A0A087XTE4_POEFO Loading...

ATP-binding cassette sub-family F member 3

AlphaFold DB , UniProt , Accession A0A087XTE4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 711 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	48.5	Very low	74.9	Confident	223 Å²	223	74 Å²	74	100%	1.099	37%	0.368	S	S	*	.				0	129.8	0	-65.9	-175.2	-156.8	0	0	106.2
2	A	52.1	Low	75.6	Confident	52 Å²	52	68.8 Å²	68.8	43%	0.43	34%	0.342	S	S	.	.			trans	-68.2	135.2	178.6	0	0	0	0	0	109.3	D6 I7	A2-D6 HydrophobicContact CB-CB 4.25Å; A2-I7 HydrophobicContact CB-CG1 4.36Å
3	T	76.1	Confident	75.6	Confident	58 Å²	58	72.1 Å²	72.1	36%	0.356	37%	0.371	S	S	.	.			trans	-76.5	159.3	171.4	62	0	0	0	0	110	V5 D6 I7	T3-V5 PolarHBondContact O-N 3.3Å; T3-V5 VanDerWaalsContact O-N 3.17Å; T3-D6 PolarHBondContact N-OD2 3.3Å; T3-D6 WeakPolarHBondContact O-CB 3.42Å; T3-D6 PolarHBondContact O-N 3.36Å; T3-D6 PolarHBondContact OG1-N 3.42Å; T3-D6 PolarHBondContact OG1-OD2 3.38Å; T3-I7 PolarHBondContact O-N 3.32Å; T3-I7 VanDerWaalsContact O-N 3.11Å
4	Y	77.1	Confident	75.6	Confident	23 Å²	23	80.1 Å²	80.1	9%	0.09	41%	0.406	C	S	.	.	H	α-helix	trans	-57.8	-30	175.6	69.2	-97.2	0	0	0	111.6	I7 L8 T24 L27 D28 L72	Y4-I7 PolarHBondContact O-N 2.87Å; Y4-L8 WeakPolarHBondContact O-CB 3.35Å; Y4-L8 PolarHBondContact O-N 3.06Å; Y4-T24 HydrophobicContact CE2-CG2 4.32Å; Y4-L27 HydrophobicContact CD2-CB 4.41Å; Y4-L27 HydrophobicContact CD2-CD1 3.68Å; Y4-L27 HydrophobicContact CE2-CB 4.09Å; Y4-L27 HydrophobicContact CE2-CD1 4.04Å; Y4-L27 HydrophobicContact CG-CD1 4.46Å; Y4-D28 PolarHBondContact OH-OD1 3.29Å; Y4-D28 PolarHBondContact OH-OD2 3.3Å; Y4-L72 HydrophobicContact CD1-CD2 3.52Å; Y4-L72 HydrophobicContact CD1-CG 4Å; Y4-L72 HydrophobicContact CE1-CD2 3.62Å; Y4-L72 HydrophobicContact CG-CD2 4.31Å; Y4-L72 HydrophobicContact CG-CG 4.48Å
5	V	81.5	Confident	76	Confident	37 Å²	37	76.5 Å²	76.5	22%	0.224	39%	0.388	C	S	.	.	H	α-helix	trans	-61.8	-41.7	172	169.2	0	0	0	0	112.2	T3 I7 L8 K9 F20 T24	T3-V5 PolarHBondContact O-N 3.3Å; T3-V5 VanDerWaalsContact O-N 3.17Å; V5-I7 VanDerWaalsContact C-N 3.35Å; V5-L8 PolarHBondContact O-N 2.91Å; V5-K9 PolarHBondContact O-N 2.89Å; V5-K9 VanDerWaalsContact O-N 3.08Å; V5-F20 HydrophobicContact CG1-CZ 4.01Å; V5-T24 HydrophobicContact CG2-CG2 4.3Å
6	D	80.3	Confident	76.4	Confident	81 Å²	81	77.2 Å²	77.2	43%	0.433	39%	0.393	S	S	.	.	H	α-helix	trans	-69.2	-35.8	177.6	-58.6	-45.6	0	0	0	111.5	A2 T3 R10	A2-D6 HydrophobicContact CB-CB 4.25Å; T3-D6 PolarHBondContact N-OD2 3.3Å; T3-D6 WeakPolarHBondContact O-CB 3.42Å; T3-D6 PolarHBondContact O-N 3.36Å; T3-D6 PolarHBondContact OG1-N 3.42Å; T3-D6 PolarHBondContact OG1-OD2 3.38Å; D6-R10 VanDerWaalsContact O-CB 3.26Å; D6-R10 WeakPolarHBondContact O-CB 3.32Å; D6-R10 PolarHBondContact O-N 2.8Å
7	I	81.3	Confident	76.5	Confident	10 Å²	10	78.6 Å²	78.6	5%	0.051	41%	0.406	C	S	.	.	H	α-helix	trans	-64.9	-45.7	174.8	-59.6	172.8	0	0	0	109.4	A2 T3 Y4 V5 K9 R10 E11 I64 Q67 M68 T71	A2-I7 HydrophobicContact CB-CG1 4.36Å; T3-I7 PolarHBondContact O-N 3.32Å; T3-I7 VanDerWaalsContact O-N 3.11Å; Y4-I7 PolarHBondContact O-N 2.87Å; V5-I7 VanDerWaalsContact C-N 3.35Å; I7-K9 PolarHBondContact O-N 3.15Å; I7-R10 PolarHBondContact O-N 3.11Å; I7-E11 HydrophobicContact CG2-CG 4.04Å; I7-E11 VanDerWaalsContact O-CB 3.3Å; I7-E11 WeakPolarHBondContact O-CB 3.46Å; I7-E11 WeakPolarHBondContact O-CG 3.47Å; I7-E11 PolarHBondContact O-N 3.02Å; I7-I64 HydrophobicContact CG2-CG2 4.29Å; I7-Q67 HydrophobicContact CD1-CB 4.46Å; I7-M68 HydrophobicContact CB-CE 4.03Å; I7-M68 HydrophobicContact CB-CG 4.47Å; I7-M68 HydrophobicContact CG2-CE 3.72Å; I7-M68 HydrophobicContact CG2-CG 4.25Å; I7-T71 HydrophobicContact CD1-CG2 3.96Å
8	L	82.9	Confident	76.7	Confident	1 Å²	1	82.9 Å²	82.9	1%	0.005	42%	0.424	C	S	.	.	H	α-helix	trans	-63.7	-43.2	-178.3	-158	120.6	0	0	0	112	Y4 V5 F12 I15 F20 I23 L48 M68	Y4-L8 WeakPolarHBondContact O-CB 3.35Å; Y4-L8 PolarHBondContact O-N 3.06Å; V5-L8 PolarHBondContact O-N 2.91Å; L8-F12 PolarHBondContact O-N 3.18Å; L8-I15 HydrophobicContact CD2-CD1 3.69Å; L8-I15 HydrophobicContact CG-CD1 4.08Å; L8-F20 HydrophobicContact CD2-CD2 3.31Å; L8-F20 HydrophobicContact CD2-CE2 3.35Å; L8-F20 HydrophobicContact CD2-CG 4.38Å; L8-F20 HydrophobicContact CD2-CZ 4.46Å; L8-I23 HydrophobicContact CD1-CB 4.35Å; L8-I23 HydrophobicContact CD1-CD1 4.47Å; L8-I23 HydrophobicContact CD1-CG2 3.51Å; L8-L48 HydrophobicContact CD1-CD2 4.25Å; L8-M68 HydrophobicContact CB-CE 3.64Å; L8-M68 HydrophobicContact CD1-CE 3.66Å; L8-M68 HydrophobicContact CD1-SD 4.12Å; L8-M68 HydrophobicContact CG-CE 4.04Å
9	K	81.1	Confident	77	Confident	125 Å²	125	81.9 Å²	81.9	54%	0.543	42%	0.42	S	S	.	.	H	α-helix	trans	-69.3	-31.5	176.4	-72.1	-175.7	176.9	178.3	0	113.8	V5 I7 F20	V5-K9 PolarHBondContact O-N 2.89Å; V5-K9 VanDerWaalsContact O-N 3.08Å; I7-K9 PolarHBondContact O-N 3.15Å; K9-F20 HydrophobicContact CD-CE2 4.39Å; K9-F20 HydrophobicContact CD-CZ 4.44Å; K9-F20 VanDerWaalsContact CE-CZ 3.46Å; K9-F20 HydrophobicContact CG-CE2 3.72Å; K9-F20 HydrophobicContact CG-CZ 4.21Å
10	R	81.9	Confident	77.2	Confident	153 Å²	153	79.7 Å²	79.7	58%	0.577	41%	0.407	S	S	*	.	H	α-helix	trans	-75.3	-44.6	178.4	-172.9	-174.7	75.4	-163.6	0	111.5	D6 I7	D6-R10 VanDerWaalsContact O-CB 3.26Å; D6-R10 WeakPolarHBondContact O-CB 3.32Å; D6-R10 PolarHBondContact O-N 2.8Å; I7-R10 PolarHBondContact O-N 3.11Å
11	E	81.4	Confident	77.4	Confident	51 Å²	51	81.1 Å²	81.1	24%	0.238	42%	0.415	C	S	.	.	H	α-helix	trans	-81.4	-24.5	-174.2	-67.2	-52.5	146	0	0	112.8	I7 K56 I64	I7-E11 HydrophobicContact CG2-CG 4.04Å; I7-E11 VanDerWaalsContact O-CB 3.3Å; I7-E11 WeakPolarHBondContact O-CB 3.46Å; I7-E11 WeakPolarHBondContact O-CG 3.47Å; I7-E11 PolarHBondContact O-N 3.02Å; E11-K56 PolarHBondContact O-NZ 3.02Å; E11-K56 IonicContact OE2-NZ 3.9Å; E11-K56 PolarHBondContact OE2-NZ 3.18Å; E11-I64 HydrophobicContact CB-CD1 4.22Å; E11-I64 HydrophobicContact CG-CD1 4.21Å; E11-I64 HydrophobicContact CG-CG1 4.37Å; E11-I64 HydrophobicContact CG-CG2 4.5Å
12	F	82.6	Confident	79	Confident	12 Å²	12	76.5 Å²	76.5	5%	0.053	39%	0.387	C	S	.	.			trans	-136.4	77.9	-179.6	-57.9	-82.5	0	0	0	111.1	L8 E14 I15 L48 K56 I64	L8-F12 PolarHBondContact O-N 3.18Å; F12-E14 VanDerWaalsContact C-N 3.27Å; F12-E14 PolarHBondContact O-N 3.32Å; F12-I15 HydrophobicContact CB-CB 4.45Å; F12-I15 HydrophobicContact CB-CD1 3.43Å; F12-I15 VanDerWaalsContact CB-CD1 3.43Å; F12-I15 HydrophobicContact CB-CG1 3.7Å; F12-I15 HydrophobicContact CD2-CD1 4.38Å; F12-I15 HydrophobicContact CG-CD1 4.01Å; F12-I15 PolarHBondContact O-N 3.39Å; F12-L48 HydrophobicContact CD2-CD2 4.01Å; F12-L48 HydrophobicContact CE2-CD2 3.84Å; F12-L48 HydrophobicContact CZ-CB 4.34Å; F12-L48 HydrophobicContact CZ-CD2 4.23Å; F12-K56 HydrophobicContact CE1-CD 4.06Å; F12-K56 HydrophobicContact CZ-CD 4.12Å; F12-I64 HydrophobicContact CE2-CD1 4.1Å; F12-I64 HydrophobicContact CE2-CG2 4.18Å; F12-I64 HydrophobicContact CZ-CD1 4.08Å
13	P	76	Confident	80.4	Confident	111 Å²	111	74 Å²	74	72%	0.721	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.7	-175.5	27	-33.8	0	0	0	114.2
14	E	76.3	Confident	80.7	Confident	184 Å²	184	72.1 Å²	72.1	86%	0.86	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	11.7	-179.4	-61.1	-170.8	168.6	0	0	113.6	F12 D16	F12-E14 VanDerWaalsContact C-N 3.27Å; F12-E14 PolarHBondContact O-N 3.32Å; E14-D16 PolarHBondContact O-N 3.29Å
15	I	80.5	Confident	80.9	Confident	26 Å²	26	72.8 Å²	72.8	13%	0.133	37%	0.368	C	S	.	.			trans	-59.2	131.5	176.2	-95.4	174.7	0	0	0	110.8	L8 F12 F20 I23 L48 V51	L8-I15 HydrophobicContact CD2-CD1 3.69Å; L8-I15 HydrophobicContact CG-CD1 4.08Å; F12-I15 HydrophobicContact CB-CB 4.45Å; F12-I15 HydrophobicContact CB-CD1 3.43Å; F12-I15 VanDerWaalsContact CB-CD1 3.43Å; F12-I15 HydrophobicContact CB-CG1 3.7Å; F12-I15 HydrophobicContact CD2-CD1 4.38Å; F12-I15 HydrophobicContact CG-CD1 4.01Å; F12-I15 PolarHBondContact O-N 3.39Å; I15-F20 HydrophobicContact CG2-CB 3.55Å; I15-F20 HydrophobicContact CG2-CD2 3.9Å; I15-F20 HydrophobicContact CG2-CG 4.22Å; I15-I23 HydrophobicContact CD1-CD1 4.3Å; I15-L48 HydrophobicContact CD1-CD2 4.25Å; I15-V51 HydrophobicContact CB-CG1 4.38Å; I15-V51 HydrophobicContact CD1-CG1 4.44Å; I15-V51 HydrophobicContact CG1-CB 4.18Å; I15-V51 HydrophobicContact CG1-CG1 3.41Å; I15-V51 VanDerWaalsContact CG1-CG1 3.41Å; I15-V51 HydrophobicContact CG1-CG2 4.23Å
16	D	83.1	Confident	80.8	Confident	88 Å²	88	72.5 Å²	72.5	47%	0.471	37%	0.366	S	S	.	.			trans	-65.9	142.9	171.7	-167.6	-10.8	0	0	0	110.9	E14 E18 L19 F20	E14-D16 PolarHBondContact O-N 3.29Å; D16-E18 VanDerWaalsContact C-N 3.28Å; D16-E18 PolarHBondContact O-N 2.94Å; D16-L19 HydrophobicContact CB-CD1 4.29Å; D16-L19 HydrophobicContact CB-CG 4.44Å; D16-L19 PolarHBondContact O-N 3.47Å; D16-L19 VanDerWaalsContact O-N 3.09Å; D16-F20 WeakPolarHBondContact O-CB 3.44Å; D16-F20 PolarHBondContact O-N 2.94Å
17	T	78.4	Confident	80.8	Confident	102 Å²	102	68.6 Å²	68.6	63%	0.626	35%	0.346	S	S	*	.	H	α-helix	trans	-51	-39.8	175.8	46.9	0	0	0	0	113.9	F20 D21	T17-F20 PolarHBondContact O-N 3.45Å; T17-D21 PolarHBondContact O-N 3.02Å
18	E	79.6	Confident	80.7	Confident	156 Å²	156	73.4 Å²	73.4	73%	0.729	37%	0.371	S	S	*	.	H	α-helix	trans	-69.5	-38.5	177.9	-67.3	-170.9	172.9	0	0	112.5	D16 Y22	D16-E18 VanDerWaalsContact C-N 3.28Å; D16-E18 PolarHBondContact O-N 2.94Å; E18-Y22 WeakPolarHBondContact O-CB 3.35Å; E18-Y22 PolarHBondContact O-N 3.14Å
19	L	81.4	Confident	80.3	Confident	64 Å²	64	77.5 Å²	77.5	34%	0.335	40%	0.4	S	S	.	.	H	α-helix	trans	-72.9	-35.3	177.2	-68	173.7	0	0	0	111.5	D16 Y22 I23 V47 V51	D16-L19 HydrophobicContact CB-CD1 4.29Å; D16-L19 HydrophobicContact CB-CG 4.44Å; D16-L19 PolarHBondContact O-N 3.47Å; D16-L19 VanDerWaalsContact O-N 3.09Å; L19-Y22 PolarHBondContact O-N 3.07Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.4Å; L19-I23 PolarHBondContact O-N 3.1Å; L19-V47 HydrophobicContact CD2-CG1 3.89Å; L19-V51 HydrophobicContact CD1-CG2 3.7Å
20	F	82.7	Confident	79.5	Confident	37 Å²	37	72.2 Å²	72.2	16%	0.162	38%	0.381	C	S	.	.	H	α-helix	trans	-59.7	-49.3	172.9	-170.7	-92.7	0	0	0	111.6	V5 L8 K9 I15 D16 T17 Y22 I23 T24	V5-F20 HydrophobicContact CG1-CZ 4.01Å; L8-F20 HydrophobicContact CD2-CD2 3.31Å; L8-F20 HydrophobicContact CD2-CE2 3.35Å; L8-F20 HydrophobicContact CD2-CG 4.38Å; L8-F20 HydrophobicContact CD2-CZ 4.46Å; K9-F20 HydrophobicContact CD-CE2 4.39Å; K9-F20 HydrophobicContact CD-CZ 4.44Å; K9-F20 VanDerWaalsContact CE-CZ 3.46Å; K9-F20 HydrophobicContact CG-CE2 3.72Å; K9-F20 HydrophobicContact CG-CZ 4.21Å; I15-F20 HydrophobicContact CG2-CB 3.55Å; I15-F20 HydrophobicContact CG2-CD2 3.9Å; I15-F20 HydrophobicContact CG2-CG 4.22Å; D16-F20 WeakPolarHBondContact O-CB 3.44Å; D16-F20 PolarHBondContact O-N 2.94Å; T17-F20 PolarHBondContact O-N 3.45Å; F20-Y22 VanDerWaalsContact C-N 3.32Å; F20-Y22 PolarHBondContact O-N 2.89Å; F20-I23 PolarHBondContact O-N 3.25Å; F20-T24 HydrophobicContact CD1-CG2 4.16Å; F20-T24 HydrophobicContact CE1-CG2 3.72Å; F20-T24 HydrophobicContact CE2-CG2 4.43Å; F20-T24 HydrophobicContact CZ-CG2 3.85Å; F20-T24 WeakPolarHBondContact O-CB 3.46Å; F20-T24 WeakPolarHBondContact O-CG2 3.47Å; F20-T24 PolarHBondContact O-N 2.87Å; F20-T24 PolarHBondContact O-OG1 3Å
21	D	79.9	Confident	78.9	Confident	110 Å²	110	65.1 Å²	65.1	59%	0.588	36%	0.355	S	S	*	.	H	α-helix	trans	-66.9	-35.1	179.4	-76.1	-6.7	0	0	0	111.6	T17 T24 G25	T17-D21 PolarHBondContact O-N 3.02Å; D21-T24 WeakPolarHBondContact CA-OG1 3.46Å; D21-T24 PolarHBondContact O-OG1 3.23Å; D21-G25 PolarHBondContact O-N 3.09Å
22	Y	82.6	Confident	78.2	Confident	125 Å²	125	66.6 Å²	66.6	49%	0.49	37%	0.369	S	S	.	.	H	α-helix	trans	-62.5	-52.4	172.4	177.2	-99.8	0	0	0	111.9	E18 L19 F20 G25 V26 V47	E18-Y22 WeakPolarHBondContact O-CB 3.35Å; E18-Y22 PolarHBondContact O-N 3.14Å; L19-Y22 PolarHBondContact O-N 3.07Å; F20-Y22 VanDerWaalsContact C-N 3.32Å; F20-Y22 PolarHBondContact O-N 2.89Å; Y22-G25 PolarHBondContact O-N 3.06Å; Y22-V26 HydrophobicContact CD1-CG2 4.48Å; Y22-V26 HydrophobicContact CD2-CG2 4.48Å; Y22-V26 HydrophobicContact CE1-CG2 4.09Å; Y22-V26 HydrophobicContact CE2-CG2 4.1Å; Y22-V26 WeakPolarHBondContact O-CG2 3.48Å; Y22-V26 PolarHBondContact O-N 3.19Å; Y22-V47 HydrophobicContact CE1-CG2 4.21Å
23	I	82.6	Confident	77.5	Confident	0 Å²	0	72 Å²	72	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-65.9	-43.7	-176.2	-65.1	163.9	0	0	0	110.8	L8 I15 L19 F20 G25 V26 L27 I44 V47 L48	L8-I23 HydrophobicContact CD1-CB 4.35Å; L8-I23 HydrophobicContact CD1-CD1 4.47Å; L8-I23 HydrophobicContact CD1-CG2 3.51Å; I15-I23 HydrophobicContact CD1-CD1 4.3Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.4Å; L19-I23 PolarHBondContact O-N 3.1Å; F20-I23 PolarHBondContact O-N 3.25Å; I23-G25 PolarHBondContact O-N 3.27Å; I23-V26 PolarHBondContact O-N 3.22Å; I23-L27 HydrophobicContact CG2-CD1 3.95Å; I23-L27 HydrophobicContact CG2-CG 4.37Å; I23-L27 WeakPolarHBondContact O-CG 3.43Å; I23-L27 PolarHBondContact O-N 3.14Å; I23-I44 HydrophobicContact CG2-CB 4.38Å; I23-I44 HydrophobicContact CG2-CD1 3.7Å; I23-I44 HydrophobicContact CG2-CG2 4.21Å; I23-V47 HydrophobicContact CD1-CG1 4.16Å; I23-V47 HydrophobicContact CG1-CG1 4.42Å; I23-L48 HydrophobicContact CD1-CD2 3.81Å; I23-L48 HydrophobicContact CD1-CG 4.39Å
24	T	82.3	Confident	77.7	Confident	19 Å²	19	67.9 Å²	67.9	12%	0.117	37%	0.37	C	S	.	.	H	α-helix	trans	-64.1	-40.1	176.1	52.8	0	0	0	0	111.8	Y4 V5 F20 D21 V26 L27 D28	Y4-T24 HydrophobicContact CE2-CG2 4.32Å; V5-T24 HydrophobicContact CG2-CG2 4.3Å; F20-T24 HydrophobicContact CD1-CG2 4.16Å; F20-T24 HydrophobicContact CE1-CG2 3.72Å; F20-T24 HydrophobicContact CE2-CG2 4.43Å; F20-T24 HydrophobicContact CZ-CG2 3.85Å; F20-T24 WeakPolarHBondContact O-CB 3.46Å; F20-T24 WeakPolarHBondContact O-CG2 3.47Å; F20-T24 PolarHBondContact O-N 2.87Å; F20-T24 PolarHBondContact O-OG1 3Å; D21-T24 WeakPolarHBondContact CA-OG1 3.46Å; D21-T24 PolarHBondContact O-OG1 3.23Å; T24-V26 PolarHBondContact O-N 3.12Å; T24-L27 PolarHBondContact O-N 3.26Å; T24-D28 WeakPolarHBondContact O-CB 3.44Å; T24-D28 PolarHBondContact O-N 3.34Å
25	G	79.5	Confident	77.6	Confident	36 Å²	36	66.6 Å²	66.6	37%	0.371	36%	0.364	S	S	.	.	H	α-helix	trans	-62.2	-38.9	173.9	0	0	0	0	0	113.7	D21 Y22 I23 S29	D21-G25 PolarHBondContact O-N 3.09Å; Y22-G25 PolarHBondContact O-N 3.06Å; I23-G25 PolarHBondContact O-N 3.27Å; G25-S29 VanDerWaalsContact O-CB 3.27Å; G25-S29 WeakPolarHBondContact O-CB 3.34Å; G25-S29 PolarHBondContact O-N 3.19Å; G25-S29 PolarHBondContact O-OG 3.41Å
26	V	80.9	Confident	77.5	Confident	31 Å²	31	68.7 Å²	68.7	19%	0.188	38%	0.375	C	S	.	.	H	α-helix	trans	-67.8	-43.8	175.3	172.5	0	0	0	0	111	Y22 I23 T24 S29 G30 F34 A43 I44	Y22-V26 HydrophobicContact CD1-CG2 4.48Å; Y22-V26 HydrophobicContact CD2-CG2 4.48Å; Y22-V26 HydrophobicContact CE1-CG2 4.09Å; Y22-V26 HydrophobicContact CE2-CG2 4.1Å; Y22-V26 WeakPolarHBondContact O-CG2 3.48Å; Y22-V26 PolarHBondContact O-N 3.19Å; I23-V26 PolarHBondContact O-N 3.22Å; T24-V26 PolarHBondContact O-N 3.12Å; V26-S29 PolarHBondContact O-OG 3.48Å; V26-G30 WeakPolarHBondContact O-CA 3.29Å; V26-G30 PolarHBondContact O-N 3.22Å; V26-F34 HydrophobicContact CG1-CZ 4.43Å; V26-A43 HydrophobicContact CG1-CB 4.26Å; V26-I44 HydrophobicContact CB-CG2 4.08Å; V26-I44 HydrophobicContact CG1-CG2 3.73Å
27	L	79.7	Confident	77.2	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-69.5	-35.3	179.7	-68.2	176.4	0	0	0	113	Y4 I23 T24 G31 F34 V40 I44 M68 L72	Y4-L27 HydrophobicContact CD2-CB 4.41Å; Y4-L27 HydrophobicContact CD2-CD1 3.68Å; Y4-L27 HydrophobicContact CE2-CB 4.09Å; Y4-L27 HydrophobicContact CE2-CD1 4.04Å; Y4-L27 HydrophobicContact CG-CD1 4.46Å; I23-L27 HydrophobicContact CG2-CD1 3.95Å; I23-L27 HydrophobicContact CG2-CG 4.37Å; I23-L27 WeakPolarHBondContact O-CG 3.43Å; I23-L27 PolarHBondContact O-N 3.14Å; T24-L27 PolarHBondContact O-N 3.26Å; L27-G31 WeakPolarHBondContact O-CA 2.95Å; L27-G31 PolarHBondContact O-N 3.11Å; L27-F34 HydrophobicContact CD2-CE2 4.43Å; L27-V40 HydrophobicContact CD2-CG1 3.83Å; L27-I44 HydrophobicContact CD1-CD1 4.01Å; L27-I44 HydrophobicContact CD2-CD1 3.88Å; L27-I44 HydrophobicContact CG-CD1 4.12Å; L27-M68 HydrophobicContact CD1-SD 4.32Å; L27-L72 HydrophobicContact CB-CD1 4.43Å; L27-L72 HydrophobicContact CD2-CD1 3.97Å
28	D	78.5	Confident	77.3	Confident	110 Å²	110	66.4 Å²	66.4	59%	0.588	36%	0.357	S	S	*	.	H	α-helix	trans	-74.7	-36.1	176.2	-84.1	-21.4	0	0	0	112.9	Y4 T24	Y4-D28 PolarHBondContact OH-OD1 3.29Å; Y4-D28 PolarHBondContact OH-OD2 3.3Å; T24-D28 WeakPolarHBondContact O-CB 3.44Å; T24-D28 PolarHBondContact O-N 3.34Å
29	S	74.5	Confident	77.4	Confident	88 Å²	88	62.7 Å²	62.7	62%	0.615	34%	0.339	S	S	*	.	H	α-helix	trans	-81.1	-37.2	179.4	60.3	0	0	0	0	113.4	G25 V26	G25-S29 VanDerWaalsContact O-CB 3.27Å; G25-S29 WeakPolarHBondContact O-CB 3.34Å; G25-S29 PolarHBondContact O-N 3.19Å; G25-S29 PolarHBondContact O-OG 3.41Å; V26-S29 PolarHBondContact O-OG 3.48Å
30	G	65.6	Low	77.4	Confident	13 Å²	13	59.6 Å²	59.6	13%	0.134	32%	0.323	C	S	.	.	H	α-helix	trans	-92.5	-10.3	179.4	0	0	0	0	0	114.7	V26 P32 D33 F34	V26-G30 WeakPolarHBondContact O-CA 3.29Å; V26-G30 PolarHBondContact O-N 3.22Å; G30-P32 VanDerWaalsContact O-N 3.16Å; G30-D33 PolarHBondContact O-N 3.43Å; G30-F34 VanDerWaalsContact C-CD2 3.4Å; G30-F34 VanDerWaalsContact C-CE2 3.41Å; G30-F34 WeakPolarHBondContact O-CD2 3.5Å; G30-F34 WeakPolarHBondContact O-CE2 3.42Å; G30-F34 PolarHBondContact O-N 3.43Å
31	G	68.6	Low	77.5	Confident	4 Å²	4	59 Å²	59	4%	0.041	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-39.6	-177.3	0	0	0	0	0	117.4	L27 N76	L27-G31 WeakPolarHBondContact O-CA 2.95Å; L27-G31 PolarHBondContact O-N 3.11Å; G31-N76 PolarHBondContact O-ND2 3.25Å
32	P	66.3	Low	77.7	Confident	82 Å²	82	60.1 Å²	60.1	53%	0.532	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-23.7	175.9	27	-31.6	0	0	0	114	G30	G30-P32 VanDerWaalsContact O-N 3.16Å
33	D	68.4	Low	77.6	Confident	126 Å²	126	56 Å²	56	67%	0.674	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-21.2	-170.3	-66	-22.5	0	0	0	113.4	G30 E35	G30-D33 PolarHBondContact O-N 3.43Å; D33-E35 PolarHBondContact O-N 3.09Å
34	F	79.8	Confident	77.7	Confident	24 Å²	24	56 Å²	56	11%	0.105	32%	0.318	C	S	.	.			trans	-66.9	129.3	175.7	-65	-60.1	0	0	0	111.4	V26 L27 G30 E39 V40 A43 F69 K73	V26-F34 HydrophobicContact CG1-CZ 4.43Å; L27-F34 HydrophobicContact CD2-CE2 4.43Å; G30-F34 VanDerWaalsContact C-CD2 3.4Å; G30-F34 VanDerWaalsContact C-CE2 3.41Å; G30-F34 WeakPolarHBondContact O-CD2 3.5Å; G30-F34 WeakPolarHBondContact O-CE2 3.42Å; G30-F34 PolarHBondContact O-N 3.43Å; F34-E39 WeakPolarHBondContact CA-OE2 3.39Å; F34-E39 HydrophobicContact CD1-CB 3.83Å; F34-E39 HydrophobicContact CE1-CB 4.49Å; F34-V40 HydrophobicContact CB-CG2 4.05Å; F34-V40 HydrophobicContact CD1-CG2 4.06Å; F34-V40 HydrophobicContact CD2-CG2 3.96Å; F34-V40 HydrophobicContact CE2-CG2 4.45Å; F34-V40 HydrophobicContact CG-CG2 3.76Å; F34-A43 HydrophobicContact CE1-CB 3.92Å; F34-A43 HydrophobicContact CZ-CB 3.94Å; F34-F69 HydrophobicContact CB-CD2 4.13Å; F34-F69 HydrophobicContact CB-CE2 3.94Å; F34-F69 WeakPolarHBondContact O-CE2 3.29Å; F34-K73 WeakPolarHBondContact O-CE 3.26Å; F34-K73 PolarHBondContact O-NZ 3.45Å
35	E	74.6	Confident	77.7	Confident	158 Å²	158	55.1 Å²	55.1	74%	0.738	31%	0.313	S	S	*	.			trans	-96.9	-28.7	180	-65.8	-166.5	172.9	0	0	113.3	D33 E39 F69	D33-E35 PolarHBondContact O-N 3.09Å; E35-E39 PolarHBondContact N-OE2 3.18Å; E35-F69 VanDerWaalsContact C-CZ 3.44Å; E35-F69 WeakPolarHBondContact O-CZ 3.34Å
36	D	78.7	Confident	77.8	Confident	70 Å²	70	55.4 Å²	55.4	37%	0.374	32%	0.316	S	S	.	.	S	Bend	trans	-146.1	178.5	177.2	66.3	22.6	0	0	0	113.5	E38 E39 F69	D36-E38 VanDerWaalsContact C-N 3.3Å; D36-E38 PolarHBondContact OD1-N 3.4Å; D36-E39 WeakPolarHBondContact OD1-CG 3.37Å; D36-E39 PolarHBondContact OD1-N 3.14Å; D36-F69 WeakPolarHBondContact O-CD2 3.4Å
37	G	76.4	Confident	77.9	Confident	8 Å²	8	55.6 Å²	55.6	8%	0.082	32%	0.317	C	S	.	.	H	α-helix	trans	-73.7	-17.7	178.2	0	0	0	0	0	114.2	F41	G37-F41 PolarHBondContact O-N 3.09Å; G37-F41 VanDerWaalsContact O-N 3.16Å
38	E	80.7	Confident	78	Confident	134 Å²	134	55.6 Å²	55.6	63%	0.626	32%	0.317	S	S	*	.	H	α-helix	trans	-75.6	-39.2	177.2	-71.9	-157.6	169	0	0	110.9	D36 V40 F41 D42	D36-E38 VanDerWaalsContact C-N 3.3Å; D36-E38 PolarHBondContact OD1-N 3.4Å; E38-V40 PolarHBondContact O-N 2.86Å; E38-F41 CarbonylContact O-C 3.54Å; E38-F41 WeakPolarHBondContact O-CA 3.45Å; E38-F41 WeakPolarHBondContact O-CB 3.06Å; E38-F41 PolarHBondContact O-N 3.46Å; E38-D42 PolarHBondContact O-N 2.88Å
39	E	80.9	Confident	78.2	Confident	77 Å²	77	54 Å²	54	36%	0.36	31%	0.306	S	S	.	.	H	α-helix	trans	-63.8	-31.6	174.9	-68.8	-176.3	160.5	0	0	112.8	F34 E35 D36 A43	F34-E39 WeakPolarHBondContact CA-OE2 3.39Å; F34-E39 HydrophobicContact CD1-CB 3.83Å; F34-E39 HydrophobicContact CE1-CB 4.49Å; E35-E39 PolarHBondContact N-OE2 3.18Å; D36-E39 WeakPolarHBondContact OD1-CG 3.37Å; D36-E39 PolarHBondContact OD1-N 3.14Å; E39-A43 WeakPolarHBondContact O-CB 3.47Å; E39-A43 PolarHBondContact O-N 3.48Å; E39-A43 VanDerWaalsContact O-N 3.13Å
40	V	82.4	Confident	78.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-68.2	-42.6	171.7	178.7	0	0	0	0	110.3	L27 F34 E38 D42 A43 I44 C65 F69	L27-V40 HydrophobicContact CD2-CG1 3.83Å; F34-V40 HydrophobicContact CB-CG2 4.05Å; F34-V40 HydrophobicContact CD1-CG2 4.06Å; F34-V40 HydrophobicContact CD2-CG2 3.96Å; F34-V40 HydrophobicContact CE2-CG2 4.45Å; F34-V40 HydrophobicContact CG-CG2 3.76Å; E38-V40 PolarHBondContact O-N 2.86Å; V40-D42 PolarHBondContact O-N 2.96Å; V40-A43 PolarHBondContact O-N 2.91Å; V40-I44 HydrophobicContact CG1-CD1 3.93Å; V40-I44 HydrophobicContact CG1-CG1 3.99Å; V40-I44 WeakPolarHBondContact O-CG1 3.21Å; V40-I44 PolarHBondContact O-N 3.22Å; V40-C65 HydrophobicContact CB-CB 4.41Å; V40-C65 HydrophobicContact CG1-CB 4.09Å; V40-F69 HydrophobicContact CG2-CB 4.12Å; V40-F69 HydrophobicContact CG2-CD2 3.9Å; V40-F69 HydrophobicContact CG2-CG 4.45Å
41	F	85	Confident	79	Confident	23 Å²	23	57.5 Å²	57.5	10%	0.101	32%	0.316	C	S	.	.	I	π-helix	trans	-62.8	-40	174.8	179.1	-95.9	0	0	0	112.2	G37 E38 A43 G45 E58 I61 R62 C65	G37-F41 PolarHBondContact O-N 3.09Å; G37-F41 VanDerWaalsContact O-N 3.16Å; E38-F41 CarbonylContact O-C 3.54Å; E38-F41 WeakPolarHBondContact O-CA 3.45Å; E38-F41 WeakPolarHBondContact O-CB 3.06Å; E38-F41 PolarHBondContact O-N 3.46Å; F41-A43 VanDerWaalsContact C-N 3.28Å; F41-A43 PolarHBondContact O-N 2.98Å; F41-G45 WeakPolarHBondContact O-CA 3.49Å; F41-G45 PolarHBondContact O-N 2.69Å; F41-E58 HydrophobicContact CE2-CG 4.26Å; F41-E58 HydrophobicContact CZ-CG 3.65Å; F41-I61 HydrophobicContact CD2-CG2 3.97Å; F41-I61 HydrophobicContact CE2-CB 4.12Å; F41-I61 HydrophobicContact CE2-CG2 3.73Å; F41-R62 HydrophobicContact CB-CG 4.47Å; F41-R62 HydrophobicContact CD1-CG 4.09Å; F41-R62 HydrophobicContact CD2-CB 4.32Å; F41-R62 HydrophobicContact CD2-CG 3.46Å; F41-R62 VanDerWaalsContact CD2-CG 3.46Å; F41-R62 HydrophobicContact CE1-CG 4.18Å; F41-R62 HydrophobicContact CE2-CG 3.57Å; F41-R62 HydrophobicContact CG-CG 3.74Å; F41-R62 HydrophobicContact CZ-CG 3.94Å; F41-C65 HydrophobicContact CB-CB 4.13Å
42	D	82.8	Confident	79.2	Confident	135 Å²	135	57.7 Å²	57.7	72%	0.722	32%	0.317	S	S	*	.	I	π-helix	trans	-64.5	-33.4	175.7	-81.2	-7.8	0	0	0	112.5	E38 V40	E38-D42 PolarHBondContact O-N 2.88Å; V40-D42 PolarHBondContact O-N 2.96Å
43	A	81.5	Confident	79	Confident	38 Å²	38	57.7 Å²	57.7	31%	0.314	32%	0.323	S	S	.	.	I	π-helix	trans	-78.7	-40.6	-178.2	0	0	0	0	0	113.6	V26 F34 E39 V40 F41	V26-A43 HydrophobicContact CG1-CB 4.26Å; F34-A43 HydrophobicContact CE1-CB 3.92Å; F34-A43 HydrophobicContact CZ-CB 3.94Å; E39-A43 WeakPolarHBondContact O-CB 3.47Å; E39-A43 PolarHBondContact O-N 3.48Å; E39-A43 VanDerWaalsContact O-N 3.13Å; V40-A43 PolarHBondContact O-N 2.91Å; F41-A43 VanDerWaalsContact C-N 3.28Å; F41-A43 PolarHBondContact O-N 2.98Å
44	I	84.4	Confident	78.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.334	C	S	.	.	I	π-helix	trans	-128.7	-9.4	-171.8	60.5	161.9	0	0	0	114.6	I23 V26 L27 V40 G46 V47 L48	I23-I44 HydrophobicContact CG2-CB 4.38Å; I23-I44 HydrophobicContact CG2-CD1 3.7Å; I23-I44 HydrophobicContact CG2-CG2 4.21Å; V26-I44 HydrophobicContact CB-CG2 4.08Å; V26-I44 HydrophobicContact CG1-CG2 3.73Å; L27-I44 HydrophobicContact CD1-CD1 4.01Å; L27-I44 HydrophobicContact CD2-CD1 3.88Å; L27-I44 HydrophobicContact CG-CD1 4.12Å; V40-I44 HydrophobicContact CG1-CD1 3.93Å; V40-I44 HydrophobicContact CG1-CG1 3.99Å; V40-I44 WeakPolarHBondContact O-CG1 3.21Å; V40-I44 PolarHBondContact O-N 3.22Å; I44-G46 PolarHBondContact O-N 3.5Å; I44-V47 PolarHBondContact O-N 3.21Å; I44-L48 HydrophobicContact CD1-CD1 3.94Å; I44-L48 HydrophobicContact CG1-CD1 4.22Å; I44-L48 WeakPolarHBondContact O-CG 3.41Å; I44-L48 PolarHBondContact O-N 3.03Å
45	G	83.3	Confident	78.1	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.36	C	S	.	.	I	π-helix	trans	-62.6	-41	-174.3	0	0	0	0	0	113.5	F41 V47 L48 Q49	F41-G45 WeakPolarHBondContact O-CA 3.49Å; F41-G45 PolarHBondContact O-N 2.69Å; G45-V47 VanDerWaalsContact C-N 3.31Å; G45-V47 PolarHBondContact O-N 2.89Å; G45-L48 PolarHBondContact O-N 3.4Å; G45-Q49 WeakPolarHBondContact O-CB 3.48Å; G45-Q49 PolarHBondContact O-N 3.1Å
46	G	81.3	Confident	78.1	Confident	42 Å²	42	57.2 Å²	57.2	43%	0.433	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-38.5	175.2	0	0	0	0	0	112.9	I44 Q49 D50	I44-G46 PolarHBondContact O-N 3.5Å; G46-Q49 PolarHBondContact O-N 3.16Å; G46-D50 PolarHBondContact O-N 3.2Å
47	V	82.8	Confident	78.2	Confident	36 Å²	36	59.6 Å²	59.6	22%	0.218	35%	0.345	C	S	.	.	H	α-helix	trans	-70.1	-40.4	176.9	-176.2	0	0	0	0	110.8	L19 Y22 I23 I44 G45 Q49 D50 V51	L19-V47 HydrophobicContact CD2-CG1 3.89Å; Y22-V47 HydrophobicContact CE1-CG2 4.21Å; I23-V47 HydrophobicContact CD1-CG1 4.16Å; I23-V47 HydrophobicContact CG1-CG1 4.42Å; I44-V47 PolarHBondContact O-N 3.21Å; G45-V47 VanDerWaalsContact C-N 3.31Å; G45-V47 PolarHBondContact O-N 2.89Å; V47-Q49 VanDerWaalsContact C-N 3.29Å; V47-Q49 PolarHBondContact O-N 3.24Å; V47-D50 PolarHBondContact O-N 2.9Å; V47-V51 WeakPolarHBondContact O-CG2 3.27Å; V47-V51 PolarHBondContact O-N 3.23Å; V47-V51 VanDerWaalsContact O-N 3.1Å
48	L	81.6	Confident	78.3	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.5	-33.9	175.4	-70.8	174.6	0	0	0	112.3	L8 F12 I15 I23 I44 G45 V51 S52 I61	L8-L48 HydrophobicContact CD1-CD2 4.25Å; F12-L48 HydrophobicContact CD2-CD2 4.01Å; F12-L48 HydrophobicContact CE2-CD2 3.84Å; F12-L48 HydrophobicContact CZ-CB 4.34Å; F12-L48 HydrophobicContact CZ-CD2 4.23Å; I15-L48 HydrophobicContact CD1-CD2 4.25Å; I23-L48 HydrophobicContact CD1-CD2 3.81Å; I23-L48 HydrophobicContact CD1-CG 4.39Å; I44-L48 HydrophobicContact CD1-CD1 3.94Å; I44-L48 HydrophobicContact CG1-CD1 4.22Å; I44-L48 WeakPolarHBondContact O-CG 3.41Å; I44-L48 PolarHBondContact O-N 3.03Å; G45-L48 PolarHBondContact O-N 3.4Å; L48-V51 PolarHBondContact O-N 3.02Å; L48-S52 WeakPolarHBondContact O-CB 3.41Å; L48-S52 PolarHBondContact O-N 3.3Å; L48-I61 HydrophobicContact CB-CG2 3.93Å; L48-I61 HydrophobicContact CD1-CG2 4.33Å
49	Q	82.3	Confident	78.3	Confident	76 Å²	76	61.7 Å²	61.7	36%	0.355	36%	0.356	S	S	.	.	H	α-helix	trans	-68.4	-43.4	176.6	-164.7	166.3	12.3	0	0	111.3	G45 G46 V47 V51 S52 I61	G45-Q49 WeakPolarHBondContact O-CB 3.48Å; G45-Q49 PolarHBondContact O-N 3.1Å; G46-Q49 PolarHBondContact O-N 3.16Å; V47-Q49 VanDerWaalsContact C-N 3.29Å; V47-Q49 PolarHBondContact O-N 3.24Å; Q49-V51 VanDerWaalsContact C-N 3.32Å; Q49-V51 PolarHBondContact O-N 3.07Å; Q49-S52 PolarHBondContact O-N 3.09Å; Q49-S52 VanDerWaalsContact O-N 3.14Å; Q49-S52 PolarHBondContact O-OG 2.98Å; Q49-I61 VanDerWaalsContact CA-CD1 3.48Å; Q49-I61 HydrophobicContact CB-CD1 3.65Å; Q49-I61 HydrophobicContact CG-CD1 3.79Å
50	D	78.6	Confident	78.4	Confident	138 Å²	138	61.5 Å²	61.5	74%	0.738	36%	0.358	S	S	*	.	H	α-helix	trans	-62.2	-38.2	175.4	-75.5	-13.6	0	0	0	112.3	G46 V47 S52	G46-D50 PolarHBondContact O-N 3.2Å; V47-D50 PolarHBondContact O-N 2.9Å; D50-S52 VanDerWaalsContact C-N 3.34Å
51	V	79.6	Confident	78.5	Confident	37 Å²	37	61.5 Å²	61.5	22%	0.224	36%	0.358	C	S	.	.	H	α-helix	trans	-75	-25.1	176.8	-177.6	0	0	0	0	112.4	I15 L19 V47 L48 Q49 A53	I15-V51 HydrophobicContact CB-CG1 4.38Å; I15-V51 HydrophobicContact CD1-CG1 4.44Å; I15-V51 HydrophobicContact CG1-CB 4.18Å; I15-V51 HydrophobicContact CG1-CG1 3.41Å; I15-V51 VanDerWaalsContact CG1-CG1 3.41Å; I15-V51 HydrophobicContact CG1-CG2 4.23Å; L19-V51 HydrophobicContact CD1-CG2 3.7Å; V47-V51 WeakPolarHBondContact O-CG2 3.27Å; V47-V51 PolarHBondContact O-N 3.23Å; V47-V51 VanDerWaalsContact O-N 3.1Å; L48-V51 PolarHBondContact O-N 3.02Å; Q49-V51 VanDerWaalsContact C-N 3.32Å; Q49-V51 PolarHBondContact O-N 3.07Å; V51-A53 PolarHBondContact O-N 3.4Å
52	S	72.8	Confident	78.5	Confident	7 Å²	7	64.9 Å²	64.9	5%	0.049	37%	0.37	C	S	.	.	H	α-helix	trans	-72.4	-13.3	-178.3	77.4	0	0	0	0	114.4	L48 Q49 D50 D54 S55	L48-S52 WeakPolarHBondContact O-CB 3.41Å; L48-S52 PolarHBondContact O-N 3.3Å; Q49-S52 PolarHBondContact O-N 3.09Å; Q49-S52 VanDerWaalsContact O-N 3.14Å; Q49-S52 PolarHBondContact O-OG 2.98Å; D50-S52 VanDerWaalsContact C-N 3.34Å; S52-D54 VanDerWaalsContact C-N 3.29Å; S52-D54 PolarHBondContact O-N 2.9Å; S52-D54 VanDerWaalsContact O-N 3.08Å; S52-S55 WeakPolarHBondContact O-CB 3.48Å; S52-S55 PolarHBondContact O-N 3.45Å; S52-S55 PolarHBondContact O-OG 3.22Å
53	A	60.6	Low	78.6	Confident	82 Å²	82	63.1 Å²	63.1	68%	0.678	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.6	56	174.4	0	0	0	0	0	114	V51 S55	V51-A53 PolarHBondContact O-N 3.4Å; A53-S55 PolarHBondContact O-N 3.05Å
54	D	62.3	Low	78.7	Confident	166 Å²	166	61.8 Å²	61.8	89%	0.888	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	7.2	179.2	-59.5	-29.6	0	0	0	117.9	S52	S52-D54 VanDerWaalsContact C-N 3.29Å; S52-D54 PolarHBondContact O-N 2.9Å; S52-D54 VanDerWaalsContact O-N 3.08Å
55	S	67.1	Low	78.8	Confident	94 Å²	94	61.8 Å²	61.8	66%	0.657	35%	0.348	S	S	*	.	S	Bend	trans	-82.8	-20.7	178.9	65.7	0	0	0	0	115	S52 A53	S52-S55 WeakPolarHBondContact O-CB 3.48Å; S52-S55 PolarHBondContact O-N 3.45Å; S52-S55 PolarHBondContact O-OG 3.22Å; A53-S55 PolarHBondContact O-N 3.05Å
56	K	75.6	Confident	78.9	Confident	39 Å²	39	65.7 Å²	65.7	17%	0.17	37%	0.369	C	S	.	.	S	Bend	trans	-135.9	135.8	-176.4	-69.5	-179.7	172.7	177.3	0	110.3	E11 F12 D60 I61 I64	E11-K56 PolarHBondContact O-NZ 3.02Å; E11-K56 IonicContact OE2-NZ 3.9Å; E11-K56 PolarHBondContact OE2-NZ 3.18Å; F12-K56 HydrophobicContact CE1-CD 4.06Å; F12-K56 HydrophobicContact CZ-CD 4.12Å; K56-D60 HydrophobicContact CB-CB 4.25Å; K56-I61 HydrophobicContact CB-CG1 4.36Å; K56-I64 HydrophobicContact CD-CD1 3.97Å
57	N	79.4	Confident	78.9	Confident	119 Å²	119	68 Å²	68	64%	0.636	37%	0.368	S	S	*	.			trans	-79.7	164.1	177.9	-68.4	-32.6	0	0	0	110.7	D59 D60 I61	N57-D59 PolarHBondContact O-N 3.05Å; N57-D60 PolarHBondContact N-OD2 2.67Å; N57-D60 WeakPolarHBondContact O-CB 3.33Å; N57-D60 PolarHBondContact O-N 2.96Å; N57-I61 PolarHBondContact O-N 3.05Å; N57-I61 VanDerWaalsContact O-N 3.13Å
58	E	79.4	Confident	78.9	Confident	80 Å²	80	66.3 Å²	66.3	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-56.1	-38.2	-179.4	-162.6	-178.5	158.5	0	0	112.6	F41 D60 I61 R62	F41-E58 HydrophobicContact CE2-CG 4.26Å; F41-E58 HydrophobicContact CZ-CG 3.65Å; E58-D60 PolarHBondContact O-N 2.86Å; E58-I61 PolarHBondContact O-N 3.39Å; E58-R62 WeakPolarHBondContact O-CG 3.4Å; E58-R62 PolarHBondContact O-N 3.32Å; E58-R62 IonicContact OE1-CZ 3.04Å; E58-R62 IonicContact OE1-NE 2.93Å; E58-R62 IonicContact OE1-NH2 3.16Å; E58-R62 PolarHBondContact OE1-NH2 2.69Å
59	D	80.8	Confident	78.9	Confident	106 Å²	106	67.3 Å²	67.3	57%	0.567	36%	0.362	S	S	*	.	H	α-helix	trans	-66.6	-35.1	176.7	-67.1	-29.2	0	0	0	112.4	N57 I61 R62 D63	N57-D59 PolarHBondContact O-N 3.05Å; D59-I61 VanDerWaalsContact C-N 3.32Å; D59-I61 PolarHBondContact O-N 3.11Å; D59-R62 PolarHBondContact O-N 3.46Å; D59-R62 IonicContact OD1-NH1 2.66Å; D59-R62 PolarHBondContact OD1-NH1 3.32Å; D59-D63 PolarHBondContact O-N 2.9Å
60	D	82.2	Confident	78.8	Confident	73 Å²	73	67.5 Å²	67.5	39%	0.39	37%	0.365	S	S	.	.	H	α-helix	trans	-67.4	-36.2	175.3	-57.5	-45.9	0	0	0	111	K56 N57 E58 D63 I64	K56-D60 HydrophobicContact CB-CB 4.25Å; N57-D60 PolarHBondContact N-OD2 2.67Å; N57-D60 WeakPolarHBondContact O-CB 3.33Å; N57-D60 PolarHBondContact O-N 2.96Å; E58-D60 PolarHBondContact O-N 2.86Å; D60-D63 PolarHBondContact O-N 3.29Å; D60-I64 WeakPolarHBondContact O-CD1 3.5Å; D60-I64 VanDerWaalsContact O-CG1 3.24Å; D60-I64 WeakPolarHBondContact O-CG1 3.16Å; D60-I64 PolarHBondContact O-N 2.93Å
61	I	84.3	Confident	78.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-70.3	-38.4	178	-62.2	170.2	0	0	0	110.5	F41 L48 Q49 K56 N57 E58 D59 D63 I64 C65	F41-I61 HydrophobicContact CD2-CG2 3.97Å; F41-I61 HydrophobicContact CE2-CB 4.12Å; F41-I61 HydrophobicContact CE2-CG2 3.73Å; L48-I61 HydrophobicContact CB-CG2 3.93Å; L48-I61 HydrophobicContact CD1-CG2 4.33Å; Q49-I61 VanDerWaalsContact CA-CD1 3.48Å; Q49-I61 HydrophobicContact CB-CD1 3.65Å; Q49-I61 HydrophobicContact CG-CD1 3.79Å; K56-I61 HydrophobicContact CB-CG1 4.36Å; N57-I61 PolarHBondContact O-N 3.05Å; N57-I61 VanDerWaalsContact O-N 3.13Å; E58-I61 PolarHBondContact O-N 3.39Å; D59-I61 VanDerWaalsContact C-N 3.32Å; D59-I61 PolarHBondContact O-N 3.11Å; I61-D63 VanDerWaalsContact C-N 3.35Å; I61-I64 PolarHBondContact O-N 2.88Å; I61-C65 PolarHBondContact O-N 3.26Å; I61-C65 PolarHBondContact O-SG 2.88Å
62	R	85.8	Confident	78.5	Confident	94 Å²	94	61.1 Å²	61.1	36%	0.355	33%	0.331	S	S	.	.	H	α-helix	trans	-61.5	-42.9	173.2	-73.2	178.4	-173.1	159.6	-1.1	111.7	F41 E58 D59 I64 C65 L66	F41-R62 HydrophobicContact CB-CG 4.47Å; F41-R62 HydrophobicContact CD1-CG 4.09Å; F41-R62 HydrophobicContact CD2-CB 4.32Å; F41-R62 HydrophobicContact CD2-CG 3.46Å; F41-R62 VanDerWaalsContact CD2-CG 3.46Å; F41-R62 HydrophobicContact CE1-CG 4.18Å; F41-R62 HydrophobicContact CE2-CG 3.57Å; F41-R62 HydrophobicContact CG-CG 3.74Å; F41-R62 HydrophobicContact CZ-CG 3.94Å; E58-R62 WeakPolarHBondContact O-CG 3.4Å; E58-R62 PolarHBondContact O-N 3.32Å; E58-R62 IonicContact OE1-CZ 3.04Å; E58-R62 IonicContact OE1-NE 2.93Å; E58-R62 IonicContact OE1-NH2 3.16Å; E58-R62 PolarHBondContact OE1-NH2 2.69Å; D59-R62 PolarHBondContact O-N 3.46Å; D59-R62 IonicContact OD1-NH1 2.66Å; D59-R62 PolarHBondContact OD1-NH1 3.32Å; R62-I64 VanDerWaalsContact C-N 3.35Å; R62-I64 PolarHBondContact O-N 3.25Å; R62-C65 PolarHBondContact O-N 2.56Å; R62-L66 WeakPolarHBondContact O-CB 3.47Å; R62-L66 PolarHBondContact O-N 2.79Å
