576	34%	0.336	S	S	*	.	H	α-helix	trans	-59.9	-42.6	-180	-72.9	-174.3	-70.9	0	0	111.7	E425 R433	E425-M429 HydrophobicContact CB-CE 4.32Å; E425-M429 WeakPolarHBondContact O-CB 3.33Å; E425-M429 WeakPolarHBondContact O-CE 3.46Å; E425-M429 VanDerWaalsContact O-CG 3.3Å; E425-M429 WeakPolarHBondContact O-CG 3.43Å; E425-M429 PolarHBondContact O-N 2.61Å; M429-R433 WeakPolarHBondContact O-CB 3.12Å; M429-R433 PolarHBondContact O-N 3.5Å
430	W	97.9	Very high	94.8	Very high	30 Å²	30	67.9 Å²	67.9	11%	0.114	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-46.8	176.9	174.5	76.9	0	0	0	111.8	L246 Y249 I252 V256 V426 V427 S428 R433 C434	L246-W430 HydrophobicContact CD2-CH2 4.39Å; L246-W430 HydrophobicContact CD2-CZ3 4.3Å; Y249-W430 AromaticContact CD1-CH2 3.31Å; Y249-W430 HydrophobicContact CD1-CH2 3.31Å; Y249-W430 AromaticContact CD1-CZ2 3.7Å; Y249-W430 HydrophobicContact CD1-CZ2 3.7Å; Y249-W430 HydrophobicContact CD1-CZ3 4.05Å; Y249-W430 HydrophobicContact CD2-CH2 4.24Å; Y249-W430 AromaticContact CE1-CH2 3.85Å; Y249-W430 HydrophobicContact CE1-CH2 3.85Å; Y249-W430 HydrophobicContact CE1-CZ2 4.43Å; Y249-W430 HydrophobicContact CE1-CZ3 4.12Å; Y249-W430 AromaticContact CG-CH2 3.53Å; Y249-W430 HydrophobicContact CG-CH2 3.53Å; Y249-W430 HydrophobicContact CG-CZ2 4.13Å; Y249-W430 HydrophobicContact CG-CZ3 4.41Å; I252-W430 HydrophobicContact CB-CZ2 4.15Å; I252-W430 HydrophobicContact CD1-CH2 3.49Å; I252-W430 VanDerWaalsContact CD1-CH2 3.49Å; I252-W430 HydrophobicContact CD1-CZ2 3.92Å; I252-W430 HydrophobicContact CD1-CZ3 4.33Å; I252-W430 HydrophobicContact CG1-CH2 3.79Å; I252-W430 HydrophobicContact CG1-CZ2 3.65Å; I252-W430 HydrophobicContact CG2-CH2 4.11Å; I252-W430 HydrophobicContact CG2-CZ2 3.81Å; V256-W430 HydrophobicContact CB-CG 4.5Å; V256-W430 HydrophobicContact CG1-CB 4.2Å; V256-W430 HydrophobicContact CG1-CD2 3.8Å; V256-W430 HydrophobicContact CG1-CE3 3.78Å; V256-W430 HydrophobicContact CG1-CG 3.97Å; V256-W430 HydrophobicContact CG1-CZ3 4.49Å; V256-W430 HydrophobicContact CG2-CB 4.01Å; V256-W430 HydrophobicContact CG2-CG 3.92Å; V426-W430 WeakPolarHBondContact O-CB 3.23Å; V426-W430 PolarHBondContact O-N 3.23Å; V427-W430 PolarHBondContact O-N 3.37Å; S428-W430 VanDerWaalsContact C-N 3.31Å; S428-W430 PolarHBondContact O-N 3.12Å; W430-R433 PolarHBondContact O-N 2.98Å; W430-C434 PolarHBondContact O-N 3.05Å; W430-C434 PolarHBondContact O-SG 3.15Å