63	D	84.6	Confident	78.4	Confident	98 Å²	98	64.1 Å²	64.1	52%	0.524	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-39.5	176.1	-83	-11.1	0	0	0	112.4	D59 D60 I61 L66 Q67	D59-D63 PolarHBondContact O-N 2.9Å; D60-D63 PolarHBondContact O-N 3.29Å; I61-D63 VanDerWaalsContact C-N 3.35Å; D63-L66 PolarHBondContact O-N 3.47Å; D63-Q67 WeakPolarHBondContact O-CG 3.47Å; D63-Q67 PolarHBondContact O-N 2.95Å
64	I	84.8	Confident	78.4	Confident	11 Å²	11	65.9 Å²	65.9	6%	0.056	34%	0.341	C	S	.	.	H	α-helix	trans	-65.1	-43	174.7	-66	164	0	0	0	110.7	I7 E11 F12 K56 D60 I61 R62 L66 Q67 M68	I7-I64 HydrophobicContact CG2-CG2 4.29Å; E11-I64 HydrophobicContact CB-CD1 4.22Å; E11-I64 HydrophobicContact CG-CD1 4.21Å; E11-I64 HydrophobicContact CG-CG1 4.37Å; E11-I64 HydrophobicContact CG-CG2 4.5Å; F12-I64 HydrophobicContact CE2-CD1 4.1Å; F12-I64 HydrophobicContact CE2-CG2 4.18Å; F12-I64 HydrophobicContact CZ-CD1 4.08Å; K56-I64 HydrophobicContact CD-CD1 3.97Å; D60-I64 WeakPolarHBondContact O-CD1 3.5Å; D60-I64 VanDerWaalsContact O-CG1 3.24Å; D60-I64 WeakPolarHBondContact O-CG1 3.16Å; D60-I64 PolarHBondContact O-N 2.93Å; I61-I64 PolarHBondContact O-N 2.88Å; R62-I64 VanDerWaalsContact C-N 3.35Å; R62-I64 PolarHBondContact O-N 3.25Å; I64-L66 VanDerWaalsContact C-N 3.32Å; I64-L66 PolarHBondContact O-N 3.08Å; I64-Q67 PolarHBondContact O-N 2.84Å; I64-M68 HydrophobicContact CG2-CE 3.79Å; I64-M68 HydrophobicContact CG2-SD 4.37Å; I64-M68 WeakPolarHBondContact O-CG 3.48Å; I64-M68 PolarHBondContact O-N 3.33Å
65	C	85.9	Confident	78	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.8	-40.4	176.1	-67.5	0	0	0	0	111.7	V40 F41 I61 R62 M68 F69	V40-C65 HydrophobicContact CB-CB 4.41Å; V40-C65 HydrophobicContact CG1-CB 4.09Å; F41-C65 HydrophobicContact CB-CB 4.13Å; I61-C65 PolarHBondContact O-N 3.26Å; I61-C65 PolarHBondContact O-SG 2.88Å; R62-C65 PolarHBondContact O-N 2.56Å; C65-M68 PolarHBondContact O-N 3.18Å; C65-F69 WeakPolarHBondContact O-CB 3.49Å; C65-F69 PolarHBondContact O-N 3.31Å
66	L	85	Confident	77.3	Confident	82 Å²	82	63.1 Å²	63.1	43%	0.429	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-37.8	176.2	-167.4	146.5	0	0	0	112	R62 D63 I64 F69 N70	R62-L66 WeakPolarHBondContact O-CB 3.47Å; R62-L66 PolarHBondContact O-N 2.79Å; D63-L66 PolarHBondContact O-N 3.47Å; I64-L66 VanDerWaalsContact C-N 3.32Å; I64-L66 PolarHBondContact O-N 3.08Å; L66-F69 PolarHBondContact O-N 2.97Å; L66-N70 WeakPolarHBondContact CD2-ND2 3.31Å; L66-N70 VanDerWaalsContact O-CG 3.31Å; L66-N70 PolarHBondContact O-N 2.89Å; L66-N70 PolarHBondContact O-ND2 3.06Å
67	Q	81.4	Confident	75.6	Confident	90 Å²	90	69.6 Å²	69.6	42%	0.421	35%	0.349	S	S	.	.	H	α-helix	trans	-64.5	-42.6	172.3	-73.3	-179.9	18.2	0	0	112.1	I7 D63 I64 N70 T71	I7-Q67 HydrophobicContact CD1-CB 4.46Å; D63-Q67 WeakPolarHBondContact O-CG 3.47Å; D63-Q67 PolarHBondContact O-N 2.95Å; I64-Q67 PolarHBondContact O-N 2.84Å; Q67-N70 PolarHBondContact O-N 3.5Å; Q67-T71 PolarHBondContact O-N 3.41Å
68	M	81.8	Confident	73.4	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.7	-45.4	175.9	-71.3	-179.8	177.3	0	0	111.5	I7 L8 L27 I64 C65 N70 T71 L72	I7-M68 HydrophobicContact CB-CE 4.03Å; I7-M68 HydrophobicContact CB-CG 4.47Å; I7-M68 HydrophobicContact CG2-CE 3.72Å; I7-M68 HydrophobicContact CG2-CG 4.25Å; L8-M68 HydrophobicContact CB-CE 3.64Å; L8-M68 HydrophobicContact CD1-CE 3.66Å; L8-M68 HydrophobicContact CD1-SD 4.12Å; L8-M68 HydrophobicContact CG-CE 4.04Å; L27-M68 HydrophobicContact CD1-SD 4.32Å; I64-M68 HydrophobicContact CG2-CE 3.79Å; I64-M68 HydrophobicContact CG2-SD 4.37Å; I64-M68 WeakPolarHBondContact O-CG 3.48Å; I64-M68 PolarHBondContact O-N 3.33Å; C65-M68 PolarHBondContact O-N 3.18Å; M68-N70 PolarHBondContact O-N 3.18Å; M68-T71 PolarHBondContact O-N 3.42Å; M68-T71 VanDerWaalsContact O-N 3.16Å; M68-T71 PolarHBondContact O-OG1 3.21Å; M68-L72 WeakPolarHBondContact O-CG 3.35Å; M68-L72 PolarHBondContact O-N 2.98Å
69	F	83	Confident	71	Confident	22 Å²	22	79.5 Å²	79.5	10%	0.096	38%	0.381	C	S	.	.	H	α-helix	trans	-55.7	-47.3	175.6	176.2	-101.1	0	0	0	112.7	F34 E35 D36 V40 C65 L66 T71 L72 K73	F34-F69 HydrophobicContact CB-CD2 4.13Å; F34-F69 HydrophobicContact CB-CE2 3.94Å; F34-F69 WeakPolarHBondContact O-CE2 3.29Å; E35-F69 VanDerWaalsContact C-CZ 3.44Å; E35-F69 WeakPolarHBondContact O-CZ 3.34Å; D36-F69 WeakPolarHBondContact O-CD2 3.4Å; V40-F69 HydrophobicContact CG2-CB 4.12Å; V40-F69 HydrophobicContact CG2-CD2 3.9Å; V40-F69 HydrophobicContact CG2-CG 4.45Å; C65-F69 WeakPolarHBondContact O-CB 3.49Å; C65-F69 PolarHBondContact O-N 3.31Å; L66-F69 PolarHBondContact O-N 2.97Å; F69-T71 VanDerWaalsContact C-N 3.27Å; F69-T71 PolarHBondContact O-N 3.13Å; F69-L72 WeakPolarHBondContact O-CB 3.23Å; F69-L72 PolarHBondContact O-N 3.23Å; F69-K73 HydrophobicContact CD2-CG 4.49Å; F69-K73 HydrophobicContact CE1-CG 3.95Å; F69-K73 HydrophobicContact CE2-CD 4.36Å; F69-K73 VanDerWaalsContact CE2-CE 3.49Å; F69-K73 HydrophobicContact CE2-CG 3.87Å; F69-K73 HydrophobicContact CZ-CD 4.13Å; F69-K73 VanDerWaalsContact CZ-CE 3.42Å; F69-K73 HydrophobicContact CZ-CG 3.56Å; F69-K73 PolarHBondContact O-N 3.1Å
70	N	80.7	Confident	68.8	Low	79 Å²	79	80.5 Å²	80.5	42%	0.422	39%	0.394	S	S	.	.	H	α-helix	trans	-61	-36.8	178.9	-74.8	-31.3	0	0	0	112.3	L66 Q67 M68 L74	L66-N70 WeakPolarHBondContact CD2-ND2 3.31Å; L66-N70 VanDerWaalsContact O-CG 3.31Å; L66-N70 PolarHBondContact O-N 2.89Å; L66-N70 PolarHBondContact O-ND2 3.06Å; Q67-N70 PolarHBondContact O-N 3.5Å; M68-N70 PolarHBondContact O-N 3.18Å; N70-L74 WeakPolarHBondContact O-CD1 3.42Å; N70-L74 WeakPolarHBondContact O-CG 3.39Å; N70-L74 PolarHBondContact O-N 2.94Å
71	T	77.4	Confident	66.4	Low	28 Å²	28	86.4 Å²	86.4	17%	0.172	42%	0.419	C	S	.	.	H	α-helix	trans	-71.1	-31.1	175	63.2	0	0	0	0	113.4	I7 Q67 M68 F69	I7-T71 HydrophobicContact CD1-CG2 3.96Å; Q67-T71 PolarHBondContact O-N 3.41Å; M68-T71 PolarHBondContact O-N 3.42Å; M68-T71 VanDerWaalsContact O-N 3.16Å; M68-T71 PolarHBondContact O-OG1 3.21Å; F69-T71 VanDerWaalsContact C-N 3.27Å; F69-T71 PolarHBondContact O-N 3.13Å
72	L	74.3	Confident	63.8	Low	13 Å²	13	96.2 Å²	96.2	7%	0.068	46%	0.462	C	S	.	.	H	α-helix	trans	-69.5	-45.1	176.1	-74.5	161	0	0	0	111.7	Y4 L27 M68 F69 N75 N76	Y4-L72 HydrophobicContact CD1-CD2 3.52Å; Y4-L72 HydrophobicContact CD1-CG 4Å; Y4-L72 HydrophobicContact CE1-CD2 3.62Å; Y4-L72 HydrophobicContact CG-CD2 4.31Å; Y4-L72 HydrophobicContact CG-CG 4.48Å; L27-L72 HydrophobicContact CB-CD1 4.43Å; L27-L72 HydrophobicContact CD2-CD1 3.97Å; M68-L72 WeakPolarHBondContact O-CG 3.35Å; M68-L72 PolarHBondContact O-N 2.98Å; F69-L72 WeakPolarHBondContact O-CB 3.23Å; F69-L72 PolarHBondContact O-N 3.23Å; L72-N75 PolarHBondContact O-N 3.32Å; L72-N76 PolarHBondContact O-N 2.93Å
73	K	69.1	Low	61.2	Low	71 Å²	71	100.9 Å²	100.9	31%	0.309	49%	0.488	S	S	.	.	H	α-helix	trans	-69.1	-35.1	179.3	-73	-71.8	-178.1	-175.8	0	113.2	F34 F69 N75 N76	F34-K73 WeakPolarHBondContact O-CE 3.26Å; F34-K73 PolarHBondContact O-NZ 3.45Å; F69-K73 HydrophobicContact CD2-CG 4.49Å; F69-K73 HydrophobicContact CE1-CG 3.95Å; F69-K73 HydrophobicContact CE2-CD 4.36Å; F69-K73 VanDerWaalsContact CE2-CE 3.49Å; F69-K73 HydrophobicContact CE2-CG 3.87Å; F69-K73 HydrophobicContact CZ-CD 4.13Å; F69-K73 VanDerWaalsContact CZ-CE 3.42Å; F69-K73 HydrophobicContact CZ-CG 3.56Å; F69-K73 PolarHBondContact O-N 3.1Å; K73-N75 PolarHBondContact O-N 3.28Å; K73-N76 PolarHBondContact O-N 3.37Å; K73-N76 VanDerWaalsContact O-N 3.14Å
74	L	60.6	Low	58.7	Low	119 Å²	119	104.8 Å²	104.8	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-60.7	-30.5	174.7	-82.9	162.4	0	0	0	112.8	N70	N70-L74 WeakPolarHBondContact O-CD1 3.42Å; N70-L74 WeakPolarHBondContact O-CG 3.39Å; N70-L74 PolarHBondContact O-N 2.94Å
75	N	54.7	Low	56.4	Low	120 Å²	120	112.1 Å²	112.1	64%	0.642	54%	0.543	S	S	*	.	H	α-helix	trans	-82.3	-23.1	176.2	-79	-19.4	0	0	0	113.7	L72 K73	L72-N75 PolarHBondContact O-N 3.32Å; K73-N75 PolarHBondContact O-N 3.28Å
76	N	52.8	Low	53.7	Low	82 Å²	82	120.1 Å²	120.1	44%	0.439	59%	0.585	S	S	.	*	H	α-helix	trans	-91.6	1	-172.2	-86.7	-13.7	0	0	0	115.7	G31 L72 K73 R78	G31-N76 PolarHBondContact O-ND2 3.25Å; L72-N76 PolarHBondContact O-N 2.93Å; K73-N76 PolarHBondContact O-N 3.37Å; K73-N76 VanDerWaalsContact O-N 3.14Å; N76-R78 PolarHBondContact O-N 3.01Å
77	H	40.5	Very low	51.4	Low	175 Å²	175	123.6 Å²	123.6	81%	0.81	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	23.9	-178.4	-98	-34.4	0	0	0	116.7
78	R	33	Very low	49.4	Very low	224 Å²	224	123.5 Å²	123.5	85%	0.845	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-0.1	-176.3	-93.8	-172	177.6	-175.4	1.3	118.9	N76	N76-R78 PolarHBondContact O-N 3.01Å
79	H	29.3	Very low	47.2	Very low	182 Å²	182	129.8 Å²	129.8	84%	0.843	66%	0.659	S	S	*	*			trans	-148.7	126.6	171	-79.2	-64.5	0	0	0	113.7
80	P	33.1	Very low	45.1	Very low	127 Å²	127	134.5 Å²	134.5	83%	0.825	69%	0.69	S	S	*	*			trans	-94.6	126.6	171	33.5	-25.8	0	0	0	110.8
81	Q	32.1	Very low	42.9	Very low	197 Å²	197	138 Å²	138	92%	0.921	70%	0.703	S	S	*	*			trans	-112.5	133.8	162	-95.3	-172.7	-13.1	0	0	110.7
82	K	30.5	Very low	41.2	Very low	207 Å²	207	143.9 Å²	143.9	90%	0.9	73%	0.733	S	S	*	*			trans	-76	125.5	-178.4	-115.3	175.5	174.2	179.2	0	110.4
83	Q	30.9	Very low	39.6	Very low	192 Å²	192	147.5 Å²	147.5	90%	0.897	76%	0.76	S	S	*	*			trans	-88.8	136	162.9	-78.3	175.1	-15.8	0	0	110.1
84	M	32.1	Very low	38.3	Very low	180 Å²	180	151.5 Å²	151.5	89%	0.887	78%	0.779	S	S	*	*			trans	-112.1	128.7	162.2	-74.6	-165.9	81.6	0	0	108.8
85	L	36.1	Very low	37.1	Very low	164 Å²	164	152.8 Å²	152.8	86%	0.859	78%	0.784	S	S	*	*			trans	-76.7	147.8	166.9	-90.5	122.3	0	0	0	110.6
86	L	30.1	Very low	36.4	Very low	168 Å²	168	152 Å²	152	88%	0.88	79%	0.788	S	S	*	*			trans	-123.1	119.3	171.1	-91.3	150.1	0	0	0	109.5
87	D	36.7	Very low	35.8	Very low	156 Å²	156	151.7 Å²	151.7	83%	0.834	80%	0.797	S	S	*	*			trans	-88.6	130	168.6	-78.4	-36.6	0	0	0	110
88	A	38.1	Very low	35.4	Very low	87 Å²	87	150.3 Å²	150.3	72%	0.719	80%	0.796	S	S	*	*	S	Bend	trans	101.4	142.1	169.8	0	0	0	0	0	118.5
89	P	36.9	Very low	35.4	Very low	132 Å²	132	144.4 Å²	144.4	86%	0.857	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84	134.4	-172	32.9	-33	0	0	0	113.2
90	V	37.3	Very low	35.7	Very low	121 Å²	121	142.1 Å²	142.1	73%	0.733	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-87.1	127.8	-177.2	179	0	0	0	0	111.7
91	Q	35.8	Very low	35.6	Very low	152 Å²	152	141.2 Å²	141.2	71%	0.71	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-77.5	121.6	171.1	-81.5	-178.9	-24.2	0	0	111.5	S93	Q91-S93 PolarHBondContact O-N 2.71Å; Q91-S93 VanDerWaalsContact O-N 3.11Å
92	L	41.5	Very low	35.6	Very low	153 Å²	153	138.2 Å²	138.2	80%	0.801	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	1.4	-174.3	-91.6	144.5	0	0	0	116.4
93	S	40.2	Very low	35.6	Very low	89 Å²	89	133.4 Å²	133.4	62%	0.622	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-12.3	-177.6	53.2	0	0	0	0	114.4	Q91	Q91-S93 PolarHBondContact O-N 2.71Å; Q91-S93 VanDerWaalsContact O-N 3.11Å
94	Q	41.2	Very low	35.5	Very low	154 Å²	154	133.5 Å²	133.5	72%	0.72	78%	0.775	S	S	*	*	S	Bend	trans	-104.7	-0.7	-170.9	-73.1	-176.5	-17.5	0	0	115.6
95	M	36.3	Very low	35.3	Very low	147 Å²	147	132 Å²	132	72%	0.724	77%	0.771	S	S	*	*	S	Bend	trans	-96.1	-2.3	-178.7	-64.9	-172.4	85.6	0	0	115.1
96	S	40.4	Very low	35	Very low	103 Å²	103	131.8 Å²	131.8	72%	0.72	77%	0.769	S	S	*	*	S	Bend	trans	-88.6	-4.1	-179.8	53.3	0	0	0	0	114.6
97	A	39	Very low	35	Very low	76 Å²	76	132.9 Å²	132.9	63%	0.628	77%	0.769	S	S	*	*	S	Bend	trans	-98.2	-24	-175.6	0	0	0	0	0	114.9
98	D	33.2	Very low	34.6	Very low	146 Å²	146	128.7 Å²	128.7	78%	0.781	76%	0.763	S	S	*	*	S	Bend	trans	-108	15.7	-164.7	-78	-11.6	0	0	0	116
99	S	32.4	Very low	34.1	Very low	99 Å²	99	132 Å²	132	69%	0.692	77%	0.767	S	S	*	*	S	Bend	trans	-110	20	-179	42.1	0	0	0	0	115.2
100	V	35.2	Very low	33.7	Very low	135 Å²	135	136.1 Å²	136.1	82%	0.818	77%	0.766	S	S	*	*	S	Bend	trans	-106.2	-1.1	-176.8	-177.7	0	0	0	0	114.7
101	S	32.7	Very low	33.3	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	77%	0.77	S	S	*	*	S	Bend	trans	-115.5	28.4	-169.1	73.3	0	0	0	0	117.8
102	T	31.6	Very low	33.2	Very low	135 Å²	135	139.8 Å²	139.8	83%	0.828	78%	0.779	S	S	*	*	S	Bend	trans	-149.3	90.8	170	47	0	0	0	0	112.4
103	A	29.3	Very low	32.6	Very low	105 Å²	105	142.4 Å²	142.4	87%	0.868	78%	0.784	S	S	*	*			trans	171.8	83.4	144.3	0	0	0	0	0	110.2
104	K	29.6	Very low	32	Very low	195 Å²	195	149.8 Å²	149.8	85%	0.848	80%	0.798	S	S	*	*			trans	-109.4	110.7	150.3	-88.1	-178.8	174.9	178.1	0	105.9
105	D	28.4	Very low	31.6	Very low	148 Å²	148	148 Å²	148	79%	0.791	80%	0.8	S	S	*	*				167.7	140.9	121.8	-90.5	-21	0	0	0	114.3
106	I	30	Very low	31.4	Very low	159 Å²	159	150.1 Å²	150.1	82%	0.815	81%	0.808	S	S	*	*			trans	92.6	116.3	155.9	-60.8	152.6	0	0	0	119.7
107	Q	29.6	Very low	31.4	Very low	192 Å²	192	152.1 Å²	152.1	90%	0.897	81%	0.811	S	S	*	*			trans	-54.7	157.4	168.3	-61.5	151.9	-29.4	0	0	112.1
108	G	27.2	Very low	31.6	Very low	68 Å²	68	154.7 Å²	154.7	70%	0.701	82%	0.819	S	S	*	*			cis	168.3	-172.9	7.1	0	0	0	0	0	107.3
109	I	28.1	Very low	32.1	Very low	156 Å²	156	154 Å²	154	80%	0.8	82%	0.82	S	S	*	*			trans	102.3	97.7	159.8	-57.8	174.9	0	0	0	116.9
110	W	28.8	Very low	32.9	Very low	219 Å²	219	154.8 Å²	154.8	83%	0.83	82%	0.82	S	S	*	*			trans	76.3	129.7	161.1	-61.9	55.3	0	0	0	116.7
111	M	28	Very low	33.6	Very low	167 Å²	167	152.8 Å²	152.8	82%	0.823	81%	0.805	S	S	*	*			cis	-160.7	153.3	30.2	-134.3	179.6	-72.8	0	0	111.3
112	M	34.4	Very low	34.7	Very low	182 Å²	182	151.3 Å²	151.3	90%	0.897	80%	0.799	S	S	*	*			trans	-47.1	144.5	-177.8	-72.6	-87.6	-145.8	0	0	118.6
113	K	28.4	Very low	36.1	Very low	208 Å²	208	153.4 Å²	153.4	90%	0.904	80%	0.797	S	S	*	*			trans	-154.7	140	135.6	-102.8	175.6	-169.1	179.9	0	111.4
114	R	29.4	Very low	37.6	Very low	245 Å²	245	155.3 Å²	155.3	93%	0.925	79%	0.786	S	S	*	*			trans	-48.5	146.9	-173.3	-73.7	170.6	166.8	165	-4.6	115.3
115	P	32.2	Very low	38.7	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	77%	0.768	S	S	*	*			trans	-82.9	128	170.5	32.2	-29.9	0	0	0	111.8
116	Q	32.2	Very low	40.5	Very low	190 Å²	190	149.7 Å²	149.7	89%	0.888	76%	0.76	S	S	*	*			trans	-82.2	114.1	156	-86.9	-173.8	-25.4	0	0	108	T118	Q116-T118 PolarHBondContact O-N 2.94Å; Q116-T118 VanDerWaalsContact O-N 3.15Å
117	N	39.5	Very low	42.6	Very low	146 Å²	146	149.1 Å²	149.1	78%	0.781	75%	0.752	S	S	*	*			trans	-68.2	105.1	173	-79.3	-15.9	0	0	0	110.4
118	T	43.5	Very low	44.2	Very low	130 Å²	130	142.5 Å²	142.5	80%	0.798	73%	0.729	S	S	*	*			trans	-146.3	71.9	153.8	42.9	0	0	0	0	109.7	Q116	Q116-T118 PolarHBondContact O-N 2.94Å; Q116-T118 VanDerWaalsContact O-N 3.15Å
119	T	43.3	Very low	46.1	Very low	132 Å²	132	145 Å²	145	81%	0.81	72%	0.723	S	S	*	*			trans	-108.5	110.5	158.8	44.7	0	0	0	0	107.4	D121	T119-D121 PolarHBondContact O-N 2.96Å
120	V	48.8	Very low	48.2	Very low	115 Å²	115	140.5 Å²	140.5	70%	0.697	71%	0.709	S	S	*	*			trans	-68.4	118.2	170.8	-178.1	0	0	0	0	106.4	A122 L125	V120-A122 PolarHBondContact O-N 2.94Å; V120-L125 HydrophobicContact CG1-CD1 3.67Å
121	D	51.5	Low	50.5	Low	92 Å²	92	137.3 Å²	137.3	49%	0.492	70%	0.701	S	S	.	*			trans	-55.5	102	177.2	-84.1	-38.9	0	0	0	109.7	T119 K123 K124 L125	T119-D121 PolarHBondContact O-N 2.96Å; D121-K123 PolarHBondContact O-N 2.94Å; D121-K124 HydrophobicContact CB-CB 4.16Å; D121-K124 HydrophobicContact CB-CD 4.08Å; D121-K124 HydrophobicContact CB-CG 4.09Å; D121-K124 PolarHBondContact O-N 3.17Å; D121-K124 IonicContact OD2-NZ 2.8Å; D121-K124 PolarHBondContact OD2-NZ 3.33Å; D121-L125 PolarHBondContact O-N 3.3Å
122	A	54.6	Low	52.2	Low	76 Å²	76	134.6 Å²	134.6	63%	0.628	69%	0.689	S	S	*	*	H	α-helix	trans	-52	-35	-178.9	0	0	0	0	0	112.5	V120 K124 L125 E126	V120-A122 PolarHBondContact O-N 2.94Å; A122-K124 VanDerWaalsContact C-N 3.34Å; A122-K124 PolarHBondContact O-N 2.94Å; A122-L125 PolarHBondContact O-N 3.5Å; A122-E126 PolarHBondContact O-N 3.11Å; A122-E126 VanDerWaalsContact O-N 3.07Å
123	K	61.2	Low	54	Low	180 Å²	180	132.5 Å²	132.5	78%	0.783	68%	0.675	S	S	*	*	H	α-helix	trans	-66.2	-28.1	176.6	-73.6	-175.1	175.8	179.7	0	114.4	D121 K127	D121-K123 PolarHBondContact O-N 2.94Å; K123-K127 WeakPolarHBondContact O-CB 3.4Å; K123-K127 PolarHBondContact O-N 3.23Å
124	K	60.1	Low	56.1	Low	145 Å²	145	124.7 Å²	124.7	63%	0.63	65%	0.649	S	S	*	*	H	α-helix	trans	-79.9	-33.4	176.6	-75.6	-179.6	-174.9	140.9	0	111.4	D121 A122 A128	D121-K124 HydrophobicContact CB-CB 4.16Å; D121-K124 HydrophobicContact CB-CD 4.08Å; D121-K124 HydrophobicContact CB-CG 4.09Å; D121-K124 PolarHBondContact O-N 3.17Å; D121-K124 IonicContact OD2-NZ 2.8Å; D121-K124 PolarHBondContact OD2-NZ 3.33Å; A122-K124 VanDerWaalsContact C-N 3.34Å; A122-K124 PolarHBondContact O-N 2.94Å; K124-A128 PolarHBondContact O-N 2.96Å; K124-A128 VanDerWaalsContact O-N 3.14Å
125	L	54	Low	58.2	Low	90 Å²	90	119.2 Å²	119.2	47%	0.471	63%	0.632	S	S	.	*	H	α-helix	trans	-69	-46.8	178.2	-147	115	0	0	0	110.9	V120 D121 A122 K127 A128 E129	V120-L125 HydrophobicContact CG1-CD1 3.67Å; D121-L125 PolarHBondContact O-N 3.3Å; A122-L125 PolarHBondContact O-N 3.5Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 2.79Å; L125-A128 WeakPolarHBondContact O-CB 3.49Å; L125-A128 PolarHBondContact O-N 3.38Å; L125-E129 PolarHBondContact O-N 3.48Å
126	E	65.3	Low	59.5	Low	134 Å²	134	118.2 Å²	118.2	63%	0.626	62%	0.62	S	S	*	*	H	α-helix	trans	-60.5	-38.3	176.7	-167.4	179.5	-172.8	0	0	111.9	A122 A128 E129 A130	A122-E126 PolarHBondContact O-N 3.11Å; A122-E126 VanDerWaalsContact O-N 3.07Å; E126-A128 VanDerWaalsContact C-N 3.33Å; E126-A128 PolarHBondContact O-N 2.93Å; E126-E129 PolarHBondContact O-N 3.4Å; E126-A130 WeakPolarHBondContact O-CB 3.45Å; E126-A130 PolarHBondContact O-N 3.06Å
127	K	74.4	Confident	61.2	Low	148 Å²	148	113.9 Å²	113.9	64%	0.643	60%	0.6	S	S	*	*	H	α-helix	trans	-70.2	-27.6	176.1	-162.1	172.6	-173	174.2	0	113.1	K123 L125 K131	K123-K127 WeakPolarHBondContact O-CB 3.4Å; K123-K127 PolarHBondContact O-N 3.23Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 2.79Å; K127-K131 WeakPolarHBondContact O-CG 3.39Å; K127-K131 PolarHBondContact O-N 3.14Å
128	A	62.7	Low	62.6	Low	52 Å²	52	115.8 Å²	115.8	43%	0.43	60%	0.596	S	S	.	*	H	α-helix	trans	-77.4	-41.9	175	0	0	0	0	0	111.4	K124 L125 E126 K131 L132	K124-A128 PolarHBondContact O-N 2.96Å; K124-A128 VanDerWaalsContact O-N 3.14Å; L125-A128 WeakPolarHBondContact O-CB 3.49Å; L125-A128 PolarHBondContact O-N 3.38Å; E126-A128 VanDerWaalsContact C-N 3.33Å; E126-A128 PolarHBondContact O-N 2.93Å; A128-K131 PolarHBondContact O-N 3.43Å; A128-L132 PolarHBondContact O-N 3.29Å
129	E	67.3	Low	63.4	Low	122 Å²	122	117.3 Å²	117.3	57%	0.57	59%	0.587	S	S	*	*	H	α-helix	trans	-64	-43.4	174.9	-73.7	-177.4	160.3	0	0	111.9	L125 E126 K131 L132 K133	L125-E129 PolarHBondContact O-N 3.48Å; E126-E129 PolarHBondContact O-N 3.4Å; E129-K131 VanDerWaalsContact C-N 3.28Å; E129-K131 PolarHBondContact O-N 3.03Å; E129-L132 PolarHBondContact O-N 3.06Å; E129-K133 WeakPolarHBondContact O-CB 3.32Å; E129-K133 PolarHBondContact O-N 3.08Å
130	A	73.1	Confident	63.8	Low	61 Å²	61	115 Å²	115	50%	0.504	57%	0.573	S	S	.	*	H	α-helix	trans	-60.8	-36.3	175.6	0	0	0	0	0	112.6	E126 A134	E126-A130 WeakPolarHBondContact O-CB 3.45Å; E126-A130 PolarHBondContact O-N 3.06Å; A130-A134 WeakPolarHBondContact O-CB 3.33Å; A130-A134 PolarHBondContact O-N 2.81Å
131	K	75.8	Confident	63.8	Low	152 Å²	152	115.2 Å²	115.2	66%	0.661	57%	0.567	S	S	*	*	H	α-helix	trans	-70	-38.1	175.3	-84.1	-175.9	175	-174.8	0	112.9	K127 A128 E129 K135	K127-K131 WeakPolarHBondContact O-CG 3.39Å; K127-K131 PolarHBondContact O-N 3.14Å; A128-K131 PolarHBondContact O-N 3.43Å; E129-K131 VanDerWaalsContact C-N 3.28Å; E129-K131 PolarHBondContact O-N 3.03Å; K131-K135 WeakPolarHBondContact O-CB 3.34Å; K131-K135 PolarHBondContact O-N 3.05Å; K131-K135 VanDerWaalsContact O-N 3.09Å
132	L	63.6	Low	63.9	Low	110 Å²	110	120.2 Å²	120.2	58%	0.576	58%	0.579	S	S	*	*	H	α-helix	trans	-67.3	-41.9	176.2	-81.4	163.7	0	0	0	111.1	A128 E129 K135 N136	A128-L132 PolarHBondContact O-N 3.29Å; E129-L132 PolarHBondContact O-N 3.06Å; L132-K135 PolarHBondContact O-N 3Å; L132-N136 PolarHBondContact O-N 2.8Å
133	K	72.9	Confident	63.6	Low	137 Å²	137	122.4 Å²	122.4	60%	0.596	58%	0.58	S	S	*	*	H	α-helix	trans	-63.5	-47.3	177.2	-157	175.3	-178.5	-179	0	111.8	E129 K135 N136 E137	E129-K133 WeakPolarHBondContact O-CB 3.32Å; E129-K133 PolarHBondContact O-N 3.08Å; K133-K135 VanDerWaalsContact C-N 3.26Å; K133-K135 PolarHBondContact O-N 2.88Å; K133-N136 PolarHBondContact O-N 2.9Å; K133-N136 VanDerWaalsContact O-N 3.12Å; K133-E137 PolarHBondContact O-N 2.97Å
134	A	73.4	Confident	62.8	Low	44 Å²	44	118.9 Å²	118.9	36%	0.364	57%	0.573	S	S	.	*	H	α-helix	trans	-62.5	-30	175.1	0	0	0	0	0	113.4	A130 R138	A130-A134 WeakPolarHBondContact O-CB 3.33Å; A130-A134 PolarHBondContact O-N 2.81Å; A134-R138 WeakPolarHBondContact O-CB 3.49Å; A134-R138 WeakPolarHBondContact O-CG 3.43Å; A134-R138 PolarHBondContact O-N 3.33Å; A134-R138 VanDerWaalsContact O-N 3.1Å
135	K	72.9	Confident	62.1	Low	130 Å²	130	119.7 Å²	119.7	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-74.4	-35.1	175.4	-168.7	179.9	179.4	-175.6	0	112.1	K131 L132 K133 R139	K131-K135 WeakPolarHBondContact O-CB 3.34Å; K131-K135 PolarHBondContact O-N 3.05Å; K131-K135 VanDerWaalsContact O-N 3.09Å; L132-K135 PolarHBondContact O-N 3Å; K133-K135 VanDerWaalsContact C-N 3.26Å; K133-K135 PolarHBondContact O-N 2.88Å; K135-R139 PolarHBondContact O-N 3.1Å
136	N	60	Low	61.8	Low	96 Å²	96	123.8 Å²	123.8	51%	0.513	59%	0.593	S	S	.	*	H	α-helix	trans	-74.6	-38.1	175.8	-78	-5.6	0	0	0	112	L132 K133 R139 T140	L132-N136 PolarHBondContact O-N 2.8Å; K133-N136 PolarHBondContact O-N 2.9Å; K133-N136 VanDerWaalsContact O-N 3.12Å; N136-R139 PolarHBondContact O-N 3.49Å; N136-T140 PolarHBondContact O-N 3.47Å; N136-T140 PolarHBondContact O-OG1 2.87Å
137	E	67.5	Low	60.7	Low	99 Å²	99	120.9 Å²	120.9	46%	0.463	59%	0.592	S	S	.	*	H	α-helix	trans	-63.2	-43.4	172.6	-76	167.1	-176.9	0	0	111.1	K133 R139 T140 E141	K133-E137 PolarHBondContact O-N 2.97Å; E137-R139 VanDerWaalsContact C-N 3.27Å; E137-R139 PolarHBondContact O-N 3.48Å; E137-T140 VanDerWaalsContact CA-OG1 3.29Å; E137-T140 WeakPolarHBondContact CA-OG1 3.44Å; E137-T140 PolarHBondContact O-N 2.87Å; E137-T140 PolarHBondContact O-OG1 2.82Å; E137-E141 WeakPolarHBondContact O-CB 3.4Å; E137-E141 WeakPolarHBondContact O-CG 3.35Å; E137-E141 PolarHBondContact O-N 3.5Å
138	R	69.7	Low	59	Low	187 Å²	187	120.6 Å²	120.6	71%	0.706	60%	0.603	S	S	*	*	H	α-helix	trans	-65.6	-24.2	173.5	-78	-179.3	177.5	-173.1	-0.7	114.9	A134 R142	A134-R138 WeakPolarHBondContact O-CB 3.49Å; A134-R138 WeakPolarHBondContact O-CG 3.43Å; A134-R138 PolarHBondContact O-N 3.33Å; A134-R138 VanDerWaalsContact O-N 3.1Å; R138-R142 PolarHBondContact O-N 3.31Å
139	R	59.6	Low	57.9	Low	161 Å²	161	120.9 Å²	120.9	61%	0.608	61%	0.611	S	S	*	*	H	α-helix	trans	-75.9	-46.4	172.7	-86.9	-177.7	168.5	-175.6	-6.6	110.6	K135 N136 E137 E141 R142 D143	K135-R139 PolarHBondContact O-N 3.1Å; N136-R139 PolarHBondContact O-N 3.49Å; E137-R139 VanDerWaalsContact C-N 3.27Å; E137-R139 PolarHBondContact O-N 3.48Å; R139-E141 PolarHBondContact O-N 3.03Å; R139-R142 WeakPolarHBondContact O-CB 3.44Å; R139-R142 PolarHBondContact O-N 3.13Å; R139-R142 VanDerWaalsContact O-N 3.14Å; R139-D143 PolarHBondContact O-N 2.9Å; R139-D143 VanDerWaalsContact O-N 3.09Å
140	T	50.5	Low	56.5	Low	83 Å²	83	120.8 Å²	120.8	51%	0.509	62%	0.621	S	S	.	*	H	α-helix	trans	-66.6	-33.2	178.6	46.8	0	0	0	0	113.1	N136 E137 D143 T144	N136-T140 PolarHBondContact O-N 3.47Å; N136-T140 PolarHBondContact O-OG1 2.87Å; E137-T140 VanDerWaalsContact CA-OG1 3.29Å; E137-T140 WeakPolarHBondContact CA-OG1 3.44Å; E137-T140 PolarHBondContact O-N 2.87Å; E137-T140 PolarHBondContact O-OG1 2.82Å; T140-D143 PolarHBondContact O-N 3.44Å; T140-T144 WeakPolarHBondContact O-CG2 3.26Å; T140-T144 PolarHBondContact O-N 3.39Å; T140-T144 VanDerWaalsContact O-N 3.09Å; T140-T144 PolarHBondContact O-OG1 2.96Å
141	E	49.5	Very low	55	Low	120 Å²	120	126.4 Å²	126.4	56%	0.561	64%	0.642	S	S	*	*	H	α-helix	trans	-67.8	-31.7	171	-77.5	179.7	164.3	0	0	113.3	E137 R139 T144 Q145	E137-E141 WeakPolarHBondContact O-CB 3.4Å; E137-E141 WeakPolarHBondContact O-CG 3.35Å; E137-E141 PolarHBondContact O-N 3.5Å; R139-E141 PolarHBondContact O-N 3.03Å; E141-T144 WeakPolarHBondContact CA-OG1 3.45Å; E141-T144 PolarHBondContact O-OG1 3.16Å; E141-Q145 WeakPolarHBondContact O-CG 3.33Å; E141-Q145 PolarHBondContact O-N 3.24Å
142	R	53.7	Low	53.2	Low	197 Å²	197	124.5 Å²	124.5	74%	0.743	64%	0.643	S	S	*	*	H	α-helix	trans	-73.6	-32.4	174.1	-89.8	-177.2	169.6	-170.9	-3.7	112.7	R138 R139	R138-R142 PolarHBondContact O-N 3.31Å; R139-R142 WeakPolarHBondContact O-CB 3.44Å; R139-R142 PolarHBondContact O-N 3.13Å; R139-R142 VanDerWaalsContact O-N 3.14Å
143	D	49.4	Very low	52.1	Low	123 Å²	123	127.4 Å²	127.4	66%	0.658	66%	0.658	S	S	*	*	H	α-helix	trans	-76.5	-29.5	178.1	-69	-24.2	0	0	0	111.9	R139 T140	R139-D143 PolarHBondContact O-N 2.9Å; R139-D143 VanDerWaalsContact O-N 3.09Å; T140-D143 PolarHBondContact O-N 3.44Å
144	T	43.7	Very low	51.1	Low	105 Å²	105	125.4 Å²	125.4	64%	0.644	65%	0.651	S	S	*	*	H	α-helix	trans	-79.7	-24	178.8	42.1	0	0	0	0	114.4	T140 E141 K146	T140-T144 WeakPolarHBondContact O-CG2 3.26Å; T140-T144 PolarHBondContact O-N 3.39Å; T140-T144 VanDerWaalsContact O-N 3.09Å; T140-T144 PolarHBondContact O-OG1 2.96Å; E141-T144 WeakPolarHBondContact CA-OG1 3.45Å; E141-T144 PolarHBondContact O-OG1 3.16Å; T144-K146 VanDerWaalsContact C-N 3.33Å; T144-K146 PolarHBondContact O-N 3.29Å
145	Q	45.2	Very low	50.4	Low	163 Å²	163	131.7 Å²	131.7	76%	0.762	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-3.5	-179.5	-75	-179.2	0.4	0	0	115.1	E141	E141-Q145 WeakPolarHBondContact O-CG 3.33Å; E141-Q145 PolarHBondContact O-N 3.24Å
146	K	47.5	Very low	50.2	Low	175 Å²	175	126.4 Å²	126.4	76%	0.761	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-5.3	180	-85	-175.4	173.6	-175.2	0	115.5	T144 T148	T144-K146 VanDerWaalsContact C-N 3.33Å; T144-K146 PolarHBondContact O-N 3.29Å; K146-T148 PolarHBondContact O-N 3.13Å
147	A	41.3	Very low	50.8	Low	73 Å²	73	124.8 Å²	124.8	60%	0.603	65%	0.649	S	S	*	*			trans	-89.2	23	-165.6	0	0	0	0	0	116.7
148	T	40.7	Very low	51.1	Low	142 Å²	142	121.8 Å²	121.8	87%	0.871	64%	0.641	S	S	*	*			trans	-141.1	72.9	175.9	48.7	0	0	0	0	112.5	K146	K146-T148 PolarHBondContact O-N 3.13Å
149	G	37.8	Very low	51.4	Low	58 Å²	58	115.9 Å²	115.9	60%	0.598	63%	0.629	S	S	*	*	S	Bend	trans	-125.7	150.3	162.2	0	0	0	0	0	109.9
150	P	38.9	Very low	52.1	Low	120 Å²	120	110.7 Å²	110.7	78%	0.779	61%	0.612	S	S	*	*			trans	-62.2	145.9	175.6	27.4	-32.1	0	0	0	110.1	V152	P150-V152 VanDerWaalsContact C-N 3.34Å; P150-V152 PolarHBondContact O-N 3.36Å
151	L	41	Very low	52.6	Low	180 Å²	180	110.3 Å²	110.3	94%	0.942	62%	0.617	S	S	*	*			trans	-57.9	90.9	177.7	-79.5	153.4	0	0	0	110.6
152	V	37.9	Very low	52.8	Low	112 Å²	112	107.9 Å²	107.9	68%	0.679	61%	0.613	S	S	*	*			trans	-82.7	135.2	162.4	-179.6	0	0	0	0	106.4	P150 E154	P150-V152 VanDerWaalsContact C-N 3.34Å; P150-V152 PolarHBondContact O-N 3.36Å; V152-E154 PolarHBondContact O-N 3.24Å
153	L	41.9	Very low	53	Low	171 Å²	171	103 Å²	103	90%	0.895	60%	0.601	S	S	*	*			trans	-47.2	108.8	170.7	-82.2	146.5	0	0	0	109	E155	L153-E155 PolarHBondContact O-N 3.02Å
154	E	50.3	Low	53.2	Low	94 Å²	94	105.1 Å²	105.1	44%	0.439	61%	0.605	S	S	.	*			trans	-68.3	115	-174.2	-67.2	-176.1	138.3	0	0	109.5	V152 F189 G190	V152-E154 PolarHBondContact O-N 3.24Å; E154-F189 HydrophobicContact CB-CD1 4.41Å; E154-F189 HydrophobicContact CB-CE1 3.98Å; E154-F189 HydrophobicContact CB-CZ 4.22Å; E154-F189 WeakPolarHBondContact O-CE2 3.36Å; E154-F189 WeakPolarHBondContact O-CZ 3.49Å; E154-G190 WeakPolarHBondContact OE1-CA 3.3Å; E154-G190 VanDerWaalsContact OE2-CA 3.32Å; E154-G190 WeakPolarHBondContact OE2-CA 3.33Å
155	E	60	Low	53.9	Low	177 Å²	177	108.8 Å²	108.8	83%	0.827	61%	0.612	S	S	*	*			trans	-79.7	140.5	169.8	-67.8	-177.2	167.4	0	0	109.7	L153	L153-E155 PolarHBondContact O-N 3.02Å
156	A	68.7	Low	54.5	Low	19 Å²	19	105.4 Å²	105.4	16%	0.157	60%	0.596	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.5	136.3	173.8	0	0	0	0	0	110.9	S188 F189 T220 M224	A156-S188 WeakPolarHBondContact CA-O 3.38Å; A156-F189 HydrophobicContact CB-CD2 3.87Å; A156-T220 HydrophobicContact CB-CG2 3.31Å; A156-M224 HydrophobicContact CB-CE 3.6Å; A156-M224 HydrophobicContact CB-SD 4.43Å; A156-M224 WeakPolarHBondContact O-CE 3.43Å
157	S	72	Confident	54.7	Low	62 Å²	62	99.2 Å²	99.2	43%	0.434	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	140	174.5	52.5	0	0	0	0	110.3	S188	S157-S188 PolarHBondContact N-O 3.17Å; S157-S188 PolarHBondContact O-N 2.95Å; S157-S188 PolarHBondContact OG-OG 2.91Å
158	A	74.8	Confident	55.4	Low	35 Å²	35	105 Å²	105	29%	0.289	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.3	134.1	173.8	0	0	0	0	0	109.3	D186 I187 M224 L230	A158-D186 WeakPolarHBondContact CA-O 3.44Å; A158-I187 HydrophobicContact CB-CG1 4.26Å; A158-M224 HydrophobicContact CB-SD 4.18Å; A158-L230 HydrophobicContact CB-CD2 4.07Å
159	S	75.3	Confident	56	Low	64 Å²	64	100.2 Å²	100.2	45%	0.448	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.3	128	169.7	55.9	0	0	0	0	110	F185 D186	S159-F185 WeakPolarHBondContact O-CA 3.13Å; S159-D186 PolarHBondContact N-O 2.99Å; S159-D186 PolarHBondContact O-N 3.41Å
160	Q	73.8	Confident	56.8	Low	52 Å²	52	102 Å²	102	24%	0.243	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-128	128.1	-180	-170.1	-179.4	8.8	0	0	110	S162 F185 R231	Q160-S162 PolarHBondContact O-N 3.17Å; Q160-F185 HydrophobicContact CB-CB 4.28Å; Q160-F185 HydrophobicContact CG-CB 4.13Å; Q160-R231 VanDerWaalsContact OE1-CG 3.3Å
161	A	60.8	Low	57.5	Low	75 Å²	75	104.3 Å²	104.3	62%	0.62	55%	0.552	S	S	*	*			trans	-71.6	119.1	175.1	0	0	0	0	0	110.1	N163	A161-N163 PolarHBondContact O-N 3.47Å
162	S	53.8	Low	58.1	Low	69 Å²	69	99.1 Å²	99.1	48%	0.483	53%	0.531	S	S	.	.			trans	-77.9	119.1	-176.1	65.4	0	0	0	0	112.3	Q160 K164	Q160-S162 PolarHBondContact O-N 3.17Å; S162-K164 PolarHBondContact O-N 3.41Å
163	N	58.4	Low	58.9	Low	93 Å²	93	95.9 Å²	95.9	50%	0.497	52%	0.52	S	S	.	.			trans	-84.5	106.3	168.3	-139.6	-9.8	0	0	0	109.6	A161 K165 E166	A161-N163 PolarHBondContact O-N 3.47Å; N163-K165 PolarHBondContact O-N 3.27Å; N163-E166 PolarHBondContact O-N 2.9Å
164	K	54.4	Low	59.4	Low	169 Å²	169	96.3 Å²	96.3	74%	0.735	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.1	-173.1	-75	-178.2	178	176.1	0	115	S162 S167	S162-K164 PolarHBondContact O-N 3.41Å; K164-S167 PolarHBondContact O-OG 3.49Å
165	K	57.3	Low	59.4	Low	181 Å²	181	97.6 Å²	97.6	79%	0.787	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-35.9	-176.1	-153.6	175.1	-179.8	-176.5	0	112.1	N163	N163-K165 PolarHBondContact O-N 3.27Å
166	E	56.9	Low	59.7	Low	92 Å²	92	98.3 Å²	98.3	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-76.1	-38.8	176.4	-75.6	177.5	146.5	0	0	112.1	N163 R168 A169 D170	N163-E166 PolarHBondContact O-N 2.9Å; E166-R168 PolarHBondContact O-N 3.35Å; E166-R168 VanDerWaalsContact O-N 3.1Å; E166-A169 WeakPolarHBondContact O-CB 3.43Å; E166-A169 PolarHBondContact O-N 3.47Å; E166-D170 PolarHBondContact O-N 2.83Å
167	S	53.2	Low	60.1	Low	45 Å²	45	100.3 Å²	100.3	32%	0.315	53%	0.533	S	S	.	.	H	α-helix	trans	-59.8	-27.2	177.7	64.4	0	0	0	0	113.7	K164 Q171	K164-S167 PolarHBondContact O-OG 3.49Å; S167-Q171 WeakPolarHBondContact O-CG 3.35Å
168	R	54.6	Low	60.6	Low	196 Å²	196	102.7 Å²	102.7	74%	0.74	53%	0.533	S	S	*	.	H	α-helix	trans	-82.1	-25.9	174.7	-77	-178.3	174.4	174.3	-1.8	112.9	E166 S172	E166-R168 PolarHBondContact O-N 3.35Å; E166-R168 VanDerWaalsContact O-N 3.1Å; R168-S172 WeakPolarHBondContact O-CB 3.39Å; R168-S172 PolarHBondContact O-N 3.09Å
169	A	53.8	Low	61.3	Low	40 Å²	40	103.5 Å²	103.5	33%	0.331	53%	0.532	S	S	.	.	H	α-helix	trans	-76.2	-41.4	178.1	0	0	0	0	0	111.2	E166 Q171 S172 G173	E166-A169 WeakPolarHBondContact O-CB 3.43Å; E166-A169 PolarHBondContact O-N 3.47Å; A169-Q171 PolarHBondContact O-N 3Å; A169-S172 WeakPolarHBondContact O-CB 3.42Å; A169-S172 PolarHBondContact O-N 3.26Å; A169-S172 VanDerWaalsContact O-N 3.15Å; A169-G173 PolarHBondContact O-N 3.32Å
170	D	54.6	Low	61.9	Low	95 Å²	95	100.6 Å²	100.6	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-39.9	174.2	-77.6	-16	0	0	0	112.1	E166 S172 G173	E166-D170 PolarHBondContact O-N 2.83Å; D170-S172 PolarHBondContact O-N 3.39Å; D170-G173 PolarHBondContact O-N 3.32Å
171	Q	53.6	Low	62.6	Low	169 Å²	169	105.3 Å²	105.3	79%	0.79	53%	0.527	S	S	*	.	H	α-helix	trans	-67.8	-22.4	175.2	-76.4	178.3	-4.2	0	0	113.8	S167 A169	S167-Q171 WeakPolarHBondContact O-CG 3.35Å; A169-Q171 PolarHBondContact O-N 3Å
172	S	53.6	Low	63.9	Low	71 Å²	71	101.8 Å²	101.8	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-85.6	-13.4	-178.7	-172.1	0	0	0	0	112.5	R168 A169 D170 K174	R168-S172 WeakPolarHBondContact O-CB 3.39Å; R168-S172 PolarHBondContact O-N 3.09Å; A169-S172 WeakPolarHBondContact O-CB 3.42Å; A169-S172 PolarHBondContact O-N 3.26Å; A169-S172 VanDerWaalsContact O-N 3.15Å; D170-S172 PolarHBondContact O-N 3.39Å; S172-K174 PolarHBondContact O-N 3.45Å
173	G	54.8	Low	65.6	Low	45 Å²	45	102.5 Å²	102.5	46%	0.464	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	5.4	176.1	0	0	0	0	0	115.6	A169 D170	A169-G173 PolarHBondContact O-N 3.32Å; D170-G173 PolarHBondContact O-N 3.32Å
174	K	52	Low	67	Low	180 Å²	180	101.9 Å²	101.9	78%	0.783	49%	0.49	S	S	*	.			trans	-83.5	-16.3	-174.3	-78.7	-175.5	176.8	-178.4	0	114.8	S172	S172-K174 PolarHBondContact O-N 3.45Å
175	N	52	Low	68.6	Low	120 Å²	120	93.8 Å²	93.8	64%	0.642	46%	0.455	S	S	*	.			trans	-123.1	86.7	175.2	-82.8	-9.4	0	0	0	109.7	S177	N175-S177 PolarHBondContact O-N 3.14Å; N175-S177 VanDerWaalsContact O-N 3.1Å
176	R	64.6	Low	70.1	Confident	193 Å²	193	87.9 Å²	87.9	73%	0.728	43%	0.432	S	S	*	.			trans	-83.5	60.9	171.4	-64.7	-178.7	-179.5	178.2	-2.7	110.2