431	V	97.8	Very high	94.3	Very high	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-51.3	176.7	170	0	0	0	0	110.7	V288 T290 V427 S428 R433 C434 L435	V288-V431 HydrophobicContact CB-CG2 4.09Å; V288-V431 HydrophobicContact CG2-CG2 3.79Å; T290-V431 HydrophobicContact CG2-CG1 4.38Å; V427-V431 HydrophobicContact CG1-CG2 4.21Å; V427-V431 WeakPolarHBondContact O-CB 3.49Å; V427-V431 VanDerWaalsContact O-CG2 3.3Å; V427-V431 WeakPolarHBondContact O-CG2 3.28Å; V427-V431 PolarHBondContact O-N 3.39Å; S428-V431 PolarHBondContact O-N 3.19Å; V431-R433 VanDerWaalsContact C-N 3.33Å; V431-R433 PolarHBondContact O-N 3.33Å; V431-C434 PolarHBondContact O-N 3.19Å; V431-L435 HydrophobicContact CG1-CD1 3.88Å; V431-L435 HydrophobicContact CG1-CG 4.26Å; V431-L435 WeakPolarHBondContact O-CG 3.42Å; V431-L435 PolarHBondContact O-N 3.2Å
432	C	97.7	Very high	93.6	Very high	41 Å²	41	74.1 Å²	74.1	28%	0.277	38%	0.378	S	S	.	.	H	α-helix	trans	-56.1	-47.6	-179.6	-70.6	0	0	0	0	111.5	S428 C434 L435 E436	S428-C432 WeakPolarHBondContact O-CB 3.48Å; S428-C432 PolarHBondContact O-N 2.78Å; S428-C432 PolarHBondContact O-SG 3.11Å; C432-C434 PolarHBondContact O-N 3.42Å; C432-L435 PolarHBondContact O-N 2.85Å; C432-E436 WeakPolarHBondContact O-CG 3.35Å; C432-E436 PolarHBondContact O-N 2.78Å
433	R	96.8	Very high	92.8	Very high	160 Å²	160	74.8 Å²	74.8	60%	0.604	38%	0.377	S	S	*	.	H	α-helix	trans	-58.6	-48.2	176.6	178.9	-179.3	170.6	167.1	2.8	112.1	M429 W430 V431 L435 E436 E437	M429-R433 WeakPolarHBondContact O-CB 3.12Å; M429-R433 PolarHBondContact O-N 3.5Å; W430-R433 PolarHBondContact O-N 2.98Å; V431-R433 VanDerWaalsContact C-N 3.33Å; V431-R433 PolarHBondContact O-N 3.33Å; R433-L435 VanDerWaalsContact C-N 3.29Å; R433-L435 PolarHBondContact O-N 3.43Å; R433-E436 PolarHBondContact O-N 2.64Å; R433-E437 WeakPolarHBondContact CG-OE1 3.19Å; R433-E437 IonicContact CZ-OE1 3.96Å; R433-E437 IonicContact NE-OE1 4Å; R433-E437 PolarHBondContact NE-OE1 3.24Å; R433-E437 IonicContact NH2-OE1 3.18Å; R433-E437 PolarHBondContact NH2-OE1 3.02Å; R433-E437 WeakPolarHBondContact O-CG 3.34Å; R433-E437 PolarHBondContact O-N 3.17Å
434	C	96.1	Very high	91.1	Very high	23 Å²	23	82.5 Å²	82.5	16%	0.155	41%	0.411	C	S	.	.	H	α-helix	trans	-62.6	-36.7	179	-74.2	0	0	0	0	112.5	Y249 W430 V431 C432 R438	Y249-C434 HydrophobicContact CD1-CB 3.93Å; Y249-C434 HydrophobicContact CE1-CB 3.69Å; W430-C434 PolarHBondContact O-N 3.05Å; W430-C434 PolarHBondContact O-SG 3.15Å; V431-C434 PolarHBondContact O-N 3.19Å; C432-C434 PolarHBondContact O-N 3.42Å; C434-R438 WeakPolarHBondContact O-CG 3.49Å; C434-R438 PolarHBondContact O-N 3.43Å; C434-R438 VanDerWaalsContact O-N 3.08Å