177	S	77.7	Confident	71.6	Confident	61 Å²	61	83.5 Å²	83.5	43%	0.427	41%	0.412	S	S	.	.			trans	-70.8	137.1	169.1	57.2	0	0	0	0	109.1	N175 D179 H235	N175-S177 PolarHBondContact O-N 3.14Å; N175-S177 VanDerWaalsContact O-N 3.1Å; S177-D179 VanDerWaalsContact C-N 3.25Å; S177-H235 PolarHBondContact O-CE1 3.43Å; S177-H235 PolarHBondContact O-NE2 3.36Å
178	Y	83.4	Confident	73.1	Confident	112 Å²	112	83 Å²	83	44%	0.439	41%	0.408	S	S	.	.			trans	-87.9	1.8	169.4	-71.8	-87.7	0	0	0	112.2	H235 I236	Y178-H235 AromaticContact CE1-CD2 3.94Å; Y178-I236 HydrophobicContact CD1-CG1 4.31Å
179	D	88	Confident	74.3	Confident	52 Å²	52	77.8 Å²	77.8	28%	0.278	39%	0.391	S	S	.	.			trans	-73.4	139.4	172	-65.3	-9.3	0	0	0	110.4	S177 R181 M202 A203 S204	S177-D179 VanDerWaalsContact C-N 3.25Å; D179-R181 IonicContact OD2-NH2 3.23Å; D179-M202 CarbonylContact C-O 3.35Å; D179-M202 WeakPolarHBondContact CA-O 3.16Å; D179-A203 WeakPolarHBondContact OD1-CA 3.46Å; D179-S204 PolarHBondContact OD1-N 3.02Å
180	I	88.5	Confident	75.4	Confident	3 Å²	3	77.4 Å²	77.4	2%	0.015	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	118.5	179	-61.1	171.4	0	0	0	107.9	I182 S201 M202 V232 I236 L350	I180-I182 HydrophobicContact CG2-CD1 3.97Å; I180-I182 HydrophobicContact CG2-CG1 4.07Å; I180-S201 CarbonylContact O-C 3.58Å; I180-S201 WeakPolarHBondContact O-CA 3.33Å; I180-M202 HydrophobicContact CB-CB 4.32Å; I180-M202 HydrophobicContact CB-CE 3.97Å; I180-M202 HydrophobicContact CD1-CE 3.77Å; I180-M202 HydrophobicContact CG1-CE 4.47Å; I180-M202 HydrophobicContact CG2-CE 3.85Å; I180-M202 PolarHBondContact N-O 2.92Å; I180-M202 PolarHBondContact O-N 3.29Å; I180-V232 HydrophobicContact CD1-CG1 3.95Å; I180-V232 HydrophobicContact CG1-CG1 4.12Å; I180-V232 HydrophobicContact CG2-CG1 4.39Å; I180-V232 HydrophobicContact CG2-CG2 4.41Å; I180-I236 HydrophobicContact CD1-CD1 4.1Å; I180-I236 HydrophobicContact CD1-CG2 4.34Å; I180-I236 HydrophobicContact CG1-CD1 3.61Å; I180-L350 HydrophobicContact CD1-CB 4.41Å; I180-L350 HydrophobicContact CD1-CD1 4.38Å; I180-L350 HydrophobicContact CD1-CD2 3.65Å; I180-L350 HydrophobicContact CD1-CG 4.37Å
181	R	89.2	Confident	76.1	Confident	151 Å²	151	80.9 Å²	80.9	57%	0.57	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.4	176.7	-62.1	-176	-170.9	176.3	4.3	109.4	D179 L200	D179-R181 IonicContact OD2-NH2 3.23Å; R181-L200 WeakPolarHBondContact CA-O 3.38Å
182	I	88.2	Confident	77.2	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.005	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	103.7	-178.7	-55.2	168.5	0	0	0	106.2	I180 F185 E199 L200 L225 L230 V232	I180-I182 HydrophobicContact CG2-CD1 3.97Å; I180-I182 HydrophobicContact CG2-CG1 4.07Å; I182-F185 HydrophobicContact CB-CD1 4.23Å; I182-F185 HydrophobicContact CB-CE1 4.38Å; I182-F185 HydrophobicContact CG2-CB 4.22Å; I182-F185 HydrophobicContact CG2-CD1 3.41Å; I182-F185 VanDerWaalsContact CG2-CD1 3.41Å; I182-F185 HydrophobicContact CG2-CE1 3.96Å; I182-F185 HydrophobicContact CG2-CG 3.97Å; I182-E199 WeakPolarHBondContact O-CA 3.49Å; I182-L200 HydrophobicContact CB-CB 4.38Å; I182-L200 HydrophobicContact CD1-CD2 4.31Å; I182-L200 PolarHBondContact N-O 3.06Å; I182-L200 PolarHBondContact O-N 3.47Å; I182-L225 HydrophobicContact CD1-CD2 3.52Å; I182-L230 HydrophobicContact CD1-CB 4.1Å; I182-L230 HydrophobicContact CD1-CD1 4.49Å; I182-L230 HydrophobicContact CG2-CD2 4.36Å; I182-V232 HydrophobicContact CD1-CG2 4.28Å
183	E	88.3	Confident	78.6	Confident	83 Å²	83	78.7 Å²	78.7	39%	0.388	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	147.7	-179.3	-61.9	179.9	175.2	0	0	111.1	F185	E183-F185 PolarHBondContact O-N 2.66Å
184	N	87.4	Confident	80.1	Confident	80 Å²	80	77.1 Å²	77.1	43%	0.428	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45.1	59.3	169.2	-68.6	-59.8	0	0	0	113.9	A198	N184-A198 WeakPolarHBondContact CA-O 3.49Å; N184-A198 PolarHBondContact N-O 3.04Å; N184-A198 VanDerWaalsContact N-O 3.08Å
185	F	89.3	Confident	81.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145	173.4	72.7	-86.5	0	0	0	111.5	S159 Q160 I182 E183 I187 L195 A198 L200 L221 L230 L404	S159-F185 WeakPolarHBondContact O-CA 3.13Å; Q160-F185 HydrophobicContact CB-CB 4.28Å; Q160-F185 HydrophobicContact CG-CB 4.13Å; I182-F185 HydrophobicContact CB-CD1 4.23Å; I182-F185 HydrophobicContact CB-CE1 4.38Å; I182-F185 HydrophobicContact CG2-CB 4.22Å; I182-F185 HydrophobicContact CG2-CD1 3.41Å; I182-F185 VanDerWaalsContact CG2-CD1 3.41Å; I182-F185 HydrophobicContact CG2-CE1 3.96Å; I182-F185 HydrophobicContact CG2-CG 3.97Å; E183-F185 PolarHBondContact O-N 2.66Å; F185-I187 HydrophobicContact CD2-CD1 4.04Å; F185-I187 HydrophobicContact CD2-CG1 3.89Å; F185-I187 HydrophobicContact CE2-CD1 3.73Å; F185-I187 HydrophobicContact CE2-CG1 4.03Å; F185-L195 HydrophobicContact CE2-CD1 3.9Å; F185-L195 HydrophobicContact CZ-CD1 4.36Å; F185-A198 HydrophobicContact CD1-CB 4.2Å; F185-A198 WeakPolarHBondContact CD1-O 3.46Å; F185-A198 HydrophobicContact CD2-CB 4.41Å; F185-A198 HydrophobicContact CE1-CB 3.78Å; F185-A198 WeakPolarHBondContact CE1-O 3.27Å; F185-A198 HydrophobicContact CE2-CB 4Å; F185-A198 HydrophobicContact CZ-CB 3.68Å; F185-A198 PolarHBondContact N-O 3.42Å; F185-A198 PolarHBondContact O-N 3.47Å; F185-L200 HydrophobicContact CE1-CB 3.85Å; F185-L200 HydrophobicContact CZ-CB 4.3Å; F185-L221 HydrophobicContact CE2-CD1 3.81Å; F185-L221 HydrophobicContact CZ-CD1 3.98Å; F185-L230 HydrophobicContact CB-CD2 3.92Å; F185-L230 HydrophobicContact CD2-CD1 4.3Å; F185-L230 HydrophobicContact CD2-CD2 3.67Å; F185-L230 HydrophobicContact CE2-CD1 4.15Å; F185-L230 HydrophobicContact CE2-CD2 4.34Å; F185-L230 HydrophobicContact CG-CD2 3.87Å; F185-L404 HydrophobicContact CE1-CD1 4.42Å; F185-L404 HydrophobicContact CZ-CD1 3.75Å
186	D	88.6	Confident	83.6	Confident	56 Å²	56	68.7 Å²	68.7	30%	0.299	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.8	173	-53.4	-46.1	0	0	0	108.8	A158 S159 L195 Q196 G197	A158-D186 WeakPolarHBondContact CA-O 3.44Å; S159-D186 PolarHBondContact N-O 2.99Å; S159-D186 PolarHBondContact O-N 3.41Å; D186-L195 CarbonylContact C-O 3.5Å; D186-L195 VanDerWaalsContact CA-O 3.28Å; D186-L195 WeakPolarHBondContact CA-O 3.45Å; D186-Q196 VanDerWaalsContact OD1-CA 3.29Å; D186-Q196 WeakPolarHBondContact OD1-CA 3.32Å; D186-G197 PolarHBondContact OD1-N 3.3Å
187	I	88.3	Confident	84.6	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.3	172.4	-62.9	179.9	0	0	0	108.5	A158 F185 L194 L195 T220 L221 M224 L230	A158-I187 HydrophobicContact CB-CG1 4.26Å; F185-I187 HydrophobicContact CD2-CD1 4.04Å; F185-I187 HydrophobicContact CD2-CG1 3.89Å; F185-I187 HydrophobicContact CE2-CD1 3.73Å; F185-I187 HydrophobicContact CE2-CG1 4.03Å; I187-L194 HydrophobicContact CG2-CB 4.44Å; I187-L194 HydrophobicContact CG2-CD1 4.25Å; I187-L194 WeakPolarHBondContact O-CA 3.49Å; I187-L194 WeakPolarHBondContact O-CB 3.15Å; I187-L194 PolarHBondContact O-N 3.32Å; I187-L195 HydrophobicContact CB-CB 4.2Å; I187-L195 HydrophobicContact CD1-CD1 4.17Å; I187-L195 PolarHBondContact N-O 2.81Å; I187-L195 PolarHBondContact O-N 3.22Å; I187-T220 HydrophobicContact CG2-CG2 4.09Å; I187-L221 HydrophobicContact CD1-CD1 3.62Å; I187-M224 HydrophobicContact CD1-CB 4.34Å; I187-M224 HydrophobicContact CD1-CG 4.28Å; I187-L230 HydrophobicContact CD1-CD1 4.26Å
188	S	85.7	Confident	85.1	Confident	34 Å²	34	58.5 Å²	58.5	24%	0.238	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.4	174.6	40.6	0	0	0	0	110.5	A156 S157 R192	A156-S188 WeakPolarHBondContact CA-O 3.38Å; S157-S188 PolarHBondContact N-O 3.17Å; S157-S188 PolarHBondContact O-N 2.95Å; S157-S188 PolarHBondContact OG-OG 2.91Å; S188-R192 WeakPolarHBondContact CA-O 3.32Å
189	F	79.9	Confident	85.4	Confident	87 Å²	87	58.4 Å²	58.4	38%	0.382	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	107.4	169.6	-174	-84.7	0	0	0	107.1	E154 A156 E191 R192 L194	E154-F189 HydrophobicContact CB-CD1 4.41Å; E154-F189 HydrophobicContact CB-CE1 3.98Å; E154-F189 HydrophobicContact CB-CZ 4.22Å; E154-F189 WeakPolarHBondContact O-CE2 3.36Å; E154-F189 WeakPolarHBondContact O-CZ 3.49Å; A156-F189 HydrophobicContact CB-CD2 3.87Å; F189-E191 PolarHBondContact O-N 3.31Å; F189-R192 PolarHBondContact N-O 3.25Å; F189-R192 PolarHBondContact O-N 3.27Å; F189-L194 HydrophobicContact CB-CD1 3.67Å; F189-L194 HydrophobicContact CB-CG 4.16Å
190	G	76.9	Confident	85.6	Confident	31 Å²	31	56.1 Å²	56.1	32%	0.32	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	-129.2	-171.8	0	0	0	0	0	113.2	E154 R192	E154-G190 WeakPolarHBondContact OE1-CA 3.3Å; E154-G190 VanDerWaalsContact OE2-CA 3.32Å; E154-G190 WeakPolarHBondContact OE2-CA 3.33Å; G190-R192 VanDerWaalsContact C-N 3.32Å
191	E	68.5	Low	85.7	Confident	168 Å²	168	58.9 Å²	58.9	79%	0.785	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.4	174.1	-61.1	-169.8	159.9	0	0	113.7	F189	F189-E191 PolarHBondContact O-N 3.31Å
192	R	77.1	Confident	85.8	Confident	149 Å²	149	51.8 Å²	51.8	56%	0.562	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.4	-174.7	-169.8	176.3	178.5	-170.1	-4.5	111.4	S188 F189 G190 L194 G215	S188-R192 WeakPolarHBondContact CA-O 3.32Å; F189-R192 PolarHBondContact N-O 3.25Å; F189-R192 PolarHBondContact O-N 3.27Å; G190-R192 VanDerWaalsContact C-N 3.32Å; R192-L194 HydrophobicContact CG-CD2 4.37Å; R192-L194 PolarHBondContact O-N 3.45Å; R192-G215 PolarHBondContact NH1-O 3.23Å; R192-G215 PolarHBondContact NH2-O 2.97Å
193	C	82.4	Confident	86	Confident	45 Å²	45	52.9 Å²	52.9	30%	0.304	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	119.7	167.8	-166.9	0	0	0	0	110.1
194	L	85.9	Confident	86.1	Confident	13 Å²	13	51.9 Å²	51.9	7%	0.068	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-43.1	178.9	-62.6	178.4	0	0	0	111.2	I187 F189 R192 T220 Q402	I187-L194 HydrophobicContact CG2-CB 4.44Å; I187-L194 HydrophobicContact CG2-CD1 4.25Å; I187-L194 WeakPolarHBondContact O-CA 3.49Å; I187-L194 WeakPolarHBondContact O-CB 3.15Å; I187-L194 PolarHBondContact O-N 3.32Å; F189-L194 HydrophobicContact CB-CD1 3.67Å; F189-L194 HydrophobicContact CB-CG 4.16Å; R192-L194 HydrophobicContact CG-CD2 4.37Å; R192-L194 PolarHBondContact O-N 3.45Å; L194-T220 HydrophobicContact CD1-CG2 4.05Å; L194-Q402 WeakPolarHBondContact O-CA 3.37Å
195	L	88.8	Confident	86.2	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137	179.4	-78.5	172.1	0	0	0	110.3	F185 D186 I187 A198 L221 L399 Q402 L404	F185-L195 HydrophobicContact CE2-CD1 3.9Å; F185-L195 HydrophobicContact CZ-CD1 4.36Å; D186-L195 CarbonylContact C-O 3.5Å; D186-L195 VanDerWaalsContact CA-O 3.28Å; D186-L195 WeakPolarHBondContact CA-O 3.45Å; I187-L195 HydrophobicContact CB-CB 4.2Å; I187-L195 HydrophobicContact CD1-CD1 4.17Å; I187-L195 PolarHBondContact N-O 2.81Å; I187-L195 PolarHBondContact O-N 3.22Å; L195-A198 HydrophobicContact CB-CB 4.25Å; L195-A198 HydrophobicContact CD1-CB 4.48Å; L195-A198 HydrophobicContact CD2-CB 4.16Å; L195-L221 HydrophobicContact CD1-CD1 4.24Å; L195-L399 HydrophobicContact CD1-CD1 4.33Å; L195-L399 HydrophobicContact CD2-CD1 3.26Å; L195-L399 HydrophobicContact CG-CD1 3.96Å; L195-Q402 WeakPolarHBondContact CA-O 3.45Å; L195-L404 HydrophobicContact CD1-CD1 4.19Å; L195-L404 HydrophobicContact CD1-CG 4.32Å; L195-L404 HydrophobicContact CD2-CD2 4.22Å; L195-L404 HydrophobicContact CD2-CG 3.93Å
196	Q	88.7	Confident	86.4	Confident	120 Å²	120	53.5 Å²	53.5	56%	0.561	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	123	178.8	-169.8	177.7	28.3	0	0	111.5	D186 A198 Q402	D186-Q196 VanDerWaalsContact OD1-CA 3.29Å; D186-Q196 WeakPolarHBondContact OD1-CA 3.32Å; Q196-A198 PolarHBondContact O-N 3.19Å; Q196-Q402 PolarHBondContact N-O 2.82Å
197	G	85.9	Confident	86.7	Confident	38 Å²	38	53.4 Å²	53.4	39%	0.392	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.7	37	-179.9	0	0	0	0	0	111.9	D186	D186-G197 PolarHBondContact OD1-N 3.3Å
198	A	89.1	Confident	87	Confident	2 Å²	2	53.8 Å²	53.8	2%	0.017	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	147.1	-176.7	0	0	0	0	0	110.6	N184 F185 L195 Q196 L404	N184-A198 WeakPolarHBondContact CA-O 3.49Å; N184-A198 PolarHBondContact N-O 3.04Å; N184-A198 VanDerWaalsContact N-O 3.08Å; F185-A198 HydrophobicContact CD1-CB 4.2Å; F185-A198 WeakPolarHBondContact CD1-O 3.46Å; F185-A198 HydrophobicContact CD2-CB 4.41Å; F185-A198 HydrophobicContact CE1-CB 3.78Å; F185-A198 WeakPolarHBondContact CE1-O 3.27Å; F185-A198 HydrophobicContact CE2-CB 4Å; F185-A198 HydrophobicContact CZ-CB 3.68Å; F185-A198 PolarHBondContact N-O 3.42Å; F185-A198 PolarHBondContact O-N 3.47Å; L195-A198 HydrophobicContact CB-CB 4.25Å; L195-A198 HydrophobicContact CD1-CB 4.48Å; L195-A198 HydrophobicContact CD2-CB 4.16Å; Q196-A198 PolarHBondContact O-N 3.19Å; A198-L404 HydrophobicContact CB-CD1 4.13Å; A198-L404 HydrophobicContact CB-CG 4.23Å
199	E	89.8	Confident	87.4	Confident	111 Å²	111	52.1 Å²	52.1	52%	0.519	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.8	173.6	-64.3	-178	172.2	0	0	108.3	I182	I182-E199 WeakPolarHBondContact O-CA 3.49Å
200	L	90.9	Very high	88.1	Confident	3 Å²	3	48 Å²	48	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	118.4	179.6	177.3	62.3	0	0	0	108.9	R181 I182 F185 M202 L225 I397 L404	R181-L200 WeakPolarHBondContact CA-O 3.38Å; I182-L200 HydrophobicContact CB-CB 4.38Å; I182-L200 HydrophobicContact CD1-CD2 4.31Å; I182-L200 PolarHBondContact N-O 3.06Å; I182-L200 PolarHBondContact O-N 3.47Å; F185-L200 HydrophobicContact CE1-CB 3.85Å; F185-L200 HydrophobicContact CZ-CB 4.3Å; L200-M202 HydrophobicContact CD1-CG 4.06Å; L200-M202 HydrophobicContact CD1-SD 4.42Å; L200-M202 HydrophobicContact CD2-CE 4.34Å; L200-M202 HydrophobicContact CG-CG 4.34Å; L200-L225 HydrophobicContact CD2-CD1 4.19Å; L200-L225 HydrophobicContact CD2-CD2 4.31Å; L200-I397 HydrophobicContact CD1-CD1 3.61Å; L200-L404 HydrophobicContact CB-CD1 4.47Å
201	S	90.6	Very high	88.7	Confident	62 Å²	62	47.1 Å²	47.1	43%	0.434	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	114.7	176.6	176	0	0	0	0	109.8	I180	I180-S201 CarbonylContact O-C 3.58Å; I180-S201 WeakPolarHBondContact O-CA 3.33Å
202	M	91.6	Very high	89.6	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122.6	176.7	-59.3	-176.1	-64.4	0	0	109.8	D179 I180 L200 Y208 L350 L380	D179-M202 CarbonylContact C-O 3.35Å; D179-M202 WeakPolarHBondContact CA-O 3.16Å; I180-M202 HydrophobicContact CB-CB 4.32Å; I180-M202 HydrophobicContact CB-CE 3.97Å; I180-M202 HydrophobicContact CD1-CE 3.77Å; I180-M202 HydrophobicContact CG1-CE 4.47Å; I180-M202 HydrophobicContact CG2-CE 3.85Å; I180-M202 PolarHBondContact N-O 2.92Å; I180-M202 PolarHBondContact O-N 3.29Å; L200-M202 HydrophobicContact CD1-CG 4.06Å; L200-M202 HydrophobicContact CD1-SD 4.42Å; L200-M202 HydrophobicContact CD2-CE 4.34Å; L200-M202 HydrophobicContact CG-CG 4.34Å; M202-Y208 WeakPolarHBondContact CA-OH 3.32Å; M202-Y208 HydrophobicContact CB-CD2 4.07Å; M202-Y208 HydrophobicContact CB-CE2 3.57Å; M202-Y208 HydrophobicContact CG-CD2 3.95Å; M202-Y208 HydrophobicContact CG-CE2 3.88Å; M202-Y208 HydrophobicContact CG-CG 4.32Å; M202-Y208 HydrophobicContact SD-CD2 4.23Å; M202-L350 HydrophobicContact CE-CD1 4.19Å; M202-L350 HydrophobicContact CE-CD2 4.19Å; M202-L380 HydrophobicContact SD-CB 4.44Å; M202-L380 HydrophobicContact SD-CD1 4.45Å; M202-L380 HydrophobicContact SD-CD2 4.22Å
203	A	92	Very high	89.7	Confident	25 Å²	25	36 Å²	36	21%	0.207	20%	0.204	C	C	.	.			trans	-85	146.2	174.2	0	0	0	0	0	110.3	D179 R206 Y208	D179-A203 WeakPolarHBondContact OD1-CA 3.46Å; A203-R206 HydrophobicContact CB-CG 4.17Å; A203-R206 PolarHBondContact O-N 3.39Å; A203-Y208 PolarHBondContact N-OH 2.91Å
204	S	90.7	Very high	89.6	Confident	62 Å²	62	35.7 Å²	35.7	43%	0.434	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	138.7	178.8	-172.2	0	0	0	0	112.6	D179 R206 T378	D179-S204 PolarHBondContact OD1-N 3.02Å; S204-R206 VanDerWaalsContact C-N 3.28Å; S204-R206 PolarHBondContact O-N 3.4Å; S204-T378 WeakPolarHBondContact CA-OG1 3.36Å
205	G	89	Confident	89	Confident	29 Å²	29	36.8 Å²	36.8	30%	0.299	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	10.8	175.9	0	0	0	0	0	115	Q376 T378	G205-Q376 WeakPolarHBondContact CA-O 3.2Å; G205-T378 PolarHBondContact N-OG1 3.3Å
206	R	93.6	Very high	88.6	Confident	84 Å²	84	38.6 Å²	38.6	32%	0.317	22%	0.223	S	C	.	.			trans	-98.1	158.8	174.4	-64.7	-156.6	-177.7	-173.7	4.5	112.2	A203 S204 Y208 T378 I379 D395	A203-R206 HydrophobicContact CB-CG 4.17Å; A203-R206 PolarHBondContact O-N 3.39Å; S204-R206 VanDerWaalsContact C-N 3.28Å; S204-R206 PolarHBondContact O-N 3.4Å; R206-Y208 HydrophobicContact CB-CD2 4.27Å; R206-Y208 HydrophobicContact CB-CE2 3.56Å; R206-T378 WeakPolarHBondContact O-CA 2.98Å; R206-T378 WeakPolarHBondContact O-CG2 3.44Å; R206-I379 PolarHBondContact O-N 2.73Å; R206-D395 VanDerWaalsContact CD-OD2 3.26Å; R206-D395 WeakPolarHBondContact CD-OD2 3.44Å; R206-D395 IonicContact NH1-OD1 3.3Å; R206-D395 PolarHBondContact NH1-OD1 3.4Å; R206-D395 IonicContact NH1-OD2 2.76Å; R206-D395 PolarHBondContact NH1-OD2 2.85Å
207	R	95	Very high	88.3	Confident	54 Å²	54	33.3 Å²	33.3	20%	0.204	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.8	-178	-61.2	178.5	-63.8	-87.8	0.8	108.9	I379 V392 T394 D395	R207-I379 HydrophobicContact CG-CB 4.36Å; R207-I379 HydrophobicContact CG-CD1 3.99Å; R207-I379 HydrophobicContact CG-CG1 4.4Å; R207-V392 WeakPolarHBondContact CB-O 3.45Å; R207-V392 VanDerWaalsContact CD-O 3.31Å; R207-V392 WeakPolarHBondContact CD-O 3.43Å; R207-V392 PolarHBondContact NE-O 3.01Å; R207-T394 HydrophobicContact CB-CG2 4.34Å; R207-T394 PolarHBondContact N-OG1 2.93Å; R207-T394 VanDerWaalsContact N-OG1 3.09Å; R207-T394 PolarHBondContact O-N 3.01Å; R207-T394 PolarHBondContact O-OG1 3.18Å; R207-T394 VanDerWaalsContact O-OG1 3.12Å; R207-D395 PolarHBondContact O-N 3.27Å
208	Y	95.3	Very high	88.4	Confident	9 Å²	9	32 Å²	32	4%	0.035	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	126	-176.5	-68	-84.1	0	0	0	110.6	M202 A203 R206 T378 I379 L380 V381 D395 I397	M202-Y208 WeakPolarHBondContact CA-OH 3.32Å; M202-Y208 HydrophobicContact CB-CD2 4.07Å; M202-Y208 HydrophobicContact CB-CE2 3.57Å; M202-Y208 HydrophobicContact CG-CD2 3.95Å; M202-Y208 HydrophobicContact CG-CE2 3.88Å; M202-Y208 HydrophobicContact CG-CG 4.32Å; M202-Y208 HydrophobicContact SD-CD2 4.23Å; A203-Y208 PolarHBondContact N-OH 2.91Å; R206-Y208 HydrophobicContact CB-CD2 4.27Å; R206-Y208 HydrophobicContact CB-CE2 3.56Å; Y208-T378 HydrophobicContact CD2-CG2 4.16Å; Y208-T378 HydrophobicContact CE2-CG2 4.21Å; Y208-I379 PolarHBondContact N-O 2.84Å; Y208-L380 CarbonylContact O-C 3.57Å; Y208-L380 WeakPolarHBondContact O-CA 3.27Å; Y208-V381 PolarHBondContact O-N 2.79Å; Y208-D395 CarbonylContact C-O 3.6Å; Y208-D395 VanDerWaalsContact CA-O 3.32Å; Y208-D395 WeakPolarHBondContact CA-O 3.32Å; Y208-D395 HydrophobicContact CD1-CB 3.61Å; Y208-D395 HydrophobicContact CE1-CB 3.55Å; Y208-I397 HydrophobicContact CD1-CD1 3.79Å; Y208-I397 HydrophobicContact CD1-CG1 3.97Å; Y208-I397 HydrophobicContact CG-CD1 4.1Å
209	G	94.8	Very high	88.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.4	168.9	0	0	0	0	0	110.8	V381 D395 I396 I397	G209-V381 CarbonylContact C-O 3.38Å; G209-V381 WeakPolarHBondContact CA-O 2.98Å; G209-D395 PolarHBondContact N-O 3.3Å; G209-I396 CarbonylContact O-C 3.57Å; G209-I396 WeakPolarHBondContact O-CA 3.38Å; G209-I397 PolarHBondContact O-N 3.48Å
210	L	93.1	Very high	88.2	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	113.7	175.5	176.7	62.1	0	0	0	110.3	K218 L221 L380 V381 V382 I397 L399 L404	L210-K218 HydrophobicContact CD2-CB 4.23Å; L210-K218 HydrophobicContact CD2-CG 4.44Å; L210-K218 HydrophobicContact CG-CG 4.39Å; L210-L221 HydrophobicContact CD2-CD2 3.89Å; L210-L380 HydrophobicContact CB-CD1 4.03Å; L210-V381 PolarHBondContact N-O 3.27Å; L210-V382 HydrophobicContact CB-CG2 3.74Å; L210-V382 HydrophobicContact CD2-CG2 3.59Å; L210-V382 HydrophobicContact CG-CG2 3.86Å; L210-I397 WeakPolarHBondContact CA-O 3.33Å; L210-I397 HydrophobicContact CD1-CB 4.01Å; L210-I397 HydrophobicContact CD1-CG2 3.74Å; L210-L399 HydrophobicContact CD1-CB 4.29Å; L210-L404 HydrophobicContact CD1-CD2 4.36Å
211	I	90.6	Very high	88.1	Confident	12 Å²	12	30.1 Å²	30.1	6%	0.062	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	150.6	-178.3	59.1	166.6	0	0	0	111.2	L389 I396 I397 H398 L399 Y411 F414	I211-L389 HydrophobicContact CG2-CD1 3.45Å; I211-L389 VanDerWaalsContact CG2-CD1 3.45Å; I211-I396 HydrophobicContact CD1-CG2 3.39Å; I211-I396 HydrophobicContact CG1-CG2 3.62Å; I211-I397 WeakPolarHBondContact CG1-O 3.49Å; I211-I397 PolarHBondContact N-O 2.96Å; I211-H398 HydrophobicContact CD1-CB 4.27Å; I211-H398 HydrophobicContact CG1-CB 4.17Å; I211-L399 WeakPolarHBondContact O-CB 3.31Å; I211-L399 PolarHBondContact O-N 2.87Å; I211-Y411 HydrophobicContact CD1-CE2 4.1Å; I211-Y411 HydrophobicContact CG2-CE2 4.45Å; I211-F414 HydrophobicContact CD1-CD1 3.72Å; I211-F414 HydrophobicContact CD1-CD2 4.42Å; I211-F414 HydrophobicContact CD1-CE1 3.14Å; I211-F414 HydrophobicContact CD1-CE2 3.93Å; I211-F414 HydrophobicContact CD1-CG 4.32Å; I211-F414 HydrophobicContact CD1-CZ 3.25Å
212	G	86.3	Confident	88.1	Confident	14 Å²	14	27.2 Å²	27.2	14%	0.144	16%	0.16	C	C	.	.			trans	165.7	161.9	178.4	0	0	0	0	0	111.2	K218	G212-K218 WeakPolarHBondContact O-CE 3.47Å; G212-K218 PolarHBondContact O-NZ 3.05Å
213	R	80.5	Confident	88	Confident	68 Å²	68	31.7 Å²	31.7	26%	0.257	18%	0.18	S	C	.	.			trans	-64.9	154.3	177.7	-54.9	178.4	89.2	-159.4	4.6	111.3	L216 D644 E646	R213-L216 HydrophobicContact CB-CD1 3.93Å; R213-L216 HydrophobicContact CB-CG 4.22Å; R213-L216 HydrophobicContact CG-CD1 4.49Å; R213-L216 WeakPolarHBondContact O-CB 3.41Å; R213-L216 WeakPolarHBondContact O-CG 3.4Å; R213-L216 PolarHBondContact O-N 3.25Å; R213-D644 WeakPolarHBondContact CA-OD1 3.21Å; R213-E646 IonicContact CZ-OE2 2.7Å; R213-E646 IonicContact NE-OE1 3.89Å; R213-E646 IonicContact NE-OE2 2.7Å; R213-E646 PolarHBondContact NE-OE2 2.88Å; R213-E646 IonicContact NH2-OE2 3.53Å; R213-E646 PolarHBondContact NH2-OE2 2.93Å
214	N	79.4	Confident	87.8	Confident	40 Å²	40	31.3 Å²	31.3	21%	0.214	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	137.5	-178.4	-77.6	-22.3	0	0	0	111.1	K218 H384 H642 D644	N214-K218 PolarHBondContact OD1-NZ 3.47Å; N214-H384 PolarHBondContact OD1-NE2 2.93Å; N214-H642 PolarHBondContact ND2-O 3.12Å; N214-D644 VanDerWaalsContact CB-OD1 3.26Å; N214-D644 WeakPolarHBondContact CB-OD1 3.46Å; N214-D644 VanDerWaalsContact N-CG 3.28Å; N214-D644 PolarHBondContact N-OD1 3.35Å; N214-D644 PolarHBondContact N-OD2 3.49Å; N214-D644 VanDerWaalsContact N-OD2 3.12Å; N214-D644 PolarHBondContact ND2-OD1 3.47Å; N214-D644 VanDerWaalsContact ND2-OD1 3.12Å; N214-D644 PolarHBondContact OD1-OD1 3.23Å
215	G	73.6	Confident	87.7	Confident	35 Å²	35	28.3 Å²	28.3	36%	0.361	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	14.8	-176.3	0	0	0	0	0	115.2	R192	R192-G215 PolarHBondContact NH1-O 3.23Å; R192-G215 PolarHBondContact NH2-O 2.97Å
216	L	80.4	Confident	87.7	Confident	40 Å²	40	28.5 Å²	28.5	21%	0.209	15%	0.152	C	C	.	.	S	Bend	trans	-85.5	-10.7	167.5	-66.4	-177.7	0	0	0	113.8	R213 L399	R213-L216 HydrophobicContact CB-CD1 3.93Å; R213-L216 HydrophobicContact CB-CG 4.22Å; R213-L216 HydrophobicContact CG-CD1 4.49Å; R213-L216 WeakPolarHBondContact O-CB 3.41Å; R213-L216 WeakPolarHBondContact O-CG 3.4Å; R213-L216 PolarHBondContact O-N 3.25Å; L216-L399 HydrophobicContact CB-CD2 3.56Å; L216-L399 HydrophobicContact CB-CG 3.93Å; L216-L399 HydrophobicContact CD1-CG 4.3Å; L216-L399 WeakPolarHBondContact CD1-O 3.43Å
217	G	81.9	Confident	87.4	Confident	10 Å²	10	27.5 Å²	27.5	10%	0.103	16%	0.158	C	C	.	.	S	Bend	trans	106.4	22.4	175.1	0	0	0	0	0	116.8	T220 L221	G217-T220 WeakPolarHBondContact O-CB 3.36Å; G217-T220 PolarHBondContact O-N 3.46Å; G217-L221 WeakPolarHBondContact O-CB 3.37Å; G217-L221 PolarHBondContact O-N 3Å
218	K	88.1	Confident	87	Confident	11 Å²	11	29.7 Å²	29.7	5%	0.048	17%	0.166	C	C	.	.	H	α-helix	trans	-56.4	-56.2	178.2	-61.5	178.1	-65.8	-178.4	0	112.8	L210 G212 N214 T220 L221 L222 E355 V382 H384 L399	L210-K218 HydrophobicContact CD2-CB 4.23Å; L210-K218 HydrophobicContact CD2-CG 4.44Å; L210-K218 HydrophobicContact CG-CG 4.39Å; G212-K218 WeakPolarHBondContact O-CE 3.47Å; G212-K218 PolarHBondContact O-NZ 3.05Å; N214-K218 PolarHBondContact OD1-NZ 3.47Å; K218-T220 VanDerWaalsContact C-N 3.26Å; K218-T220 PolarHBondContact O-N 2.85Å; K218-L221 WeakPolarHBondContact O-CB 3.06Å; K218-L221 PolarHBondContact O-N 2.71Å; K218-L221 VanDerWaalsContact O-N 3.16Å; K218-L222 PolarHBondContact O-N 3.37Å; K218-L222 VanDerWaalsContact O-N 3.07Å; K218-E355 IonicContact NZ-OE1 3.98Å; K218-V382 HydrophobicContact CB-CG1 4.12Å; K218-V382 HydrophobicContact CB-CG2 4.12Å; K218-V382 HydrophobicContact CD-CG1 3.93Å; K218-H384 PolarHBondContact NZ-CE1 2.74Å; K218-H384 PolarHBondContact NZ-NE2 3.26Å; K218-L399 HydrophobicContact CG-CD2 3.71Å
219	T	86.3	Confident	86.6	Confident	47 Å²	47	33.8 Å²	33.8	29%	0.288	19%	0.188	S	C	.	.	H	α-helix	trans	-58.9	-38.4	174.1	-54	0	0	0	0	111.9	L221 L222 K223 D354	T219-L221 PolarHBondContact O-N 3.31Å; T219-L222 PolarHBondContact O-N 3.43Å; T219-K223 HydrophobicContact CG2-CD 4.3Å; T219-K223 WeakPolarHBondContact O-CG 3.28Å; T219-K223 PolarHBondContact O-N 3.06Å; T219-D354 WeakPolarHBondContact CB-OD2 3.24Å; T219-D354 WeakPolarHBondContact CG2-OD2 3.32Å; T219-D354 PolarHBondContact OG1-OD2 3.43Å
220	T	88.3	Confident	86.1	Confident	27 Å²	27	33.8 Å²	33.8	17%	0.166	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-42.5	177.1	-47.5	0	0	0	0	111.5	A156 I187 L194 G217 K218 K223 M224	A156-T220 HydrophobicContact CB-CG2 3.31Å; I187-T220 HydrophobicContact CG2-CG2 4.09Å; L194-T220 HydrophobicContact CD1-CG2 4.05Å; G217-T220 WeakPolarHBondContact O-CB 3.36Å; G217-T220 PolarHBondContact O-N 3.46Å; K218-T220 VanDerWaalsContact C-N 3.26Å; K218-T220 PolarHBondContact O-N 2.85Å; T220-K223 PolarHBondContact O-N 3.24Å; T220-M224 WeakPolarHBondContact O-CB 3.42Å; T220-M224 WeakPolarHBondContact O-CG 3.36Å; T220-M224 PolarHBondContact O-N 3.39Å
221	L	89.8	Confident	85.5	Confident	2 Å²	2	40 Å²	40	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-45.6	175.5	179	64.7	0	0	0	111.1	F185 I187 L195 L210 G217 K218 T219 K223 M224 L225 L230 L404	F185-L221 HydrophobicContact CE2-CD1 3.81Å; F185-L221 HydrophobicContact CZ-CD1 3.98Å; I187-L221 HydrophobicContact CD1-CD1 3.62Å; L195-L221 HydrophobicContact CD1-CD1 4.24Å; L210-L221 HydrophobicContact CD2-CD2 3.89Å; G217-L221 WeakPolarHBondContact O-CB 3.37Å; G217-L221 PolarHBondContact O-N 3Å; K218-L221 WeakPolarHBondContact O-CB 3.06Å; K218-L221 PolarHBondContact O-N 2.71Å; K218-L221 VanDerWaalsContact O-N 3.16Å; T219-L221 PolarHBondContact O-N 3.31Å; L221-K223 PolarHBondContact O-N 3.13Å; L221-M224 PolarHBondContact O-N 3.47Å; L221-L225 HydrophobicContact CG-CD1 4.34Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.06Å; L221-L230 HydrophobicContact CD1-CD1 3.81Å; L221-L404 HydrophobicContact CD2-CD1 4.12Å; L221-L404 HydrophobicContact CD2-CD2 4.47Å
222	L	90.7	Very high	85.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-46.2	176	-69.8	168.9	0	0	0	111.9	K218 T219 M224 L225 A226 L352 D354 L380 V382	K218-L222 PolarHBondContact O-N 3.37Å; K218-L222 VanDerWaalsContact O-N 3.07Å; T219-L222 PolarHBondContact O-N 3.43Å; L222-M224 VanDerWaalsContact C-N 3.34Å; L222-M224 PolarHBondContact O-N 3.38Å; L222-L225 PolarHBondContact O-N 3.01Å; L222-A226 WeakPolarHBondContact O-CB 3.45Å; L222-A226 PolarHBondContact O-N 3.48Å; L222-L352 HydrophobicContact CD2-CB 4.01Å; L222-L352 HydrophobicContact CD2-CD1 4.38Å; L222-L352 HydrophobicContact CD2-CD2 3.94Å; L222-L352 HydrophobicContact CD2-CG 4.34Å; L222-D354 HydrophobicContact CD1-CB 3.65Å; L222-L380 HydrophobicContact CD2-CD2 3.79Å; L222-L380 HydrophobicContact CD2-CG 4.13Å; L222-V382 HydrophobicContact CD1-CB 4.18Å; L222-V382 HydrophobicContact CD1-CG2 3.49Å; L222-V382 VanDerWaalsContact CD1-CG2 3.49Å; L222-V382 HydrophobicContact CG-CG2 4.17Å
223	K	88.5	Confident	85.2	Confident	95 Å²	95	40.4 Å²	40.4	41%	0.413	21%	0.212	S	C	.	.	H	α-helix	trans	-61.6	-39.8	176	-73.7	-177.8	176.9	-171.1	0	112.6	T219 T220 L221 L225 A226 S227	T219-K223 HydrophobicContact CG2-CD 4.3Å; T219-K223 WeakPolarHBondContact O-CG 3.28Å; T219-K223 PolarHBondContact O-N 3.06Å; T220-K223 PolarHBondContact O-N 3.24Å; L221-K223 PolarHBondContact O-N 3.13Å; K223-L225 VanDerWaalsContact C-N 3.34Å; K223-A226 PolarHBondContact O-N 2.79Å; K223-S227 WeakPolarHBondContact O-CB 3.31Å; K223-S227 PolarHBondContact O-N 2.53Å; K223-S227 PolarHBondContact O-OG 3.39Å
224	M	88.4	Confident	85.3	Confident	17 Å²	17	41.6 Å²	41.6	8%	0.084	24%	0.236	C	C	.	.	H	α-helix	trans	-69.1	-31.1	177.1	-69.3	-65.3	120.8	0	0	112.8	A156 A158 I187 T220 L221 L222 S227 N229 L230	A156-M224 HydrophobicContact CB-CE 3.6Å; A156-M224 HydrophobicContact CB-SD 4.43Å; A156-M224 WeakPolarHBondContact O-CE 3.43Å; A158-M224 HydrophobicContact CB-SD 4.18Å; I187-M224 HydrophobicContact CD1-CB 4.34Å; I187-M224 HydrophobicContact CD1-CG 4.28Å; T220-M224 WeakPolarHBondContact O-CB 3.42Å; T220-M224 WeakPolarHBondContact O-CG 3.36Å; T220-M224 PolarHBondContact O-N 3.39Å; L221-M224 PolarHBondContact O-N 3.47Å; L222-M224 VanDerWaalsContact C-N 3.34Å; L222-M224 PolarHBondContact O-N 3.38Å; M224-S227 WeakPolarHBondContact CA-OG 3.42Å; M224-S227 PolarHBondContact O-OG 2.85Å; M224-N229 PolarHBondContact O-N 3.41Å; M224-N229 VanDerWaalsContact O-N 3.14Å; M224-N229 HydrophobicContact SD-CB 3.83Å; M224-N229 PolarHBondContact SD-ND2 3.49Å; M224-N229 VanDerWaalsContact SD-ND2 3.39Å; M224-L230 HydrophobicContact CB-CD1 4.16Å; M224-L230 HydrophobicContact CB-CG 4.14Å; M224-L230 PolarHBondContact O-N 3.1Å
225	L	89.1	Confident	85.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-71.5	-46.5	171.4	-71.5	169.8	0	0	0	111.4	I182 L200 L221 L222 K223 R228 L230 V232 L352 L380	I182-L225 HydrophobicContact CD1-CD2 3.52Å; L200-L225 HydrophobicContact CD2-CD1 4.19Å; L200-L225 HydrophobicContact CD2-CD2 4.31Å; L221-L225 HydrophobicContact CG-CD1 4.34Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.06Å; L222-L225 PolarHBondContact O-N 3.01Å; K223-L225 VanDerWaalsContact C-N 3.34Å; L225-R228 PolarHBondContact O-N 3.46Å; L225-R228 VanDerWaalsContact O-N 3.12Å; L225-L230 HydrophobicContact CD2-CB 4.11Å; L225-L230 HydrophobicContact CD2-CD1 3.72Å; L225-L230 HydrophobicContact CG-CD1 3.99Å; L225-V232 HydrophobicContact CD2-CG2 4.14Å; L225-L352 HydrophobicContact CB-CD1 4.01Å; L225-L380 HydrophobicContact CD1-CD2 3.88Å
226	A	88.3	Confident	86.1	Confident	33 Å²	33	41.7 Å²	41.7	27%	0.273	23%	0.226	S	C	.	.	H	α-helix	trans	-63.4	-43.5	-178.8	0	0	0	0	0	112.6	L222 K223 R228 H240 L352	L222-A226 WeakPolarHBondContact O-CB 3.45Å; L222-A226 PolarHBondContact O-N 3.48Å; K223-A226 PolarHBondContact O-N 2.79Å; A226-R228 PolarHBondContact O-N 2.7Å; A226-H240 HydrophobicContact CB-CB 3.52Å; A226-L352 HydrophobicContact CB-CD1 4.2Å
227	S	87.5	Confident	86.5	Confident	62 Å²	62	42.1 Å²	42.1	43%	0.434	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-4.6	176	55.7	0	0	0	0	114	K223 M224 N229	K223-S227 WeakPolarHBondContact O-CB 3.31Å; K223-S227 PolarHBondContact O-N 2.53Å; K223-S227 PolarHBondContact O-OG 3.39Å; M224-S227 WeakPolarHBondContact CA-OG 3.42Å; M224-S227 PolarHBondContact O-OG 2.85Å; S227-N229 PolarHBondContact O-N 3.28Å
228	R	86.6	Confident	86.8	Confident	100 Å²	100	43.2 Å²	43.2	38%	0.377	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	23.6	-173.2	-57	-176.3	177.8	-102.6	3	114.1	L225 A226 L230 P233 I236 I238	L225-R228 PolarHBondContact O-N 3.46Å; L225-R228 VanDerWaalsContact O-N 3.12Å; A226-R228 PolarHBondContact O-N 2.7Å; R228-L230 CarbonylContact C-O 3.56Å; R228-L230 PolarHBondContact O-N 3.26Å; R228-P233 PolarHBondContact NH1-O 3.43Å; R228-I236 PolarHBondContact NH2-O 3Å; R228-I238 HydrophobicContact CG-CD1 4.38Å
229	N	86.2	Confident	86.9	Confident	95 Å²	95	45.6 Å²	45.6	51%	0.508	25%	0.249	S	C	.	.			trans	-64.3	-34.8	169.1	-77.2	-5	0	0	0	110.8	M224 S227	M224-N229 PolarHBondContact O-N 3.41Å; M224-N229 VanDerWaalsContact O-N 3.14Å; M224-N229 HydrophobicContact SD-CB 3.83Å; M224-N229 PolarHBondContact SD-ND2 3.49Å; M224-N229 VanDerWaalsContact SD-ND2 3.39Å; S227-N229 PolarHBondContact O-N 3.28Å
230	L	85.1	Confident	86.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-83.6	136.5	162.2	-65.7	175.5	0	0	0	109.8	A158 I182 F185 I187 L221 M224 L225 R228 V232	A158-L230 HydrophobicContact CB-CD2 4.07Å; I182-L230 HydrophobicContact CD1-CB 4.1Å; I182-L230 HydrophobicContact CD1-CD1 4.49Å; I182-L230 HydrophobicContact CG2-CD2 4.36Å; F185-L230 HydrophobicContact CB-CD2 3.92Å; F185-L230 HydrophobicContact CD2-CD1 4.3Å; F185-L230 HydrophobicContact CD2-CD2 3.67Å; F185-L230 HydrophobicContact CE2-CD1 4.15Å; F185-L230 HydrophobicContact CE2-CD2 4.34Å; F185-L230 HydrophobicContact CG-CD2 3.87Å; I187-L230 HydrophobicContact CD1-CD1 4.26Å; L221-L230 HydrophobicContact CD1-CD1 3.81Å; M224-L230 HydrophobicContact CB-CD1 4.16Å; M224-L230 HydrophobicContact CB-CG 4.14Å; M224-L230 PolarHBondContact O-N 3.1Å; L225-L230 HydrophobicContact CD2-CB 4.11Å; L225-L230 HydrophobicContact CD2-CD1 3.72Å; L225-L230 HydrophobicContact CG-CD1 3.99Å; R228-L230 CarbonylContact C-O 3.56Å; R228-L230 PolarHBondContact O-N 3.26Å; L230-V232 PolarHBondContact O-N 2.9Å
231	R	80.8	Confident	86.6	Confident	133 Å²	133	44 Å²	44	50%	0.502	24%	0.237	S	C	.	.			trans	-68.1	104	-176.6	-69	178.9	179.5	-167.5	-1.6	111.3	Q160	Q160-R231 VanDerWaalsContact OE1-CG 3.3Å
232	V	85.1	Confident	85.5	Confident	16 Å²	16	48.4 Å²	48.4	10%	0.097	26%	0.257	C	S	.	.			trans	-112	138.9	168.9	-174.5	0	0	0	0	108.6	I180 I182 L225 L230 A234 I236 I238	I180-V232 HydrophobicContact CD1-CG1 3.95Å; I180-V232 HydrophobicContact CG1-CG1 4.12Å; I180-V232 HydrophobicContact CG2-CG1 4.39Å; I180-V232 HydrophobicContact CG2-CG2 4.41Å; I182-V232 HydrophobicContact CD1-CG2 4.28Å; L225-V232 HydrophobicContact CD2-CG2 4.14Å; L230-V232 PolarHBondContact O-N 2.9Å; V232-A234 PolarHBondContact O-N 3.18Å; V232-I236 HydrophobicContact CG1-CB 4.4Å; V232-I236 HydrophobicContact CG1-CD1 4.38Å; V232-I238 HydrophobicContact CB-CD1 3.91Å; V232-I238 HydrophobicContact CG1-CD1 3.74Å; V232-I238 HydrophobicContact CG1-CG1 4.47Å; V232-I238 HydrophobicContact CG2-CD1 4.04Å
233	P	84.6	Confident	83.9	Confident	18 Å²	18	52.9 Å²	52.9	12%	0.117	28%	0.278	C	S	.	.			trans	-50.6	139.1	178.1	-27.7	33.1	0	0	0	113.5	R228 H235 I236	R228-P233 PolarHBondContact NH1-O 3.43Å; P233-H235 VanDerWaalsContact C-N 3.29Å; P233-H235 WeakPolarHBondContact CB-CE1 3.43Å; P233-H235 PolarHBondContact O-N 3.22Å; P233-I236 HydrophobicContact CB-CD1 3.99Å; P233-I236 HydrophobicContact CB-CG1 4.19Å; P233-I236 HydrophobicContact CG-CD1 3.95Å; P233-I236 PolarHBondContact O-N 2.88Å
234	A	82.1	Confident	82.7	Confident	92 Å²	92	56.7 Å²	56.7	76%	0.76	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-28.6	-171.3	0	0	0	0	0	113.5	V232 I236	V232-A234 PolarHBondContact O-N 3.18Å; A234-I236 VanDerWaalsContact C-N 3.3Å; A234-I236 PolarHBondContact O-N 3.45Å
235	H	84	Confident	81.5	Confident	74 Å²	74	57.8 Å²	57.8	34%	0.343	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.3	179.9	62.1	-82.6	0	0	0	114.1	S177 Y178 P233	S177-H235 PolarHBondContact O-CE1 3.43Å; S177-H235 PolarHBondContact O-NE2 3.36Å; Y178-H235 AromaticContact CE1-CD2 3.94Å; P233-H235 VanDerWaalsContact C-N 3.29Å; P233-H235 WeakPolarHBondContact CB-CE1 3.43Å; P233-H235 PolarHBondContact O-N 3.22Å
236	I	86.9	Confident	80.5	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.015	33%	0.334	C	S	.	.	S	Bend	trans	-83.5	120.2	177.9	-61.4	177.9	0	0	0	108.3	Y178 I180 R228 V232 P233 A234 I238 D349 L350	Y178-I236 HydrophobicContact CD1-CG1 4.31Å; I180-I236 HydrophobicContact CD1-CD1 4.1Å; I180-I236 HydrophobicContact CD1-CG2 4.34Å; I180-I236 HydrophobicContact CG1-CD1 3.61Å; R228-I236 PolarHBondContact NH2-O 3Å; V232-I236 HydrophobicContact CG1-CB 4.4Å; V232-I236 HydrophobicContact CG1-CD1 4.38Å; P233-I236 HydrophobicContact CB-CD1 3.99Å; P233-I236 HydrophobicContact CB-CG1 4.19Å; P233-I236 HydrophobicContact CG-CD1 3.95Å; P233-I236 PolarHBondContact O-N 2.88Å; A234-I236 VanDerWaalsContact C-N 3.3Å; A234-I236 PolarHBondContact O-N 3.45Å; I236-I238 HydrophobicContact CG2-CG1 4.4Å; I236-D349 HydrophobicContact CG2-CB 3.81Å; I236-L350 HydrophobicContact CG2-CB 4.17Å
237	S	87.5	Confident	79.7	Confident	50 Å²	50	60.7 Å²	60.7	35%	0.35	33%	0.331	S	S	.	.			trans	-75.4	127.5	170.6	59.3	0	0	0	0	110.4	D349 L350	S237-D349 WeakPolarHBondContact CB-OD2 3.35Å; S237-D349 PolarHBondContact N-OD2 3.34Å; S237-D349 PolarHBondContact O-N 2.81Å; S237-D349 VanDerWaalsContact OG-CG 3.23Å; S237-D349 PolarHBondContact OG-N 3.37Å; S237-D349 PolarHBondContact OG-OD2 3.21Å; S237-L350 PolarHBondContact O-N 3.13Å
238	I	89.9	Confident	79.4	Confident	33 Å²	33	62 Å²	62	17%	0.169	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.2	-180	-51.6	174.1	0	0	0	107.4	R228 V232 I236 L350 L352	R228-I238 HydrophobicContact CG-CD1 4.38Å; V232-I238 HydrophobicContact CB-CD1 3.91Å; V232-I238 HydrophobicContact CG1-CD1 3.74Å; V232-I238 HydrophobicContact CG1-CG1 4.47Å; V232-I238 HydrophobicContact CG2-CD1 4.04Å; I236-I238 HydrophobicContact CG2-CG1 4.4Å; I238-L350 WeakPolarHBondContact CA-O 3.47Å; I238-L350 HydrophobicContact CD1-CD2 4.45Å; I238-L350 HydrophobicContact CG1-CB 4.38Å; I238-L350 HydrophobicContact CG1-CD2 4.19Å; I238-L350 HydrophobicContact CG2-CD2 4.11Å; I238-L350 HydrophobicContact CG2-CG 4.48Å; I238-L352 HydrophobicContact CG2-CD1 3.64Å; I238-L352 HydrophobicContact CG2-CG 4.01Å
239	L	89.6	Confident	79.4	Confident	61 Å²	61	62.8 Å²	62.8	32%	0.319	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.9	171.1	-167.3	63.5	0	0	0	109.9	A343 A346 P348 L350 L352	L239-A343 VanDerWaalsContact CD2-CA 3.42Å; L239-A343 HydrophobicContact CD2-CB 3.57Å; L239-A343 HydrophobicContact CG-CB 4.25Å; L239-A346 HydrophobicContact CD2-CB 3.86Å; L239-P348 HydrophobicContact CB-CB 3.84Å; L239-P348 HydrophobicContact CB-CG 3.76Å; L239-P348 HydrophobicContact CD2-CG 4.46Å; L239-L350 PolarHBondContact N-O 3.44Å; L239-L350 VanDerWaalsContact N-O 3.11Å; L239-L352 PolarHBondContact O-N 3.15Å
240	H	86.8	Confident	79.4	Confident	30 Å²	30	60.1 Å²	60.1	14%	0.139	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.9	178.7	-179.3	-136.7	0	0	0	109.7	A226 E242 L352	A226-H240 HydrophobicContact CB-CB 3.52Å; H240-E242 VanDerWaalsContact CE1-CG 3.47Å; H240-E242 WeakPolarHBondContact CE1-CG 3.22Å; H240-E242 IonicContact CE1-OE1 2.91Å; H240-E242 VanDerWaalsContact ND1-CG 3.27Å; H240-E242 WeakPolarHBondContact ND1-CG 3.42Å; H240-E242 IonicContact ND1-OE1 3.88Å; H240-E242 PolarHBondContact ND1-OE1 2.86Å; H240-E242 PolarHBondContact O-N 3.34Å; H240-L352 HydrophobicContact CB-CB 4.21Å; H240-L352 HydrophobicContact CB-CD1 4.33Å
241	V	80.2	Confident	79.8	Confident	11 Å²	11	63.9 Å²	63.9	7%	0.067	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	101	172.4	-175.7	0	0	0	0	107.7	M336 A339 A343 L352 L353	V241-M336 HydrophobicContact CG1-SD 4.05Å; V241-A339 HydrophobicContact CG1-CB 3.98Å; V241-A343 HydrophobicContact CG2-CB 3.25Å; V241-L352 PolarHBondContact N-O 3.49Å; V241-L352 VanDerWaalsContact N-O 3.16Å; V241-L353 HydrophobicContact CB-CD2 4.26Å; V241-L353 HydrophobicContact CG2-CD2 3.81Å
242	E	67.7	Low	80.2	Confident	93 Å²	93	57.5 Å²	57.5	44%	0.435	33%	0.327	S	S	.	.			trans	-78.6	157	176.4	-70	-163.1	168.8	0	0	112.5	H240 E244 M336	H240-E242 VanDerWaalsContact CE1-CG 3.47Å; H240-E242 WeakPolarHBondContact CE1-CG 3.22Å; H240-E242 IonicContact CE1-OE1 2.91Å; H240-E242 VanDerWaalsContact ND1-CG 3.27Å; H240-E242 WeakPolarHBondContact ND1-CG 3.42Å; H240-E242 IonicContact ND1-OE1 3.88Å; H240-E242 PolarHBondContact ND1-OE1 2.86Å; H240-E242 PolarHBondContact O-N 3.34Å; E242-E244 PolarHBondContact O-N 2.92Å; E242-M336 WeakPolarHBondContact O-CE 3.21Å
243	Q	57.5	Low	80.4	Confident	94 Å²	94	58.9 Å²	58.9	44%	0.439	33%	0.334	S	S	.	.	S	Bend	trans	-67	-15.1	-172.7	-86.2	-179.3	-10.5	0	0	115.5	M336	Q243-M336 HydrophobicContact CB-CE 4.18Å; Q243-M336 HydrophobicContact CG-CE 4.24Å; Q243-M336 WeakPolarHBondContact O-CE 3.43Å
244	E	62.5	Low	80.7	Confident	176 Å²	176	61.3 Å²	61.3	82%	0.822	34%	0.344	S	S	*	.			trans	-136.5	118.8	-176.3	-64.9	-177.3	178.6	0	0	111.1	E242	E242-E244 PolarHBondContact O-N 2.92Å
245	V	63.6	Low	81	Confident	40 Å²	40	57.2 Å²	57.2	24%	0.242	31%	0.309	C	S	.	.			trans	-116.9	123	173.3	178	0	0	0	0	109.1	R335 A339	V245-R335 WeakPolarHBondContact O-CD 3.13Å; V245-A339 HydrophobicContact CB-CB 4.31Å; V245-A339 HydrophobicContact CG2-CB 3.44Å; V245-A339 VanDerWaalsContact CG2-CB 3.44Å
246	A	68.1	Low	81.2	Confident	73 Å²	73	53.7 Å²	53.7	60%	0.603	29%	0.293	S	S	*	.			trans	-63.5	139.8	172.8	0	0	0	0	0	109.9
247	G	71.8	Confident	81.3	Confident	21 Å²	21	53.9 Å²	53.9	22%	0.216	29%	0.294	C	S	.	.			trans	-88.2	135.9	176.4	0	0	0	0	0	110.3
248	D	81.7	Confident	81.2	Confident	89 Å²	89	54.8 Å²	54.8	48%	0.476	29%	0.293	S	S	.	.			trans	-113.4	177.3	178.3	-60.5	-32.7	0	0	0	111	T250 T327 K328	D248-T250 PolarHBondContact O-N 2.83Å; D248-T327 WeakPolarHBondContact CA-OG1 3.43Å; D248-T327 PolarHBondContact N-OG1 3.33Å; D248-T327 PolarHBondContact O-N 3.22Å; D248-T327 PolarHBondContact O-OG1 2.99Å; D248-K328 PolarHBondContact O-N 3.3Å
249	D	86.1	Confident	80.9	Confident	117 Å²	117	54.8 Å²	54.8	63%	0.626	30%	0.295	S	S	*	.	S	Bend	trans	-74.7	-6.8	175.4	-73.4	-42.8	0	0	0	113.7	K328	D249-K328 WeakPolarHBondContact OD1-CD 3.4Å; D249-K328 WeakPolarHBondContact OD1-CE 3.45Å; D249-K328 IonicContact OD1-NZ 3.98Å; D249-K328 PolarHBondContact OD1-NZ 3.18Å
250	T	86.9	Confident	80.7	Confident	39 Å²	39	53.5 Å²	53.5	24%	0.239	29%	0.289	C	S	.	.	S	Bend	trans	-65.7	148.9	177.8	54.3	0	0	0	0	111.1	D248 P326 T327	D248-T250 PolarHBondContact O-N 2.83Å; T250-P326 CarbonylContact O-C 3.58Å; T250-P326 WeakPolarHBondContact O-CA 3.36Å; T250-T327 WeakPolarHBondContact O-CG2 3.06Å; T250-T327 PolarHBondContact O-N 3.28Å
251	I	92	Very high	80.5	Confident	78 Å²	78	56.9 Å²	56.9	40%	0.4	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-74.8	144	175.6	-69.1	162.5	0	0	0	109.2	L253 Q254 S255 Q323	I251-L253 HydrophobicContact CG2-CB 4.46Å; I251-L253 PolarHBondContact O-N 2.86Å; I251-Q254 HydrophobicContact CB-CB 4.16Å; I251-Q254 PolarHBondContact O-N 3.35Å; I251-Q254 VanDerWaalsContact O-N 3.17Å; I251-S255 VanDerWaalsContact O-CB 3.32Å; I251-S255 WeakPolarHBondContact O-CB 3.05Å; I251-S255 PolarHBondContact O-N 3.26Å; I251-Q323 WeakPolarHBondContact CG2-O 3.08Å
252	A	89.2	Confident	80.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-49.8	-51.7	179.8	0	0	0	0	0	113.7	Q254 S255 V256 Q325 F330 L338	A252-Q254 PolarHBondContact O-N 3.1Å; A252-S255 PolarHBondContact O-N 3.17Å; A252-V256 PolarHBondContact O-N 3.45Å; A252-Q325 PolarHBondContact N-O 2.77Å; A252-Q325 VanDerWaalsContact N-O 3.07Å; A252-F330 HydrophobicContact CB-CE2 3.89Å; A252-F330 HydrophobicContact CB-CZ 4.31Å; A252-L338 HydrophobicContact CB-CD1 4.17Å
253	L	90.5	Very high	81.5	Confident	44 Å²	44	58.4 Å²	58.4	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-59.7	-47.9	179.3	-178.6	66.8	0	0	0	112.1	I251 S255 V256 L257 A309 L313 Q323	I251-L253 HydrophobicContact CG2-CB 4.46Å; I251-L253 PolarHBondContact O-N 2.86Å; L253-S255 PolarHBondContact O-N 3.2Å; L253-V256 PolarHBondContact O-N 3.45Å; L253-L257 HydrophobicContact CG-CD1 4.4Å; L253-L257 WeakPolarHBondContact O-CG 3.41Å; L253-L257 PolarHBondContact O-N 3.04Å; L253-L257 VanDerWaalsContact O-N 3.13Å; L253-A309 HydrophobicContact CD1-CB 3.8Å; L253-L313 HydrophobicContact CB-CD1 4.32Å; L253-L313 HydrophobicContact CD1-CD1 3.97Å; L253-Q323 HydrophobicContact CB-CB 4.45Å; L253-Q323 WeakPolarHBondContact CB-O 3.4Å; L253-Q323 PolarHBondContact N-O 2.91Å; L253-Q323 VanDerWaalsContact N-O 3.07Å
254	Q	89.3	Confident	82.9	Confident	70 Å²	70	55.3 Å²	55.3	33%	0.327	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-37.1	-179.7	-179.7	57.5	22.4	0	0	111.1	I251 A252 V256 L257 E258	I251-Q254 HydrophobicContact CB-CB 4.16Å; I251-Q254 PolarHBondContact O-N 3.35Å; I251-Q254 VanDerWaalsContact O-N 3.17Å; A252-Q254 PolarHBondContact O-N 3.1Å; Q254-V256 VanDerWaalsContact C-N 3.32Å; Q254-V256 PolarHBondContact O-N 2.78Å; Q254-L257 WeakPolarHBondContact O-CB 3.47Å; Q254-L257 PolarHBondContact O-N 3.3Å; Q254-L257 VanDerWaalsContact O-N 3.09Å; Q254-E258 HydrophobicContact CG-CG 4.43Å; Q254-E258 VanDerWaalsContact CG-OE1 3.31Å; Q254-E258 WeakPolarHBondContact CG-OE1 3.34Å; Q254-E258 PolarHBondContact NE2-OE1 3.05Å; Q254-E258 VanDerWaalsContact NE2-OE1 3.15Å; Q254-E258 VanDerWaalsContact O-CG 3.32Å; Q254-E258 WeakPolarHBondContact O-CG 3.44Å; Q254-E258 PolarHBondContact O-N 3.02Å
255	S	88.4	Confident	84.1	Confident	5 Å²	5	52 Å²	52	4%	0.035	29%	0.291	C	S	.	.	H	α-helix	trans	-70.7	-27	-179.4	-161.5	0	0	0	0	114.1	I251 A252 L253 R342	I251-S255 VanDerWaalsContact O-CB 3.32Å; I251-S255 WeakPolarHBondContact O-CB 3.05Å; I251-S255 PolarHBondContact O-N 3.26Å; A252-S255 PolarHBondContact O-N 3.17Å; L253-S255 PolarHBondContact O-N 3.2Å; S255-R342 PolarHBondContact O-NE 3.46Å; S255-R342 PolarHBondContact OG-NE 3.49Å; S255-R342 PolarHBondContact OG-NH2 3.36Å
256	V	88.9	Confident	85.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-71.8	-39.6	167.7	177.9	0	0	0	0	110.7	A252 L253 Q254 E258 S259 A309 L313 L338 A341 R342 F345	A252-V256 PolarHBondContact O-N 3.45Å; L253-V256 PolarHBondContact O-N 3.45Å; Q254-V256 VanDerWaalsContact C-N 3.32Å; Q254-V256 PolarHBondContact O-N 2.78Å; V256-E258 VanDerWaalsContact C-N 3.3Å; V256-E258 PolarHBondContact O-N 2.95Å; V256-S259 PolarHBondContact O-N 2.89Å; V256-S259 PolarHBondContact O-OG 3.33Å; V256-A309 HydrophobicContact CB-CB 4.36Å; V256-A309 HydrophobicContact CG1-CB 3.88Å; V256-L313 HydrophobicContact CG2-CD1 3.98Å; V256-L313 HydrophobicContact CG2-CD2 3.9Å; V256-L313 HydrophobicContact CG2-CG 4.05Å; V256-L338 HydrophobicContact CG2-CD1 3.58Å; V256-A341 HydrophobicContact CG2-CB 3.85Å; V256-R342 HydrophobicContact CG2-CG 4.24Å; V256-F345 HydrophobicContact CG1-CB 3.54Å; V256-F345 HydrophobicContact CG1-CD1 4.14Å; V256-F345 HydrophobicContact CG1-CD2 4.2Å; V256-F345 HydrophobicContact CG1-CG 3.69Å; V256-F345 VanDerWaalsContact O-CD1 3.23Å; V256-F345 WeakPolarHBondContact O-CD1 3.48Å
257	L	88.8	Confident	86.2	Confident	7 Å²	7	48.9 Å²	48.9	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-34	178.5	-71.6	176.3	0	0	0	113	L253 Q254 S259 D260 R263 A305 P306 A309 F345	L253-L257 HydrophobicContact CG-CD1 4.4Å; L253-L257 WeakPolarHBondContact O-CG 3.41Å; L253-L257 PolarHBondContact O-N 3.04Å; L253-L257 VanDerWaalsContact O-N 3.13Å; Q254-L257 WeakPolarHBondContact O-CB 3.47Å; Q254-L257 PolarHBondContact O-N 3.3Å; Q254-L257 VanDerWaalsContact O-N 3.09Å; L257-S259 VanDerWaalsContact C-N 3.26Å; L257-S259 PolarHBondContact O-N 3.02Å; L257-D260 PolarHBondContact O-N 2.87Å; L257-R263 PolarHBondContact O-NH1 2.85Å; L257-A305 HydrophobicContact CD2-CB 3.93Å; L257-P306 HydrophobicContact CD1-CB 4.37Å; L257-P306 HydrophobicContact CD1-CG 4.29Å; L257-A309 HydrophobicContact CD2-CB 3.88Å; L257-A309 HydrophobicContact CG-CB 4.26Å; L257-F345 HydrophobicContact CD2-CE1 4.38Å; L257-F345 HydrophobicContact CD2-CE2 4.42Å; L257-F345 HydrophobicContact CD2-CZ 3.92Å
258	E	85.8	Confident	87	Confident	70 Å²	70	50.1 Å²	50.1	33%	0.327	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.7	177	-75.3	167.1	-177.2	0	0	113.6	Q254 V256 D260	Q254-E258 HydrophobicContact CG-CG 4.43Å; Q254-E258 VanDerWaalsContact CG-OE1 3.31Å; Q254-E258 WeakPolarHBondContact CG-OE1 3.34Å; Q254-E258 PolarHBondContact NE2-OE1 3.05Å; Q254-E258 VanDerWaalsContact NE2-OE1 3.15Å; Q254-E258 VanDerWaalsContact O-CG 3.32Å; Q254-E258 WeakPolarHBondContact O-CG 3.44Å; Q254-E258 PolarHBondContact O-N 3.02Å; V256-E258 VanDerWaalsContact C-N 3.3Å; V256-E258 PolarHBondContact O-N 2.95Å; E258-D260 PolarHBondContact O-N 2.96Å
259	S	83.8	Confident	87.3	Confident	32 Å²	32	48.8 Å²	48.8	22%	0.224	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.4	177.3	72.1	0	0	0	0	112.7	V256 L257 T261 R342	V256-S259 PolarHBondContact O-N 2.89Å; V256-S259 PolarHBondContact O-OG 3.33Å; L257-S259 VanDerWaalsContact C-N 3.26Å; L257-S259 PolarHBondContact O-N 3.02Å; S259-T261 PolarHBondContact O-N 2.7Å; S259-R342 PolarHBondContact OG-O 2.91Å; S259-R342 VanDerWaalsContact OG-O 3.13Å
260	D	84.5	Confident	87.4	Confident	35 Å²	35	45 Å²	45	19%	0.187	23%	0.233	C	C	.	.			trans	-83.2	84.3	168.8	-174.8	-8.9	0	0	0	109.6	L257 E258 Q262 R263 E264 F345	L257-D260 PolarHBondContact O-N 2.87Å; E258-D260 PolarHBondContact O-N 2.96Å; D260-Q262 PolarHBondContact O-N 3.45Å; D260-Q262 PolarHBondContact OD1-N 2.94Å; D260-R263 HydrophobicContact CB-CB 4.03Å; D260-R263 VanDerWaalsContact CG-CB 3.41Å; D260-R263 PolarHBondContact O-N 2.92Å; D260-R263 PolarHBondContact OD1-N 3.31Å; D260-R263 WeakPolarHBondContact OD2-CB 3.45Å; D260-E264 PolarHBondContact O-N 2.85Å; D260-F345 HydrophobicContact CB-CD1 4.37Å; D260-F345 HydrophobicContact CB-CE1 3.79Å
261	T	83.2	Confident	87.5	Confident	100 Å²	100	49.5 Å²	49.5	61%	0.613	25%	0.246	S	C	*	.	H	α-helix	trans	-56.2	-37	179.8	53.5	0	0	0	0	112.6	S259 E264 D265	S259-T261 PolarHBondContact O-N 2.7Å; T261-E264 PolarHBondContact O-N 3.34Å; T261-D265 VanDerWaalsContact O-CB 3.27Å; T261-D265 WeakPolarHBondContact O-CB 3.28Å; T261-D265 PolarHBondContact O-N 3.34Å
262	Q	83.8	Confident	87.3	Confident	116 Å²	116	54.3 Å²	54.3	54%	0.542	26%	0.259	S	S	.	.	H	α-helix	trans	-65.8	-45.6	179.8	-178.2	177.1	-11.1	0	0	111.2	D260 L266 I300	D260-Q262 PolarHBondContact O-N 3.45Å; D260-Q262 PolarHBondContact OD1-N 2.94Å; Q262-L266 HydrophobicContact CG-CD1 4.3Å; Q262-L266 VanDerWaalsContact O-CG 3.25Å; Q262-L266 WeakPolarHBondContact O-CG 3.46Å; Q262-L266 PolarHBondContact O-N 3.49Å; Q262-L266 VanDerWaalsContact O-N 3.11Å; Q262-I300 HydrophobicContact CG-CD1 4.09Å
263	R	85.9	Confident	87.1	Confident	20 Å²	20	55 Å²	55	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-46.2	175.6	175.5	177.8	167.5	-87.1	-4.1	111.6	L257 D260 L266 L267 A302	L257-R263 PolarHBondContact O-NH1 2.85Å; D260-R263 HydrophobicContact CB-CB 4.03Å; D260-R263 VanDerWaalsContact CG-CB 3.41Å; D260-R263 PolarHBondContact O-N 2.92Å; D260-R263 PolarHBondContact OD1-N 3.31Å; D260-R263 WeakPolarHBondContact OD2-CB 3.45Å; R263-L266 PolarHBondContact O-N 3.5Å; R263-L267 HydrophobicContact CG-CD1 3.95Å; R263-L267 HydrophobicContact CG-CG 4.47Å; R263-L267 WeakPolarHBondContact O-CG 3.35Å; R263-L267 PolarHBondContact O-N 3.4Å; R263-A302 HydrophobicContact CG-CB 4.45Å
264	E	85.6	Confident	87	Confident	29 Å²	29	55.7 Å²	55.7	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-38.7	-177.8	-171	55.8	-146.8	0	0	111.8	D260 T261 L267 N268 R271	D260-E264 PolarHBondContact O-N 2.85Å; T261-E264 PolarHBondContact O-N 3.34Å; E264-L267 PolarHBondContact O-N 2.88Å; E264-N268 WeakPolarHBondContact O-CB 3.29Å; E264-N268 VanDerWaalsContact O-CG 3.31Å; E264-N268 PolarHBondContact O-N 3.34Å; E264-N268 PolarHBondContact O-ND2 3.06Å; E264-N268 PolarHBondContact OE1-ND2 3.08Å; E264-R271 IonicContact OE1-NH2 2.86Å; E264-R271 PolarHBondContact OE1-NH2 2.96Å
265	D	87.8	Confident	86.8	Confident	107 Å²	107	54.6 Å²	54.6	57%	0.572	27%	0.27	S	S	*	.	H	α-helix	trans	-62	-44.8	174.2	-76.9	-19.5	0	0	0	111.6	T261 N268 E269	T261-D265 VanDerWaalsContact O-CB 3.27Å; T261-D265 WeakPolarHBondContact O-CB 3.28Å; T261-D265 PolarHBondContact O-N 3.34Å; D265-N268 PolarHBondContact O-N 2.89Å; D265-E269 WeakPolarHBondContact O-CB 3.31Å; D265-E269 PolarHBondContact O-N 2.89Å
266	L	88.7	Confident	86.5	Confident	13 Å²	13	60.5 Å²	60.5	7%	0.068	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-43.1	177.1	-72.1	171.1	0	0	0	112	Q262 R263 N268 E269 E270 I293 K296 L297 I300	Q262-L266 HydrophobicContact CG-CD1 4.3Å; Q262-L266 VanDerWaalsContact O-CG 3.25Å; Q262-L266 WeakPolarHBondContact O-CG 3.46Å; Q262-L266 PolarHBondContact O-N 3.49Å; Q262-L266 VanDerWaalsContact O-N 3.11Å; R263-L266 PolarHBondContact O-N 3.5Å; L266-N268 VanDerWaalsContact C-N 3.34Å; L266-N268 PolarHBondContact O-N 3.34Å; L266-E269 PolarHBondContact O-N 2.7Å; L266-E270 WeakPolarHBondContact O-CB 3.49Å; L266-E270 PolarHBondContact O-N 3.25Å; L266-I293 HydrophobicContact CB-CG2 4.34Å; L266-I293 HydrophobicContact CD2-CG1 4.22Å; L266-I293 HydrophobicContact CD2-CG2 4.27Å; L266-K296 HydrophobicContact CD1-CB 4.01Å; L266-K296 HydrophobicContact CD2-CD 4.29Å; L266-L297 HydrophobicContact CB-CD2 3.82Å; L266-L297 HydrophobicContact CB-CG 4.3Å; L266-L297 HydrophobicContact CD1-CD2 4.3Å; L266-I300 HydrophobicContact CD1-CD1 3.67Å
267	L	88	Confident	86.2	Confident	34 Å²	34	63.8 Å²	63.8	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-67.5	-33.1	176.9	-71.2	172.5	0	0	0	112.6	R263 E264 R271 L297	R263-L267 HydrophobicContact CG-CD1 3.95Å; R263-L267 HydrophobicContact CG-CG 4.47Å; R263-L267 WeakPolarHBondContact O-CG 3.35Å; R263-L267 PolarHBondContact O-N 3.4Å; E264-L267 PolarHBondContact O-N 2.88Å; L267-R271 WeakPolarHBondContact O-CB 3.35Å; L267-R271 WeakPolarHBondContact O-CG 3.44Å; L267-R271 PolarHBondContact O-N 3.39Å; L267-R271 PolarHBondContact O-NE 3Å; L267-L297 HydrophobicContact CD2-CD1 4.14Å; L267-L297 HydrophobicContact CD2-CD2 4.09Å; L267-L297 HydrophobicContact CG-CD2 4.18Å
268	N	88.4	Confident	85.9	Confident	47 Å²	47	67.5 Å²	67.5	25%	0.251	34%	0.34	S	S	.	.	H	α-helix	trans	-72.3	-39.5	173.8	-78.5	-46	0	0	0	111.7	E264 D265 L266 R271 R272	E264-N268 WeakPolarHBondContact O-CB 3.29Å; E264-N268 VanDerWaalsContact O-CG 3.31Å; E264-N268 PolarHBondContact O-N 3.34Å; E264-N268 PolarHBondContact O-ND2 3.06Å; E264-N268 PolarHBondContact OE1-ND2 3.08Å; D265-N268 PolarHBondContact O-N 2.89Å; L266-N268 VanDerWaalsContact C-N 3.34Å; L266-N268 PolarHBondContact O-N 3.34Å; N268-R271 PolarHBondContact OD1-NH2 2.94Å; N268-R272 WeakPolarHBondContact O-CB 3.46Å; N268-R272 VanDerWaalsContact O-CG 3.24Å; N268-R272 WeakPolarHBondContact O-CG 3.3Å; N268-R272 PolarHBondContact O-N 3.19Å
269	E	88.3	Confident	85.8	Confident	61 Å²	61	70.1 Å²	70.1	29%	0.285	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-45.3	172.9	-162.7	179.5	170	0	0	110.3	D265 L266 R272 L273 R289 I293	D265-E269 WeakPolarHBondContact O-CB 3.31Å; D265-E269 PolarHBondContact O-N 2.89Å; L266-E269 PolarHBondContact O-N 2.7Å; E269-R272 PolarHBondContact O-N 2.97Å; E269-L273 HydrophobicContact CG-CD1 4.23Å; E269-L273 WeakPolarHBondContact O-CG 3.39Å; E269-L273 PolarHBondContact O-N 3.14Å; E269-R289 IonicContact OE1-CZ 3.18Å; E269-R289 IonicContact OE1-NE 2.91Å; E269-R289 PolarHBondContact OE1-NE 3.36Å; E269-R289 IonicContact OE1-NH2 2.77Å; E269-R289 PolarHBondContact OE1-NH2 3.23Å; E269-R289 IonicContact OE2-NE 2.99Å; E269-R289 IonicContact OE2-NH2 3.59Å; E269-R289 PolarHBondContact OE2-NH2 3.49Å; E269-I293 HydrophobicContact CB-CD1 4.05Å; E269-I293 HydrophobicContact CG-CD1 3.7Å
270	E	88.8	Confident	85.3	Confident	37 Å²	37	71.9 Å²	71.9	17%	0.173	38%	0.379	C	S	.	.	H	α-helix	trans	-57.5	-52.1	174.7	-169.8	-154.3	160.5	0	0	111.9	L266 R272 L273 N274 I293 Y294	L266-E270 WeakPolarHBondContact O-CB 3.49Å; L266-E270 PolarHBondContact O-N 3.25Å; E270-R272 VanDerWaalsContact C-N 3.29Å; E270-R272 PolarHBondContact O-N 3.32Å; E270-L273 PolarHBondContact O-N 2.72Å; E270-N274 WeakPolarHBondContact O-CB 3.38Å; E270-N274 PolarHBondContact O-N 3.3Å; E270-N274 PolarHBondContact OE1-ND2 2.69Å; E270-I293 HydrophobicContact CB-CG2 4.22Å; E270-Y294 HydrophobicContact CG-CE1 4.13Å; E270-Y294 WeakPolarHBondContact OE1-CE1 3.22Å; E270-Y294 PolarHBondContact OE1-OH 3.48Å
271	R	87.9	Confident	84.6	Confident	135 Å²	135	75.1 Å²	75.1	51%	0.509	40%	0.401	S	S	.	.	H	α-helix	trans	-57	-41.6	177.3	-82	-178.3	-87	168.3	-8.7	112	E264 L267 N268 A275	E264-R271 IonicContact OE1-NH2 2.86Å; E264-R271 PolarHBondContact OE1-NH2 2.96Å; L267-R271 WeakPolarHBondContact O-CB 3.35Å; L267-R271 WeakPolarHBondContact O-CG 3.44Å; L267-R271 PolarHBondContact O-N 3.39Å; L267-R271 PolarHBondContact O-NE 3Å; N268-R271 PolarHBondContact OD1-NH2 2.94Å; R271-A275 WeakPolarHBondContact O-CB 3.47Å; R271-A275 PolarHBondContact O-N 3.44Å
272	R	87.8	Confident	83.7	Confident	179 Å²	179	72.2 Å²	72.2	68%	0.675	39%	0.387	S	S	*	.	H	α-helix	trans	-66.7	-45	178.5	-75.2	172.8	-177.6	174.8	4.4	112.1	N268 E269 E270 A275 R276	N268-R272 WeakPolarHBondContact O-CB 3.46Å; N268-R272 VanDerWaalsContact O-CG 3.24Å; N268-R272 WeakPolarHBondContact O-CG 3.3Å; N268-R272 PolarHBondContact O-N 3.19Å; E269-R272 PolarHBondContact O-N 2.97Å; E270-R272 VanDerWaalsContact C-N 3.29Å; E270-R272 PolarHBondContact O-N 3.32Å; R272-A275 PolarHBondContact O-N 3.41Å; R272-R276 WeakPolarHBondContact O-CG 3.42Å; R272-R276 PolarHBondContact O-N 3.25Å; R272-R276 VanDerWaalsContact O-N 3.12Å
273	L	86.1	Confident	83	Confident	14 Å²	14	73 Å²	73	7%	0.073	39%	0.394	C	S	.	.	H	α-helix	trans	-68	-44	179.3	-69.8	174.2	0	0	0	111.3	E269 E270 A275 R276 I277 E286 R289 L290 I293	E269-L273 HydrophobicContact CG-CD1 4.23Å; E269-L273 WeakPolarHBondContact O-CG 3.39Å; E269-L273 PolarHBondContact O-N 3.14Å; E270-L273 PolarHBondContact O-N 2.72Å; L273-A275 VanDerWaalsContact C-N 3.3Å; L273-A275 PolarHBondContact O-N 3.23Å; L273-R276 PolarHBondContact O-N 3.35Å; L273-R276 VanDerWaalsContact O-N 3.11Å; L273-I277 VanDerWaalsContact O-CG1 3.3Å; L273-I277 WeakPolarHBondContact O-CG1 3.43Å; L273-I277 PolarHBondContact O-N 3.39Å; L273-E286 HydrophobicContact CD2-CB 4.03Å; L273-E286 HydrophobicContact CD2-CG 3.93Å; L273-R289 HydrophobicContact CD1-CB 4.42Å; L273-R289 HydrophobicContact CD1-CG 4Å; L273-L290 HydrophobicContact CB-CD1 3.81Å; L273-L290 HydrophobicContact CD1-CD1 4.46Å; L273-I293 HydrophobicContact CD1-CD1 3.65Å
274	N	86.4	Confident	82.3	Confident	58 Å²	58	74.9 Å²	74.9	31%	0.31	42%	0.421	S	S	.	.	H	α-helix	trans	-59.1	-40.2	174.9	-80.6	-25.3	0	0	0	112	E270 I277 A278 L290	E270-N274 WeakPolarHBondContact O-CB 3.38Å; E270-N274 PolarHBondContact O-N 3.3Å; E270-N274 PolarHBondContact OE1-ND2 2.69Å; N274-I277 PolarHBondContact O-N 3.08Å; N274-A278 VanDerWaalsContact O-CB 3.31Å; N274-A278 WeakPolarHBondContact O-CB 3.13Å; N274-A278 PolarHBondContact O-N 3.13Å; N274-L290 WeakPolarHBondContact OD1-CD1 3.48Å
275	A	85.8	Confident	81.7	Confident	48 Å²	48	81.4 Å²	81.4	40%	0.397	45%	0.453	S	S	.	.	H	α-helix	trans	-65	-38.1	175	0	0	0	0	0	112.9	R271 R272 L273 N279	R271-A275 WeakPolarHBondContact O-CB 3.47Å; R271-A275 PolarHBondContact O-N 3.44Å; R272-A275 PolarHBondContact O-N 3.41Å; L273-A275 VanDerWaalsContact C-N 3.3Å; L273-A275 PolarHBondContact O-N 3.23Å; A275-N279 WeakPolarHBondContact O-CB 3.47Å; A275-N279 PolarHBondContact O-N 3.04Å; A275-N279 PolarHBondContact O-ND2 3Å
276	R	83.2	Confident	81.2	Confident	129 Å²	129	77.9 Å²	77.9	49%	0.487	43%	0.433	S	S	.	.	H	α-helix	trans	-69.6	-39.5	176.4	-74.1	-178.2	-175.7	-176.1	1.7	113	R272 L273 N279 G280 T281 E286	R272-R276 WeakPolarHBondContact O-CG 3.42Å; R272-R276 PolarHBondContact O-N 3.25Å; R272-R276 VanDerWaalsContact O-N 3.12Å; L273-R276 PolarHBondContact O-N 3.35Å; L273-R276 VanDerWaalsContact O-N 3.11Å; R276-N279 PolarHBondContact O-N 3.33Å; R276-G280 PolarHBondContact O-N 3.07Å; R276-T281 PolarHBondContact O-N 3.07Å; R276-T281 PolarHBondContact O-OG1 2.87Å; R276-E286 WeakPolarHBondContact CD-OE1 3.01Å; R276-E286 IonicContact CZ-OE1 3.83Å; R276-E286 IonicContact NH1-OE1 3.46Å; R276-E286 PolarHBondContact NH1-OE1 3.04Å
277	I	82.4	Confident	80.7	Confident	69 Å²	69	80.8 Å²	80.8	35%	0.354	45%	0.454	S	S	.	.	H	α-helix	trans	-63.4	-46	174.7	-67	164.2	0	0	0	109.7	L273 N274 N279 G280 A282 L290	L273-I277 VanDerWaalsContact O-CG1 3.3Å; L273-I277 WeakPolarHBondContact O-CG1 3.43Å; L273-I277 PolarHBondContact O-N 3.39Å; N274-I277 PolarHBondContact O-N 3.08Å; I277-N279 VanDerWaalsContact C-N 3.26Å; I277-N279 PolarHBondContact O-N 3.02Å; I277-G280 PolarHBondContact O-N 3.26Å; I277-A282 HydrophobicContact CB-CB 4.2Å; I277-A282 HydrophobicContact CG1-CB 3.56Å; I277-L290 HydrophobicContact CD1-CD1 4.26Å
278	A	82.2	Confident	80.6	Confident	84 Å²	84	83.4 Å²	83.4	69%	0.694	47%	0.472	S	S	*	.	H	α-helix	trans	-61.7	-33.6	176.4	0	0	0	0	0	112.8	N274 G280	N274-A278 VanDerWaalsContact O-CB 3.31Å; N274-A278 WeakPolarHBondContact O-CB 3.13Å; N274-A278 PolarHBondContact O-N 3.13Å; A278-G280 VanDerWaalsContact C-N 3.27Å; A278-G280 PolarHBondContact O-N 2.98Å
279	N	82.6	Confident	80.5	Confident	126 Å²	126	85.1 Å²	85.1	67%	0.674	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	0.8	176.8	-69.4	-19.7	0	0	0	114	A275 R276 I277 T281	A275-N279 WeakPolarHBondContact O-CB 3.47Å; A275-N279 PolarHBondContact O-N 3.04Å; A275-N279 PolarHBondContact O-ND2 3Å; R276-N279 PolarHBondContact O-N 3.33Å; I277-N279 VanDerWaalsContact C-N 3.26Å; I277-N279 PolarHBondContact O-N 3.02Å; N279-T281 PolarHBondContact O-N 3.4Å
280	G	74.3	Confident	80.4	Confident	69 Å²	69	83.1 Å²	83.1	71%	0.711	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	13.2	175.5	0	0	0	0	0	115.2	R276 I277 A278	R276-G280 PolarHBondContact O-N 3.07Å; I277-G280 PolarHBondContact O-N 3.26Å; A278-G280 VanDerWaalsContact C-N 3.27Å; A278-G280 PolarHBondContact O-N 2.98Å
281	T	70	Confident	80.3	Confident	103 Å²	103	85.1 Å²	85.1	63%	0.632	48%	0.484	S	S	*	.			trans	-97.4	8.7	180	49.7	0	0	0	0	113.4	R276 N279	R276-T281 PolarHBondContact O-N 3.07Å; R276-T281 PolarHBondContact O-OG1 2.87Å; N279-T281 PolarHBondContact O-N 3.4Å
282	A	63.6	Low	80.4	Confident	39 Å²	39	83 Å²	83	32%	0.322	48%	0.479	S	S	.	.			trans	-88.2	132.8	-171	0	0	0	0	0	113	I277 E286	I277-A282 HydrophobicContact CB-CB 4.2Å; I277-A282 HydrophobicContact CG1-CB 3.56Å; A282-E286 WeakPolarHBondContact CA-OE2 3.21Å; A282-E286 WeakPolarHBondContact CB-OE2 3.45Å
283	D	69.3	Low	80.5	Confident	131 Å²	131	74.4 Å²	74.4	70%	0.701	45%	0.447	S	S	*	.			trans	-85.7	157.2	169.1	-87.4	-25.5	0	0	0	111.3	M285 E286	D283-M285 PolarHBondContact O-N 3.17Å; D283-E286 PolarHBondContact O-N 3.06Å
284	G	70.6	Confident	80.6	Confident	61 Å²	61	78.6 Å²	78.6	63%	0.629	46%	0.463	S	S	*	.	H	α-helix	trans	-57	-21.5	179	0	0	0	0	0	115.2
285	M	74.2	Confident	80.8	Confident	165 Å²	165	78.6 Å²	78.6	81%	0.813	47%	0.47	S	S	*	.	H	α-helix	trans	-68	-33.5	172.7	-87.5	-176.8	173.9	0	0	113.3	D283 S287 V288 R289	D283-M285 PolarHBondContact O-N 3.17Å; M285-S287 VanDerWaalsContact C-N 3.3Å; M285-S287 PolarHBondContact O-N 3.17Å; M285-V288 PolarHBondContact O-N 3.49Å; M285-R289 PolarHBondContact O-N 3.37Å; M285-R289 VanDerWaalsContact O-N 3.11Å
286	E	76.7	Confident	80.9	Confident	34 Å²	34	80 Å²	80	16%	0.159	47%	0.468	C	S	.	.	H	α-helix	trans	-68	-32.3	180	-70.4	-167.1	155.9	0	0	111.2	L273 R276 A282 D283 R289 L290	L273-E286 HydrophobicContact CD2-CB 4.03Å; L273-E286 HydrophobicContact CD2-CG 3.93Å; R276-E286 WeakPolarHBondContact CD-OE1 3.01Å; R276-E286 IonicContact CZ-OE1 3.83Å; R276-E286 IonicContact NH1-OE1 3.46Å; R276-E286 PolarHBondContact NH1-OE1 3.04Å; A282-E286 WeakPolarHBondContact CA-OE2 3.21Å; A282-E286 WeakPolarHBondContact CB-OE2 3.45Å; D283-E286 PolarHBondContact O-N 3.06Å; E286-R289 PolarHBondContact O-N 3.37Å; E286-L290 WeakPolarHBondContact O-CB 3.4Å; E286-L290 PolarHBondContact O-N 3.12Å
287	S	78.3	Confident	81.1	Confident	73 Å²	73	74.6 Å²	74.6	51%	0.51	45%	0.448	S	S	.	.	H	α-helix	trans	-67.9	-35.4	174.1	-175.6	0	0	0	0	113	M285 S291	M285-S287 VanDerWaalsContact C-N 3.3Å; M285-S287 PolarHBondContact O-N 3.17Å; S287-S291 PolarHBondContact O-N 3.19Å
288	V	85	Confident	81.4	Confident	90 Å²	90	78.8 Å²	78.8	55%	0.545	47%	0.466	S	S	.	.	H	α-helix	trans	-67.9	-44.9	175.7	177.4	0	0	0	0	109.6	M285 L290 S291 E292	M285-V288 PolarHBondContact O-N 3.49Å; V288-L290 VanDerWaalsContact C-N 3.32Å; V288-L290 PolarHBondContact O-N 3.37Å; V288-S291 WeakPolarHBondContact O-CB 3.32Å; V288-S291 PolarHBondContact O-N 2.83Å; V288-S291 VanDerWaalsContact O-N 3.16Å; V288-E292 PolarHBondContact O-N 2.92Å; V288-E292 VanDerWaalsContact O-N 3.1Å
289	R	86.6	Confident	81.6	Confident	83 Å²	83	82.5 Å²	82.5	31%	0.313	47%	0.469	S	S	.	.	H	α-helix	trans	-60.6	-40.6	176.2	-177.3	56.4	177	-176.8	-0.9	112.5	E269 L273 M285 E286 S291 E292 I293	E269-R289 IonicContact OE1-CZ 3.18Å; E269-R289 IonicContact OE1-NE 2.91Å; E269-R289 PolarHBondContact OE1-NE 3.36Å; E269-R289 IonicContact OE1-NH2 2.77Å; E269-R289 PolarHBondContact OE1-NH2 3.23Å; E269-R289 IonicContact OE2-NE 2.99Å; E269-R289 IonicContact OE2-NH2 3.59Å; E269-R289 PolarHBondContact OE2-NH2 3.49Å; L273-R289 HydrophobicContact CD1-CB 4.42Å; L273-R289 HydrophobicContact CD1-CG 4Å; M285-R289 PolarHBondContact O-N 3.37Å; M285-R289 VanDerWaalsContact O-N 3.11Å; E286-R289 PolarHBondContact O-N 3.37Å; R289-S291 VanDerWaalsContact C-N 3.31Å; R289-S291 PolarHBondContact O-N 3.36Å; R289-E292 WeakPolarHBondContact CD-OE2 3.48Å; R289-E292 IonicContact CZ-OE2 3.09Å; R289-E292 IonicContact NH1-OE2 3.23Å; R289-E292 PolarHBondContact NH1-OE2 3.25Å; R289-E292 WeakPolarHBondContact O-CB 3.42Å; R289-E292 PolarHBondContact O-N 3.22Å; R289-I293 HydrophobicContact CG-CD1 4.13Å; R289-I293 WeakPolarHBondContact O-CG1 3.32Å; R289-I293 PolarHBondContact O-N 2.91Å
290	L	86.4	Confident	81.6	Confident	19 Å²	19	78.2 Å²	78.2	10%	0.099	45%	0.446	C	S	.	.	H	α-helix	trans	-59.9	-40.9	175.3	-165.3	103.5	0	0	0	111.9	L273 N274 I277 E286 V288 I293 Y294	L273-L290 HydrophobicContact CB-CD1 3.81Å; L273-L290 HydrophobicContact CD1-CD1 4.46Å; N274-L290 WeakPolarHBondContact OD1-CD1 3.48Å; I277-L290 HydrophobicContact CD1-CD1 4.26Å; E286-L290 WeakPolarHBondContact O-CB 3.4Å; E286-L290 PolarHBondContact O-N 3.12Å; V288-L290 VanDerWaalsContact C-N 3.32Å; V288-L290 PolarHBondContact O-N 3.37Å; L290-I293 PolarHBondContact O-N 3.39Å; L290-Y294 HydrophobicContact CD2-CD2 4.14Å; L290-Y294 HydrophobicContact CD2-CE2 3.34Å; L290-Y294 HydrophobicContact CG-CD2 4.3Å; L290-Y294 HydrophobicContact CG-CE2 3.76Å; L290-Y294 WeakPolarHBondContact O-CD2 3.47Å; L290-Y294 PolarHBondContact O-N 2.92Å
291	S	86.8	Confident	82.1	Confident	78 Å²	78	79 Å²	79	55%	0.545	43%	0.431	S	S	.	.	H	α-helix	trans	-65.4	-37.9	175.4	-169.7	0	0	0	0	112.8	S287 V288 R289 I293 Y294 A295	S287-S291 PolarHBondContact O-N 3.19Å; V288-S291 WeakPolarHBondContact O-CB 3.32Å; V288-S291 PolarHBondContact O-N 2.83Å; V288-S291 VanDerWaalsContact O-N 3.16Å; R289-S291 VanDerWaalsContact C-N 3.31Å; R289-S291 PolarHBondContact O-N 3.36Å; S291-I293 VanDerWaalsContact C-N 3.32Å; S291-Y294 PolarHBondContact O-N 3.22Å; S291-A295 PolarHBondContact O-N 3.34Å; S291-A295 VanDerWaalsContact O-N 3.11Å
292	E	89.8	Confident	82.7	Confident	90 Å²	90	74.5 Å²	74.5	42%	0.421	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-38.4	173.3	-66.4	177.4	176.1	0	0	111.8	V288 R289 A295 K296	V288-E292 PolarHBondContact O-N 2.92Å; V288-E292 VanDerWaalsContact O-N 3.1Å; R289-E292 WeakPolarHBondContact CD-OE2 3.48Å; R289-E292 IonicContact CZ-OE2 3.09Å; R289-E292 IonicContact NH1-OE2 3.23Å; R289-E292 PolarHBondContact NH1-OE2 3.25Å; R289-E292 WeakPolarHBondContact O-CB 3.42Å; R289-E292 PolarHBondContact O-N 3.22Å; E292-A295 PolarHBondContact O-N 2.69Å; E292-K296 WeakPolarHBondContact O-CG 3.41Å; E292-K296 PolarHBondContact O-N 2.81Å; E292-K296 VanDerWaalsContact O-N 3.09Å
293	I	89.8	Confident	83.7	Confident	0 Å²	0	80 Å²	80	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-65.9	-46	177.6	-68.7	164.4	0	0	0	110.2	L266 E269 E270 L273 R289 L290 S291 A295 K296 L297	L266-I293 HydrophobicContact CB-CG2 4.34Å; L266-I293 HydrophobicContact CD2-CG1 4.22Å; L266-I293 HydrophobicContact CD2-CG2 4.27Å; E269-I293 HydrophobicContact CB-CD1 4.05Å; E269-I293 HydrophobicContact CG-CD1 3.7Å; E270-I293 HydrophobicContact CB-CG2 4.22Å; L273-I293 HydrophobicContact CD1-CD1 3.65Å; R289-I293 HydrophobicContact CG-CD1 4.13Å; R289-I293 WeakPolarHBondContact O-CG1 3.32Å; R289-I293 PolarHBondContact O-N 2.91Å; L290-I293 PolarHBondContact O-N 3.39Å; S291-I293 VanDerWaalsContact C-N 3.32Å; I293-A295 VanDerWaalsContact C-N 3.33Å; I293-A295 PolarHBondContact O-N 3.1Å; I293-K296 PolarHBondContact O-N 3.2Å; I293-K296 VanDerWaalsContact O-N 3.16Å; I293-L297 HydrophobicContact CG2-CD1 3.78Å; I293-L297 HydrophobicContact CG2-CG 4.17Å; I293-L297 WeakPolarHBondContact O-CB 3.49Å; I293-L297 WeakPolarHBondContact O-CG 3.36Å; I293-L297 PolarHBondContact O-N 3.49Å