435	L	94.7	Very high	91	Very high	25 Å²	25	84.4 Å²	84.4	13%	0.131	41%	0.413	C	S	.	.	H	α-helix	trans	-68.3	-39.9	176.4	-67.3	177.6	0	0	0	112.1	T290 V431 C432 R433 R438 R439	T290-L435 HydrophobicContact CG2-CD1 3.88Å; V431-L435 HydrophobicContact CG1-CD1 3.88Å; V431-L435 HydrophobicContact CG1-CG 4.26Å; V431-L435 WeakPolarHBondContact O-CG 3.42Å; V431-L435 PolarHBondContact O-N 3.2Å; C432-L435 PolarHBondContact O-N 2.85Å; R433-L435 VanDerWaalsContact C-N 3.29Å; R433-L435 PolarHBondContact O-N 3.43Å; L435-R438 PolarHBondContact O-N 3.06Å; L435-R439 WeakPolarHBondContact O-CG 3.41Å; L435-R439 PolarHBondContact O-N 3.34Å
436	E	94.4	Very high	90.7	Very high	120 Å²	120	81.6 Å²	81.6	56%	0.561	40%	0.401	S	S	*	.	H	α-helix	trans	-63.1	-43.9	174.5	-73.3	171.7	-177.6	0	0	112.1	C432 R433 R438 R439 S440	C432-E436 WeakPolarHBondContact O-CG 3.35Å; C432-E436 PolarHBondContact O-N 2.78Å; R433-E436 PolarHBondContact O-N 2.64Å; E436-R438 VanDerWaalsContact C-N 3.35Å; E436-R438 PolarHBondContact O-N 2.95Å; E436-R439 PolarHBondContact O-N 3.41Å; E436-S440 WeakPolarHBondContact O-CB 3.3Å; E436-S440 PolarHBondContact O-N 2.92Å; E436-S440 PolarHBondContact O-OG 3.48Å
437	E	92.8	Very high	90.3	Very high	81 Å²	81	84.9 Å²	84.9	38%	0.379	42%	0.416	S	S	.	.	H	α-helix	trans	-60.8	-42.8	176.4	-73.1	173.7	-174.1	0	0	111.3	R433 S440 Q441	R433-E437 WeakPolarHBondContact CG-OE1 3.19Å; R433-E437 IonicContact CZ-OE1 3.96Å; R433-E437 IonicContact NE-OE1 4Å; R433-E437 PolarHBondContact NE-OE1 3.24Å; R433-E437 IonicContact NH2-OE1 3.18Å; R433-E437 PolarHBondContact NH2-OE1 3.02Å; R433-E437 WeakPolarHBondContact O-CG 3.34Å; R433-E437 PolarHBondContact O-N 3.17Å; E437-S440 PolarHBondContact O-N 3.29Å; E437-Q441 WeakPolarHBondContact O-CG 3.38Å; E437-Q441 PolarHBondContact O-N 3.06Å; E437-Q441 VanDerWaalsContact O-N 3.1Å
438	R	89.7	Confident	89.9	Confident	67 Å²	67	89.7 Å²	89.7	25%	0.253	44%	0.439	S	S	.	.	H	α-helix	trans	-64	-44.5	175.8	-75.1	-178.4	-172.1	147.3	7.7	112.7	V248 Y249 C434 L435 E436 S440 Q441 Q442	V248-R438 PolarHBondContact O-NH2 3.16Å; Y249-R438 VanDerWaalsContact CG-NH2 3.26Å; C434-R438 WeakPolarHBondContact O-CG 3.49Å; C434-R438 PolarHBondContact O-N 3.43Å; C434-R438 VanDerWaalsContact O-N 3.08Å; L435-R438 PolarHBondContact O-N 3.06Å; E436-R438 VanDerWaalsContact C-N 3.35Å; E436-R438 PolarHBondContact O-N 2.95Å; R438-S440 VanDerWaalsContact C-N 3.3Å; R438-S440 PolarHBondContact O-N 2.91Å; R438-Q441 PolarHBondContact O-N 3.35Å; R438-Q442 WeakPolarHBondContact O-CG 3.49Å; R438-Q442 PolarHBondContact O-N 3.18Å; R438-Q442 VanDerWaalsContact O-N 3.1Å