294	Y	88.9	Confident	84.6	Confident	102 Å²	102	79.2 Å²	79.2	40%	0.4	42%	0.419	S	S	.	.	H	α-helix	trans	-59.8	-42.3	176.1	-72.1	-44.9	0	0	0	112.4	E270 L290 S291 K296 L297 E298	E270-Y294 HydrophobicContact CG-CE1 4.13Å; E270-Y294 WeakPolarHBondContact OE1-CE1 3.22Å; E270-Y294 PolarHBondContact OE1-OH 3.48Å; L290-Y294 HydrophobicContact CD2-CD2 4.14Å; L290-Y294 HydrophobicContact CD2-CE2 3.34Å; L290-Y294 HydrophobicContact CG-CD2 4.3Å; L290-Y294 HydrophobicContact CG-CE2 3.76Å; L290-Y294 WeakPolarHBondContact O-CD2 3.47Å; L290-Y294 PolarHBondContact O-N 2.92Å; S291-Y294 PolarHBondContact O-N 3.22Å; Y294-K296 VanDerWaalsContact C-N 3.31Å; Y294-K296 PolarHBondContact O-N 2.88Å; Y294-L297 HydrophobicContact CD1-CD1 4.44Å; Y294-L297 PolarHBondContact O-N 2.99Å; Y294-E298 WeakPolarHBondContact O-CB 3.21Å; Y294-E298 PolarHBondContact O-N 3.37Å
295	A	89.7	Confident	85.5	Confident	57 Å²	57	76.3 Å²	76.3	47%	0.471	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-40.8	175.7	0	0	0	0	0	112.2	S291 E292 I293 E299	S291-A295 PolarHBondContact O-N 3.34Å; S291-A295 VanDerWaalsContact O-N 3.11Å; E292-A295 PolarHBondContact O-N 2.69Å; I293-A295 VanDerWaalsContact C-N 3.33Å; I293-A295 PolarHBondContact O-N 3.1Å; A295-E299 PolarHBondContact O-N 3.38Å
296	K	88.6	Confident	86.2	Confident	79 Å²	79	70.8 Å²	70.8	34%	0.343	37%	0.366	S	S	.	.	H	α-helix	trans	-70.2	-38.3	176.1	-72.7	176.9	179.5	178.2	0	113	L266 E292 I293 Y294 E298 E299 I300	L266-K296 HydrophobicContact CD1-CB 4.01Å; L266-K296 HydrophobicContact CD2-CD 4.29Å; E292-K296 WeakPolarHBondContact O-CG 3.41Å; E292-K296 PolarHBondContact O-N 2.81Å; E292-K296 VanDerWaalsContact O-N 3.09Å; I293-K296 PolarHBondContact O-N 3.2Å; I293-K296 VanDerWaalsContact O-N 3.16Å; Y294-K296 VanDerWaalsContact C-N 3.31Å; Y294-K296 PolarHBondContact O-N 2.88Å; K296-E298 VanDerWaalsContact C-N 3.3Å; K296-E299 PolarHBondContact O-N 2.91Å; K296-I300 WeakPolarHBondContact O-CD1 3.5Å; K296-I300 VanDerWaalsContact O-CG1 3.25Å; K296-I300 WeakPolarHBondContact O-CG1 3.47Å; K296-I300 PolarHBondContact O-N 3.49Å
297	L	87.4	Confident	86.8	Confident	14 Å²	14	72.2 Å²	72.2	7%	0.073	38%	0.383	C	S	.	.	H	α-helix	trans	-65.6	-36.2	176.4	-74.7	172.6	0	0	0	111.4	L266 L267 I293 Y294 E301 A302	L266-L297 HydrophobicContact CB-CD2 3.82Å; L266-L297 HydrophobicContact CB-CG 4.3Å; L266-L297 HydrophobicContact CD1-CD2 4.3Å; L267-L297 HydrophobicContact CD2-CD1 4.14Å; L267-L297 HydrophobicContact CD2-CD2 4.09Å; L267-L297 HydrophobicContact CG-CD2 4.18Å; I293-L297 HydrophobicContact CG2-CD1 3.78Å; I293-L297 HydrophobicContact CG2-CG 4.17Å; I293-L297 WeakPolarHBondContact O-CB 3.49Å; I293-L297 WeakPolarHBondContact O-CG 3.36Å; I293-L297 PolarHBondContact O-N 3.49Å; Y294-L297 HydrophobicContact CD1-CD1 4.44Å; Y294-L297 PolarHBondContact O-N 2.99Å; L297-E301 PolarHBondContact O-N 2.76Å; L297-A302 HydrophobicContact CB-CB 4.17Å; L297-A302 HydrophobicContact CD2-CB 3.82Å; L297-A302 WeakPolarHBondContact O-CB 3.48Å; L297-A302 PolarHBondContact O-N 3.28Å
298	E	88.3	Confident	87.3	Confident	158 Å²	158	71.8 Å²	71.8	74%	0.738	37%	0.37	S	S	*	.	H	α-helix	trans	-67	-44.1	173	-168.3	174.1	-171.5	0	0	111.4	Y294 K296 I300 E301	Y294-E298 WeakPolarHBondContact O-CB 3.21Å; Y294-E298 PolarHBondContact O-N 3.37Å; K296-E298 VanDerWaalsContact C-N 3.3Å; E298-I300 VanDerWaalsContact C-N 3.31Å; E298-I300 PolarHBondContact O-N 2.86Å; E298-E301 PolarHBondContact O-N 3.49Å
299	E	86.7	Confident	87.6	Confident	162 Å²	162	67.5 Å²	67.5	76%	0.757	34%	0.344	S	S	*	.	H	α-helix	trans	-59.9	-38.2	176	-173.1	178.9	-171.8	0	0	112.8	A295 K296 E301	A295-E299 PolarHBondContact O-N 3.38Å; K296-E299 PolarHBondContact O-N 2.91Å; E299-E301 PolarHBondContact O-N 2.88Å
300	I	83	Confident	87.8	Confident	35 Å²	35	65.5 Å²	65.5	18%	0.179	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.8	178.1	-63.3	164.9	0	0	0	111.9	Q262 L266 K296 E298 A302 R308	Q262-I300 HydrophobicContact CG-CD1 4.09Å; L266-I300 HydrophobicContact CD1-CD1 3.67Å; K296-I300 WeakPolarHBondContact O-CD1 3.5Å; K296-I300 VanDerWaalsContact O-CG1 3.25Å; K296-I300 WeakPolarHBondContact O-CG1 3.47Å; K296-I300 PolarHBondContact O-N 3.49Å; E298-I300 VanDerWaalsContact C-N 3.31Å; E298-I300 PolarHBondContact O-N 2.86Å; I300-A302 VanDerWaalsContact C-N 3.32Å; I300-A302 PolarHBondContact O-N 2.95Å; I300-R308 PolarHBondContact O-NH2 3.31Å
301	E	85.2	Confident	88	Confident	85 Å²	85	68.2 Å²	68.2	40%	0.397	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	49.6	-171.8	-54.3	-169.1	133.3	0	0	111.9	L297 E298 E299 D303 K304 A305	L297-E301 PolarHBondContact O-N 2.76Å; E298-E301 PolarHBondContact O-N 3.49Å; E299-E301 PolarHBondContact O-N 2.88Å; E301-D303 PolarHBondContact O-N 3.39Å; E301-K304 HydrophobicContact CB-CB 4.33Å; E301-K304 HydrophobicContact CB-CD 4.25Å; E301-K304 HydrophobicContact CB-CG 4.47Å; E301-K304 PolarHBondContact O-N 2.84Å; E301-K304 IonicContact OE1-NZ 2.69Å; E301-K304 PolarHBondContact OE1-NZ 2.91Å; E301-K304 IonicContact OE2-NZ 3.5Å; E301-A305 PolarHBondContact O-N 3.1Å
302	A	82.3	Confident	88.2	Confident	9 Å²	9	64.9 Å²	64.9	7%	0.074	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.3	-174.2	0	0	0	0	0	113.4	R263 L297 I300 A305	R263-A302 HydrophobicContact CG-CB 4.45Å; L297-A302 HydrophobicContact CB-CB 4.17Å; L297-A302 HydrophobicContact CD2-CB 3.82Å; L297-A302 WeakPolarHBondContact O-CB 3.48Å; L297-A302 PolarHBondContact O-N 3.28Å; I300-A302 VanDerWaalsContact C-N 3.32Å; I300-A302 PolarHBondContact O-N 2.95Å; A302-A305 VanDerWaalsContact O-CB 3.23Å; A302-A305 WeakPolarHBondContact O-CB 3.38Å; A302-A305 PolarHBondContact O-N 3.41Å
303	D	84.7	Confident	88.3	Confident	156 Å²	156	60.6 Å²	60.6	83%	0.834	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-30.6	177.4	-65.4	-31.2	0	0	0	113.1	E301 A305 P306	E301-D303 PolarHBondContact O-N 3.39Å; D303-A305 VanDerWaalsContact C-N 3.32Å; D303-P306 WeakPolarHBondContact O-CD 3.36Å
304	K	88.6	Confident	88.3	Confident	114 Å²	114	61.1 Å²	61.1	50%	0.496	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-12.7	176.8	-61.7	-178.7	-169.3	165.2	0	112.2	E301 A307 R308	E301-K304 HydrophobicContact CB-CB 4.33Å; E301-K304 HydrophobicContact CB-CD 4.25Å; E301-K304 HydrophobicContact CB-CG 4.47Å; E301-K304 PolarHBondContact O-N 2.84Å; E301-K304 IonicContact OE1-NZ 2.69Å; E301-K304 PolarHBondContact OE1-NZ 2.91Å; E301-K304 IonicContact OE2-NZ 3.5Å; K304-A307 PolarHBondContact O-N 3.34Å; K304-R308 WeakPolarHBondContact O-CG 3.44Å; K304-R308 PolarHBondContact O-N 2.93Å
305	A	87.8	Confident	88.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-56.7	-46.1	-177.5	0	0	0	0	0	113.9	L257 E301 A302 D303 A307 R308 A309 F345	L257-A305 HydrophobicContact CD2-CB 3.93Å; E301-A305 PolarHBondContact O-N 3.1Å; A302-A305 VanDerWaalsContact O-CB 3.23Å; A302-A305 WeakPolarHBondContact O-CB 3.38Å; A302-A305 PolarHBondContact O-N 3.41Å; D303-A305 VanDerWaalsContact C-N 3.32Å; A305-A307 VanDerWaalsContact C-N 3.35Å; A305-A307 PolarHBondContact O-N 3.07Å; A305-R308 PolarHBondContact O-N 3.41Å; A305-A309 WeakPolarHBondContact O-CB 3.29Å; A305-A309 PolarHBondContact O-N 2.87Å; A305-F345 HydrophobicContact CB-CE2 4.37Å; A305-F345 HydrophobicContact CB-CZ 3.88Å
306	P	89.6	Confident	88.1	Confident	49 Å²	49	53.7 Å²	53.7	32%	0.318	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-40.4	179.1	-22.8	35.3	0	0	0	112.9	L257 D303 A309 S310	L257-P306 HydrophobicContact CD1-CB 4.37Å; L257-P306 HydrophobicContact CD1-CG 4.29Å; D303-P306 WeakPolarHBondContact O-CD 3.36Å; P306-A309 PolarHBondContact O-N 3.3Å; P306-S310 WeakPolarHBondContact O-CB 3.41Å; P306-S310 PolarHBondContact O-N 2.92Å
307	A	90.5	Very high	88	Confident	64 Å²	64	51.1 Å²	51.1	53%	0.529	28%	0.277	S	S	.	.	H	α-helix	trans	-64.3	-45	176.1	0	0	0	0	0	111.1	K304 A305 S310 V311	K304-A307 PolarHBondContact O-N 3.34Å; A305-A307 VanDerWaalsContact C-N 3.35Å; A305-A307 PolarHBondContact O-N 3.07Å; A307-S310 PolarHBondContact O-N 3.28Å; A307-V311 WeakPolarHBondContact O-CG2 3.48Å; A307-V311 PolarHBondContact O-N 3.1Å
308	R	88.9	Confident	88.1	Confident	64 Å²	64	50.6 Å²	50.6	24%	0.242	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-46.1	175.3	-71.6	-172.4	-68.7	159.3	-10	112.2	I300 K304 A305 V311 I312 F345	I300-R308 PolarHBondContact O-NH2 3.31Å; K304-R308 WeakPolarHBondContact O-CG 3.44Å; K304-R308 PolarHBondContact O-N 2.93Å; A305-R308 PolarHBondContact O-N 3.41Å; R308-V311 PolarHBondContact O-N 3.35Å; R308-I312 WeakPolarHBondContact O-CG1 3.07Å; R308-I312 PolarHBondContact O-N 3.42Å; R308-I312 VanDerWaalsContact O-N 3.09Å; R308-F345 HydrophobicContact CB-CE2 4.3Å
309	A	90.9	Very high	88	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-42.2	177.9	0	0	0	0	0	111.8	L253 V256 L257 A305 P306 V311 I312 L313 F345	L253-A309 HydrophobicContact CD1-CB 3.8Å; V256-A309 HydrophobicContact CB-CB 4.36Å; V256-A309 HydrophobicContact CG1-CB 3.88Å; L257-A309 HydrophobicContact CD2-CB 3.88Å; L257-A309 HydrophobicContact CG-CB 4.26Å; A305-A309 WeakPolarHBondContact O-CB 3.29Å; A305-A309 PolarHBondContact O-N 2.87Å; P306-A309 PolarHBondContact O-N 3.3Å; A309-V311 VanDerWaalsContact C-N 3.35Å; A309-V311 PolarHBondContact O-N 3.23Å; A309-I312 PolarHBondContact O-N 3.47Å; A309-L313 WeakPolarHBondContact O-CB 3.29Å; A309-L313 WeakPolarHBondContact O-CG 3.42Å; A309-L313 PolarHBondContact O-N 3.23Å; A309-F345 HydrophobicContact CB-CD2 4.15Å; A309-F345 HydrophobicContact CB-CE2 4.12Å
310	S	91	Very high	88	Confident	41 Å²	41	42.5 Å²	42.5	29%	0.287	25%	0.25	S	C	.	.	H	α-helix	trans	-60.7	-40.6	175.1	177.4	0	0	0	0	112.5	P306 A307 A314 Q323	P306-S310 WeakPolarHBondContact O-CB 3.41Å; P306-S310 PolarHBondContact O-N 2.92Å; A307-S310 PolarHBondContact O-N 3.28Å; S310-A314 VanDerWaalsContact O-CB 3.24Å; S310-A314 WeakPolarHBondContact O-CB 3.41Å; S310-A314 PolarHBondContact O-N 3.49Å; S310-Q323 PolarHBondContact O-NE2 3.12Å; S310-Q323 PolarHBondContact OG-OE1 3.26Å; S310-Q323 VanDerWaalsContact OG-OE1 3.12Å
311	V	90.3	Very high	88.3	Confident	76 Å²	76	49.7 Å²	49.7	46%	0.461	28%	0.275	S	S	.	.	H	α-helix	trans	-66.5	-43.6	177.9	171.3	0	0	0	0	111.2	A307 R308 A309 A314 G315	A307-V311 WeakPolarHBondContact O-CG2 3.48Å; A307-V311 PolarHBondContact O-N 3.1Å; R308-V311 PolarHBondContact O-N 3.35Å; A309-V311 VanDerWaalsContact C-N 3.35Å; A309-V311 PolarHBondContact O-N 3.23Å; V311-A314 PolarHBondContact O-N 3.49Å; V311-G315 PolarHBondContact O-N 3.35Å
312	I	91	Very high	88.4	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.036	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-46.6	176.7	-67.5	169.1	0	0	0	110.6	R308 A309 G315 L316 A341 L344 F345 W367 Y371	R308-I312 WeakPolarHBondContact O-CG1 3.07Å; R308-I312 PolarHBondContact O-N 3.42Å; R308-I312 VanDerWaalsContact O-N 3.09Å; A309-I312 PolarHBondContact O-N 3.47Å; I312-G315 PolarHBondContact O-N 2.92Å; I312-L316 HydrophobicContact CG2-CD1 4.22Å; I312-L316 WeakPolarHBondContact O-CG 3.33Å; I312-L316 PolarHBondContact O-N 3.23Å; I312-L316 VanDerWaalsContact O-N 3.1Å; I312-A341 HydrophobicContact CG2-CB 3.97Å; I312-L344 HydrophobicContact CG2-CB 4.27Å; I312-L344 HydrophobicContact CG2-CD1 4.29Å; I312-F345 HydrophobicContact CD1-CB 4.21Å; I312-F345 HydrophobicContact CD1-CD2 4.18Å; I312-W367 HydrophobicContact CB-CH2 4.21Å; I312-W367 HydrophobicContact CG1-CH2 4.27Å; I312-W367 HydrophobicContact CG2-CH2 4.01Å; I312-Y371 HydrophobicContact CG1-CE2 4.42Å
313	L	91.3	Very high	88.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-44.8	177.7	-77.7	171.6	0	0	0	111.5	L253 V256 A309 G315 L316 G317 F318 Q323 L338 A341	L253-L313 HydrophobicContact CB-CD1 4.32Å; L253-L313 HydrophobicContact CD1-CD1 3.97Å; V256-L313 HydrophobicContact CG2-CD1 3.98Å; V256-L313 HydrophobicContact CG2-CD2 3.9Å; V256-L313 HydrophobicContact CG2-CG 4.05Å; A309-L313 WeakPolarHBondContact O-CB 3.29Å; A309-L313 WeakPolarHBondContact O-CG 3.42Å; A309-L313 PolarHBondContact O-N 3.23Å; L313-G315 PolarHBondContact O-N 3.4Å; L313-L316 CarbonylContact O-C 3.52Å; L313-L316 PolarHBondContact O-N 3.05Å; L313-G317 PolarHBondContact O-N 3.27Å; L313-F318 HydrophobicContact CB-CB 4.03Å; L313-F318 HydrophobicContact CB-CD2 4.32Å; L313-F318 HydrophobicContact CB-CG 4.37Å; L313-F318 HydrophobicContact CD2-CB 4.5Å; L313-F318 HydrophobicContact CD2-CD1 4.42Å; L313-F318 HydrophobicContact CD2-CD2 3.64Å; L313-F318 HydrophobicContact CD2-CE2 3.81Å; L313-F318 HydrophobicContact CD2-CG 3.96Å; L313-F318 HydrophobicContact CD2-CZ 4.28Å; L313-F318 WeakPolarHBondContact O-CB 3.4Å; L313-F318 WeakPolarHBondContact O-CD2 3.35Å; L313-F318 PolarHBondContact O-N 3.18Å; L313-Q323 HydrophobicContact CB-CG 4.1Å; L313-Q323 HydrophobicContact CD1-CG 4.13Å; L313-L338 HydrophobicContact CD2-CD1 3.91Å; L313-A341 HydrophobicContact CD2-CB 3.74Å; L313-A341 HydrophobicContact CG-CB 4.39Å
314	A	89.3	Confident	89.2	Confident	12 Å²	12	47 Å²	47	10%	0.099	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-40.9	177.9	0	0	0	0	0	112.3	S310 V311 L316 G317 Y710	S310-A314 VanDerWaalsContact O-CB 3.24Å; S310-A314 WeakPolarHBondContact O-CB 3.41Å; S310-A314 PolarHBondContact O-N 3.49Å; V311-A314 PolarHBondContact O-N 3.49Å; A314-L316 VanDerWaalsContact C-N 3.27Å; A314-L316 PolarHBondContact O-N 2.59Å; A314-G317 WeakPolarHBondContact O-CA 3.46Å; A314-G317 PolarHBondContact O-N 3.27Å; A314-Y710 HydrophobicContact CB-CE1 3.84Å; A314-Y710 WeakPolarHBondContact CB-OH 3.44Å
315	G	86.7	Confident	89.2	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-31.8	174.8	0	0	0	0	0	114	V311 I312 L313 G317	V311-G315 PolarHBondContact O-N 3.35Å; I312-G315 PolarHBondContact O-N 2.92Å; L313-G315 PolarHBondContact O-N 3.4Å; G315-G317 VanDerWaalsContact C-N 3.25Å; G315-G317 PolarHBondContact O-N 2.94Å
316	L	88.5	Confident	89.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	2.5	172.7	-65.5	173	0	0	0	113.6	I312 L313 A314 F318 R337 L340 A341 L344 L360 W367	I312-L316 HydrophobicContact CG2-CD1 4.22Å; I312-L316 WeakPolarHBondContact O-CG 3.33Å; I312-L316 PolarHBondContact O-N 3.23Å; I312-L316 VanDerWaalsContact O-N 3.1Å; L313-L316 CarbonylContact O-C 3.52Å; L313-L316 PolarHBondContact O-N 3.05Å; A314-L316 VanDerWaalsContact C-N 3.27Å; A314-L316 PolarHBondContact O-N 2.59Å; L316-F318 HydrophobicContact CB-CD2 4.31Å; L316-F318 HydrophobicContact CB-CE2 4.46Å; L316-R337 WeakPolarHBondContact CD1-O 3.26Å; L316-R337 WeakPolarHBondContact O-CD 3.47Å; L316-R337 PolarHBondContact O-NH1 3.14Å; L316-L340 HydrophobicContact CD1-CD2 4.45Å; L316-L340 HydrophobicContact CD1-CG 4.42Å; L316-L340 HydrophobicContact CD2-CD2 3.85Å; L316-A341 HydrophobicContact CD1-CB 3.69Å; L316-L344 HydrophobicContact CD1-CD1 4.46Å; L316-L360 HydrophobicContact CD2-CD2 4.31Å; L316-W367 HydrophobicContact CD2-CE3 3.93Å; L316-W367 HydrophobicContact CD2-CZ3 3.78Å; L316-W367 HydrophobicContact CG-CE3 4.17Å; L316-W367 HydrophobicContact CG-CZ3 3.77Å
317	G	87	Confident	89.3	Confident	25 Å²	25	43.5 Å²	43.5	26%	0.258	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.3	7	174.3	0	0	0	0	0	115.6	L313 A314 G315 S319 W334	L313-G317 PolarHBondContact O-N 3.27Å; A314-G317 WeakPolarHBondContact O-CA 3.46Å; A314-G317 PolarHBondContact O-N 3.27Å; G315-G317 VanDerWaalsContact C-N 3.25Å; G315-G317 PolarHBondContact O-N 2.94Å; G317-S319 PolarHBondContact O-N 2.92Å; G317-W334 VanDerWaalsContact O-CH2 3.29Å; G317-W334 WeakPolarHBondContact O-CH2 3.34Å
318	F	88.3	Confident	89.1	Confident	3 Å²	3	45.5 Å²	45.5	1%	0.013	24%	0.237	C	C	.	.			trans	-77	112.7	176.5	-70	-100	0	0	0	111.1	L313 L316 M322 Q323 F330 W334 R337 L338	L313-F318 HydrophobicContact CB-CB 4.03Å; L313-F318 HydrophobicContact CB-CD2 4.32Å; L313-F318 HydrophobicContact CB-CG 4.37Å; L313-F318 HydrophobicContact CD2-CB 4.5Å; L313-F318 HydrophobicContact CD2-CD1 4.42Å; L313-F318 HydrophobicContact CD2-CD2 3.64Å; L313-F318 HydrophobicContact CD2-CE2 3.81Å; L313-F318 HydrophobicContact CD2-CG 3.96Å; L313-F318 HydrophobicContact CD2-CZ 4.28Å; L313-F318 WeakPolarHBondContact O-CB 3.4Å; L313-F318 WeakPolarHBondContact O-CD2 3.35Å; L313-F318 PolarHBondContact O-N 3.18Å; L316-F318 HydrophobicContact CB-CD2 4.31Å; L316-F318 HydrophobicContact CB-CE2 4.46Å; F318-M322 HydrophobicContact CD1-CB 4.25Å; F318-M322 HydrophobicContact CD1-CE 4.39Å; F318-Q323 HydrophobicContact CB-CG 3.95Å; F318-Q323 PolarHBondContact O-NE2 3.5Å; F318-Q323 VanDerWaalsContact O-NE2 3.09Å; F318-F330 HydrophobicContact CD1-CE1 4.46Å; F318-F330 HydrophobicContact CD1-CZ 4.3Å; F318-F330 HydrophobicContact CE1-CE1 4.21Å; F318-F330 HydrophobicContact CE1-CE2 4.28Å; F318-F330 HydrophobicContact CE1-CZ 4.08Å; F318-W334 AromaticContact CD1-CE3 3.95Å; F318-W334 HydrophobicContact CD1-CE3 3.95Å; F318-W334 HydrophobicContact CD1-CZ3 4.06Å; F318-W334 HydrophobicContact CD2-CE3 4.24Å; F318-W334 HydrophobicContact CD2-CZ3 4.02Å; F318-W334 AromaticContact CE1-CE3 3.67Å; F318-W334 HydrophobicContact CE1-CE3 3.67Å; F318-W334 HydrophobicContact CE1-CZ3 4.24Å; F318-W334 AromaticContact CE2-CE3 4Å; F318-W334 HydrophobicContact CE2-CE3 4Å; F318-W334 HydrophobicContact CE2-CZ3 4.21Å; F318-W334 HydrophobicContact CG-CE3 4.23Å; F318-W334 AromaticContact CG-CZ3 3.96Å; F318-W334 HydrophobicContact CG-CZ3 3.96Å; F318-W334 AromaticContact CZ-CE3 3.71Å; F318-W334 HydrophobicContact CZ-CE3 3.71Å; F318-W334 HydrophobicContact CZ-CZ3 4.32Å; F318-W334 WeakPolarHBondContact CZ-O 3.03Å; F318-R337 HydrophobicContact CE2-CB 3.67Å; F318-R337 HydrophobicContact CZ-CB 4.05Å; F318-L338 HydrophobicContact CZ-CB 4.06Å
319	S	86.8	Confident	88.9	Confident	49 Å²	49	48.2 Å²	48.2	34%	0.343	25%	0.253	S	S	.	.			trans	-61.6	155.4	172.3	70.7	0	0	0	0	111.9	G317 R321 M322 Q323	G317-S319 PolarHBondContact O-N 2.92Å; S319-R321 PolarHBondContact O-N 3.35Å; S319-M322 WeakPolarHBondContact O-CA 3.41Å; S319-M322 WeakPolarHBondContact O-CB 3.49Å; S319-M322 PolarHBondContact O-N 2.53Å; S319-M322 WeakPolarHBondContact OG-CG 3.44Å; S319-M322 PolarHBondContact OG-N 3.39Å; S319-Q323 WeakPolarHBondContact O-CG 3.39Å; S319-Q323 PolarHBondContact O-N 3.21Å
320	P	87.4	Confident	88.6	Confident	100 Å²	100	48.7 Å²	48.7	65%	0.649	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-31.8	178.1	-27.8	35.2	0	0	0	113.7
321	R	88.4	Confident	88	Confident	186 Å²	186	50.1 Å²	50.1	70%	0.702	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-44.7	174.2	-175.3	179.3	176.4	179.5	-0.6	111.8	S319 Q323 Q324	S319-R321 PolarHBondContact O-N 3.35Å; R321-Q323 VanDerWaalsContact C-N 3.29Å; R321-Q323 PolarHBondContact O-N 2.99Å; R321-Q324 PolarHBondContact O-N 3.36Å
322	M	88	Confident	87.3	Confident	34 Å²	34	49.1 Å²	49.1	17%	0.167	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-64.7	-34.4	178.1	-69.5	170.7	75.8	0	0	111.9	F318 S319 Q324 Q325 F330 W334	F318-M322 HydrophobicContact CD1-CB 4.25Å; F318-M322 HydrophobicContact CD1-CE 4.39Å; S319-M322 WeakPolarHBondContact O-CA 3.41Å; S319-M322 WeakPolarHBondContact O-CB 3.49Å; S319-M322 PolarHBondContact O-N 2.53Å; S319-M322 WeakPolarHBondContact OG-CG 3.44Å; S319-M322 PolarHBondContact OG-N 3.39Å; M322-Q324 PolarHBondContact O-N 2.94Å; M322-Q325 WeakPolarHBondContact O-CB 3.11Å; M322-Q325 PolarHBondContact O-N 3.12Å; M322-F330 HydrophobicContact CB-CE1 4.16Å; M322-F330 HydrophobicContact CB-CZ 4.26Å; M322-F330 HydrophobicContact CE-CD1 4.17Å; M322-F330 HydrophobicContact CE-CE1 3.63Å; M322-F330 HydrophobicContact CG-CE1 4.4Å; M322-F330 WeakPolarHBondContact O-CZ 3.34Å; M322-W334 HydrophobicContact CE-CD2 3.63Å; M322-W334 HydrophobicContact CE-CE3 3.55Å; M322-W334 HydrophobicContact CE-CG 4.44Å; M322-W334 HydrophobicContact CE-CH2 3.54Å; M322-W334 HydrophobicContact CE-CZ2 3.61Å; M322-W334 HydrophobicContact CE-CZ3 3.5Å; M322-W334 HydrophobicContact SD-CH2 4.14Å; M322-W334 HydrophobicContact SD-CZ2 4.43Å; M322-W334 HydrophobicContact SD-CZ3 4.4Å
323	Q	90.6	Very high	86.7	Confident	10 Å²	10	49.8 Å²	49.8	5%	0.047	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-59.3	-22.4	176.3	-66.3	179.4	22.2	0	0	113.3	I251 L253 S310 L313 F318 S319 R321	I251-Q323 WeakPolarHBondContact CG2-O 3.08Å; L253-Q323 HydrophobicContact CB-CB 4.45Å; L253-Q323 WeakPolarHBondContact CB-O 3.4Å; L253-Q323 PolarHBondContact N-O 2.91Å; L253-Q323 VanDerWaalsContact N-O 3.07Å; S310-Q323 PolarHBondContact O-NE2 3.12Å; S310-Q323 PolarHBondContact OG-OE1 3.26Å; S310-Q323 VanDerWaalsContact OG-OE1 3.12Å; L313-Q323 HydrophobicContact CB-CG 4.1Å; L313-Q323 HydrophobicContact CD1-CG 4.13Å; F318-Q323 HydrophobicContact CB-CG 3.95Å; F318-Q323 PolarHBondContact O-NE2 3.5Å; F318-Q323 VanDerWaalsContact O-NE2 3.09Å; S319-Q323 WeakPolarHBondContact O-CG 3.39Å; S319-Q323 PolarHBondContact O-N 3.21Å; R321-Q323 VanDerWaalsContact C-N 3.29Å; R321-Q323 PolarHBondContact O-N 2.99Å
324	Q	91.4	Very high	86.4	Confident	149 Å²	149	51.8 Å²	51.8	70%	0.696	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-95.9	-1.2	177	-61.5	-179.7	7.9	0	0	113.6	R321 M322	R321-Q324 PolarHBondContact O-N 3.36Å; M322-Q324 PolarHBondContact O-N 2.94Å
325	Q	89.9	Confident	86.1	Confident	56 Å²	56	54.3 Å²	54.3	26%	0.262	29%	0.293	S	S	.	.	S	Bend	trans	-86.2	149.5	179.9	-70.9	-178.2	-58.9	0	0	112.3	A252 M322 F330	A252-Q325 PolarHBondContact N-O 2.77Å; A252-Q325 VanDerWaalsContact N-O 3.07Å; M322-Q325 WeakPolarHBondContact O-CB 3.11Å; M322-Q325 PolarHBondContact O-N 3.12Å; Q325-F330 HydrophobicContact CB-CE2 4.46Å; Q325-F330 HydrophobicContact CB-CZ 3.88Å
326	P	91.2	Very high	86	Confident	34 Å²	34	55.5 Å²	55.5	22%	0.221	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-64.3	144.5	173.7	-20.9	33.1	0	0	0	113	T250 K328 E329	T250-P326 CarbonylContact O-C 3.58Å; T250-P326 WeakPolarHBondContact O-CA 3.36Å; P326-K328 VanDerWaalsContact C-N 3.3Å; P326-K328 HydrophobicContact CB-CG 4.14Å; P326-K328 PolarHBondContact O-N 2.68Å; P326-E329 PolarHBondContact O-N 2.71Å
327	T	87.2	Confident	86	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-69	-25.2	-173.8	63.1	0	0	0	0	114.7	D248 T250 E329 F330 R335 L338	D248-T327 WeakPolarHBondContact CA-OG1 3.43Å; D248-T327 PolarHBondContact N-OG1 3.33Å; D248-T327 PolarHBondContact O-N 3.22Å; D248-T327 PolarHBondContact O-OG1 2.99Å; T250-T327 WeakPolarHBondContact O-CG2 3.06Å; T250-T327 PolarHBondContact O-N 3.28Å; T327-E329 VanDerWaalsContact C-N 3.26Å; T327-E329 PolarHBondContact O-N 3.16Å; T327-F330 PolarHBondContact O-N 3.24Å; T327-R335 PolarHBondContact O-NE 3.19Å; T327-L338 HydrophobicContact CG2-CD2 3.22Å
328	K	86.6	Confident	86.1	Confident	105 Å²	105	54.6 Å²	54.6	46%	0.457	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-61.9	-27.4	172.9	66.5	177.7	177.4	-169.9	0	114.4	D248 D249 P326 F330 R335	D248-K328 PolarHBondContact O-N 3.3Å; D249-K328 WeakPolarHBondContact OD1-CD 3.4Å; D249-K328 WeakPolarHBondContact OD1-CE 3.45Å; D249-K328 IonicContact OD1-NZ 3.98Å; D249-K328 PolarHBondContact OD1-NZ 3.18Å; P326-K328 VanDerWaalsContact C-N 3.3Å; P326-K328 HydrophobicContact CB-CG 4.14Å; P326-K328 PolarHBondContact O-N 2.68Å; K328-F330 VanDerWaalsContact C-N 3.28Å; K328-F330 PolarHBondContact O-N 3.12Å; K328-R335 PolarHBondContact O-NH2 3.23Å
329	E	85	Confident	86	Confident	122 Å²	122	54.9 Å²	54.9	57%	0.57	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-76.8	-19	-179	-65.2	-176.7	-174.7	0	0	112.4	P326 T327	P326-E329 PolarHBondContact O-N 2.71Å; T327-E329 VanDerWaalsContact C-N 3.26Å; T327-E329 PolarHBondContact O-N 3.16Å
330	F	83.8	Confident	86.2	Confident	10 Å²	10	52.8 Å²	52.8	4%	0.044	28%	0.275	C	S	.	.	S	Bend	trans	-73.5	144	177.3	-68.7	-53.1	0	0	0	112.2	A252 F318 M322 Q325 T327 K328 W334 R335	A252-F330 HydrophobicContact CB-CE2 3.89Å; A252-F330 HydrophobicContact CB-CZ 4.31Å; F318-F330 HydrophobicContact CD1-CE1 4.46Å; F318-F330 HydrophobicContact CD1-CZ 4.3Å; F318-F330 HydrophobicContact CE1-CE1 4.21Å; F318-F330 HydrophobicContact CE1-CE2 4.28Å; F318-F330 HydrophobicContact CE1-CZ 4.08Å; M322-F330 HydrophobicContact CB-CE1 4.16Å; M322-F330 HydrophobicContact CB-CZ 4.26Å; M322-F330 HydrophobicContact CE-CD1 4.17Å; M322-F330 HydrophobicContact CE-CE1 3.63Å; M322-F330 HydrophobicContact CG-CE1 4.4Å; M322-F330 WeakPolarHBondContact O-CZ 3.34Å; Q325-F330 HydrophobicContact CB-CE2 4.46Å; Q325-F330 HydrophobicContact CB-CZ 3.88Å; T327-F330 PolarHBondContact O-N 3.24Å; K328-F330 VanDerWaalsContact C-N 3.28Å; K328-F330 PolarHBondContact O-N 3.12Å; F330-W334 HydrophobicContact CB-CB 3.63Å; F330-W334 HydrophobicContact CD1-CB 3.83Å; F330-W334 HydrophobicContact CD1-CG 4.14Å; F330-W334 HydrophobicContact CG-CB 3.89Å; F330-R335 HydrophobicContact CB-CG 3.94Å; F330-R335 PolarHBondContact O-NE 2.94Å; F330-R335 PolarHBondContact O-NH2 3.43Å
331	S	79.6	Confident	86.4	Confident	71 Å²	71	48 Å²	48	50%	0.497	24%	0.244	S	C	.	.			trans	-67.8	164.3	167.2	74	0	0	0	0	111	G333 W334 R335	S331-G333 VanDerWaalsContact C-N 3.27Å; S331-G333 PolarHBondContact O-N 2.92Å; S331-W334 PolarHBondContact O-N 2.93Å; S331-R335 WeakPolarHBondContact O-CG 3.17Å; S331-R335 PolarHBondContact O-N 3.34Å
332	G	75.8	Confident	86.4	Confident	54 Å²	54	41.5 Å²	41.5	56%	0.557	22%	0.219	S	C	*	.	H	α-helix	trans	-52.6	-41.2	-179.5	0	0	0	0	0	113.7	W334 R335 M336	G332-W334 PolarHBondContact O-N 3.5Å; G332-R335 PolarHBondContact O-N 3.46Å; G332-M336 PolarHBondContact O-N 3.5Å
333	G	77.7	Confident	86.4	Confident	22 Å²	22	40 Å²	40	23%	0.227	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-36.7	176.8	0	0	0	0	0	113.7	S331 M336 R337	S331-G333 VanDerWaalsContact C-N 3.27Å; S331-G333 PolarHBondContact O-N 2.92Å; G333-M336 WeakPolarHBondContact O-CB 3.06Å; G333-M336 PolarHBondContact O-N 2.86Å; G333-R337 WeakPolarHBondContact O-CG 3.38Å; G333-R337 PolarHBondContact O-N 3.21Å; G333-R337 VanDerWaalsContact O-N 3.12Å
334	W	84.3	Confident	86.5	Confident	41 Å²	41	39.5 Å²	39.5	16%	0.155	21%	0.21	C	C	.	.	H	α-helix	trans	-71.9	-36	173.8	-78.1	106.5	0	0	0	111.9	G317 F318 M322 F330 S331 G332 M336 R337 L338	G317-W334 VanDerWaalsContact O-CH2 3.29Å; G317-W334 WeakPolarHBondContact O-CH2 3.34Å; F318-W334 AromaticContact CD1-CE3 3.95Å; F318-W334 HydrophobicContact CD1-CE3 3.95Å; F318-W334 HydrophobicContact CD1-CZ3 4.06Å; F318-W334 HydrophobicContact CD2-CE3 4.24Å; F318-W334 HydrophobicContact CD2-CZ3 4.02Å; F318-W334 AromaticContact CE1-CE3 3.67Å; F318-W334 HydrophobicContact CE1-CE3 3.67Å; F318-W334 HydrophobicContact CE1-CZ3 4.24Å; F318-W334 AromaticContact CE2-CE3 4Å; F318-W334 HydrophobicContact CE2-CE3 4Å; F318-W334 HydrophobicContact CE2-CZ3 4.21Å; F318-W334 HydrophobicContact CG-CE3 4.23Å; F318-W334 AromaticContact CG-CZ3 3.96Å; F318-W334 HydrophobicContact CG-CZ3 3.96Å; F318-W334 AromaticContact CZ-CE3 3.71Å; F318-W334 HydrophobicContact CZ-CE3 3.71Å; F318-W334 HydrophobicContact CZ-CZ3 4.32Å; F318-W334 WeakPolarHBondContact CZ-O 3.03Å; M322-W334 HydrophobicContact CE-CD2 3.63Å; M322-W334 HydrophobicContact CE-CE3 3.55Å; M322-W334 HydrophobicContact CE-CG 4.44Å; M322-W334 HydrophobicContact CE-CH2 3.54Å; M322-W334 HydrophobicContact CE-CZ2 3.61Å; M322-W334 HydrophobicContact CE-CZ3 3.5Å; M322-W334 HydrophobicContact SD-CH2 4.14Å; M322-W334 HydrophobicContact SD-CZ2 4.43Å; M322-W334 HydrophobicContact SD-CZ3 4.4Å; F330-W334 HydrophobicContact CB-CB 3.63Å; F330-W334 HydrophobicContact CD1-CB 3.83Å; F330-W334 HydrophobicContact CD1-CG 4.14Å; F330-W334 HydrophobicContact CG-CB 3.89Å; S331-W334 PolarHBondContact O-N 2.93Å; G332-W334 PolarHBondContact O-N 3.5Å; W334-M336 VanDerWaalsContact C-N 3.31Å; W334-M336 PolarHBondContact O-N 3.16Å; W334-R337 PolarHBondContact O-N 3.34Å; W334-L338 PolarHBondContact O-N 3.33Å
335	R	84.8	Confident	86.4	Confident	65 Å²	65	33 Å²	33	25%	0.245	18%	0.179	C	C	.	.	H	α-helix	trans	-64.7	-36.7	173.3	-64.4	179.5	-168.4	174.1	1.1	111.9	V245 T327 K328 F330 S331 G332 L338 A339	V245-R335 WeakPolarHBondContact O-CD 3.13Å; T327-R335 PolarHBondContact O-NE 3.19Å; K328-R335 PolarHBondContact O-NH2 3.23Å; F330-R335 HydrophobicContact CB-CG 3.94Å; F330-R335 PolarHBondContact O-NE 2.94Å; F330-R335 PolarHBondContact O-NH2 3.43Å; S331-R335 WeakPolarHBondContact O-CG 3.17Å; S331-R335 PolarHBondContact O-N 3.34Å; G332-R335 PolarHBondContact O-N 3.46Å; R335-L338 WeakPolarHBondContact O-CB 3.38Å; R335-L338 PolarHBondContact O-N 3.07Å; R335-A339 PolarHBondContact O-N 3.09Å
336	M	84	Confident	86.3	Confident	29 Å²	29	32.1 Å²	32.1	14%	0.143	18%	0.181	C	C	.	.	H	α-helix	trans	-59	-49.9	170.6	173.5	50.9	71	0	0	111.7	V241 E242 Q243 G332 G333 W334 L338 A339 L340 M359	V241-M336 HydrophobicContact CG1-SD 4.05Å; E242-M336 WeakPolarHBondContact O-CE 3.21Å; Q243-M336 HydrophobicContact CB-CE 4.18Å; Q243-M336 HydrophobicContact CG-CE 4.24Å; Q243-M336 WeakPolarHBondContact O-CE 3.43Å; G332-M336 PolarHBondContact O-N 3.5Å; G333-M336 WeakPolarHBondContact O-CB 3.06Å; G333-M336 PolarHBondContact O-N 2.86Å; W334-M336 VanDerWaalsContact C-N 3.31Å; W334-M336 PolarHBondContact O-N 3.16Å; M336-L338 PolarHBondContact O-N 2.96Å; M336-A339 WeakPolarHBondContact O-CA 3.33Å; M336-A339 VanDerWaalsContact O-CB 3.29Å; M336-A339 WeakPolarHBondContact O-CB 3.38Å; M336-A339 PolarHBondContact O-N 3.26Å; M336-L340 PolarHBondContact O-N 2.84Å; M336-M359 HydrophobicContact CG-CB 4.38Å
337	R	88.1	Confident	86.1	Confident	4 Å²	4	37 Å²	37	2%	0.015	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-36.7	177	-67.5	-176.8	-177.2	-165.5	3.3	112	L316 F318 G333 W334 L340 A341 M359 L360 D361 N529	L316-R337 WeakPolarHBondContact CD1-O 3.26Å; L316-R337 WeakPolarHBondContact O-CD 3.47Å; L316-R337 PolarHBondContact O-NH1 3.14Å; F318-R337 HydrophobicContact CE2-CB 3.67Å; F318-R337 HydrophobicContact CZ-CB 4.05Å; G333-R337 WeakPolarHBondContact O-CG 3.38Å; G333-R337 PolarHBondContact O-N 3.21Å; G333-R337 VanDerWaalsContact O-N 3.12Å; W334-R337 PolarHBondContact O-N 3.34Å; R337-L340 PolarHBondContact O-N 3.03Å; R337-A341 WeakPolarHBondContact O-CB 3.48Å; R337-A341 PolarHBondContact O-N 2.81Å; R337-M359 PolarHBondContact NE-O 3.12Å; R337-M359 PolarHBondContact NH2-O 3.22Å; R337-L360 HydrophobicContact CG-CD2 3.66Å; R337-D361 IonicContact CZ-OD2 3.74Å; R337-D361 IonicContact NH1-OD2 3.15Å; R337-D361 PolarHBondContact NH1-OD2 3.13Å; R337-D361 VanDerWaalsContact NH2-N 3.15Å; R337-D361 IonicContact NH2-OD2 2.83Å; R337-D361 PolarHBondContact NH2-OD2 3.18Å; R337-N529 PolarHBondContact NH2-ND2 3.41Å
338	L	88.8	Confident	86.2	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-65.5	-40.8	174.1	-176.2	66.5	0	0	0	112.1	A252 V256 L313 F318 T327 W334 R335 M336 L340 A341 R342	A252-L338 HydrophobicContact CB-CD1 4.17Å; V256-L338 HydrophobicContact CG2-CD1 3.58Å; L313-L338 HydrophobicContact CD2-CD1 3.91Å; F318-L338 HydrophobicContact CZ-CB 4.06Å; T327-L338 HydrophobicContact CG2-CD2 3.22Å; W334-L338 PolarHBondContact O-N 3.33Å; R335-L338 WeakPolarHBondContact O-CB 3.38Å; R335-L338 PolarHBondContact O-N 3.07Å; M336-L338 PolarHBondContact O-N 2.96Å; L338-L340 VanDerWaalsContact C-N 3.32Å; L338-L340 PolarHBondContact O-N 3.18Å; L338-A341 WeakPolarHBondContact O-CB 3.43Å; L338-A341 PolarHBondContact O-N 3.14Å; L338-R342 WeakPolarHBondContact O-CG 3.39Å; L338-R342 PolarHBondContact O-N 3.43Å
339	A	87.8	Confident	86.4	Confident	9 Å²	9	34.9 Å²	34.9	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-43.1	175	0	0	0	0	0	111.7	V241 V245 R335 M336 R342 A343	V241-A339 HydrophobicContact CG1-CB 3.98Å; V245-A339 HydrophobicContact CB-CB 4.31Å; V245-A339 HydrophobicContact CG2-CB 3.44Å; V245-A339 VanDerWaalsContact CG2-CB 3.44Å; R335-A339 PolarHBondContact O-N 3.09Å; M336-A339 WeakPolarHBondContact O-CA 3.33Å; M336-A339 VanDerWaalsContact O-CB 3.29Å; M336-A339 WeakPolarHBondContact O-CB 3.38Å; M336-A339 PolarHBondContact O-N 3.26Å; A339-R342 PolarHBondContact O-N 3.41Å; A339-A343 PolarHBondContact O-N 2.98Å
340	L	89.8	Confident	86.8	Confident	5 Å²	5	29.1 Å²	29.1	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-61.2	-45.1	172.3	-176.6	63.5	0	0	0	111.1	L316 M336 R337 L338 R342 A343 L344 L353 L360 L368	L316-L340 HydrophobicContact CD1-CD2 4.45Å; L316-L340 HydrophobicContact CD1-CG 4.42Å; L316-L340 HydrophobicContact CD2-CD2 3.85Å; M336-L340 PolarHBondContact O-N 2.84Å; R337-L340 PolarHBondContact O-N 3.03Å; L338-L340 VanDerWaalsContact C-N 3.32Å; L338-L340 PolarHBondContact O-N 3.18Å; L340-R342 PolarHBondContact O-N 3.23Å; L340-A343 PolarHBondContact O-N 3.32Å; L340-A343 VanDerWaalsContact O-N 3.12Å; L340-L344 HydrophobicContact CD1-CD1 4.47Å; L340-L344 HydrophobicContact CD1-CG 4.33Å; L340-L344 HydrophobicContact CG-CD1 4.12Å; L340-L344 HydrophobicContact CG-CG 4.38Å; L340-L344 VanDerWaalsContact O-CG 3.3Å; L340-L344 WeakPolarHBondContact O-CG 3.37Å; L340-L344 PolarHBondContact O-N 3.41Å; L340-L353 HydrophobicContact CD1-CD1 4.48Å; L340-L353 HydrophobicContact CD1-CD2 3.65Å; L340-L360 HydrophobicContact CD2-CD1 4.15Å; L340-L368 HydrophobicContact CD2-CD1 4.21Å; L340-L368 HydrophobicContact CD2-CD2 4.02Å
341	A	90.9	Very high	87.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-45.7	177.2	0	0	0	0	0	112.4	V256 I312 L313 L316 R337 L338 A343 L344 F345	V256-A341 HydrophobicContact CG2-CB 3.85Å; I312-A341 HydrophobicContact CG2-CB 3.97Å; L313-A341 HydrophobicContact CD2-CB 3.74Å; L313-A341 HydrophobicContact CG-CB 4.39Å; L316-A341 HydrophobicContact CD1-CB 3.69Å; R337-A341 WeakPolarHBondContact O-CB 3.48Å; R337-A341 PolarHBondContact O-N 2.81Å; L338-A341 WeakPolarHBondContact O-CB 3.43Å; L338-A341 PolarHBondContact O-N 3.14Å; A341-A343 VanDerWaalsContact C-N 3.29Å; A341-A343 PolarHBondContact O-N 2.89Å; A341-L344 PolarHBondContact O-N 2.84Å; A341-F345 VanDerWaalsContact O-CB 3.32Å; A341-F345 WeakPolarHBondContact O-CB 3.49Å; A341-F345 PolarHBondContact O-N 3.12Å
342	R	89.2	Confident	87.9	Confident	49 Å²	49	25.2 Å²	25.2	19%	0.185	14%	0.137	C	C	.	.	H	α-helix	trans	-56.3	-44.7	173.7	-72.6	175.4	-174.1	166.2	9.3	110.9	S255 V256 S259 L338 A339 L340 F345 A346	S255-R342 PolarHBondContact O-NE 3.46Å; S255-R342 PolarHBondContact OG-NE 3.49Å; S255-R342 PolarHBondContact OG-NH2 3.36Å; V256-R342 HydrophobicContact CG2-CG 4.24Å; S259-R342 PolarHBondContact OG-O 2.91Å; S259-R342 VanDerWaalsContact OG-O 3.13Å; L338-R342 WeakPolarHBondContact O-CG 3.39Å; L338-R342 PolarHBondContact O-N 3.43Å; A339-R342 PolarHBondContact O-N 3.41Å; L340-R342 PolarHBondContact O-N 3.23Å; R342-F345 PolarHBondContact O-N 3.26Å; R342-A346 WeakPolarHBondContact O-CB 3.47Å; R342-A346 PolarHBondContact O-N 2.92Å
343	A	89.2	Confident	88.6	Confident	2 Å²	2	22.8 Å²	22.8	2%	0.017	11%	0.111	C	C	.	.	H	α-helix	trans	-70.7	-38.8	-178.2	0	0	0	0	0	114.2	L239 V241 A339 L340 A341 F345 L351	L239-A343 VanDerWaalsContact CD2-CA 3.42Å; L239-A343 HydrophobicContact CD2-CB 3.57Å; L239-A343 HydrophobicContact CG-CB 4.25Å; V241-A343 HydrophobicContact CG2-CB 3.25Å; A339-A343 PolarHBondContact O-N 2.98Å; L340-A343 PolarHBondContact O-N 3.32Å; L340-A343 VanDerWaalsContact O-N 3.12Å; A341-A343 VanDerWaalsContact C-N 3.29Å; A341-A343 PolarHBondContact O-N 2.89Å; A343-F345 VanDerWaalsContact C-N 3.31Å; A343-L351 HydrophobicContact CB-CD1 3.97Å
344	L	90.8	Very high	89.2	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.9	-35.5	173.5	-65.6	176.4	0	0	0	111.6	I312 L316 L340 A341 L351 W367 L368 Y371 L372 W375	I312-L344 HydrophobicContact CG2-CB 4.27Å; I312-L344 HydrophobicContact CG2-CD1 4.29Å; L316-L344 HydrophobicContact CD1-CD1 4.46Å; L340-L344 HydrophobicContact CD1-CD1 4.47Å; L340-L344 HydrophobicContact CD1-CG 4.33Å; L340-L344 HydrophobicContact CG-CD1 4.12Å; L340-L344 HydrophobicContact CG-CG 4.38Å; L340-L344 VanDerWaalsContact O-CG 3.3Å; L340-L344 WeakPolarHBondContact O-CG 3.37Å; L340-L344 PolarHBondContact O-N 3.41Å; A341-L344 PolarHBondContact O-N 2.84Å; L344-L351 HydrophobicContact CD2-CD2 4.17Å; L344-W367 HydrophobicContact CD1-CH2 4.24Å; L344-W367 HydrophobicContact CD1-CZ3 3.97Å; L344-L368 HydrophobicContact CD1-CD1 3.87Å; L344-L368 HydrophobicContact CD2-CD1 4.39Å; L344-Y371 HydrophobicContact CB-CE1 4.05Å; L344-Y371 HydrophobicContact CD1-CD1 4.26Å; L344-Y371 HydrophobicContact CD1-CE1 4.28Å; L344-Y371 HydrophobicContact CD2-CD1 4.06Å; L344-Y371 HydrophobicContact CD2-CE1 3.94Å; L344-Y371 HydrophobicContact CG-CE1 4.3Å; L344-L372 HydrophobicContact CD2-CD2 3.92Å; L344-W375 HydrophobicContact CD2-CZ3 4.33Å; L344-W375 WeakPolarHBondContact O-CH2 3.36Å
345	F	90.3	Very high	89.2	Confident	11 Å²	11	21.1 Å²	21.1	5%	0.048	10%	0.1	C	C	.	.	H	α-helix	trans	-70.8	-41.2	177.8	-174.9	-100.8	0	0	0	112.5	V256 L257 D260 A305 R308 A309 I312 A341 R342 A343 R347	V256-F345 HydrophobicContact CG1-CB 3.54Å; V256-F345 HydrophobicContact CG1-CD1 4.14Å; V256-F345 HydrophobicContact CG1-CD2 4.2Å; V256-F345 HydrophobicContact CG1-CG 3.69Å; V256-F345 VanDerWaalsContact O-CD1 3.23Å; V256-F345 WeakPolarHBondContact O-CD1 3.48Å; L257-F345 HydrophobicContact CD2-CE1 4.38Å; L257-F345 HydrophobicContact CD2-CE2 4.42Å; L257-F345 HydrophobicContact CD2-CZ 3.92Å; D260-F345 HydrophobicContact CB-CD1 4.37Å; D260-F345 HydrophobicContact CB-CE1 3.79Å; A305-F345 HydrophobicContact CB-CE2 4.37Å; A305-F345 HydrophobicContact CB-CZ 3.88Å; R308-F345 HydrophobicContact CB-CE2 4.3Å; A309-F345 HydrophobicContact CB-CD2 4.15Å; A309-F345 HydrophobicContact CB-CE2 4.12Å; I312-F345 HydrophobicContact CD1-CB 4.21Å; I312-F345 HydrophobicContact CD1-CD2 4.18Å; A341-F345 VanDerWaalsContact O-CB 3.32Å; A341-F345 WeakPolarHBondContact O-CB 3.49Å; A341-F345 PolarHBondContact O-N 3.12Å; R342-F345 PolarHBondContact O-N 3.26Å; A343-F345 VanDerWaalsContact C-N 3.31Å; F345-R347 VanDerWaalsContact C-N 3.27Å; F345-R347 PolarHBondContact O-N 3.48Å
346	A	87.2	Confident	89.2	Confident	38 Å²	38	18.7 Å²	18.7	31%	0.314	9%	0.092	S	C	.	.	H	α-helix	trans	-66.2	-22.6	-178.4	0	0	0	0	0	114.6	L239 R342	L239-A346 HydrophobicContact CD2-CB 3.86Å; R342-A346 WeakPolarHBondContact O-CB 3.47Å; R342-A346 PolarHBondContact O-N 2.92Å
347	R	87.3	Confident	89.1	Confident	137 Å²	137	17.9 Å²	17.9	52%	0.517	9%	0.089	S	C	.	.			trans	48	60.4	178.2	-65.1	-179.1	174.7	173.7	-4.1	114.6	F345 W375	F345-R347 VanDerWaalsContact C-N 3.27Å; F345-R347 PolarHBondContact O-N 3.48Å; R347-W375 HydrophobicContact CB-CH2 4.13Å; R347-W375 HydrophobicContact CB-CZ2 4.43Å; R347-W375 HydrophobicContact CG-CH2 3.71Å; R347-W375 HydrophobicContact CG-CZ2 4.43Å; R347-W375 HydrophobicContact CG-CZ3 4.12Å
348	P	90.1	Very high	88.7	Confident	8 Å²	8	19.2 Å²	19.2	5%	0.052	10%	0.096	C	C	.	.			trans	-65.7	163	176.4	34	-42.4	0	0	0	112.6	L239 L351 S377	L239-P348 HydrophobicContact CB-CB 3.84Å; L239-P348 HydrophobicContact CB-CG 3.76Å; L239-P348 HydrophobicContact CD2-CG 4.46Å; P348-L351 HydrophobicContact CG-CB 3.93Å; P348-L351 HydrophobicContact CG-CD1 3.95Å; P348-S377 VanDerWaalsContact O-CB 3.29Å; P348-S377 WeakPolarHBondContact O-CB 3.31Å; P348-S377 PolarHBondContact O-OG 3.36Å
349	D	90.9	Very high	87.9	Confident	53 Å²	53	21.8 Å²	21.8	28%	0.283	11%	0.109	S	C	.	.	S	Bend	trans	-68.8	-36.2	173	-60.3	-56.8	0	0	0	111.9	I236 S237 T378	I236-D349 HydrophobicContact CG2-CB 3.81Å; S237-D349 WeakPolarHBondContact CB-OD2 3.35Å; S237-D349 PolarHBondContact N-OD2 3.34Å; S237-D349 PolarHBondContact O-N 2.81Å; S237-D349 VanDerWaalsContact OG-CG 3.23Å; S237-D349 PolarHBondContact OG-N 3.37Å; S237-D349 PolarHBondContact OG-OD2 3.21Å; D349-T378 WeakPolarHBondContact O-CB 3.31Å; D349-T378 PolarHBondContact O-N 3.42Å
350	L	92.3	Very high	87.6	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	110.7	171.5	178.7	66.9	0	0	0	110.2	I180 M202 I236 S237 I238 L239 L352 T378	I180-L350 HydrophobicContact CD1-CB 4.41Å; I180-L350 HydrophobicContact CD1-CD1 4.38Å; I180-L350 HydrophobicContact CD1-CD2 3.65Å; I180-L350 HydrophobicContact CD1-CG 4.37Å; M202-L350 HydrophobicContact CE-CD1 4.19Å; M202-L350 HydrophobicContact CE-CD2 4.19Å; I236-L350 HydrophobicContact CG2-CB 4.17Å; S237-L350 PolarHBondContact O-N 3.13Å; I238-L350 WeakPolarHBondContact CA-O 3.47Å; I238-L350 HydrophobicContact CD1-CD2 4.45Å; I238-L350 HydrophobicContact CG1-CB 4.38Å; I238-L350 HydrophobicContact CG1-CD2 4.19Å; I238-L350 HydrophobicContact CG2-CD2 4.11Å; I238-L350 HydrophobicContact CG2-CG 4.48Å; L239-L350 PolarHBondContact N-O 3.44Å; L239-L350 VanDerWaalsContact N-O 3.11Å; L350-L352 HydrophobicContact CD1-CD2 4.07Å; L350-L352 HydrophobicContact CD2-CD2 3.84Å; L350-L352 HydrophobicContact CD2-CG 4.33Å; L350-L352 HydrophobicContact CG-CD2 3.79Å; L350-L352 HydrophobicContact CG-CG 4.24Å; L350-T378 WeakPolarHBondContact CA-O 3.26Å; L350-T378 HydrophobicContact CD1-CG2 3.82Å
351	L	93.3	Very high	87.2	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	121.9	173.1	-177.3	63.5	0	0	0	110.2	A343 L344 P348 L353 L372 W375 T378 I379 L380	A343-L351 HydrophobicContact CB-CD1 3.97Å; L344-L351 HydrophobicContact CD2-CD2 4.17Å; P348-L351 HydrophobicContact CG-CB 3.93Å; P348-L351 HydrophobicContact CG-CD1 3.95Å; L351-L353 HydrophobicContact CD1-CD2 4.03Å; L351-L353 HydrophobicContact CD2-CD1 4.13Å; L351-L353 HydrophobicContact CD2-CD2 4.19Å; L351-L353 HydrophobicContact CD2-CG 4.18Å; L351-L353 HydrophobicContact CG-CD1 4.5Å; L351-L353 HydrophobicContact CG-CD2 3.98Å; L351-L353 HydrophobicContact CG-CG 4.02Å; L351-L372 HydrophobicContact CD2-CD2 4.35Å; L351-W375 HydrophobicContact CD2-CZ2 4.11Å; L351-T378 PolarHBondContact N-O 3.34Å; L351-I379 HydrophobicContact CB-CG1 4.37Å; L351-I379 HydrophobicContact CB-CG2 4.45Å; L351-I379 HydrophobicContact CD2-CG1 4.5Å; L351-I379 HydrophobicContact CD2-CG2 4.48Å; L351-I379 WeakPolarHBondContact O-CA 3.33Å; L351-L380 PolarHBondContact O-N 2.78Å
352	L	93.3	Very high	86.7	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.5	177.2	-59.8	-175	0	0	0	109.8	L222 L225 A226 I238 L239 H240 V241 L350 L380	L222-L352 HydrophobicContact CD2-CB 4.01Å; L222-L352 HydrophobicContact CD2-CD1 4.38Å; L222-L352 HydrophobicContact CD2-CD2 3.94Å; L222-L352 HydrophobicContact CD2-CG 4.34Å; L225-L352 HydrophobicContact CB-CD1 4.01Å; A226-L352 HydrophobicContact CB-CD1 4.2Å; I238-L352 HydrophobicContact CG2-CD1 3.64Å; I238-L352 HydrophobicContact CG2-CG 4.01Å; L239-L352 PolarHBondContact O-N 3.15Å; H240-L352 HydrophobicContact CB-CB 4.21Å; H240-L352 HydrophobicContact CB-CD1 4.33Å; V241-L352 PolarHBondContact N-O 3.49Å; V241-L352 VanDerWaalsContact N-O 3.16Å; L350-L352 HydrophobicContact CD1-CD2 4.07Å; L350-L352 HydrophobicContact CD2-CD2 3.84Å; L350-L352 HydrophobicContact CD2-CG 4.33Å; L350-L352 HydrophobicContact CG-CD2 3.79Å; L350-L352 HydrophobicContact CG-CG 4.24Å; L352-L380 HydrophobicContact CD2-CB 3.67Å; L352-L380 HydrophobicContact CD2-CD2 3.89Å; L352-L380 HydrophobicContact CD2-CG 4.27Å
353	L	91.3	Very high	86.4	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.01	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.6	179.8	-59.6	-179.2	0	0	0	110.3	V241 L340 L351 P356 L372 I379 L380 V381 V382	V241-L353 HydrophobicContact CB-CD2 4.26Å; V241-L353 HydrophobicContact CG2-CD2 3.81Å; L340-L353 HydrophobicContact CD1-CD1 4.48Å; L340-L353 HydrophobicContact CD1-CD2 3.65Å; L351-L353 HydrophobicContact CD1-CD2 4.03Å; L351-L353 HydrophobicContact CD2-CD1 4.13Å; L351-L353 HydrophobicContact CD2-CD2 4.19Å; L351-L353 HydrophobicContact CD2-CG 4.18Å; L351-L353 HydrophobicContact CG-CD1 4.5Å; L351-L353 HydrophobicContact CG-CD2 3.98Å; L351-L353 HydrophobicContact CG-CG 4.02Å; L353-P356 HydrophobicContact CB-CB 4.42Å; L353-P356 HydrophobicContact CB-CG 4.06Å; L353-P356 HydrophobicContact CD1-CG 4.31Å; L353-L372 HydrophobicContact CD1-CD1 4.12Å; L353-L372 HydrophobicContact CD1-CD2 4.47Å; L353-I379 HydrophobicContact CD1-CG2 4.45Å; L353-L380 PolarHBondContact N-O 3.01Å; L353-V381 HydrophobicContact CB-CB 4.43Å; L353-V381 HydrophobicContact CB-CG1 4.06Å; L353-V381 HydrophobicContact CB-CG2 4.2Å; L353-V381 HydrophobicContact CD1-CG2 3.98Å; L353-V381 HydrophobicContact CG-CG2 4.44Å; L353-V381 WeakPolarHBondContact O-CA 3.46Å; L353-V382 PolarHBondContact O-N 3.43Å
354	D	88.9	Confident	86.3	Confident	12 Å²	12	21.6 Å²	21.6	6%	0.064	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	102.3	176.6	-160.5	11.3	0	0	0	111.6	T219 L222	T219-D354 WeakPolarHBondContact CB-OD2 3.24Å; T219-D354 WeakPolarHBondContact CG2-OD2 3.32Å; T219-D354 PolarHBondContact OG1-OD2 3.43Å; L222-D354 HydrophobicContact CD1-CB 3.65Å
355	E	85.9	Confident	86.1	Confident	17 Å²	17	22.1 Å²	22.1	8%	0.079	11%	0.11	C	C	.	.	S	Bend	trans	49.4	57.7	-179.1	-61.9	-70.2	161.6	0	0	113.8	K218 T357 N358 V382 S383 H384	K218-E355 IonicContact NZ-OE1 3.98Å; E355-T357 PolarHBondContact O-N 3.19Å; E355-T357 VanDerWaalsContact O-N 3.15Å; E355-N358 WeakPolarHBondContact CB-ND2 3.36Å; E355-N358 PolarHBondContact O-N 3.01Å; E355-V382 WeakPolarHBondContact CA-O 3.32Å; E355-V382 HydrophobicContact CG-CG1 4.1Å; E355-V382 PolarHBondContact N-O 2.98Å; E355-V382 WeakPolarHBondContact OE1-CG1 3.37Å; E355-S383 WeakPolarHBondContact OE2-CA 3.46Å; E355-H384 VanDerWaalsContact CD-CD2 3.4Å; E355-H384 IonicContact OE1-CD2 3.9Å; E355-H384 PolarHBondContact OE1-CD2 2.81Å; E355-H384 IonicContact OE1-CG 2.88Å; E355-H384 PolarHBondContact OE1-N 3.43Å; E355-H384 IonicContact OE1-NE2 3.76Å; E355-H384 PolarHBondContact OE1-NE2 3.23Å; E355-H384 IonicContact OE2-CD2 3.95Å; E355-H384 PolarHBondContact OE2-N 3.43Å
356	P	84.8	Confident	85.9	Confident	14 Å²	14	22.7 Å²	22.7	9%	0.091	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-65.1	-20.7	-174.2	28.5	-35.7	0	0	0	113.3	L353 L360 L368 V381 V382 F388	L353-P356 HydrophobicContact CB-CB 4.42Å; L353-P356 HydrophobicContact CB-CG 4.06Å; L353-P356 HydrophobicContact CD1-CG 4.31Å; P356-L360 WeakPolarHBondContact O-CD1 3.12Å; P356-L360 WeakPolarHBondContact O-CG 3.4Å; P356-L368 HydrophobicContact CB-CD2 4.21Å; P356-V381 HydrophobicContact CG-CG1 3.85Å; P356-V382 WeakPolarHBondContact CD-O 3.48Å; P356-F388 HydrophobicContact CG-CZ 4.41Å
357	T	82.1	Confident	86	Confident	12 Å²	12	21.8 Å²	21.8	7%	0.074	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-79	-23.7	-175.9	50.6	0	0	0	0	114	E355 M359 L360 I365 D385 F388	E355-T357 PolarHBondContact O-N 3.19Å; E355-T357 VanDerWaalsContact O-N 3.15Å; T357-M359 PolarHBondContact O-N 3.25Å; T357-L360 PolarHBondContact O-N 3.46Å; T357-L360 VanDerWaalsContact O-N 3.09Å; T357-I365 HydrophobicContact CG2-CG1 4.39Å; T357-I365 HydrophobicContact CG2-CG2 4.4Å; T357-D385 HydrophobicContact CG2-CB 4.48Å; T357-F388 HydrophobicContact CG2-CB 4.27Å; T357-F388 HydrophobicContact CG2-CD1 4.4Å; T357-F388 HydrophobicContact CG2-CD2 3.79Å; T357-F388 HydrophobicContact CG2-CE2 4.23Å; T357-F388 HydrophobicContact CG2-CG 3.87Å
358	N	78.6	Confident	86.2	Confident	31 Å²	31	15.2 Å²	15.2	17%	0.166	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-61.5	-20.6	-170.9	-75.9	-13.6	0	0	0	115.4	E355	E355-N358 WeakPolarHBondContact CB-ND2 3.36Å; E355-N358 PolarHBondContact O-N 3.01Å
359	M	72.6	Confident	86.2	Confident	56 Å²	56	16 Å²	16	28%	0.276	8%	0.08	S	C	.	.	G	3₁₀ helix	trans	-119.7	10.7	-178.5	-60	-68.2	148.7	0	0	112.2	M336 R337 T357	M336-M359 HydrophobicContact CG-CB 4.38Å; R337-M359 PolarHBondContact NE-O 3.12Å; R337-M359 PolarHBondContact NH2-O 3.22Å; T357-M359 PolarHBondContact O-N 3.25Å
360	L	80.4	Confident	86.1	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.01	8%	0.084	C	C	.	.			trans	-104.3	138.6	-178	-64.2	-179.2	0	0	0	110.5	L316 R337 L340 P356 T357 A364 I365 L368 H667	L316-L360 HydrophobicContact CD2-CD2 4.31Å; R337-L360 HydrophobicContact CG-CD2 3.66Å; L340-L360 HydrophobicContact CD2-CD1 4.15Å; P356-L360 WeakPolarHBondContact O-CD1 3.12Å; P356-L360 WeakPolarHBondContact O-CG 3.4Å; T357-L360 PolarHBondContact O-N 3.46Å; T357-L360 VanDerWaalsContact O-N 3.09Å; L360-A364 HydrophobicContact CB-CB 4.19Å; L360-A364 HydrophobicContact CD2-CB 3.99Å; L360-I365 HydrophobicContact CB-CD1 4.32Å; L360-I365 HydrophobicContact CB-CG1 3.56Å; L360-I365 HydrophobicContact CD1-CG1 4.47Å; L360-L368 HydrophobicContact CD1-CD2 3.63Å; L360-H667 PolarHBondContact O-CD2 3.21Å
361	D	81.1	Confident	86	Confident	9 Å²	9	18.7 Å²	18.7	5%	0.048	9%	0.092	C	C	.	.			trans	-74.1	161	169.5	-60.8	-66	0	0	0	110	R337 R363 A364 I365 N529 K533 H667	R337-D361 IonicContact CZ-OD2 3.74Å; R337-D361 IonicContact NH1-OD2 3.15Å; R337-D361 PolarHBondContact NH1-OD2 3.13Å; R337-D361 VanDerWaalsContact NH2-N 3.15Å; R337-D361 IonicContact NH2-OD2 2.83Å; R337-D361 PolarHBondContact NH2-OD2 3.18Å; D361-R363 PolarHBondContact O-N 2.84Å; D361-R363 VanDerWaalsContact O-N 3.1Å; D361-A364 PolarHBondContact O-N 2.97Å; D361-I365 WeakPolarHBondContact O-CG1 3.44Å; D361-I365 PolarHBondContact O-N 3.41Å; D361-N529 VanDerWaalsContact CG-CG 3.45Å; D361-N529 PolarHBondContact OD1-N 3.45Å; D361-N529 PolarHBondContact OD1-ND2 3.46Å; D361-N529 PolarHBondContact OD1-OD1 3.47Å; D361-N529 VanDerWaalsContact OD2-CB 3.24Å; D361-N529 WeakPolarHBondContact OD2-CB 3.4Å; D361-N529 VanDerWaalsContact OD2-CG 3.32Å; D361-N529 PolarHBondContact OD2-N 2.89Å; D361-K533 IonicContact OD1-NZ 3.91Å; D361-K533 PolarHBondContact OD1-NZ 2.85Å; D361-H667 IonicContact OD1-CE1 3.23Å; D361-H667 PolarHBondContact OD1-CE1 3.1Å; D361-H667 IonicContact OD1-NE2 2.81Å; D361-H667 PolarHBondContact OD1-NE2 3.5Å
362	I	81	Confident	85.9	Confident	9 Å²	9	18.7 Å²	18.7	5%	0.046	9%	0.092	C	C	.	.	H	α-helix	trans	-49.3	-42.2	176.4	-64.3	157.7	0	0	0	111.4	I365 L366 V526 H667 F694 Y697 L701	I362-I365 PolarHBondContact O-N 3.41Å; I362-L366 HydrophobicContact CG2-CD1 4.14Å; I362-L366 WeakPolarHBondContact O-CG 3.47Å; I362-L366 PolarHBondContact O-N 3.44Å; I362-V526 HydrophobicContact CD1-CB 4.23Å; I362-V526 HydrophobicContact CD1-CG1 3.8Å; I362-H667 HydrophobicContact CG1-CB 4.29Å; I362-F694 HydrophobicContact CD1-CE2 3.82Å; I362-F694 HydrophobicContact CD1-CZ 4.37Å; I362-F694 HydrophobicContact CG2-CZ 4.15Å; I362-Y697 HydrophobicContact CD1-CE1 3.96Å; I362-Y697 HydrophobicContact CG2-CE1 4.46Å; I362-L701 HydrophobicContact CB-CD1 4.49Å; I362-L701 HydrophobicContact CG2-CD1 3.84Å
363	R	82.7	Confident	85.8	Confident	38 Å²	38	22.7 Å²	22.7	14%	0.143	11%	0.11	C	C	.	.	H	α-helix	trans	-56.5	-55	174.8	-174.4	180	176.5	-159.9	2	111.4	D361 I365 L366 W367 E528 F705 E708	D361-R363 PolarHBondContact O-N 2.84Å; D361-R363 VanDerWaalsContact O-N 3.1Å; R363-I365 VanDerWaalsContact C-N 3.33Å; R363-I365 PolarHBondContact O-N 2.82Å; R363-L366 PolarHBondContact O-N 3.17Å; R363-W367 PolarHBondContact O-N 3.28Å; R363-W367 VanDerWaalsContact O-N 3.11Å; R363-E528 WeakPolarHBondContact CD-OE1 3.49Å; R363-E528 IonicContact CZ-OE1 3.92Å; R363-E528 IonicContact NE-OE1 2.97Å; R363-E528 IonicContact NH1-OE1 3.66Å; R363-E528 PolarHBondContact NH1-OE1 3.42Å; R363-F705 HydrophobicContact CB-CE2 4.46Å; R363-F705 HydrophobicContact CB-CZ 4.24Å; R363-F705 HydrophobicContact CG-CE1 3.95Å; R363-F705 HydrophobicContact CG-CE2 3.63Å; R363-F705 HydrophobicContact CG-CZ 3.18Å; R363-F705 VanDerWaalsContact O-CZ 3.23Å; R363-F705 WeakPolarHBondContact O-CZ 3.45Å; R363-E708 IonicContact CZ-OE1 3.98Å; R363-E708 IonicContact CZ-OE2 3.03Å; R363-E708 IonicContact NH2-OE1 3.36Å; R363-E708 PolarHBondContact NH2-OE1 3.26Å; R363-E708 IonicContact NH2-OE2 3.91Å; R363-E708 PolarHBondContact NH2-OE2 3.02Å
364	A	87	Confident	85.7	Confident	3 Å²	3	27.7 Å²	27.7	3%	0.025	14%	0.141	C	C	.	.	H	α-helix	trans	-67.3	-32.2	-178.1	0	0	0	0	0	112.9	L360 D361 L368	L360-A364 HydrophobicContact CB-CB 4.19Å; L360-A364 HydrophobicContact CD2-CB 3.99Å; D361-A364 PolarHBondContact O-N 2.97Å; A364-L368 VanDerWaalsContact O-CB 3.3Å; A364-L368 WeakPolarHBondContact O-CB 3.37Å; A364-L368 PolarHBondContact O-N 2.93Å
365	I	87.3	Confident	85.8	Confident	11 Å²	11	28 Å²	28	6%	0.056	14%	0.142	C	C	.	.	H	α-helix	trans	-62.5	-51.7	173.9	-65.7	170.9	0	0	0	110	T357 L360 D361 I362 R363 W367 L368 E369 F388 H667	T357-I365 HydrophobicContact CG2-CG1 4.39Å; T357-I365 HydrophobicContact CG2-CG2 4.4Å; L360-I365 HydrophobicContact CB-CD1 4.32Å; L360-I365 HydrophobicContact CB-CG1 3.56Å; L360-I365 HydrophobicContact CD1-CG1 4.47Å; D361-I365 WeakPolarHBondContact O-CG1 3.44Å; D361-I365 PolarHBondContact O-N 3.41Å; I362-I365 PolarHBondContact O-N 3.41Å; R363-I365 VanDerWaalsContact C-N 3.33Å; R363-I365 PolarHBondContact O-N 2.82Å; I365-W367 VanDerWaalsContact C-N 3.29Å; I365-W367 PolarHBondContact O-N 2.99Å; I365-L368 PolarHBondContact O-N 3.43Å; I365-L368 VanDerWaalsContact O-N 3.1Å; I365-E369 HydrophobicContact CG2-CG 4.38Å; I365-E369 WeakPolarHBondContact O-CG 3.37Å; I365-E369 PolarHBondContact O-N 2.86Å; I365-F388 HydrophobicContact CG2-CD2 4.27Å; I365-H667 HydrophobicContact CD1-CB 4.25Å
366	L	86.1	Confident	85.9	Confident	24 Å²	24	35.6 Å²	35.6	13%	0.126	18%	0.177	C	C	.	.	H	α-helix	trans	-59.8	-39.4	178.8	-70.7	171.1	0	0	0	112.3	I362 R363 N370 R698 L701 F705	I362-L366 HydrophobicContact CG2-CD1 4.14Å; I362-L366 WeakPolarHBondContact O-CG 3.47Å; I362-L366 PolarHBondContact O-N 3.44Å; R363-L366 PolarHBondContact O-N 3.17Å; L366-N370 PolarHBondContact O-N 2.9Å; L366-N370 PolarHBondContact O-ND2 3.03Å; L366-R698 HydrophobicContact CD1-CG 4.18Å; L366-L701 HydrophobicContact CD1-CD1 4.41Å; L366-F705 HydrophobicContact CB-CE2 4.42Å
367	W	89.2	Confident	86.1	Confident	18 Å²	18	36.5 Å²	36.5	7%	0.068	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-46.2	174.6	179.8	85.5	0	0	0	111.5	I312 L316 L344 R363 I365 E369 N370 Y371 F705	I312-W367 HydrophobicContact CB-CH2 4.21Å; I312-W367 HydrophobicContact CG1-CH2 4.27Å; I312-W367 HydrophobicContact CG2-CH2 4.01Å; L316-W367 HydrophobicContact CD2-CE3 3.93Å; L316-W367 HydrophobicContact CD2-CZ3 3.78Å; L316-W367 HydrophobicContact CG-CE3 4.17Å; L316-W367 HydrophobicContact CG-CZ3 3.77Å; L344-W367 HydrophobicContact CD1-CH2 4.24Å; L344-W367 HydrophobicContact CD1-CZ3 3.97Å; R363-W367 PolarHBondContact O-N 3.28Å; R363-W367 VanDerWaalsContact O-N 3.11Å; I365-W367 VanDerWaalsContact C-N 3.29Å; I365-W367 PolarHBondContact O-N 2.99Å; W367-E369 VanDerWaalsContact C-N 3.35Å; W367-E369 PolarHBondContact O-N 2.83Å; W367-N370 PolarHBondContact O-N 3.46Å; W367-Y371 HydrophobicContact CH2-CD1 4.39Å; W367-Y371 AromaticContact CH2-CD2 3.86Å; W367-Y371 HydrophobicContact CH2-CD2 3.86Å; W367-Y371 HydrophobicContact CH2-CE2 4.27Å; W367-Y371 AromaticContact CH2-CG 3.92Å; W367-Y371 HydrophobicContact CH2-CG 3.92Å; W367-Y371 AromaticContact CZ2-CD2 3.69Å; W367-Y371 HydrophobicContact CZ2-CD2 3.69Å; W367-Y371 HydrophobicContact CZ2-CE2 4.19Å; W367-Y371 HydrophobicContact CZ2-CG 4.13Å; W367-Y371 HydrophobicContact CZ3-CG 4.39Å; W367-Y371 WeakPolarHBondContact O-CB 3.38Å; W367-Y371 PolarHBondContact O-N 3.1Å; W367-F705 HydrophobicContact CB-CE1 4.21Å; W367-F705 HydrophobicContact CB-CZ 4.06Å
368	L	90.8	Very high	86.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-41	179.5	-177.9	65.9	0	0	0	111.8	L340 L344 P356 L360 A364 I365 Y371 L372 F388	L340-L368 HydrophobicContact CD2-CD1 4.21Å; L340-L368 HydrophobicContact CD2-CD2 4.02Å; L344-L368 HydrophobicContact CD1-CD1 3.87Å; L344-L368 HydrophobicContact CD2-CD1 4.39Å; P356-L368 HydrophobicContact CB-CD2 4.21Å; L360-L368 HydrophobicContact CD1-CD2 3.63Å; A364-L368 VanDerWaalsContact O-CB 3.3Å; A364-L368 WeakPolarHBondContact O-CB 3.37Å; A364-L368 PolarHBondContact O-N 2.93Å; I365-L368 PolarHBondContact O-N 3.43Å; I365-L368 VanDerWaalsContact O-N 3.1Å; L368-Y371 PolarHBondContact O-N 3.36Å; L368-L372 HydrophobicContact CD1-CD1 3.89Å; L368-L372 HydrophobicContact CD1-CD2 4.4Å; L368-L372 HydrophobicContact CD1-CG 3.91Å; L368-L372 HydrophobicContact CD2-CD1 4.34Å; L368-L372 HydrophobicContact CG-CD1 3.77Å; L368-L372 HydrophobicContact CG-CG 4.16Å; L368-L372 WeakPolarHBondContact O-CB 3.45Å; L368-L372 VanDerWaalsContact O-CG 3.25Å; L368-L372 WeakPolarHBondContact O-CG 3.17Å; L368-L372 PolarHBondContact O-N 3.4Å; L368-F388 HydrophobicContact CD2-CE2 4.02Å; L368-F388 HydrophobicContact CD2-CZ 4.29Å; L368-F388 HydrophobicContact CG-CE2 4.22Å
369	E	90.3	Very high	87.4	Confident	25 Å²	25	34.7 Å²	34.7	12%	0.117	17%	0.173	C	C	.	.	H	α-helix	trans	-56.3	-53.8	175.4	-75	175.4	177.8	0	0	111.4	I365 W367 Y371 L372 Q373 F388 V392	I365-E369 HydrophobicContact CG2-CG 4.38Å; I365-E369 WeakPolarHBondContact O-CG 3.37Å; I365-E369 PolarHBondContact O-N 2.86Å; W367-E369 VanDerWaalsContact C-N 3.35Å; W367-E369 PolarHBondContact O-N 2.83Å; E369-Y371 VanDerWaalsContact C-N 3.3Å; E369-Y371 PolarHBondContact O-N 2.96Å; E369-L372 PolarHBondContact O-N 2.78Å; E369-Q373 WeakPolarHBondContact O-CG 3.42Å; E369-Q373 PolarHBondContact O-N 3.28Å; E369-F388 HydrophobicContact CG-CD2 3.41Å; E369-F388 VanDerWaalsContact CG-CD2 3.41Å; E369-F388 HydrophobicContact CG-CE2 3.82Å; E369-F388 HydrophobicContact CG-CG 4.38Å; E369-F388 WeakPolarHBondContact OE1-CA 3.48Å; E369-V392 HydrophobicContact CB-CG2 4.41Å; E369-V392 HydrophobicContact CG-CG2 4.3Å
370	N	89.5	Confident	88.4	Confident	66 Å²	66	32.1 Å²	32.1	35%	0.353	16%	0.161	S	C	.	.	H	α-helix	trans	-62.1	-39.9	179.2	-69.9	-46.4	0	0	0	111.7	L366 W367 Q373	L366-N370 PolarHBondContact O-N 2.9Å; L366-N370 PolarHBondContact O-ND2 3.03Å; W367-N370 PolarHBondContact O-N 3.46Å; N370-Q373 PolarHBondContact O-N 3.46Å
371	Y	90.6	Very high	89	Confident	43 Å²	43	32.2 Å²	32.2	17%	0.169	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-47.9	178	-168.3	-95.3	0	0	0	111.7	I312 L344 W367 L368 E369 Q373 T374 W375	I312-Y371 HydrophobicContact CG1-CE2 4.42Å; L344-Y371 HydrophobicContact CB-CE1 4.05Å; L344-Y371 HydrophobicContact CD1-CD1 4.26Å; L344-Y371 HydrophobicContact CD1-CE1 4.28Å; L344-Y371 HydrophobicContact CD2-CD1 4.06Å; L344-Y371 HydrophobicContact CD2-CE1 3.94Å; L344-Y371 HydrophobicContact CG-CE1 4.3Å; W367-Y371 HydrophobicContact CH2-CD1 4.39Å; W367-Y371 AromaticContact CH2-CD2 3.86Å; W367-Y371 HydrophobicContact CH2-CD2 3.86Å; W367-Y371 HydrophobicContact CH2-CE2 4.27Å; W367-Y371 AromaticContact CH2-CG 3.92Å; W367-Y371 HydrophobicContact CH2-CG 3.92Å; W367-Y371 AromaticContact CZ2-CD2 3.69Å; W367-Y371 HydrophobicContact CZ2-CD2 3.69Å; W367-Y371 HydrophobicContact CZ2-CE2 4.19Å; W367-Y371 HydrophobicContact CZ2-CG 4.13Å; W367-Y371 HydrophobicContact CZ3-CG 4.39Å; W367-Y371 WeakPolarHBondContact O-CB 3.38Å; W367-Y371 PolarHBondContact O-N 3.1Å; L368-Y371 PolarHBondContact O-N 3.36Å; E369-Y371 VanDerWaalsContact C-N 3.3Å; E369-Y371 PolarHBondContact O-N 2.96Å; Y371-Q373 VanDerWaalsContact C-N 3.32Å; Y371-Q373 PolarHBondContact O-N 2.85Å; Y371-T374 PolarHBondContact O-N 2.93Å; Y371-T374 PolarHBondContact O-OG1 3.02Å; Y371-W375 HydrophobicContact CD1-CE3 4.41Å; Y371-W375 AromaticContact CE1-CE3 3.85Å; Y371-W375 HydrophobicContact CE1-CE3 3.85Å; Y371-W375 AromaticContact CE1-CZ3 3.66Å; Y371-W375 HydrophobicContact CE1-CZ3 3.66Å
372	L	91.6	Very high	89.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-70.1	-25.2	-179.1	-67.8	177	0	0	0	113.4	L344 L351 L353 L368 E369 T374 W375 I379 F388 V392	L344-L372 HydrophobicContact CD2-CD2 3.92Å; L351-L372 HydrophobicContact CD2-CD2 4.35Å; L353-L372 HydrophobicContact CD1-CD1 4.12Å; L353-L372 HydrophobicContact CD1-CD2 4.47Å; L368-L372 HydrophobicContact CD1-CD1 3.89Å; L368-L372 HydrophobicContact CD1-CD2 4.4Å; L368-L372 HydrophobicContact CD1-CG 3.91Å; L368-L372 HydrophobicContact CD2-CD1 4.34Å; L368-L372 HydrophobicContact CG-CD1 3.77Å; L368-L372 HydrophobicContact CG-CG 4.16Å; L368-L372 WeakPolarHBondContact O-CB 3.45Å; L368-L372 VanDerWaalsContact O-CG 3.25Å; L368-L372 WeakPolarHBondContact O-CG 3.17Å; L368-L372 PolarHBondContact O-N 3.4Å; E369-L372 PolarHBondContact O-N 2.78Å; L372-T374 VanDerWaalsContact C-N 3.28Å; L372-T374 PolarHBondContact O-N 2.89Å; L372-W375 WeakPolarHBondContact O-CB 3.31Å; L372-W375 PolarHBondContact O-N 2.78Å; L372-I379 HydrophobicContact CB-CD1 4.38Å; L372-I379 HydrophobicContact CD2-CD1 3.86Å; L372-F388 HydrophobicContact CD1-CE2 4.27Å; L372-F388 HydrophobicContact CD1-CZ 3.65Å; L372-V392 HydrophobicContact CB-CG1 3.88Å; L372-V392 HydrophobicContact CB-CG2 4.28Å; L372-V392 HydrophobicContact CD1-CG1 4.3Å
373	Q	90.7	Very high	89.8	Confident	85 Å²	85	31.5 Å²	31.5	40%	0.397	16%	0.158	S	C	.	.	H	α-helix	trans	-63.1	-34.7	172.4	-79.1	178.3	-2	0	0	112.6	E369 N370 Y371 W375 A391	E369-Q373 WeakPolarHBondContact O-CG 3.42Å; E369-Q373 PolarHBondContact O-N 3.28Å; N370-Q373 PolarHBondContact O-N 3.46Å; Y371-Q373 VanDerWaalsContact C-N 3.32Å; Y371-Q373 PolarHBondContact O-N 2.85Å; Q373-W375 VanDerWaalsContact C-N 3.27Å; Q373-W375 PolarHBondContact O-N 2.92Å; Q373-A391 PolarHBondContact NE2-O 3.19Å
374	T	89.4	Confident	89.8	Confident	107 Å²	107	30.6 Å²	30.6	66%	0.656	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.5	177.9	67.5	0	0	0	0	113.8	Y371 L372	Y371-T374 PolarHBondContact O-N 2.93Å; Y371-T374 PolarHBondContact O-OG1 3.02Å; L372-T374 VanDerWaalsContact C-N 3.28Å; L372-T374 PolarHBondContact O-N 2.89Å
375	W	89.5	Confident	89.6	Confident	19 Å²	19	31.6 Å²	31.6	7%	0.072	16%	0.16	C	C	.	.			trans	-71.8	131.2	-176.7	-163.9	-95.1	0	0	0	112	L344 R347 L351 Y371 L372 Q373 S377 I379	L344-W375 HydrophobicContact CD2-CZ3 4.33Å; L344-W375 WeakPolarHBondContact O-CH2 3.36Å; R347-W375 HydrophobicContact CB-CH2 4.13Å; R347-W375 HydrophobicContact CB-CZ2 4.43Å; R347-W375 HydrophobicContact CG-CH2 3.71Å; R347-W375 HydrophobicContact CG-CZ2 4.43Å; R347-W375 HydrophobicContact CG-CZ3 4.12Å; L351-W375 HydrophobicContact CD2-CZ2 4.11Å; Y371-W375 HydrophobicContact CD1-CE3 4.41Å; Y371-W375 AromaticContact CE1-CE3 3.85Å; Y371-W375 HydrophobicContact CE1-CE3 3.85Å; Y371-W375 AromaticContact CE1-CZ3 3.66Å; Y371-W375 HydrophobicContact CE1-CZ3 3.66Å; L372-W375 WeakPolarHBondContact O-CB 3.31Å; L372-W375 PolarHBondContact O-N 2.78Å; Q373-W375 VanDerWaalsContact C-N 3.27Å; Q373-W375 PolarHBondContact O-N 2.92Å; W375-S377 VanDerWaalsContact CD1-O 3.3Å; W375-I379 HydrophobicContact CB-CD1 3.66Å; W375-I379 HydrophobicContact CD2-CD1 4.42Å; W375-I379 HydrophobicContact CG-CD1 3.55Å; W375-I379 HydrophobicContact CG-CG1 4.07Å
376	Q	87.8	Confident	89.5	Confident	176 Å²	176	32.9 Å²	32.9	82%	0.822	16%	0.164	S	C	*	.			trans	-92.9	-26.9	-173.6	-64.2	-176.4	-9.9	0	0	113.7	G205	G205-Q376 WeakPolarHBondContact CA-O 3.2Å
377	S	91	Very high	89.5	Confident	32 Å²	32	34.4 Å²	34.4	22%	0.224	17%	0.172	C	C	.	.	S	Bend	trans	-84.9	178	-178.7	-44.9	0	0	0	0	112	P348 W375	P348-S377 VanDerWaalsContact O-CB 3.29Å; P348-S377 WeakPolarHBondContact O-CB 3.31Å; P348-S377 PolarHBondContact O-OG 3.36Å; W375-S377 VanDerWaalsContact CD1-O 3.3Å
378	T	93.3	Very high	89.4	Confident	5 Å²	5	33.5 Å²	33.5	3%	0.031	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.6	178.6	-50.1	0	0	0	0	110.5	S204 G205 R206 Y208 D349 L350 L351	S204-T378 WeakPolarHBondContact CA-OG1 3.36Å; G205-T378 PolarHBondContact N-OG1 3.3Å; R206-T378 WeakPolarHBondContact O-CA 2.98Å; R206-T378 WeakPolarHBondContact O-CG2 3.44Å; Y208-T378 HydrophobicContact CD2-CG2 4.16Å; Y208-T378 HydrophobicContact CE2-CG2 4.21Å; D349-T378 WeakPolarHBondContact O-CB 3.31Å; D349-T378 PolarHBondContact O-N 3.42Å; L350-T378 WeakPolarHBondContact CA-O 3.26Å; L350-T378 HydrophobicContact CD1-CG2 3.82Å; L351-T378 PolarHBondContact N-O 3.34Å
379	I	94.1	Very high	89.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.4	174.8	-53.3	166.8	0	0	0	108.9	R206 R207 Y208 L351 L353 L372 W375 V381	R206-I379 PolarHBondContact O-N 2.73Å; R207-I379 HydrophobicContact CG-CB 4.36Å; R207-I379 HydrophobicContact CG-CD1 3.99Å; R207-I379 HydrophobicContact CG-CG1 4.4Å; Y208-I379 PolarHBondContact N-O 2.84Å; L351-I379 HydrophobicContact CB-CG1 4.37Å; L351-I379 HydrophobicContact CB-CG2 4.45Å; L351-I379 HydrophobicContact CD2-CG1 4.5Å; L351-I379 HydrophobicContact CD2-CG2 4.48Å; L351-I379 WeakPolarHBondContact O-CA 3.33Å; L353-I379 HydrophobicContact CD1-CG2 4.45Å; L372-I379 HydrophobicContact CB-CD1 4.38Å; L372-I379 HydrophobicContact CD2-CD1 3.86Å; W375-I379 HydrophobicContact CB-CD1 3.66Å; W375-I379 HydrophobicContact CD2-CD1 4.42Å; W375-I379 HydrophobicContact CG-CD1 3.55Å; W375-I379 HydrophobicContact CG-CG1 4.07Å; I379-V381 HydrophobicContact CG2-CG2 3.33Å
380	L	94.3	Very high	89.5	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	109.6	164.1	-179.6	64.5	0	0	0	108.5	M202 Y208 L210 L222 L225 L351 L352 L353 I397	M202-L380 HydrophobicContact SD-CB 4.44Å; M202-L380 HydrophobicContact SD-CD1 4.45Å; M202-L380 HydrophobicContact SD-CD2 4.22Å; Y208-L380 CarbonylContact O-C 3.57Å; Y208-L380 WeakPolarHBondContact O-CA 3.27Å; L210-L380 HydrophobicContact CB-CD1 4.03Å; L222-L380 HydrophobicContact CD2-CD2 3.79Å; L222-L380 HydrophobicContact CD2-CG 4.13Å; L225-L380 HydrophobicContact CD1-CD2 3.88Å; L351-L380 PolarHBondContact O-N 2.78Å; L352-L380 HydrophobicContact CD2-CB 3.67Å; L352-L380 HydrophobicContact CD2-CD2 3.89Å; L352-L380 HydrophobicContact CD2-CG 4.27Å; L353-L380 PolarHBondContact N-O 3.01Å; L380-I397 HydrophobicContact CD1-CD1 3.89Å
381	V	92.9	Very high	89.5	Confident	5 Å²	5	33.4 Å²	33.4	3%	0.03	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.3	179.1	-171.1	0	0	0	0	110.4	Y208 G209 L210 L353 P356 I379 F388	Y208-V381 PolarHBondContact O-N 2.79Å; G209-V381 CarbonylContact C-O 3.38Å; G209-V381 WeakPolarHBondContact CA-O 2.98Å; L210-V381 PolarHBondContact N-O 3.27Å; L353-V381 HydrophobicContact CB-CB 4.43Å; L353-V381 HydrophobicContact CB-CG1 4.06Å; L353-V381 HydrophobicContact CB-CG2 4.2Å; L353-V381 HydrophobicContact CD1-CG2 3.98Å; L353-V381 HydrophobicContact CG-CG2 4.44Å; L353-V381 WeakPolarHBondContact O-CA 3.46Å; P356-V381 HydrophobicContact CG-CG1 3.85Å; I379-V381 HydrophobicContact CG2-CG2 3.33Å; V381-F388 HydrophobicContact CG1-CE1 3.83Å
382	V	91.2	Very high	89.6	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.8	161.2	174.5	0	0	0	0	107.5	L210 K218 L222 L353 E355 P356	L210-V382 HydrophobicContact CB-CG2 3.74Å; L210-V382 HydrophobicContact CD2-CG2 3.59Å; L210-V382 HydrophobicContact CG-CG2 3.86Å; K218-V382 HydrophobicContact CB-CG1 4.12Å; K218-V382 HydrophobicContact CB-CG2 4.12Å; K218-V382 HydrophobicContact CD-CG1 3.93Å; L222-V382 HydrophobicContact CD1-CB 4.18Å; L222-V382 HydrophobicContact CD1-CG2 3.49Å; L222-V382 VanDerWaalsContact CD1-CG2 3.49Å; L222-V382 HydrophobicContact CG-CG2 4.17Å; L353-V382 PolarHBondContact O-N 3.43Å; E355-V382 WeakPolarHBondContact CA-O 3.32Å; E355-V382 HydrophobicContact CG-CG1 4.1Å; E355-V382 PolarHBondContact N-O 2.98Å; E355-V382 WeakPolarHBondContact OE1-CG1 3.37Å; P356-V382 WeakPolarHBondContact CD-O 3.48Å
383	S	87.3	Confident	89.7	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.007	17%	0.172	C	C	.	.			trans	-150	144.6	175.6	-179.8	0	0	0	0	110.6	E355 D385 L389	E355-S383 WeakPolarHBondContact OE2-CA 3.46Å; S383-D385 PolarHBondContact OG-N 2.95Å; S383-L389 WeakPolarHBondContact O-CD1 3.47Å
384	H	81.3	Confident	89.8	Confident	20 Å²	20	30 Å²	30	9%	0.093	17%	0.165	C	C	.	.	S	Bend	trans	-91.3	-5	166.6	-73.8	-68.2	0	0	0	114	N214 K218 E355 D644 M645	N214-H384 PolarHBondContact OD1-NE2 2.93Å; K218-H384 PolarHBondContact NZ-CE1 2.74Å; K218-H384 PolarHBondContact NZ-NE2 3.26Å; E355-H384 VanDerWaalsContact CD-CD2 3.4Å; E355-H384 IonicContact OE1-CD2 3.9Å; E355-H384 PolarHBondContact OE1-CD2 2.81Å; E355-H384 IonicContact OE1-CG 2.88Å; E355-H384 PolarHBondContact OE1-N 3.43Å; E355-H384 IonicContact OE1-NE2 3.76Å; E355-H384 PolarHBondContact OE1-NE2 3.23Å; E355-H384 IonicContact OE2-CD2 3.95Å; E355-H384 PolarHBondContact OE2-N 3.43Å; H384-D644 IonicContact CE1-OD1 3.64Å; H384-D644 PolarHBondContact CE1-OD1 3.1Å; H384-D644 IonicContact NE2-OD1 3.39Å; H384-M645 WeakPolarHBondContact O-CE 3.46Å
385	D	83.8	Confident	90.1	Very high	23 Å²	23	25.2 Å²	25.2	12%	0.123	14%	0.135	C	C	.	.			trans	-84.3	116.6	179.5	-174	-13.3	0	0	0	111.1	T357 S383 N387 F388 L389	T357-D385 HydrophobicContact CG2-CB 4.48Å; S383-D385 PolarHBondContact OG-N 2.95Å; D385-N387 PolarHBondContact OD1-N 3.49Å; D385-F388 HydrophobicContact CB-CB 3.82Å; D385-F388 PolarHBondContact OD1-N 3.25Å; D385-L389 WeakPolarHBondContact O-CB 3.35Å; D385-L389 VanDerWaalsContact O-CG 3.25Å; D385-L389 WeakPolarHBondContact O-CG 3.49Å; D385-L389 PolarHBondContact O-N 2.91Å; D385-L389 VanDerWaalsContact O-N 3.09Å
386	R	84.6	Confident	90.4	Very high	38 Å²	38	24.3 Å²	24.3	14%	0.143	13%	0.132	C	C	.	.	H	α-helix	trans	-65.7	-41.7	179.2	-65.3	-173.5	174	177.6	4.7	112.2	L389 N390 Y411 M645 E649	R386-L389 PolarHBondContact O-N 3.1Å; R386-N390 VanDerWaalsContact O-CB 3.23Å; R386-N390 WeakPolarHBondContact O-CB 3.37Å; R386-N390 PolarHBondContact O-N 3.31Å; R386-Y411 HydrophobicContact CB-CD1 4.03Å; R386-Y411 HydrophobicContact CB-CE1 4.03Å; R386-Y411 HydrophobicContact CG-CD1 4.04Å; R386-Y411 HydrophobicContact CG-CE1 3.53Å; R386-M645 HydrophobicContact CB-CE 4.48Å; R386-M645 HydrophobicContact CG-CE 3.37Å; R386-M645 HydrophobicContact CG-CG 4.22Å; R386-M645 HydrophobicContact CG-SD 3.67Å; R386-M645 VanDerWaalsContact NE-CG 3.34Å; R386-M645 PolarHBondContact NE-SD 3.36Å; R386-E649 IonicContact CZ-OE1 3.97Å; R386-E649 IonicContact CZ-OE2 3.27Å; R386-E649 IonicContact NH1-OE1 3.49Å; R386-E649 PolarHBondContact NH1-OE1 3.34Å; R386-E649 IonicContact NH2-OE1 3Å; R386-E649 PolarHBondContact NH2-OE1 2.91Å; R386-E649 IonicContact NH2-OE2 2.84Å; R386-E649 PolarHBondContact NH2-OE2 3.46Å