439	R	89.3	Confident	89.4	Confident	171 Å²	171	93.6 Å²	93.6	65%	0.645	45%	0.454	S	S	*	.	H	α-helix	trans	-61.8	-40.6	177.6	-73.2	175	-172.7	166.4	4.5	111.5	L435 E436 Q441 Q442 A443	L435-R439 WeakPolarHBondContact O-CG 3.41Å; L435-R439 PolarHBondContact O-N 3.34Å; E436-R439 PolarHBondContact O-N 3.41Å; R439-Q441 VanDerWaalsContact C-N 3.32Å; R439-Q441 PolarHBondContact O-N 3.32Å; R439-Q442 PolarHBondContact O-N 3.23Å; R439-A443 PolarHBondContact O-N 3.23Å; R439-A443 VanDerWaalsContact O-N 3.16Å
440	S	88.7	Confident	88.8	Confident	68 Å²	68	92 Å²	92	48%	0.476	45%	0.446	S	S	.	.	H	α-helix	trans	-64.6	-37.4	178	-56.2	0	0	0	0	112.2	E436 E437 R438 A443	E436-S440 WeakPolarHBondContact O-CB 3.3Å; E436-S440 PolarHBondContact O-N 2.92Å; E436-S440 PolarHBondContact O-OG 3.48Å; E437-S440 PolarHBondContact O-N 3.29Å; R438-S440 VanDerWaalsContact C-N 3.3Å; R438-S440 PolarHBondContact O-N 2.91Å; S440-A443 PolarHBondContact O-N 3.45Å
441	Q	84.6	Confident	88.2	Confident	121 Å²	121	96.4 Å²	96.4	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-72.2	-26.9	176.3	-71.7	168	23.6	0	0	113.6	E437 R438 R439	E437-Q441 WeakPolarHBondContact O-CG 3.38Å; E437-Q441 PolarHBondContact O-N 3.06Å; E437-Q441 VanDerWaalsContact O-N 3.1Å; R438-Q441 PolarHBondContact O-N 3.35Å; R439-Q441 VanDerWaalsContact C-N 3.32Å; R439-Q441 PolarHBondContact O-N 3.32Å
442	Q	80.6	Confident	87.4	Confident	163 Å²	163	103.8 Å²	103.8	76%	0.762	51%	0.506	S	S	*	.	H	α-helix	trans	-82.2	-19.9	176.3	-72.4	176	-8.4	0	0	113.2	R438 R439	R438-Q442 WeakPolarHBondContact O-CG 3.49Å; R438-Q442 PolarHBondContact O-N 3.18Å; R438-Q442 VanDerWaalsContact O-N 3.1Å; R439-Q442 PolarHBondContact O-N 3.23Å
443	A	73.7	Confident	86.6	Confident	90 Å²	90	109.1 Å²	109.1	74%	0.744	53%	0.525	S	S	*	.			trans	-88	-11.4	178.5	0	0	0	0	0	113.5	R439 S440	R439-A443 PolarHBondContact O-N 3.23Å; R439-A443 VanDerWaalsContact O-N 3.16Å; S440-A443 PolarHBondContact O-N 3.45Å
444	Q	57.3	Low	85.6	Confident	220 Å²	220	104.5 Å²	104.5	100%	1.028	52%	0.518	S	S	*	.			trans	-96.4	0	171.6	-69.8	179	-2.3	0	0	109.6

Retrieved 444 of 444 residues in 184.4 ms (Link to these results)

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