387	N	86	Confident	90.7	Very high	56 Å²	56	16 Å²	16	30%	0.299	9%	0.093	S	C	.	.	H	α-helix	trans	-71.2	-45.1	-173.1	-69.8	-4.8	0	0	0	109.3	D385 L389 N390 A391 E669	D385-N387 PolarHBondContact OD1-N 3.49Å; N387-L389 PolarHBondContact O-N 3.17Å; N387-N390 PolarHBondContact O-N 2.98Å; N387-A391 WeakPolarHBondContact O-CB 3.49Å; N387-A391 PolarHBondContact O-N 2.83Å; N387-E669 PolarHBondContact ND2-OE2 3.4Å
388	F	88.3	Confident	90.7	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-56.8	-49.2	172.8	-177.7	-88.7	0	0	0	112.1	P356 T357 I365 L368 E369 L372 V381 D385 N390 A391 V392	P356-F388 HydrophobicContact CG-CZ 4.41Å; T357-F388 HydrophobicContact CG2-CB 4.27Å; T357-F388 HydrophobicContact CG2-CD1 4.4Å; T357-F388 HydrophobicContact CG2-CD2 3.79Å; T357-F388 HydrophobicContact CG2-CE2 4.23Å; T357-F388 HydrophobicContact CG2-CG 3.87Å; I365-F388 HydrophobicContact CG2-CD2 4.27Å; L368-F388 HydrophobicContact CD2-CE2 4.02Å; L368-F388 HydrophobicContact CD2-CZ 4.29Å; L368-F388 HydrophobicContact CG-CE2 4.22Å; E369-F388 HydrophobicContact CG-CD2 3.41Å; E369-F388 VanDerWaalsContact CG-CD2 3.41Å; E369-F388 HydrophobicContact CG-CE2 3.82Å; E369-F388 HydrophobicContact CG-CG 4.38Å; E369-F388 WeakPolarHBondContact OE1-CA 3.48Å; L372-F388 HydrophobicContact CD1-CE2 4.27Å; L372-F388 HydrophobicContact CD1-CZ 3.65Å; V381-F388 HydrophobicContact CG1-CE1 3.83Å; D385-F388 HydrophobicContact CB-CB 3.82Å; D385-F388 PolarHBondContact OD1-N 3.25Å; F388-N390 VanDerWaalsContact C-N 3.32Å; F388-N390 PolarHBondContact O-N 2.79Å; F388-A391 PolarHBondContact O-N 2.98Å; F388-V392 HydrophobicContact CD2-CG2 4.43Å; F388-V392 HydrophobicContact CE1-CB 4.41Å; F388-V392 HydrophobicContact CE1-CG2 4.24Å; F388-V392 HydrophobicContact CE2-CG2 4.11Å; F388-V392 HydrophobicContact CZ-CG2 4.02Å; F388-V392 WeakPolarHBondContact O-CB 3.5Å; F388-V392 WeakPolarHBondContact O-CG2 3.35Å; F388-V392 PolarHBondContact O-N 3.45Å
389	L	90.8	Very high	90.6	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-63.3	-38.1	177.7	-75.2	176.3	0	0	0	112.2	I211 S383 D385 R386 N387 A391 A393 Y411	I211-L389 HydrophobicContact CG2-CD1 3.45Å; I211-L389 VanDerWaalsContact CG2-CD1 3.45Å; S383-L389 WeakPolarHBondContact O-CD1 3.47Å; D385-L389 WeakPolarHBondContact O-CB 3.35Å; D385-L389 VanDerWaalsContact O-CG 3.25Å; D385-L389 WeakPolarHBondContact O-CG 3.49Å; D385-L389 PolarHBondContact O-N 2.91Å; D385-L389 VanDerWaalsContact O-N 3.09Å; R386-L389 PolarHBondContact O-N 3.1Å; N387-L389 PolarHBondContact O-N 3.17Å; L389-A391 VanDerWaalsContact C-N 3.34Å; L389-A393 WeakPolarHBondContact O-CA 3.44Å; L389-A393 WeakPolarHBondContact O-CB 3.4Å; L389-A393 PolarHBondContact O-N 3.41Å; L389-Y411 HydrophobicContact CB-CD2 4.49Å; L389-Y411 HydrophobicContact CB-CG 4.46Å; L389-Y411 HydrophobicContact CD1-CD2 4.11Å
390	N	91.3	Very high	90.2	Very high	52 Å²	52	16.8 Å²	16.8	28%	0.278	9%	0.093	S	C	.	.	H	α-helix	trans	-68.2	-34.7	178	-157.6	58.3	0	0	0	112.2	R386 N387 F388 D410 Y411 E412	R386-N390 VanDerWaalsContact O-CB 3.23Å; R386-N390 WeakPolarHBondContact O-CB 3.37Å; R386-N390 PolarHBondContact O-N 3.31Å; N387-N390 PolarHBondContact O-N 2.98Å; F388-N390 VanDerWaalsContact C-N 3.32Å; F388-N390 PolarHBondContact O-N 2.79Å; N390-D410 VanDerWaalsContact OD1-CB 3.32Å; N390-D410 WeakPolarHBondContact OD1-CB 3.27Å; N390-Y411 PolarHBondContact OD1-N 2.91Å; N390-E412 PolarHBondContact OD1-N 3.3Å
391	A	90.1	Very high	89.8	Confident	35 Å²	35	20.3 Å²	20.3	29%	0.289	12%	0.117	S	C	.	.	H	α-helix	trans	-77.2	-35.7	178.9	0	0	0	0	0	113.2	Q373 N387 F388 L389	Q373-A391 PolarHBondContact NE2-O 3.19Å; N387-A391 WeakPolarHBondContact O-CB 3.49Å; N387-A391 PolarHBondContact O-N 2.83Å; F388-A391 PolarHBondContact O-N 2.98Å; L389-A391 VanDerWaalsContact C-N 3.34Å
392	V	91.9	Very high	89.5	Confident	4 Å²	4	24 Å²	24	2%	0.024	14%	0.135	C	C	.	.	H	α-helix	trans	-102.7	-41.4	-171.3	180	0	0	0	0	112.8	R207 E369 L372 F388	R207-V392 WeakPolarHBondContact CB-O 3.45Å; R207-V392 VanDerWaalsContact CD-O 3.31Å; R207-V392 WeakPolarHBondContact CD-O 3.43Å; R207-V392 PolarHBondContact NE-O 3.01Å; E369-V392 HydrophobicContact CB-CG2 4.41Å; E369-V392 HydrophobicContact CG-CG2 4.3Å; L372-V392 HydrophobicContact CB-CG1 3.88Å; L372-V392 HydrophobicContact CB-CG2 4.28Å; L372-V392 HydrophobicContact CD1-CG1 4.3Å; F388-V392 HydrophobicContact CD2-CG2 4.43Å; F388-V392 HydrophobicContact CE1-CB 4.41Å; F388-V392 HydrophobicContact CE1-CG2 4.24Å; F388-V392 HydrophobicContact CE2-CG2 4.11Å; F388-V392 HydrophobicContact CZ-CG2 4.02Å; F388-V392 WeakPolarHBondContact O-CB 3.5Å; F388-V392 WeakPolarHBondContact O-CG2 3.35Å; F388-V392 PolarHBondContact O-N 3.45Å
393	A	93.8	Very high	89.3	Confident	12 Å²	12	31.7 Å²	31.7	10%	0.099	16%	0.164	C	C	.	.			trans	-77.9	138.1	-169.2	0	0	0	0	0	113	L389 I396	L389-A393 WeakPolarHBondContact O-CA 3.44Å; L389-A393 WeakPolarHBondContact O-CB 3.4Å; L389-A393 PolarHBondContact O-N 3.41Å; A393-I396 HydrophobicContact CB-CD1 3.73Å
394	T	93.7	Very high	89.5	Confident	40 Å²	40	32.4 Å²	32.4	25%	0.245	17%	0.167	C	C	.	.	S	Bend	trans	-98.4	-25.3	170.8	60.5	0	0	0	0	112.6	R207 G409	R207-T394 HydrophobicContact CB-CG2 4.34Å; R207-T394 PolarHBondContact N-OG1 2.93Å; R207-T394 VanDerWaalsContact N-OG1 3.09Å; R207-T394 PolarHBondContact O-N 3.01Å; R207-T394 PolarHBondContact O-OG1 3.18Å; R207-T394 VanDerWaalsContact O-OG1 3.12Å; T394-G409 CarbonylContact C-O 3.59Å; T394-G409 CarbonylContact O-C 3.55Å; T394-G409 WeakPolarHBondContact O-CA 3.37Å; T394-G409 PolarHBondContact O-N 2.82Å; T394-G409 VanDerWaalsContact O-O 3.12Å
395	D	95.1	Very high	90	Very high	7 Å²	7	33.3 Å²	33.3	4%	0.037	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	144.1	-179.1	-60	-105.6	0	0	0	108.4	R206 R207 Y208 G209 Y407	R206-D395 VanDerWaalsContact CD-OD2 3.26Å; R206-D395 WeakPolarHBondContact CD-OD2 3.44Å; R206-D395 IonicContact NH1-OD1 3.3Å; R206-D395 PolarHBondContact NH1-OD1 3.4Å; R206-D395 IonicContact NH1-OD2 2.76Å; R206-D395 PolarHBondContact NH1-OD2 2.85Å; R207-D395 PolarHBondContact O-N 3.27Å; Y208-D395 CarbonylContact C-O 3.6Å; Y208-D395 VanDerWaalsContact CA-O 3.32Å; Y208-D395 WeakPolarHBondContact CA-O 3.32Å; Y208-D395 HydrophobicContact CD1-CB 3.61Å; Y208-D395 HydrophobicContact CE1-CB 3.55Å; G209-D395 PolarHBondContact N-O 3.3Å; D395-Y407 CarbonylContact C-O 3.26Å; D395-Y407 VanDerWaalsContact CA-O 3.31Å; D395-Y407 WeakPolarHBondContact CA-O 3.4Å
396	I	95.3	Very high	90.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.7	-179.2	-61.7	-63.8	0	0	0	109.3	G209 I211 A393 Y407 Y411 F414	G209-I396 CarbonylContact O-C 3.57Å; G209-I396 WeakPolarHBondContact O-CA 3.38Å; I211-I396 HydrophobicContact CD1-CG2 3.39Å; I211-I396 HydrophobicContact CG1-CG2 3.62Å; A393-I396 HydrophobicContact CB-CD1 3.73Å; I396-Y407 PolarHBondContact N-O 3.01Å; I396-Y407 PolarHBondContact O-N 3.23Å; I396-Y411 HydrophobicContact CD1-CD2 4.49Å; I396-F414 HydrophobicContact CB-CB 4.09Å; I396-F414 HydrophobicContact CB-CD2 4.5Å; I396-F414 HydrophobicContact CB-CG 4.25Å; I396-F414 HydrophobicContact CG1-CB 4.05Å; I396-F414 HydrophobicContact CG2-CB 4.22Å; I396-F414 HydrophobicContact CG2-CD1 4.21Å; I396-F414 HydrophobicContact CG2-CD2 4Å; I396-F414 HydrophobicContact CG2-CE2 4.48Å; I396-F414 HydrophobicContact CG2-CG 3.85Å
397	I	94.4	Very high	90.8	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	114.9	172.9	-57.1	171.2	0	0	0	107.3	L200 Y208 G209 L210 I211 L380 L404 T406	L200-I397 HydrophobicContact CD1-CD1 3.61Å; Y208-I397 HydrophobicContact CD1-CD1 3.79Å; Y208-I397 HydrophobicContact CD1-CG1 3.97Å; Y208-I397 HydrophobicContact CG-CD1 4.1Å; G209-I397 PolarHBondContact O-N 3.48Å; L210-I397 WeakPolarHBondContact CA-O 3.33Å; L210-I397 HydrophobicContact CD1-CB 4.01Å; L210-I397 HydrophobicContact CD1-CG2 3.74Å; I211-I397 WeakPolarHBondContact CG1-O 3.49Å; I211-I397 PolarHBondContact N-O 2.96Å; L380-I397 HydrophobicContact CD1-CD1 3.89Å; I397-L404 HydrophobicContact CG2-CB 4.34Å; I397-L404 HydrophobicContact CG2-CD2 3.95Å; I397-T406 HydrophobicContact CG1-CG2 4.4Å
398	H	92.5	Very high	91.1	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	112.8	-178.9	-177.8	-134.7	0	0	0	110.6	I211 H400 D405 Y407 F414	I211-H398 HydrophobicContact CD1-CB 4.27Å; I211-H398 HydrophobicContact CG1-CB 4.17Å; H398-H400 AromaticContact CE1-CD2 3.57Å; H398-H400 AromaticContact CE1-CG 3.64Å; H398-H400 AromaticContact CG-CD2 3.97Å; H398-H400 AromaticContact ND1-CD2 3.2Å; H398-H400 PolarHBondContact ND1-CD2 2.85Å; H398-H400 AromaticContact ND1-CG 3.77Å; H398-H400 AromaticContact ND1-NE2 3.99Å; H398-D405 PolarHBondContact N-O 3.24Å; H398-D405 PolarHBondContact O-N 3.02Å; H398-Y407 HydrophobicContact CB-CD2 4.24Å; H398-Y407 HydrophobicContact CB-CE2 3.87Å; H398-F414 HydrophobicContact CB-CE2 3.8Å; H398-F414 HydrophobicContact CB-CZ 4.22Å; H398-F414 AromaticContact CD2-CZ 3.9Å; H398-F414 AromaticContact CG-CE2 3.83Å; H398-F414 AromaticContact CG-CZ 3.87Å
399	L	90.3	Very high	91.2	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	106.6	173.2	176.2	64.9	0	0	0	109.6	L195 L210 I211 L216 K218 R403 L404	L195-L399 HydrophobicContact CD1-CD1 4.33Å; L195-L399 HydrophobicContact CD2-CD1 3.26Å; L195-L399 HydrophobicContact CG-CD1 3.96Å; L210-L399 HydrophobicContact CD1-CB 4.29Å; I211-L399 WeakPolarHBondContact O-CB 3.31Å; I211-L399 PolarHBondContact O-N 2.87Å; L216-L399 HydrophobicContact CB-CD2 3.56Å; L216-L399 HydrophobicContact CB-CG 3.93Å; L216-L399 HydrophobicContact CD1-CG 4.3Å; L216-L399 WeakPolarHBondContact CD1-O 3.43Å; K218-L399 HydrophobicContact CG-CD2 3.71Å; L399-R403 WeakPolarHBondContact CA-O 3.46Å; L399-L404 HydrophobicContact CB-CD2 3.92Å; L399-L404 HydrophobicContact CD1-CD2 3.64Å; L399-L404 HydrophobicContact CG-CD2 4.36Å
400	H	86.7	Confident	91.2	Very high	40 Å²	40	44.9 Å²	44.9	19%	0.185	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	151.9	177.4	75.2	97.1	0	0	0	110.8	H398 Q402 R403 D405	H398-H400 AromaticContact CE1-CD2 3.57Å; H398-H400 AromaticContact CE1-CG 3.64Å; H398-H400 AromaticContact CG-CD2 3.97Å; H398-H400 AromaticContact ND1-CD2 3.2Å; H398-H400 PolarHBondContact ND1-CD2 2.85Å; H398-H400 AromaticContact ND1-CG 3.77Å; H398-H400 AromaticContact ND1-NE2 3.99Å; H400-Q402 PolarHBondContact O-N 3.46Å; H400-R403 PolarHBondContact N-O 2.68Å; H400-R403 VanDerWaalsContact N-O 3.1Å; H400-R403 WeakPolarHBondContact O-CA 3.3Å; H400-R403 PolarHBondContact O-N 2.8Å; H400-R403 VanDerWaalsContact O-O 3.06Å; H400-D405 IonicContact CD2-OD2 3.44Å; H400-D405 IonicContact CE1-OD2 3.36Å; H400-D405 IonicContact NE2-OD2 3.22Å; H400-D405 PolarHBondContact NE2-OD2 2.86Å
401	S	84.2	Confident	91.1	Very high	75 Å²	75	43 Å²	43	52%	0.524	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	37.1	173.6	-49.6	0	0	0	0	114.9	R403	S401-R403 PolarHBondContact O-N 2.87Å
402	Q	86.8	Confident	91.1	Very high	84 Å²	84	46.2 Å²	46.2	39%	0.393	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	24.3	-175.7	-53.3	169.5	12.2	0	0	114.7	L194 L195 Q196 H400	L194-Q402 WeakPolarHBondContact O-CA 3.37Å; L195-Q402 WeakPolarHBondContact CA-O 3.45Å; Q196-Q402 PolarHBondContact N-O 2.82Å; H400-Q402 PolarHBondContact O-N 3.46Å
403	R	88.4	Confident	91	Very high	162 Å²	162	49.4 Å²	49.4	61%	0.611	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.4	161.8	179.7	-65.7	-177.4	176.1	-170.4	-4.8	111.4	L399 H400 S401	L399-R403 WeakPolarHBondContact CA-O 3.46Å; H400-R403 PolarHBondContact N-O 2.68Å; H400-R403 VanDerWaalsContact N-O 3.1Å; H400-R403 WeakPolarHBondContact O-CA 3.3Å; H400-R403 PolarHBondContact O-N 2.8Å; H400-R403 VanDerWaalsContact O-O 3.06Å; S401-R403 PolarHBondContact O-N 2.87Å
404	L	91.3	Very high	90.9	Very high	15 Å²	15	49.1 Å²	49.1	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.2	173	-65.4	176.8	0	0	0	109	F185 L195 A198 L200 L210 L221 I397 L399	F185-L404 HydrophobicContact CE1-CD1 4.42Å; F185-L404 HydrophobicContact CZ-CD1 3.75Å; L195-L404 HydrophobicContact CD1-CD1 4.19Å; L195-L404 HydrophobicContact CD1-CG 4.32Å; L195-L404 HydrophobicContact CD2-CD2 4.22Å; L195-L404 HydrophobicContact CD2-CG 3.93Å; A198-L404 HydrophobicContact CB-CD1 4.13Å; A198-L404 HydrophobicContact CB-CG 4.23Å; L200-L404 HydrophobicContact CB-CD1 4.47Å; L210-L404 HydrophobicContact CD1-CD2 4.36Å; L221-L404 HydrophobicContact CD2-CD1 4.12Å; L221-L404 HydrophobicContact CD2-CD2 4.47Å; I397-L404 HydrophobicContact CG2-CB 4.34Å; I397-L404 HydrophobicContact CG2-CD2 3.95Å; L399-L404 HydrophobicContact CB-CD2 3.92Å; L399-L404 HydrophobicContact CD1-CD2 3.64Å; L399-L404 HydrophobicContact CG-CD2 4.36Å
405	D	91.2	Very high	90.6	Very high	40 Å²	40	49.5 Å²	49.5	21%	0.214	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.5	170.6	-78.2	-24.3	0	0	0	109.2	H398 H400 Y407 R421	H398-D405 PolarHBondContact N-O 3.24Å; H398-D405 PolarHBondContact O-N 3.02Å; H400-D405 IonicContact CD2-OD2 3.44Å; H400-D405 IonicContact CE1-OD2 3.36Å; H400-D405 IonicContact NE2-OD2 3.22Å; H400-D405 PolarHBondContact NE2-OD2 2.86Å; D405-Y407 HydrophobicContact CB-CD2 4.38Å; D405-Y407 HydrophobicContact CB-CE2 3.56Å; D405-R421 IonicContact OD2-NH1 3.01Å; D405-R421 PolarHBondContact OD2-NH1 3.44Å
406	T	92.2	Very high	90.4	Very high	69 Å²	69	54.6 Å²	54.6	42%	0.423	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	132.9	177.5	-53.5	0	0	0	0	110.4	I397	I397-T406 HydrophobicContact CG1-CG2 4.4Å
407	Y	92.9	Very high	90.3	Very high	25 Å²	25	57.9 Å²	57.9	10%	0.098	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.7	179.2	-64.2	-97.9	0	0	0	109.3	D395 I396 H398 D405 F414 T417 R421	D395-Y407 CarbonylContact C-O 3.26Å; D395-Y407 VanDerWaalsContact CA-O 3.31Å; D395-Y407 WeakPolarHBondContact CA-O 3.4Å; I396-Y407 PolarHBondContact N-O 3.01Å; I396-Y407 PolarHBondContact O-N 3.23Å; H398-Y407 HydrophobicContact CB-CD2 4.24Å; H398-Y407 HydrophobicContact CB-CE2 3.87Å; D405-Y407 HydrophobicContact CB-CD2 4.38Å; D405-Y407 HydrophobicContact CB-CE2 3.56Å; Y407-F414 HydrophobicContact CD1-CD2 4.1Å; Y407-F414 AromaticContact CD2-CD2 3.63Å; Y407-F414 HydrophobicContact CD2-CD2 3.63Å; Y407-F414 AromaticContact CD2-CE2 3.91Å; Y407-F414 HydrophobicContact CD2-CE2 3.91Å; Y407-F414 HydrophobicContact CE1-CD2 4.39Å; Y407-F414 AromaticContact CE2-CD2 3.97Å; Y407-F414 HydrophobicContact CE2-CD2 3.97Å; Y407-F414 AromaticContact CE2-CE2 3.81Å; Y407-F414 HydrophobicContact CE2-CE2 3.81Å; Y407-F414 AromaticContact CG-CD2 3.7Å; Y407-F414 HydrophobicContact CG-CD2 3.7Å; Y407-F414 HydrophobicContact CG-CE2 4.38Å; Y407-T417 HydrophobicContact CD1-CG2 3.99Å; Y407-T417 HydrophobicContact CE1-CG2 4.03Å; Y407-R421 PolarHBondContact OH-NH1 3.24Å
408	R	92	Very high	89.9	Confident	203 Å²	203	59.6 Å²	59.6	77%	0.766	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.9	176.4	-172.8	178.5	-178.5	-174	-1.8	109.8
409	G	91	Very high	89.7	Confident	18 Å²	18	64.1 Å²	64.1	19%	0.186	31%	0.31	C	S	.	.	S	Bend	trans	117.5	176.5	-178.1	0	0	0	0	0	112.3	T394	T394-G409 CarbonylContact C-O 3.59Å; T394-G409 CarbonylContact O-C 3.55Å; T394-G409 WeakPolarHBondContact O-CA 3.37Å; T394-G409 PolarHBondContact O-N 2.82Å; T394-G409 VanDerWaalsContact O-O 3.12Å
410	D	90.1	Very high	89.7	Confident	47 Å²	47	68.1 Å²	68.1	25%	0.251	33%	0.331	S	S	.	.			trans	-67.7	178.2	174.4	62.1	17.5	0	0	0	112.7	N390 E412 N413 F414	N390-D410 VanDerWaalsContact OD1-CB 3.32Å; N390-D410 WeakPolarHBondContact OD1-CB 3.27Å; D410-E412 VanDerWaalsContact C-N 3.34Å; D410-E412 PolarHBondContact O-N 3.21Å; D410-E412 PolarHBondContact OD1-N 2.9Å; D410-N413 VanDerWaalsContact CG-ND2 3.33Å; D410-N413 PolarHBondContact O-N 3.19Å; D410-N413 WeakPolarHBondContact OD1-CB 3.44Å; D410-N413 PolarHBondContact OD1-N 3.44Å; D410-N413 PolarHBondContact OD1-ND2 2.8Å; D410-N413 PolarHBondContact OD2-ND2 3.29Å; D410-F414 PolarHBondContact O-N 3.49Å; D410-F414 VanDerWaalsContact O-N 3.1Å
411	Y	89.1	Confident	89.7	Confident	13 Å²	13	71.6 Å²	71.6	5%	0.051	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-36.9	-177.5	-177.5	-98.1	0	0	0	112.8	I211 R386 L389 N390 I396 F414 L415 M645	I211-Y411 HydrophobicContact CD1-CE2 4.1Å; I211-Y411 HydrophobicContact CG2-CE2 4.45Å; R386-Y411 HydrophobicContact CB-CD1 4.03Å; R386-Y411 HydrophobicContact CB-CE1 4.03Å; R386-Y411 HydrophobicContact CG-CD1 4.04Å; R386-Y411 HydrophobicContact CG-CE1 3.53Å; L389-Y411 HydrophobicContact CB-CD2 4.49Å; L389-Y411 HydrophobicContact CB-CG 4.46Å; L389-Y411 HydrophobicContact CD1-CD2 4.11Å; N390-Y411 PolarHBondContact OD1-N 2.91Å; I396-Y411 HydrophobicContact CD1-CD2 4.49Å; Y411-F414 HydrophobicContact CD2-CD1 4.06Å; Y411-F414 AromaticContact CE2-CD1 3.84Å; Y411-F414 HydrophobicContact CE2-CD1 3.84Å; Y411-F414 HydrophobicContact CE2-CE1 4Å; Y411-F414 WeakPolarHBondContact O-CB 3.43Å; Y411-F414 PolarHBondContact O-N 3.39Å; Y411-L415 HydrophobicContact CD1-CD1 4.11Å; Y411-L415 HydrophobicContact CD1-CG 4.39Å; Y411-L415 HydrophobicContact CE1-CD1 3.35Å; Y411-L415 HydrophobicContact CE1-CD2 4.4Å; Y411-L415 HydrophobicContact CE1-CG 3.72Å; Y411-L415 PolarHBondContact O-N 3.21Å; Y411-L415 WeakPolarHBondContact OH-CD2 3.3Å; Y411-M645 HydrophobicContact CE1-CE 4.44Å; Y411-M645 HydrophobicContact CE1-SD 4.28Å; Y411-M645 HydrophobicContact CE2-CE 3.99Å; Y411-M645 HydrophobicContact CE2-SD 4.22Å; Y411-M645 VanDerWaalsContact CZ-SD 3.57Å; Y411-M645 PolarHBondContact OH-SD 2.91Å
412	E	89.6	Confident	89.8	Confident	102 Å²	102	71.2 Å²	71.2	48%	0.477	33%	0.334	S	S	.	.	H	α-helix	trans	-66.5	-41.7	177.5	-72.8	-168.9	-177.2	0	0	112.9	N390 D410 F414 L415 K416	N390-E412 PolarHBondContact OD1-N 3.3Å; D410-E412 VanDerWaalsContact C-N 3.34Å; D410-E412 PolarHBondContact O-N 3.21Å; D410-E412 PolarHBondContact OD1-N 2.9Å; E412-F414 VanDerWaalsContact C-N 3.31Å; E412-L415 PolarHBondContact O-N 2.86Å; E412-K416 WeakPolarHBondContact O-CG 3.29Å; E412-K416 PolarHBondContact O-N 3.01Å
413	N	90.7	Very high	89.8	Confident	71 Å²	71	71.9 Å²	71.9	38%	0.38	34%	0.336	S	S	.	.	H	α-helix	trans	-65.3	-37.6	176.2	-72.7	-43.6	0	0	0	111.4	D410 T417	D410-N413 VanDerWaalsContact CG-ND2 3.33Å; D410-N413 PolarHBondContact O-N 3.19Å; D410-N413 WeakPolarHBondContact OD1-CB 3.44Å; D410-N413 PolarHBondContact OD1-N 3.44Å; D410-N413 PolarHBondContact OD1-ND2 2.8Å; D410-N413 PolarHBondContact OD2-ND2 3.29Å; N413-T417 VanDerWaalsContact O-CB 3.3Å; N413-T417 WeakPolarHBondContact O-CB 3.35Å; N413-T417 PolarHBondContact O-N 2.89Å; N413-T417 PolarHBondContact O-OG1 3.42Å
414	F	91.9	Very high	89.8	Confident	5 Å²	5	68 Å²	68	2%	0.022	33%	0.328	C	S	.	.	H	α-helix	trans	-57.4	-49.8	170.7	155.5	-100.8	0	0	0	111.5	I211 I396 H398 Y407 D410 Y411 E412 K416 T417 K418	I211-F414 HydrophobicContact CD1-CD1 3.72Å; I211-F414 HydrophobicContact CD1-CD2 4.42Å; I211-F414 HydrophobicContact CD1-CE1 3.14Å; I211-F414 HydrophobicContact CD1-CE2 3.93Å; I211-F414 HydrophobicContact CD1-CG 4.32Å; I211-F414 HydrophobicContact CD1-CZ 3.25Å; I396-F414 HydrophobicContact CB-CB 4.09Å; I396-F414 HydrophobicContact CB-CD2 4.5Å; I396-F414 HydrophobicContact CB-CG 4.25Å; I396-F414 HydrophobicContact CG1-CB 4.05Å; I396-F414 HydrophobicContact CG2-CB 4.22Å; I396-F414 HydrophobicContact CG2-CD1 4.21Å; I396-F414 HydrophobicContact CG2-CD2 4Å; I396-F414 HydrophobicContact CG2-CE2 4.48Å; I396-F414 HydrophobicContact CG2-CG 3.85Å; H398-F414 HydrophobicContact CB-CE2 3.8Å; H398-F414 HydrophobicContact CB-CZ 4.22Å; H398-F414 AromaticContact CD2-CZ 3.9Å; H398-F414 AromaticContact CG-CE2 3.83Å; H398-F414 AromaticContact CG-CZ 3.87Å; Y407-F414 HydrophobicContact CD1-CD2 4.1Å; Y407-F414 AromaticContact CD2-CD2 3.63Å; Y407-F414 HydrophobicContact CD2-CD2 3.63Å; Y407-F414 AromaticContact CD2-CE2 3.91Å; Y407-F414 HydrophobicContact CD2-CE2 3.91Å; Y407-F414 HydrophobicContact CE1-CD2 4.39Å; Y407-F414 AromaticContact CE2-CD2 3.97Å; Y407-F414 HydrophobicContact CE2-CD2 3.97Å; Y407-F414 AromaticContact CE2-CE2 3.81Å; Y407-F414 HydrophobicContact CE2-CE2 3.81Å; Y407-F414 AromaticContact CG-CD2 3.7Å; Y407-F414 HydrophobicContact CG-CD2 3.7Å; Y407-F414 HydrophobicContact CG-CE2 4.38Å; D410-F414 PolarHBondContact O-N 3.49Å; D410-F414 VanDerWaalsContact O-N 3.1Å; Y411-F414 HydrophobicContact CD2-CD1 4.06Å; Y411-F414 AromaticContact CE2-CD1 3.84Å; Y411-F414 HydrophobicContact CE2-CD1 3.84Å; Y411-F414 HydrophobicContact CE2-CE1 4Å; Y411-F414 WeakPolarHBondContact O-CB 3.43Å; Y411-F414 PolarHBondContact O-N 3.39Å; E412-F414 VanDerWaalsContact C-N 3.31Å; F414-K416 PolarHBondContact O-N 2.81Å; F414-T417 PolarHBondContact O-N 3.24Å; F414-K418 HydrophobicContact CE1-CD 4.46Å; F414-K418 HydrophobicContact CE2-CB 4.18Å; F414-K418 HydrophobicContact CE2-CD 4.24Å; F414-K418 HydrophobicContact CZ-CB 4.31Å; F414-K418 HydrophobicContact CZ-CD 3.72Å; F414-K418 WeakPolarHBondContact O-CB 3.28Å; F414-K418 PolarHBondContact O-N 3.15Å
415	L	88.1	Confident	89.6	Confident	49 Å²	49	71.2 Å²	71.2	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-47.7	-179.3	-81.5	-178.9	0	0	0	112.1	Y411 E412 T417 K418 E419	Y411-L415 HydrophobicContact CD1-CD1 4.11Å; Y411-L415 HydrophobicContact CD1-CG 4.39Å; Y411-L415 HydrophobicContact CE1-CD1 3.35Å; Y411-L415 HydrophobicContact CE1-CD2 4.4Å; Y411-L415 HydrophobicContact CE1-CG 3.72Å; Y411-L415 PolarHBondContact O-N 3.21Å; Y411-L415 WeakPolarHBondContact OH-CD2 3.3Å; E412-L415 PolarHBondContact O-N 2.86Å; L415-T417 VanDerWaalsContact C-N 3.35Å; L415-T417 PolarHBondContact O-N 3.41Å; L415-K418 PolarHBondContact O-N 3.03Å; L415-E419 PolarHBondContact O-N 3.5Å
416	K	90.7	Very high	89.4	Confident	113 Å²	113	72.6 Å²	72.6	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-58.4	-48	176.5	-69.5	170	-173.6	161	0	111	E412 F414 K418 E419 D420	E412-K416 WeakPolarHBondContact O-CG 3.29Å; E412-K416 PolarHBondContact O-N 3.01Å; F414-K416 PolarHBondContact O-N 2.81Å; K416-K418 PolarHBondContact O-N 2.83Å; K416-E419 PolarHBondContact O-N 3.02Å; K416-D420 WeakPolarHBondContact O-CB 3.39Å; K416-D420 VanDerWaalsContact O-CG 3.32Å; K416-D420 PolarHBondContact O-N 2.93Å
417	T	91.4	Very high	89.2	Confident	69 Å²	69	77.1 Å²	77.1	42%	0.423	36%	0.357	S	S	.	.	H	α-helix	trans	-64.6	-38.3	179.7	-54.2	0	0	0	0	112	Y407 N413 F414 L415 R421	Y407-T417 HydrophobicContact CD1-CG2 3.99Å; Y407-T417 HydrophobicContact CE1-CG2 4.03Å; N413-T417 VanDerWaalsContact O-CB 3.3Å; N413-T417 WeakPolarHBondContact O-CB 3.35Å; N413-T417 PolarHBondContact O-N 2.89Å; N413-T417 PolarHBondContact O-OG1 3.42Å; F414-T417 PolarHBondContact O-N 3.24Å; L415-T417 VanDerWaalsContact C-N 3.35Å; L415-T417 PolarHBondContact O-N 3.41Å; T417-R421 VanDerWaalsContact O-CB 3.26Å; T417-R421 WeakPolarHBondContact O-CB 3.47Å; T417-R421 PolarHBondContact O-N 3.09Å
418	K	87.4	Confident	88.9	Confident	38 Å²	38	81.7 Å²	81.7	17%	0.165	38%	0.379	C	S	.	.	H	α-helix	trans	-63.4	-48.8	175	-178	-179.2	174.9	-179.1	0	110.4	F414 L415 K416 R421 L422 E475	F414-K418 HydrophobicContact CE1-CD 4.46Å; F414-K418 HydrophobicContact CE2-CB 4.18Å; F414-K418 HydrophobicContact CE2-CD 4.24Å; F414-K418 HydrophobicContact CZ-CB 4.31Å; F414-K418 HydrophobicContact CZ-CD 3.72Å; F414-K418 WeakPolarHBondContact O-CB 3.28Å; F414-K418 PolarHBondContact O-N 3.15Å; L415-K418 PolarHBondContact O-N 3.03Å; K416-K418 PolarHBondContact O-N 2.83Å; K418-R421 PolarHBondContact O-N 3.11Å; K418-L422 HydrophobicContact CG-CD1 4.17Å; K418-L422 WeakPolarHBondContact O-CB 3.46Å; K418-L422 WeakPolarHBondContact O-CG 3.48Å; K418-L422 PolarHBondContact O-N 2.84Å; K418-E475 IonicContact NZ-OE2 2.63Å; K418-E475 PolarHBondContact NZ-OE2 3.48Å; K418-E475 VanDerWaalsContact NZ-OE2 3.09Å
419	E	87.6	Confident	88.6	Confident	106 Å²	106	75.2 Å²	75.2	50%	0.495	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-44.5	178.4	-77.5	-171.3	-164.6	0	0	112.5	L415 K416 R421 L422 K423	L415-E419 PolarHBondContact O-N 3.5Å; K416-E419 PolarHBondContact O-N 3.02Å; E419-R421 VanDerWaalsContact C-N 3.34Å; E419-R421 PolarHBondContact O-N 2.91Å; E419-L422 PolarHBondContact O-N 2.87Å; E419-K423 WeakPolarHBondContact O-CB 3.39Å; E419-K423 VanDerWaalsContact O-CG 3.31Å; E419-K423 WeakPolarHBondContact O-CG 3.32Å; E419-K423 PolarHBondContact O-N 3.01Å; E419-K423 IonicContact OE2-NZ 3.51Å; E419-K423 PolarHBondContact OE2-NZ 2.69Å
420	D	90.1	Very high	88.5	Confident	86 Å²	86	78.4 Å²	78.4	46%	0.46	37%	0.365	S	S	.	.	H	α-helix	trans	-65.3	-40	179	-71.2	-19.3	0	0	0	111.2	K416 K423 N424	K416-D420 WeakPolarHBondContact O-CB 3.39Å; K416-D420 VanDerWaalsContact O-CG 3.32Å; K416-D420 PolarHBondContact O-N 2.93Å; D420-K423 PolarHBondContact O-N 2.65Å; D420-N424 WeakPolarHBondContact O-CB 3.37Å; D420-N424 PolarHBondContact O-N 3.16Å; D420-N424 PolarHBondContact O-ND2 2.98Å
421	R	87.4	Confident	88.5	Confident	113 Å²	113	78.8 Å²	78.8	43%	0.426	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-42.6	173.7	-167.3	176.9	-169.3	-171.3	1.1	111.5	D405 Y407 T417 K418 E419 N424 Q425	D405-R421 IonicContact OD2-NH1 3.01Å; D405-R421 PolarHBondContact OD2-NH1 3.44Å; Y407-R421 PolarHBondContact OH-NH1 3.24Å; T417-R421 VanDerWaalsContact O-CB 3.26Å; T417-R421 WeakPolarHBondContact O-CB 3.47Å; T417-R421 PolarHBondContact O-N 3.09Å; K418-R421 PolarHBondContact O-N 3.11Å; E419-R421 VanDerWaalsContact C-N 3.34Å; E419-R421 PolarHBondContact O-N 2.91Å; R421-N424 PolarHBondContact O-N 2.87Å; R421-Q425 WeakPolarHBondContact O-CB 3.28Å; R421-Q425 VanDerWaalsContact O-CG 3.29Å; R421-Q425 WeakPolarHBondContact O-CG 3.49Å; R421-Q425 PolarHBondContact O-N 3.47Å
422	L	85.6	Confident	88.4	Confident	68 Å²	68	81.6 Å²	81.6	36%	0.356	39%	0.388	S	S	.	.	H	α-helix	trans	-66.2	-43.6	176.8	-75.4	172.9	0	0	0	112.1	K418 E419 N424 Q425 Q426 V472	K418-L422 HydrophobicContact CG-CD1 4.17Å; K418-L422 WeakPolarHBondContact O-CB 3.46Å; K418-L422 WeakPolarHBondContact O-CG 3.48Å; K418-L422 PolarHBondContact O-N 2.84Å; E419-L422 PolarHBondContact O-N 2.87Å; L422-N424 VanDerWaalsContact C-N 3.34Å; L422-N424 PolarHBondContact O-N 3.39Å; L422-Q425 PolarHBondContact O-N 3.06Å; L422-Q426 WeakPolarHBondContact O-CB 3.3Å; L422-Q426 PolarHBondContact O-N 3.04Å; L422-V472 HydrophobicContact CD2-CG1 4.25Å
423	K	87.8	Confident	88.3	Confident	97 Å²	97	79.5 Å²	79.5	42%	0.422	38%	0.38	S	S	.	.	H	α-helix	trans	-61.7	-42.4	175.6	-73.3	169	-169.2	157.2	0	111.2	E419 D420 Q426 R427	E419-K423 WeakPolarHBondContact O-CB 3.39Å; E419-K423 VanDerWaalsContact O-CG 3.31Å; E419-K423 WeakPolarHBondContact O-CG 3.32Å; E419-K423 PolarHBondContact O-N 3.01Å; E419-K423 IonicContact OE2-NZ 3.51Å; E419-K423 PolarHBondContact OE2-NZ 2.69Å; D420-K423 PolarHBondContact O-N 2.65Å; K423-Q426 PolarHBondContact O-N 3.47Å; K423-R427 WeakPolarHBondContact O-CG 3.39Å; K423-R427 PolarHBondContact O-N 3.44Å
424	N	88.5	Confident	88.3	Confident	82 Å²	82	82.1 Å²	82.1	44%	0.439	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-45.1	177	-71.1	-17	0	0	0	111.7	D420 R421 L422 Q426 R427 E428	D420-N424 WeakPolarHBondContact O-CB 3.37Å; D420-N424 PolarHBondContact O-N 3.16Å; D420-N424 PolarHBondContact O-ND2 2.98Å; R421-N424 PolarHBondContact O-N 2.87Å; L422-N424 VanDerWaalsContact C-N 3.34Å; L422-N424 PolarHBondContact O-N 3.39Å; N424-Q426 VanDerWaalsContact C-N 3.31Å; N424-Q426 PolarHBondContact O-N 3.25Å; N424-R427 PolarHBondContact O-N 3.43Å; N424-E428 WeakPolarHBondContact O-CB 3.48Å; N424-E428 WeakPolarHBondContact O-CG 3.32Å; N424-E428 PolarHBondContact O-N 2.92Å
425	Q	86.2	Confident	88.1	Confident	82 Å²	82	87 Å²	87	38%	0.383	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-40.5	174.2	-77.3	176.6	-0.6	0	0	112.2	R421 L422 E428 Y429 V472	R421-Q425 WeakPolarHBondContact O-CB 3.28Å; R421-Q425 VanDerWaalsContact O-CG 3.29Å; R421-Q425 WeakPolarHBondContact O-CG 3.49Å; R421-Q425 PolarHBondContact O-N 3.47Å; L422-Q425 PolarHBondContact O-N 3.06Å; Q425-E428 PolarHBondContact O-N 3.28Å; Q425-Y429 VanDerWaalsContact O-CB 3.22Å; Q425-Y429 WeakPolarHBondContact O-CB 3.5Å; Q425-Y429 PolarHBondContact O-N 2.95Å; Q425-V472 HydrophobicContact CB-CG2 4.28Å
426	Q	87	Confident	88.1	Confident	68 Å²	68	87.1 Å²	87.1	32%	0.318	41%	0.406	S	S	.	.	H	α-helix	trans	-65.7	-43.4	177.5	-171.2	177.7	-19.4	0	0	111.4	L422 K423 N424 Y429 E430 V472	L422-Q426 WeakPolarHBondContact O-CB 3.3Å; L422-Q426 PolarHBondContact O-N 3.04Å; K423-Q426 PolarHBondContact O-N 3.47Å; N424-Q426 VanDerWaalsContact C-N 3.31Å; N424-Q426 PolarHBondContact O-N 3.25Å; Q426-Y429 WeakPolarHBondContact O-CB 3.38Å; Q426-Y429 PolarHBondContact O-N 2.97Å; Q426-E430 WeakPolarHBondContact CG-OE1 3.24Å; Q426-E430 PolarHBondContact NE2-OE1 3.38Å; Q426-E430 WeakPolarHBondContact O-CB 3.37Å; Q426-E430 VanDerWaalsContact O-CG 3.31Å; Q426-E430 WeakPolarHBondContact O-CG 3.36Å; Q426-E430 PolarHBondContact O-N 3.06Å; Q426-V472 HydrophobicContact CB-CG2 4.47Å
427	R	87.8	Confident	88	Confident	165 Å²	165	87 Å²	87	62%	0.623	41%	0.407	S	S	*	.	H	α-helix	trans	-63.5	-43.7	175.3	-73.4	173.9	-179.3	171.1	-0.7	112.5	K423 N424 Y429 E430 A431	K423-R427 WeakPolarHBondContact O-CG 3.39Å; K423-R427 PolarHBondContact O-N 3.44Å; N424-R427 PolarHBondContact O-N 3.43Å; R427-Y429 VanDerWaalsContact C-N 3.33Å; R427-E430 PolarHBondContact O-N 3.12Å; R427-A431 VanDerWaalsContact O-CB 3.29Å; R427-A431 WeakPolarHBondContact O-CB 3.41Å; R427-A431 PolarHBondContact O-N 2.81Å
428	E	87.2	Confident	87.9	Confident	121 Å²	121	90.3 Å²	90.3	57%	0.565	42%	0.417	S	S	*	.	H	α-helix	trans	-61.9	-42.2	175.4	-76.3	178.4	-176.4	0	0	111.5	N424 Q425 A431 Q432	N424-E428 WeakPolarHBondContact O-CB 3.48Å; N424-E428 WeakPolarHBondContact O-CG 3.32Å; N424-E428 PolarHBondContact O-N 2.92Å; Q425-E428 PolarHBondContact O-N 3.28Å; E428-A431 PolarHBondContact O-N 3.2Å; E428-Q432 WeakPolarHBondContact O-CB 3.41Å; E428-Q432 VanDerWaalsContact O-CG 3.3Å; E428-Q432 WeakPolarHBondContact O-CG 3.18Å; E428-Q432 PolarHBondContact O-N 2.7Å
429	Y	86.7	Confident	87.9	Confident	66 Å²	66	88.7 Å²	88.7	26%	0.259	41%	0.411	S	S	.	.	H	α-helix	trans	-61.6	-49.2	175.5	176.5	-91	0	0	0	111.5	Q425 Q426 R427 A431 Q432 L433 L469 P471	Q425-Y429 VanDerWaalsContact O-CB 3.22Å; Q425-Y429 WeakPolarHBondContact O-CB 3.5Å; Q425-Y429 PolarHBondContact O-N 2.95Å; Q426-Y429 WeakPolarHBondContact O-CB 3.38Å; Q426-Y429 PolarHBondContact O-N 2.97Å; R427-Y429 VanDerWaalsContact C-N 3.33Å; Y429-A431 PolarHBondContact O-N 3.07Å; Y429-Q432 PolarHBondContact O-N 2.77Å; Y429-L433 HydrophobicContact CE1-CD1 4.05Å; Y429-L433 WeakPolarHBondContact O-CB 3.16Å; Y429-L433 PolarHBondContact O-N 3.1Å; Y429-L469 HydrophobicContact CD2-CD2 3.36Å; Y429-L469 HydrophobicContact CD2-CG 4.49Å; Y429-L469 HydrophobicContact CE2-CB 4.05Å; Y429-L469 HydrophobicContact CE2-CD2 3.6Å; Y429-L469 HydrophobicContact CE2-CG 4.31Å; Y429-L469 HydrophobicContact CG-CD2 4.16Å; Y429-P471 HydrophobicContact CE2-CB 4.36Å
430	E	88.4	Confident	87.9	Confident	86 Å²	86	87.3 Å²	87.3	40%	0.402	40%	0.404	S	S	.	.	H	α-helix	trans	-61.9	-43	178.2	-74.1	170.3	-168.9	0	0	111.6	Q426 R427 L433 Q434	Q426-E430 WeakPolarHBondContact CG-OE1 3.24Å; Q426-E430 PolarHBondContact NE2-OE1 3.38Å; Q426-E430 WeakPolarHBondContact O-CB 3.37Å; Q426-E430 VanDerWaalsContact O-CG 3.31Å; Q426-E430 WeakPolarHBondContact O-CG 3.36Å; Q426-E430 PolarHBondContact O-N 3.06Å; R427-E430 PolarHBondContact O-N 3.12Å; E430-L433 PolarHBondContact O-N 3.4Å; E430-Q434 WeakPolarHBondContact O-CG 3.29Å; E430-Q434 PolarHBondContact O-N 3.06Å
431	A	89.2	Confident	87.9	Confident	54 Å²	54	87.1 Å²	87.1	45%	0.446	41%	0.406	S	S	.	.	H	α-helix	trans	-63.6	-42.9	176.6	0	0	0	0	0	112.2	R427 E428 Y429 L433 Y435	R427-A431 VanDerWaalsContact O-CB 3.29Å; R427-A431 WeakPolarHBondContact O-CB 3.41Å; R427-A431 PolarHBondContact O-N 2.81Å; E428-A431 PolarHBondContact O-N 3.2Å; Y429-A431 PolarHBondContact O-N 3.07Å; A431-L433 VanDerWaalsContact C-N 3.34Å; A431-Y435 WeakPolarHBondContact O-CB 3.41Å; A431-Y435 PolarHBondContact O-N 3.47Å
432	Q	87	Confident	87.8	Confident	73 Å²	73	84.3 Å²	84.3	34%	0.341	40%	0.397	S	S	.	.	H	α-helix	trans	-66.3	-36.4	175.2	-77.1	-177.7	19.4	0	0	112.3	E428 Y429 Y435 R436 L469	E428-Q432 WeakPolarHBondContact O-CB 3.41Å; E428-Q432 VanDerWaalsContact O-CG 3.3Å; E428-Q432 WeakPolarHBondContact O-CG 3.18Å; E428-Q432 PolarHBondContact O-N 2.7Å; Y429-Q432 PolarHBondContact O-N 2.77Å; Q432-Y435 PolarHBondContact O-N 2.89Å; Q432-R436 WeakPolarHBondContact O-CB 3.45Å; Q432-R436 PolarHBondContact O-N 2.86Å; Q432-L469 HydrophobicContact CB-CD2 3.77Å; Q432-L469 HydrophobicContact CB-CG 4.45Å; Q432-L469 VanDerWaalsContact OE1-CD2 3.3Å
433	L	88.3	Confident	87.8	Confident	57 Å²	57	81.6 Å²	81.6	30%	0.298	38%	0.382	S	S	.	.	H	α-helix	trans	-66.2	-46.8	176.8	-170.2	120.8	0	0	0	111	Y429 E430 A431 Y435 R436 Q437	Y429-L433 HydrophobicContact CE1-CD1 4.05Å; Y429-L433 WeakPolarHBondContact O-CB 3.16Å; Y429-L433 PolarHBondContact O-N 3.1Å; E430-L433 PolarHBondContact O-N 3.4Å; A431-L433 VanDerWaalsContact C-N 3.34Å; L433-Y435 VanDerWaalsContact C-N 3.34Å; L433-Y435 PolarHBondContact O-N 2.85Å; L433-R436 PolarHBondContact O-N 2.86Å; L433-Q437 WeakPolarHBondContact O-CB 3.25Å; L433-Q437 WeakPolarHBondContact O-CG 3.4Å; L433-Q437 PolarHBondContact O-N 2.93Å
434	Q	89.6	Confident	87.7	Confident	127 Å²	127	80.9 Å²	80.9	59%	0.593	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-42.7	174.1	-72.7	176.1	1.6	0	0	111.6	E430 R436 Q437 H438	E430-Q434 WeakPolarHBondContact O-CG 3.29Å; E430-Q434 PolarHBondContact O-N 3.06Å; Q434-R436 PolarHBondContact O-N 3.34Å; Q434-Q437 PolarHBondContact O-N 2.94Å; Q434-H438 WeakPolarHBondContact O-CB 3.47Å; Q434-H438 PolarHBondContact O-N 2.98Å
435	Y	88	Confident	87.5	Confident	107 Å²	107	85.9 Å²	85.9	42%	0.42	40%	0.396	S	S	.	.	H	α-helix	trans	-61.7	-43.3	176.8	-173.7	-111	0	0	0	112.2	A431 Q432 L433 H438 I439 L462 L466	A431-Y435 WeakPolarHBondContact O-CB 3.41Å; A431-Y435 PolarHBondContact O-N 3.47Å; Q432-Y435 PolarHBondContact O-N 2.89Å; L433-Y435 VanDerWaalsContact C-N 3.34Å; L433-Y435 PolarHBondContact O-N 2.85Å; Y435-H438 PolarHBondContact O-N 2.9Å; Y435-I439 HydrophobicContact CD1-CD1 3.73Å; Y435-I439 HydrophobicContact CE1-CD1 3.33Å; Y435-I439 HydrophobicContact CE2-CD1 4.23Å; Y435-I439 HydrophobicContact CG-CD1 4.33Å; Y435-I439 WeakPolarHBondContact O-CG1 3.48Å; Y435-I439 PolarHBondContact O-N 3.35Å; Y435-I439 VanDerWaalsContact O-N 3.1Å; Y435-L462 HydrophobicContact CE1-CD2 4.18Å; Y435-L462 WeakPolarHBondContact OH-CD2 3.32Å; Y435-L466 HydrophobicContact CD1-CD1 3.94Å; Y435-L466 HydrophobicContact CE1-CD1 4.01Å; Y435-L466 HydrophobicContact CE1-CD2 4.32Å
436	R	87.4	Confident	87.3	Confident	51 Å²	51	83.7 Å²	83.7	19%	0.192	39%	0.385	C	S	.	.	H	α-helix	trans	-63.5	-44.8	174.2	-84.7	-177.8	150.8	130	0.9	112	Q432 L433 Q434 H438 I439 Q440 L466 P467 L469	Q432-R436 WeakPolarHBondContact O-CB 3.45Å; Q432-R436 PolarHBondContact O-N 2.86Å; L433-R436 PolarHBondContact O-N 2.86Å; Q434-R436 PolarHBondContact O-N 3.34Å; R436-H438 PolarHBondContact O-N 3.3Å; R436-I439 PolarHBondContact O-N 3.01Å; R436-Q440 WeakPolarHBondContact O-CB 3.12Å; R436-Q440 PolarHBondContact O-N 2.97Å; R436-L466 HydrophobicContact CG-CD1 3.89Å; R436-L466 PolarHBondContact NH2-O 3.03Å; R436-P467 PolarHBondContact NH1-O 3.37Å; R436-P467 PolarHBondContact NH2-O 3.39Å; R436-L469 VanDerWaalsContact NH1-CD1 3.31Å
437	Q	88.9	Confident	86.7	Confident	111 Å²	111	87.9 Å²	87.9	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-60.4	-44.9	176.8	-75.5	175.3	-8.8	0	0	111.7	L433 Q434 I439 Q440 V441	L433-Q437 WeakPolarHBondContact O-CB 3.25Å; L433-Q437 WeakPolarHBondContact O-CG 3.4Å; L433-Q437 PolarHBondContact O-N 2.93Å; Q434-Q437 PolarHBondContact O-N 2.94Å; Q437-I439 PolarHBondContact O-N 3.39Å; Q437-Q440 WeakPolarHBondContact O-CB 3.42Å; Q437-Q440 PolarHBondContact O-N 2.91Å; Q437-Q440 VanDerWaalsContact O-N 3.14Å; Q437-V441 WeakPolarHBondContact O-CG2 3.4Å; Q437-V441 PolarHBondContact O-N 3.25Å
438	H	90.2	Very high	86	Confident	139 Å²	139	89.9 Å²	89.9	64%	0.644	41%	0.407	S	S	*	.	H	α-helix	trans	-60.6	-43.6	177.7	178.7	-95.5	0	0	0	112.1	Q434 Y435 R436 Q440 F442	Q434-H438 WeakPolarHBondContact O-CB 3.47Å; Q434-H438 PolarHBondContact O-N 2.98Å; Y435-H438 PolarHBondContact O-N 2.9Å; R436-H438 PolarHBondContact O-N 3.3Å; H438-Q440 VanDerWaalsContact C-N 3.34Å; H438-F442 PolarHBondContact O-N 3.36Å
439	I	88.2	Confident	85.6	Confident	4 Å²	4	87.4 Å²	87.4	2%	0.021	40%	0.398	C	S	.	.	H	α-helix	trans	-64.9	-40.4	174.6	-68	163.6	0	0	0	111.1	Y435 R436 Q437 F442 I443 K459 L462 L463 L466	Y435-I439 HydrophobicContact CD1-CD1 3.73Å; Y435-I439 HydrophobicContact CE1-CD1 3.33Å; Y435-I439 HydrophobicContact CE2-CD1 4.23Å; Y435-I439 HydrophobicContact CG-CD1 4.33Å; Y435-I439 WeakPolarHBondContact O-CG1 3.48Å; Y435-I439 PolarHBondContact O-N 3.35Å; Y435-I439 VanDerWaalsContact O-N 3.1Å; R436-I439 PolarHBondContact O-N 3.01Å; Q437-I439 PolarHBondContact O-N 3.39Å; I439-F442 WeakPolarHBondContact O-CB 3.38Å; I439-F442 PolarHBondContact O-N 2.76Å; I439-I443 HydrophobicContact CG2-CD1 3.69Å; I439-I443 HydrophobicContact CG2-CG1 4.31Å; I439-I443 VanDerWaalsContact O-CG1 3.31Å; I439-I443 WeakPolarHBondContact O-CG1 3.47Å; I439-I443 PolarHBondContact O-N 3.3Å; I439-K459 HydrophobicContact CG2-CB 4.02Å; I439-L462 HydrophobicContact CD1-CD2 3.64Å; I439-L463 HydrophobicContact CB-CD1 4.28Å; I439-L463 HydrophobicContact CG2-CB 4.44Å; I439-L463 HydrophobicContact CG2-CD1 3.84Å; I439-L466 HydrophobicContact CD1-CD1 4.48Å
440	Q	86.8	Confident	84.7	Confident	77 Å²	77	88.4 Å²	88.4	36%	0.36	42%	0.42	S	S	.	.	H	α-helix	trans	-63.9	-46	-179.8	-170.6	59.9	41.3	0	0	111.7	R436 Q437 H438 F442 I443 D444	R436-Q440 WeakPolarHBondContact O-CB 3.12Å; R436-Q440 PolarHBondContact O-N 2.97Å; Q437-Q440 WeakPolarHBondContact O-CB 3.42Å; Q437-Q440 PolarHBondContact O-N 2.91Å; Q437-Q440 VanDerWaalsContact O-N 3.14Å; H438-Q440 VanDerWaalsContact C-N 3.34Å; Q440-F442 VanDerWaalsContact C-N 3.27Å; Q440-F442 PolarHBondContact O-N 3.14Å; Q440-I443 WeakPolarHBondContact O-CB 3.48Å; Q440-I443 PolarHBondContact O-N 3.02Å; Q440-I443 VanDerWaalsContact O-N 3.08Å; Q440-D444 PolarHBondContact NE2-OD1 2.94Å; Q440-D444 PolarHBondContact NE2-OD2 3.19Å; Q440-D444 VanDerWaalsContact O-CG 3.32Å; Q440-D444 PolarHBondContact O-N 3.24Å
441	V	89.3	Confident	84.1	Confident	81 Å²	81	91.8 Å²	91.8	49%	0.491	44%	0.441	S	S	.	.	H	α-helix	trans	-58.6	-40.4	175.6	172.1	0	0	0	0	111.2	Q437 R445	Q437-V441 WeakPolarHBondContact O-CG2 3.4Å; Q437-V441 PolarHBondContact O-N 3.25Å; V441-R445 VanDerWaalsContact O-CB 3.23Å; V441-R445 WeakPolarHBondContact O-CB 3.49Å; V441-R445 PolarHBondContact O-N 3.5Å
442	F	85.6	Confident	83.4	Confident	54 Å²	54	94.2 Å²	94.2	24%	0.237	44%	0.438	C	S	.	.	H	α-helix	trans	-64.4	-44	174.8	-177.5	-86.9	0	0	0	112.1	H438 I439 Q440 F446 V456 K459	H438-F442 PolarHBondContact O-N 3.36Å; I439-F442 WeakPolarHBondContact O-CB 3.38Å; I439-F442 PolarHBondContact O-N 2.76Å; Q440-F442 VanDerWaalsContact C-N 3.27Å; Q440-F442 PolarHBondContact O-N 3.14Å; F442-F446 HydrophobicContact CD1-CD2 4.32Å; F442-F446 AromaticContact CD2-CD2 3.64Å; F442-F446 HydrophobicContact CD2-CD2 3.64Å; F442-F446 AromaticContact CD2-CE2 3.75Å; F442-F446 HydrophobicContact CD2-CE2 3.75Å; F442-F446 HydrophobicContact CE1-CD2 4.24Å; F442-F446 AromaticContact CE2-CD2 3.56Å; F442-F446 HydrophobicContact CE2-CD2 3.56Å; F442-F446 AromaticContact CE2-CE2 3.68Å; F442-F446 HydrophobicContact CE2-CE2 3.68Å; F442-F446 HydrophobicContact CG-CD2 4.04Å; F442-F446 AromaticContact CZ-CD2 3.88Å; F442-F446 HydrophobicContact CZ-CD2 3.88Å; F442-F446 HydrophobicContact CZ-CE2 4.41Å; F442-F446 WeakPolarHBondContact O-CD2 3.45Å; F442-F446 PolarHBondContact O-N 3.45Å; F442-F446 VanDerWaalsContact O-N 3.1Å; F442-V456 HydrophobicContact CE1-CG2 4.25Å; F442-K459 HydrophobicContact CD1-CG 4.28Å; F442-K459 HydrophobicContact CE1-CG 4.34Å
443	I	85.4	Confident	82.6	Confident	11 Å²	11	93 Å²	93	6%	0.056	44%	0.441	C	S	.	.	H	α-helix	trans	-60.6	-49.2	177.1	-70.1	164.5	0	0	0	109.8	I439 Q440 R445 F446 R447 V456 K459 I460 L463	I439-I443 HydrophobicContact CG2-CD1 3.69Å; I439-I443 HydrophobicContact CG2-CG1 4.31Å; I439-I443 VanDerWaalsContact O-CG1 3.31Å; I439-I443 WeakPolarHBondContact O-CG1 3.47Å; I439-I443 PolarHBondContact O-N 3.3Å; Q440-I443 WeakPolarHBondContact O-CB 3.48Å; Q440-I443 PolarHBondContact O-N 3.02Å; Q440-I443 VanDerWaalsContact O-N 3.08Å; I443-R445 PolarHBondContact O-N 3.4Å; I443-F446 PolarHBondContact O-N 2.87Å; I443-R447 WeakPolarHBondContact O-CA 3.49Å; I443-R447 VanDerWaalsContact O-CB 3.26Å; I443-R447 WeakPolarHBondContact O-CB 3.36Å; I443-R447 PolarHBondContact O-N 2.97Å; I443-V456 HydrophobicContact CG1-CG1 4.41Å; I443-V456 HydrophobicContact CG2-CG1 4.1Å; I443-K459 HydrophobicContact CD1-CB 4.41Å; I443-K459 HydrophobicContact CG1-CB 4.24Å; I443-I460 HydrophobicContact CD1-CG1 3.72Å; I443-I460 HydrophobicContact CG1-CG1 4.09Å; I443-I460 HydrophobicContact CG2-CD1 4.31Å; I443-I460 HydrophobicContact CG2-CG1 4.15Å; I443-L463 HydrophobicContact CD1-CD1 4.28Å
444	D	85.7	Confident	82.3	Confident	83 Å²	83	94.2 Å²	94.2	44%	0.444	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-40.7	-175.9	-67	-28	0	0	0	111.8	Q440	Q440-D444 PolarHBondContact NE2-OD1 2.94Å; Q440-D444 PolarHBondContact NE2-OD2 3.19Å; Q440-D444 VanDerWaalsContact O-CG 3.32Å; Q440-D444 PolarHBondContact O-N 3.24Å
445	R	84.2	Confident	81.9	Confident	186 Å²	186	93.5 Å²	93.5	70%	0.702	46%	0.455	S	S	*	.	H	α-helix	trans	-66.6	-38.6	178	-173.1	178.4	-69.8	178.5	-2.8	112.9	V441 I443	V441-R445 VanDerWaalsContact O-CB 3.23Å; V441-R445 WeakPolarHBondContact O-CB 3.49Å; V441-R445 PolarHBondContact O-N 3.5Å; I443-R445 PolarHBondContact O-N 3.4Å
446	F	82.6	Confident	81.7	Confident	37 Å²	37	88.8 Å²	88.8	16%	0.162	44%	0.438	C	S	.	.	H	α-helix	trans	-106.8	6.7	-173.4	-63.3	-67.1	0	0	0	114.4	F442 I443 Y448 N449 R452 V456	F442-F446 HydrophobicContact CD1-CD2 4.32Å; F442-F446 AromaticContact CD2-CD2 3.64Å; F442-F446 HydrophobicContact CD2-CD2 3.64Å; F442-F446 AromaticContact CD2-CE2 3.75Å; F442-F446 HydrophobicContact CD2-CE2 3.75Å; F442-F446 HydrophobicContact CE1-CD2 4.24Å; F442-F446 AromaticContact CE2-CD2 3.56Å; F442-F446 HydrophobicContact CE2-CD2 3.56Å; F442-F446 AromaticContact CE2-CE2 3.68Å; F442-F446 HydrophobicContact CE2-CE2 3.68Å; F442-F446 HydrophobicContact CG-CD2 4.04Å; F442-F446 AromaticContact CZ-CD2 3.88Å; F442-F446 HydrophobicContact CZ-CD2 3.88Å; F442-F446 HydrophobicContact CZ-CE2 4.41Å; F442-F446 WeakPolarHBondContact O-CD2 3.45Å; F442-F446 PolarHBondContact O-N 3.45Å; F442-F446 VanDerWaalsContact O-N 3.1Å; I443-F446 PolarHBondContact O-N 2.87Å; F446-Y448 PolarHBondContact O-N 3.07Å; F446-N449 PolarHBondContact O-N 2.88Å; F446-R452 HydrophobicContact CB-CB 4.48Å; F446-V456 HydrophobicContact CB-CG2 3.8Å
447	R	74.6	Confident	81.4	Confident	156 Å²	156	92.1 Å²	92.1	59%	0.589	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-36.3	-178	-165.1	171.2	178.3	175.6	-2.6	113.6	I443	I443-R447 WeakPolarHBondContact O-CA 3.49Å; I443-R447 VanDerWaalsContact O-CB 3.26Å; I443-R447 WeakPolarHBondContact O-CB 3.36Å; I443-R447 PolarHBondContact O-N 2.97Å
448	Y	73.5	Confident	81.2	Confident	206 Å²	206	90.3 Å²	90.3	81%	0.808	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-0.4	-175.1	-57.9	-71.4	0	0	0	113.7	F446	F446-Y448 PolarHBondContact O-N 3.07Å
449	N	77.4	Confident	80.9	Confident	69 Å²	69	87.5 Å²	87.5	37%	0.369	44%	0.441	S	S	.	.			trans	-91	111	179.3	-170.2	-28.5	0	0	0	110.9	F446 N451 R452 A453	F446-N449 PolarHBondContact O-N 2.88Å; N449-N451 VanDerWaalsContact C-N 3.25Å; N449-N451 PolarHBondContact O-N 2.72Å; N449-N451 PolarHBondContact OD1-N 2.63Å; N449-N451 VanDerWaalsContact OD1-N 3.11Å; N449-R452 PolarHBondContact O-N 2.94Å; N449-A453 PolarHBondContact O-N 3.35Å
450	A	68.8	Low	80.8	Confident	87 Å²	87	90.4 Å²	90.4	72%	0.719	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-58.4	-32.8	-177	0	0	0	0	0	113.7	R452	A450-R452 VanDerWaalsContact C-N 3.33Å; A450-R452 PolarHBondContact O-N 2.96Å
451	N	76.1	Confident	80.8	Confident	158 Å²	158	92.6 Å²	92.6	85%	0.845	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-75.1	-20.5	-177.1	-69.4	-18.1	0	0	0	113.2	N449	N449-N451 VanDerWaalsContact C-N 3.25Å; N449-N451 PolarHBondContact O-N 2.72Å; N449-N451 PolarHBondContact OD1-N 2.63Å; N449-N451 VanDerWaalsContact OD1-N 3.11Å
452	R	73.6	Confident	80.6	Confident	105 Å²	105	91.8 Å²	91.8	40%	0.396	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-109.1	6.9	-179.5	-67.9	-173.1	178.8	174.4	0.5	113.9	F446 N449 A450 A454 Q455 V456	F446-R452 HydrophobicContact CB-CB 4.48Å; N449-R452 PolarHBondContact O-N 2.94Å; A450-R452 VanDerWaalsContact C-N 3.33Å; A450-R452 PolarHBondContact O-N 2.96Å; R452-A454 VanDerWaalsContact C-N 3.28Å; R452-A454 PolarHBondContact O-N 2.78Å; R452-Q455 PolarHBondContact O-N 2.8Å; R452-V456 PolarHBondContact O-N 3.36Å
453	A	71.1	Confident	80.6	Confident	48 Å²	48	91.2 Å²	91.2	40%	0.397	46%	0.456	S	S	.	.	H	α-helix	trans	-54.3	-38.9	-177.3	0	0	0	0	0	113.8	N449 V456 Q457	N449-A453 PolarHBondContact O-N 3.35Å; A453-V456 PolarHBondContact O-N 2.78Å; A453-Q457 WeakPolarHBondContact O-CG 3.19Å; A453-Q457 PolarHBondContact O-N 3.17Å
454	A	81.1	Confident	80.4	Confident	81 Å²	81	97.7 Å²	97.7	67%	0.669	49%	0.486	S	S	*	.	H	α-helix	trans	-66.4	-37.2	177.8	0	0	0	0	0	113.1	R452 S458	R452-A454 VanDerWaalsContact C-N 3.28Å; R452-A454 PolarHBondContact O-N 2.78Å; A454-S458 PolarHBondContact O-N 3.28Å; A454-S458 VanDerWaalsContact O-N 3.11Å
455	Q	80.8	Confident	80.4	Confident	112 Å²	112	102.4 Å²	102.4	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-71.5	-41.1	177	-68.8	-178.6	-3.3	0	0	111.2	R452 S458 K459	R452-Q455 PolarHBondContact O-N 2.8Å; Q455-S458 WeakPolarHBondContact O-CB 3.32Å; Q455-S458 PolarHBondContact O-N 2.82Å; Q455-K459 VanDerWaalsContact O-CG 3.32Å; Q455-K459 WeakPolarHBondContact O-CG 3.26Å; Q455-K459 PolarHBondContact O-N 3.29Å
456	V	84.3	Confident	80.2	Confident	8 Å²	8	95.7 Å²	95.7	5%	0.048	48%	0.481	C	S	.	.	H	α-helix	trans	-61	-45	174.9	175.4	0	0	0	0	110.7	F442 I443 F446 R452 A453 S458 K459 I460	F442-V456 HydrophobicContact CE1-CG2 4.25Å; I443-V456 HydrophobicContact CG1-CG1 4.41Å; I443-V456 HydrophobicContact CG2-CG1 4.1Å; F446-V456 HydrophobicContact CB-CG2 3.8Å; R452-V456 PolarHBondContact O-N 3.36Å; A453-V456 PolarHBondContact O-N 2.78Å; V456-S458 VanDerWaalsContact C-N 3.34Å; V456-S458 PolarHBondContact O-N 2.97Å; V456-K459 PolarHBondContact O-N 3.27Å; V456-I460 HydrophobicContact CG1-CD1 3.82Å; V456-I460 HydrophobicContact CG1-CG1 4.4Å; V456-I460 VanDerWaalsContact O-CG1 3.29Å; V456-I460 WeakPolarHBondContact O-CG1 3.45Å; V456-I460 PolarHBondContact O-N 3.34Å
457	Q	82.1	Confident	79.9	Confident	121 Å²	121	98 Å²	98	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-62.5	-37.6	175.5	-75.9	-158.6	-2.7	0	0	113.6	A453 K461	A453-Q457 WeakPolarHBondContact O-CG 3.19Å; A453-Q457 PolarHBondContact O-N 3.17Å; Q457-K461 WeakPolarHBondContact O-CG 3.33Å; Q457-K461 PolarHBondContact O-N 3.49Å; Q457-K461 VanDerWaalsContact O-N 3.09Å
458	S	84.6	Confident	79.6	Confident	73 Å²	73	98.5 Å²	98.5	51%	0.51	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-44.2	174.3	175.9	0	0	0	0	111.7	A454 Q455 V456 K461 L462	A454-S458 PolarHBondContact O-N 3.28Å; A454-S458 VanDerWaalsContact O-N 3.11Å; Q455-S458 WeakPolarHBondContact O-CB 3.32Å; Q455-S458 PolarHBondContact O-N 2.82Å; V456-S458 VanDerWaalsContact C-N 3.34Å; V456-S458 PolarHBondContact O-N 2.97Å; S458-K461 PolarHBondContact O-N 2.86Å; S458-L462 WeakPolarHBondContact O-CB 3.47Å; S458-L462 PolarHBondContact O-N 2.97Å
459	K	83.6	Confident	79.3	Confident	81 Å²	81	90.8 Å²	90.8	35%	0.352	48%	0.48	S	S	.	.	H	α-helix	trans	-69.7	-35.2	179	-67.1	-69	-177.8	178.1	0	112.9	I439 F442 I443 Q455 V456 L462 L463	I439-K459 HydrophobicContact CG2-CB 4.02Å; F442-K459 HydrophobicContact CD1-CG 4.28Å; F442-K459 HydrophobicContact CE1-CG 4.34Å; I443-K459 HydrophobicContact CD1-CB 4.41Å; I443-K459 HydrophobicContact CG1-CB 4.24Å; Q455-K459 VanDerWaalsContact O-CG 3.32Å; Q455-K459 WeakPolarHBondContact O-CG 3.26Å; Q455-K459 PolarHBondContact O-N 3.29Å; V456-K459 PolarHBondContact O-N 3.27Å; K459-L462 WeakPolarHBondContact O-CB 3.37Å; K459-L462 PolarHBondContact O-N 3.02Å; K459-L463 WeakPolarHBondContact O-CB 3.3Å; K459-L463 PolarHBondContact O-N 2.84Å
460	I	85.8	Confident	78.8	Confident	65 Å²	65	95.3 Å²	95.3	33%	0.333	50%	0.497	S	S	.	.	H	α-helix	trans	-61	-49.1	171.1	-69.6	165.2	0	0	0	110.3	I443 V456 L462 L463 E464	I443-I460 HydrophobicContact CD1-CG1 3.72Å; I443-I460 HydrophobicContact CG1-CG1 4.09Å; I443-I460 HydrophobicContact CG2-CD1 4.31Å; I443-I460 HydrophobicContact CG2-CG1 4.15Å; V456-I460 HydrophobicContact CG1-CD1 3.82Å; V456-I460 HydrophobicContact CG1-CG1 4.4Å; V456-I460 VanDerWaalsContact O-CG1 3.29Å; V456-I460 WeakPolarHBondContact O-CG1 3.45Å; V456-I460 PolarHBondContact O-N 3.34Å; I460-L462 VanDerWaalsContact C-N 3.26Å; I460-L462 PolarHBondContact O-N 3.46Å; I460-L463 WeakPolarHBondContact O-CB 3.45Å; I460-L463 PolarHBondContact O-N 3.38Å; I460-L463 VanDerWaalsContact O-N 3.1Å; I460-E464 PolarHBondContact O-N 3.46Å
461	K	87.3	Confident	78.8	Confident	122 Å²	122	95.1 Å²	95.1	53%	0.53	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-33.5	176	-72.4	178.3	-176.2	176.7	0	112.8	Q457 S458 K465	Q457-K461 WeakPolarHBondContact O-CG 3.33Å; Q457-K461 PolarHBondContact O-N 3.49Å; Q457-K461 VanDerWaalsContact O-N 3.09Å; S458-K461 PolarHBondContact O-N 2.86Å; K461-K465 WeakPolarHBondContact O-CB 3.09Å; K461-K465 WeakPolarHBondContact O-CG 3.38Å; K461-K465 PolarHBondContact O-N 3.18Å; K461-K465 VanDerWaalsContact O-N 3.13Å
462	L	85.4	Confident	78.4	Confident	65 Å²	65	89.4 Å²	89.4	34%	0.34	46%	0.459	S	S	.	.	H	α-helix	trans	-65.6	-43	174.4	-165.8	100.3	0	0	0	110.7	Y435 I439 S458 K459 I460 K465 L466	Y435-L462 HydrophobicContact CE1-CD2 4.18Å; Y435-L462 WeakPolarHBondContact OH-CD2 3.32Å; I439-L462 HydrophobicContact CD1-CD2 3.64Å; S458-L462 WeakPolarHBondContact O-CB 3.47Å; S458-L462 PolarHBondContact O-N 2.97Å; K459-L462 WeakPolarHBondContact O-CB 3.37Å; K459-L462 PolarHBondContact O-N 3.02Å; I460-L462 VanDerWaalsContact C-N 3.26Å; I460-L462 PolarHBondContact O-N 3.46Å; L462-K465 PolarHBondContact O-N 3.46Å; L462-L466 WeakPolarHBondContact O-CG 3.38Å; L462-L466 PolarHBondContact O-N 3.06Å; L462-L466 VanDerWaalsContact O-N 3.13Å
463	L	83.9	Confident	77.8	Confident	42 Å²	42	92.2 Å²	92.2	22%	0.22	48%	0.477	C	S	.	.	H	α-helix	trans	-66.2	-36.7	179.3	-162.2	146.5	0	0	0	112.2	I439 I443 K459 I460 L466	I439-L463 HydrophobicContact CB-CD1 4.28Å; I439-L463 HydrophobicContact CG2-CB 4.44Å; I439-L463 HydrophobicContact CG2-CD1 3.84Å; I443-L463 HydrophobicContact CD1-CD1 4.28Å; K459-L463 WeakPolarHBondContact O-CB 3.3Å; K459-L463 PolarHBondContact O-N 2.84Å; I460-L463 WeakPolarHBondContact O-CB 3.45Å; I460-L463 PolarHBondContact O-N 3.38Å; I460-L463 VanDerWaalsContact O-N 3.1Å; L463-L466 PolarHBondContact O-N 3.01Å
464	E	82.9	Confident	77.1	Confident	147 Å²	147	97 Å²	97	69%	0.687	49%	0.489	S	S	*	.	H	α-helix	trans	-67.6	-31.5	172.5	-72.7	176.8	171.1	0	0	113.4	I460	I460-E464 PolarHBondContact O-N 3.46Å
465	K	85.2	Confident	76.1	Confident	181 Å²	181	96.8 Å²	96.8	79%	0.787	47%	0.474	S	S	*	.	H	α-helix	trans	-81.4	-18.1	177.9	-78.4	-179	179.8	-175.9	0	113.8	K461 L462	K461-K465 WeakPolarHBondContact O-CB 3.09Å; K461-K465 WeakPolarHBondContact O-CG 3.38Å; K461-K465 PolarHBondContact O-N 3.18Å; K461-K465 VanDerWaalsContact O-N 3.13Å; L462-K465 PolarHBondContact O-N 3.46Å
466	L	79.6	Confident	75.2	Confident	46 Å²	46	96.5 Å²	96.5	24%	0.241	48%	0.48	C	S	.	.	S	Bend	trans	-65.2	135.7	177.6	-77	170.3	0	0	0	109.7	Y435 R436 I439 L462 L463	Y435-L466 HydrophobicContact CD1-CD1 3.94Å; Y435-L466 HydrophobicContact CE1-CD1 4.01Å; Y435-L466 HydrophobicContact CE1-CD2 4.32Å; R436-L466 HydrophobicContact CG-CD1 3.89Å; R436-L466 PolarHBondContact NH2-O 3.03Å; I439-L466 HydrophobicContact CD1-CD1 4.48Å; L462-L466 WeakPolarHBondContact O-CG 3.38Å; L462-L466 PolarHBondContact O-N 3.06Å; L462-L466 VanDerWaalsContact O-N 3.13Å; L463-L466 PolarHBondContact O-N 3.01Å
467	P	75.9	Confident	74.2	Confident	84 Å²	84	104.1 Å²	104.1	55%	0.545	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-56.4	150.1	179.5	21.5	-30.8	0	0	0	111.6	R436 L469	R436-P467 PolarHBondContact NH1-O 3.37Å; R436-P467 PolarHBondContact NH2-O 3.39Å; P467-L469 PolarHBondContact O-N 3.03Å
468	E	68.9	Low	73.6	Confident	168 Å²	168	99.3 Å²	99.3	79%	0.785	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-60	125.5	177	-72.2	-178.8	171.6	0	0	110.2	K470	E468-K470 PolarHBondContact O-N 2.8Å
469	L	65.9	Low	73.1	Confident	43 Å²	43	99.3 Å²	99.3	23%	0.225	49%	0.491	C	S	.	.			trans	-71.2	109.7	172.6	-88.6	161.3	0	0	0	108.1	Y429 Q432 R436 P467	Y429-L469 HydrophobicContact CD2-CD2 3.36Å; Y429-L469 HydrophobicContact CD2-CG 4.49Å; Y429-L469 HydrophobicContact CE2-CB 4.05Å; Y429-L469 HydrophobicContact CE2-CD2 3.6Å; Y429-L469 HydrophobicContact CE2-CG 4.31Å; Y429-L469 HydrophobicContact CG-CD2 4.16Å; Q432-L469 HydrophobicContact CB-CD2 3.77Å; Q432-L469 HydrophobicContact CB-CG 4.45Å; Q432-L469 VanDerWaalsContact OE1-CD2 3.3Å; R436-L469 VanDerWaalsContact NH1-CD1 3.31Å; P467-L469 PolarHBondContact O-N 3.03Å
470	K	68.6	Low	73.2	Confident	165 Å²	165	96.1 Å²	96.1	72%	0.717	48%	0.478	S	S	*	.			trans	-88	120.8	165.1	-66.7	-177.3	-179.6	-179.7	0	107.2	E468 V472	E468-K470 PolarHBondContact O-N 2.8Å; K470-V472 PolarHBondContact O-N 2.93Å
471	P	69.1	Low	73.2	Confident	83 Å²	83	98.9 Å²	98.9	54%	0.539	49%	0.487	S	S	.	.			trans	-58.4	140.2	174.3	24.6	-32.2	0	0	0	109.1	Y429 Q473	Y429-P471 HydrophobicContact CE2-CB 4.36Å; P471-Q473 PolarHBondContact O-N 3.28Å
472	V	67.3	Low	73.2	Confident	38 Å²	38	93.9 Å²	93.9	23%	0.23	47%	0.465	C	S	.	.			trans	-59.6	107.3	169.6	-178.8	0	0	0	0	106.4	L422 Q425 Q426 K470 K474	L422-V472 HydrophobicContact CD2-CG1 4.25Å; Q425-V472 HydrophobicContact CB-CG2 4.28Å; Q426-V472 HydrophobicContact CB-CG2 4.47Å; K470-V472 PolarHBondContact O-N 2.93Å; V472-K474 PolarHBondContact O-N 2.96Å
473	Q	59.7	Low	73.2	Confident	163 Å²	163	92.2 Å²	92.2	76%	0.762	46%	0.458	S	S	*	.			trans	-67.4	99.6	175.2	-68	-176.8	5.6	0	0	106.9	P471 E475	P471-Q473 PolarHBondContact O-N 3.28Å; Q473-E475 PolarHBondContact O-N 3.25Å
474	K	57.8	Low	73.1	Confident	150 Å²	150	92.6 Å²	92.6	65%	0.652	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-70.8	120.8	168	-71.7	-172.3	178.2	-177.9	0	107.1	V472 T476	V472-K474 PolarHBondContact O-N 2.96Å; K474-T476 PolarHBondContact O-N 3.12Å
475	E	60.3	Low	72.8	Confident	75 Å²	75	92.2 Å²	92.2	35%	0.35	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-56	126	170.3	-62.8	-179.5	127.8	0	0	107.2	K418 Q473 E477	K418-E475 IonicContact NZ-OE2 2.63Å; K418-E475 PolarHBondContact NZ-OE2 3.48Å; K418-E475 VanDerWaalsContact NZ-OE2 3.09Å; Q473-E475 PolarHBondContact O-N 3.25Å; E475-E477 PolarHBondContact O-N 3.46Å; E475-E477 VanDerWaalsContact O-N 3.12Å
476	T	60.8	Low	72.6	Confident	107 Å²	107	85.7 Å²	85.7	66%	0.656	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-61.2	118	179.6	48.6	0	0	0	0	108.9	K474 T478	K474-T476 PolarHBondContact O-N 3.12Å; T476-T478 PolarHBondContact O-N 2.91Å
477	E	64.6	Low	72.6	Confident	168 Å²	168	91.7 Å²	91.7	79%	0.785	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-58.6	124.7	177.4	-72.1	-172.1	175.6	0	0	109.9	E475 T479	E475-E477 PolarHBondContact O-N 3.46Å; E475-E477 VanDerWaalsContact O-N 3.12Å; E477-T479 PolarHBondContact O-N 3.09Å
478	T	68.3	Low	72.8	Confident	19 Å²	19	96.5 Å²	96.5	12%	0.117	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-71.2	123.9	171.9	52.6	0	0	0	0	108.3	T476 E646 A650	T476-T478 PolarHBondContact O-N 2.91Å; T478-E646 PolarHBondContact OG1-O 3.01Å; T478-A650 WeakPolarHBondContact O-CB 3.25Å
479	T	74.9	Confident	73.5	Confident	73 Å²	73	89.7 Å²	89.7	45%	0.448	44%	0.443	S	S	.	.			trans	-113.9	138.4	174.1	57.4	0	0	0	0	109	E477	E477-T479 PolarHBondContact O-N 3.09Å
480	L	85.6	Confident	74.4	Confident	15 Å²	15	91.2 Å²	91.2	8%	0.079	46%	0.457	C	S	.	.			trans	-119	135.1	172.5	-66.9	172.1	0	0	0	107.1	F482 Y599 T647 A650 L651 A654	L480-F482 HydrophobicContact CB-CE2 4.34Å; L480-Y599 HydrophobicContact CD2-CD1 3.47Å; L480-Y599 VanDerWaalsContact CD2-CD1 3.47Å; L480-Y599 HydrophobicContact CD2-CE1 4.3Å; L480-Y599 HydrophobicContact CD2-CG 4.22Å; L480-T647 HydrophobicContact CD1-CG2 3.97Å; L480-A650 HydrophobicContact CD1-CB 4.12Å; L480-A650 HydrophobicContact CG-CB 4.11Å; L480-L651 HydrophobicContact CD1-CB 3.65Å; L480-L651 HydrophobicContact CD1-CD1 4.17Å; L480-A654 HydrophobicContact CB-CB 4.09Å; L480-A654 WeakPolarHBondContact O-CB 3.23Å
481	K	85.4	Confident	75.1	Confident	123 Å²	123	87.9 Å²	87.9	54%	0.535	45%	0.453	S	S	.	.			trans	-112.1	138.4	177.7	-66	-177.4	-178.1	176.4	0	109.3	Y599	K481-Y599 WeakPolarHBondContact O-CE1 3.38Å; K481-Y599 PolarHBondContact O-OH 3.34Å
482	F	88.1	Confident	75.8	Confident	17 Å²	17	86.9 Å²	86.9	8%	0.075	45%	0.446	C	S	.	.			trans	-123	110.3	170.4	-76.9	-103.7	0	0	0	106.6	L480 D484 F623 M626 T627 Y634 L651 A654 L655 F658	L480-F482 HydrophobicContact CB-CE2 4.34Å; F482-D484 PolarHBondContact O-N 3.03Å; F482-F623 HydrophobicContact CZ-CD1 4.23Å; F482-M626 HydrophobicContact CE1-CE 3.88Å; F482-T627 HydrophobicContact CD1-CG2 4.02Å; F482-T627 HydrophobicContact CE1-CG2 4.15Å; F482-Y634 HydrophobicContact CB-CE2 4.49Å; F482-Y634 HydrophobicContact CD1-CD1 4.48Å; F482-Y634 AromaticContact CD1-CD2 3.93Å; F482-Y634 HydrophobicContact CD1-CD2 3.93Å; F482-Y634 HydrophobicContact CD1-CE1 4.13Å; F482-Y634 AromaticContact CD1-CE2 3.56Å; F482-Y634 HydrophobicContact CD1-CE2 3.56Å; F482-Y634 HydrophobicContact CD1-CG 4.39Å; F482-Y634 AromaticContact CD1-CZ 3.65Å; F482-Y634 HydrophobicContact CE1-CD1 4.38Å; F482-Y634 HydrophobicContact CE1-CD2 4.42Å; F482-Y634 HydrophobicContact CE1-CE1 4.27Å; F482-Y634 HydrophobicContact CE1-CE2 4.35Å; F482-Y634 HydrophobicContact CE1-CG 4.44Å; F482-L651 HydrophobicContact CE2-CD1 3.67Å; F482-L651 HydrophobicContact CZ-CD1 3.53Å; F482-A654 HydrophobicContact CD2-CB 3.55Å; F482-A654 HydrophobicContact CE2-CB 3.93Å; F482-L655 HydrophobicContact CD1-CD2 4.16Å; F482-L655 HydrophobicContact CE1-CD2 3.87Å; F482-L655 HydrophobicContact CE2-CD2 4.28Å; F482-L655 HydrophobicContact CG-CD2 4.49Å; F482-L655 HydrophobicContact CZ-CD2 3.93Å; F482-F658 HydrophobicContact CB-CB 4.16Å; F482-F658 HydrophobicContact CB-CD2 3.92Å; F482-F658 HydrophobicContact CB-CG 4.23Å
483	P	85	Confident	76.8	Confident	29 Å²	29	85.3 Å²	85.3	19%	0.188	44%	0.436	C	S	.	.			trans	-66	130.4	-175.1	25.1	-32.4	0	0	0	110.6	C630 F658	P483-C630 HydrophobicContact CB-CB 4.49Å; P483-C630 HydrophobicContact CG-CB 4.23Å; P483-F658 WeakPolarHBondContact O-CE2 3.44Å
484	D	81.1	Confident	78.3	Confident	50 Å²	50	77.7 Å²	77.7	27%	0.267	40%	0.401	S	S	.	.			trans	-109.2	19.4	-179.4	65.4	-38.4	0	0	0	113.3	F482 F486 F658 K659	F482-D484 PolarHBondContact O-N 3.03Å; D484-F486 HydrophobicContact CB-CE1 4.38Å; D484-F486 PolarHBondContact O-N 3.1Å; D484-F658 HydrophobicContact CB-CD2 4.32Å; D484-K659 HydrophobicContact CB-CB 4.35Å; D484-K659 HydrophobicContact CB-CG 4.47Å; D484-K659 WeakPolarHBondContact OD2-CD 3.08Å; D484-K659 VanDerWaalsContact OD2-CE 3.31Å; D484-K659 WeakPolarHBondContact OD2-CE 3.2Å; D484-K659 IonicContact OD2-NZ 3.6Å; D484-K659 PolarHBondContact OD2-NZ 3.2Å
485	N	77.9	Confident	79.9	Confident	140 Å²	140	73 Å²	73	75%	0.749	38%	0.381	S	S	*	.			trans	-82.4	54.8	-175.5	-63.9	-10	0	0	0	112.7
486	F	80.8	Confident	81.5	Confident	44 Å²	44	69.6 Å²	69.6	19%	0.193	37%	0.365	C	S	.	.			trans	-125.2	152.5	176.5	55.6	-97.2	0	0	0	112	D484 L519 N632 F658 G660	D484-F486 HydrophobicContact CB-CE1 4.38Å; D484-F486 PolarHBondContact O-N 3.1Å; F486-L519 HydrophobicContact CE2-CD2 3.88Å; F486-L519 HydrophobicContact CE2-CG 4.37Å; F486-N632 HydrophobicContact CB-CB 4.17Å; F486-N632 HydrophobicContact CD1-CB 3.91Å; F486-N632 HydrophobicContact CD2-CB 3.68Å; F486-N632 HydrophobicContact CE1-CB 4.26Å; F486-N632 HydrophobicContact CE2-CB 4.07Å; F486-N632 HydrophobicContact CG-CB 3.62Å; F486-N632 HydrophobicContact CZ-CB 4.35Å; F486-F658 AromaticContact CE1-CE2 3.55Å; F486-F658 HydrophobicContact CE1-CE2 3.55Å; F486-F658 AromaticContact CE1-CZ 3.75Å; F486-F658 HydrophobicContact CE1-CZ 3.75Å; F486-F658 HydrophobicContact CZ-CE2 4.22Å; F486-F658 HydrophobicContact CZ-CZ 4.15Å; F486-G660 VanDerWaalsContact CZ-CA 3.44Å
487	E	78.6	Confident	83	Confident	171 Å²	171	66.6 Å²	66.6	80%	0.799	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-70.3	146	174.4	-67	-179.7	177.2	0	0	111	L489	E487-L489 PolarHBondContact O-N 3.43Å
488	K	80.6	Confident	84.2	Confident	186 Å²	186	65.3 Å²	65.3	81%	0.809	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-64.1	131.1	176.5	-70	-169.6	176.5	-167.3	0	110.1
489	L	84	Confident	85.3	Confident	24 Å²	24	64.4 Å²	64.4	13%	0.126	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-89.4	141.9	174.5	-58.1	-178.2	0	0	0	110.2	E487 I493 L519 N556 L557	E487-L489 PolarHBondContact O-N 3.43Å; L489-I493 HydrophobicContact CB-CD1 4.37Å; L489-I493 HydrophobicContact CB-CG1 4.27Å; L489-L519 HydrophobicContact CD1-CD1 4.17Å; L489-L519 HydrophobicContact CG-CD1 4.41Å; L489-N556 HydrophobicContact CD2-CB 3.92Å; L489-L557 HydrophobicContact CD1-CD1 4.16Å
490	S	84.1	Confident	86	Confident	75 Å²	75	64.9 Å²	64.9	52%	0.524	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-79.6	140.1	170.1	49.8	0	0	0	0	110.8	H554	S490-H554 PolarHBondContact O-CD2 3.34Å; S490-H554 VanDerWaalsContact O-CD2 3.3Å
491	P	83.1	Confident	86.2	Confident	96 Å²	96	64.7 Å²	64.7	62%	0.623	33%	0.329	S	S	*	.	S	Bend	trans	-65.4	154.3	173.6	27.8	-33.8	0	0	0	111.8
492	P	84.1	Confident	86.4	Confident	62 Å²	62	61.9 Å²	61.9	40%	0.403	32%	0.316	S	S	.	.	P	Polyproline II helix	cis	-78.5	138.7	0.5	31.4	-34	0	0	0	112.5
493	I	88.9	Confident	86.2	Confident	5 Å²	5	67.6 Å²	67.6	3%	0.026	34%	0.338	C	S	.	.			trans	-91.2	-56.4	-176.9	-70.8	167.7	0	0	0	110.8	L489 A517 L519 A553 H554 L557 F633	L489-I493 HydrophobicContact CB-CD1 4.37Å; L489-I493 HydrophobicContact CB-CG1 4.27Å; I493-A517 WeakPolarHBondContact CB-O 3.47Å; I493-L519 HydrophobicContact CD1-CB 3.49Å; I493-L519 VanDerWaalsContact CD1-CB 3.49Å; I493-L519 HydrophobicContact CD1-CD1 3.94Å; I493-L519 HydrophobicContact CD1-CG 4.26Å; I493-A553 CarbonylContact O-C 3.59Å; I493-A553 WeakPolarHBondContact O-CA 3.33Å; I493-H554 PolarHBondContact O-N 3.28Å; I493-L557 HydrophobicContact CG2-CD1 3.72Å; I493-F633 HydrophobicContact CG2-CD2 4.25Å
494	L	90.9	Very high	86.1	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	121.9	176.9	-174.7	65	0	0	0	109.2	A517 L540 Q552 A553 L557	L494-A517 HydrophobicContact CB-CB 4.42Å; L494-A517 PolarHBondContact N-O 3.47Å; L494-A517 PolarHBondContact O-N 3.07Å; L494-L540 HydrophobicContact CD1-CD2 4.33Å; L494-L540 HydrophobicContact CD2-CB 4.11Å; L494-L540 HydrophobicContact CD2-CD2 3.71Å; L494-L540 HydrophobicContact CD2-CG 4.33Å; L494-L540 HydrophobicContact CG-CD2 3.84Å; L494-Q552 CarbonylContact C-O 3.58Å; L494-Q552 WeakPolarHBondContact CA-O 3.41Å; L494-A553 HydrophobicContact CD1-CB 4.05Å; L494-L557 HydrophobicContact CB-CD2 4.43Å; L494-L557 HydrophobicContact CD1-CD2 4.28Å
495	Q	92	Very high	85.8	Confident	53 Å²	53	77.2 Å²	77.2	25%	0.248	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	140	-175.9	-175.1	172.4	-4.2	0	0	110.9	D497 L515 R551 Q552	Q495-D497 WeakPolarHBondContact CG-OD1 3.49Å; Q495-D497 PolarHBondContact NE2-OD1 2.98Å; Q495-D497 PolarHBondContact NE2-OD2 3.3Å; Q495-L515 CarbonylContact C-O 3.58Å; Q495-L515 VanDerWaalsContact CA-O 3.3Å; Q495-L515 WeakPolarHBondContact CA-O 3.5Å; Q495-R551 CarbonylContact O-C 3.55Å; Q495-R551 WeakPolarHBondContact O-CA 3.29Å; Q495-Q552 HydrophobicContact CB-CB 4.35Å; Q495-Q552 PolarHBondContact N-O 3.13Å; Q495-Q552 PolarHBondContact O-N 2.82Å
496	L	91.9	Very high	85.7	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.01	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.9	169.8	-61.2	177.8	0	0	0	107.3	V499 N514 L515 L540 R551	L496-V499 HydrophobicContact CB-CB 4.45Å; L496-V499 HydrophobicContact CB-CG2 3.95Å; L496-V499 HydrophobicContact CD2-CG2 4.2Å; L496-N514 CarbonylContact O-C 3.55Å; L496-N514 VanDerWaalsContact O-CA 3.31Å; L496-N514 WeakPolarHBondContact O-CA 3.44Å; L496-L515 HydrophobicContact CB-CB 4.37Å; L496-L515 HydrophobicContact CD1-CD1 4.31Å; L496-L515 PolarHBondContact N-O 3.33Å; L496-L515 PolarHBondContact O-N 2.85Å; L496-L540 HydrophobicContact CD1-CD2 3.58Å; L496-L540 HydrophobicContact CD1-CG 4.12Å; L496-L540 HydrophobicContact CD2-CD2 4.3Å; L496-L540 HydrophobicContact CG-CD2 3.76Å; L496-R551 HydrophobicContact CD2-CB 3.75Å; L496-R551 HydrophobicContact CD2-CG 3.77Å
497	D	92.4	Very high	85.6	Confident	44 Å²	44	82.5 Å²	82.5	24%	0.235	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.2	179.9	-66.8	-38.2	0	0	0	110.2	Q495 V499 G549 I550 Q552	Q495-D497 WeakPolarHBondContact CG-OD1 3.49Å; Q495-D497 PolarHBondContact NE2-OD1 2.98Å; Q495-D497 PolarHBondContact NE2-OD2 3.3Å; D497-V499 PolarHBondContact O-N 3.42Å; D497-V499 VanDerWaalsContact O-N 3.14Å; D497-G549 CarbonylContact O-C 3.58Å; D497-G549 VanDerWaalsContact O-CA 3.24Å; D497-G549 WeakPolarHBondContact O-CA 3.5Å; D497-I550 PolarHBondContact N-O 3.48Å; D497-I550 PolarHBondContact O-N 2.88Å; D497-Q552 PolarHBondContact OD2-NE2 2.96Å
498	E	91.1	Very high	85.7	Confident	141 Å²	141	79 Å²	79	66%	0.659	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.7	38.4	178	-61	-174.9	163.5	0	0	113.4	E500 L513 N514 G549	E498-E500 PolarHBondContact O-N 3.05Å; E498-L513 PolarHBondContact N-O 2.95Å; E498-L513 VanDerWaalsContact N-O 3.16Å; E498-N514 WeakPolarHBondContact CA-OD1 3.43Å; E498-N514 PolarHBondContact N-OD1 2.87Å; E498-G549 WeakPolarHBondContact O-CA 3.32Å
499	V	90.4	Very high	85.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	127.5	-172.7	167.4	0	0	0	0	111.6	L496 D497 G512 L513 L539 P546 S548	L496-V499 HydrophobicContact CB-CB 4.45Å; L496-V499 HydrophobicContact CB-CG2 3.95Å; L496-V499 HydrophobicContact CD2-CG2 4.2Å; D497-V499 PolarHBondContact O-N 3.42Å; D497-V499 VanDerWaalsContact O-N 3.14Å; V499-G512 PolarHBondContact O-N 2.93Å; V499-L513 HydrophobicContact CB-CB 4.12Å; V499-L513 PolarHBondContact N-O 3.15Å; V499-L513 PolarHBondContact O-N 2.62Å; V499-L539 HydrophobicContact CG1-CD1 4.35Å; V499-P546 HydrophobicContact CB-CB 4.48Å; V499-P546 HydrophobicContact CG1-CB 3.62Å; V499-P546 HydrophobicContact CG2-CB 4.22Å; V499-S548 VanDerWaalsContact CA-O 3.32Å; V499-S548 WeakPolarHBondContact CA-O 3.27Å
500	E	90.5	Very high	86.1	Confident	83 Å²	83	70.9 Å²	70.9	39%	0.388	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.5	169.3	-55.6	-171.3	151.6	0	0	110.4	E498 F510 V547 S548	E498-E500 PolarHBondContact O-N 3.05Å; E500-F510 WeakPolarHBondContact CA-O 3.41Å; E500-V547 PolarHBondContact O-N 2.92Å; E500-S548 PolarHBondContact N-O 3.5Å; E500-S548 PolarHBondContact O-N 3.21Å
501	F	90.1	Very high	86.1	Confident	11 Å²	11	70 Å²	70	5%	0.048	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	141.3	179.6	-175.6	-93.8	0	0	0	112.6	Y503 L509 F510 T535 L539 L544 V547	F501-Y503 HydrophobicContact CE1-CD1 4.15Å; F501-Y503 AromaticContact CE1-CD2 3.96Å; F501-Y503 HydrophobicContact CE1-CD2 3.96Å; F501-Y503 AromaticContact CE1-CE1 3.99Å; F501-Y503 HydrophobicContact CE1-CE1 3.99Å; F501-Y503 AromaticContact CE1-CE2 3.8Å; F501-Y503 HydrophobicContact CE1-CE2 3.8Å; F501-Y503 HydrophobicContact CE1-CG 4.13Å; F501-Y503 AromaticContact CE1-CZ 3.82Å; F501-Y503 HydrophobicContact CZ-CD1 4.15Å; F501-Y503 HydrophobicContact CZ-CE1 4.01Å; F501-L509 HydrophobicContact CD1-CD2 4.42Å; F501-L509 PolarHBondContact O-N 3.28Å; F501-F510 HydrophobicContact CB-CD2 4.26Å; F501-F510 PolarHBondContact N-O 3.36Å; F501-F510 VanDerWaalsContact N-O 3.12Å; F501-F510 PolarHBondContact O-N 2.88Å; F501-T535 HydrophobicContact CD1-CG2 3.55Å; F501-T535 HydrophobicContact CE1-CG2 3.44Å; F501-T535 VanDerWaalsContact CE1-CG2 3.44Å; F501-T535 HydrophobicContact CG-CG2 4.49Å; F501-T535 HydrophobicContact CZ-CG2 4.31Å; F501-L539 HydrophobicContact CB-CD1 4.03Å; F501-L539 HydrophobicContact CB-CD2 4.44Å; F501-L539 HydrophobicContact CD2-CD2 3.81Å; F501-L539 HydrophobicContact CE2-CD2 4.36Å; F501-L539 HydrophobicContact CG-CD1 4.21Å; F501-L539 HydrophobicContact CG-CD2 4.17Å; F501-L544 HydrophobicContact CE1-CD1 4.21Å; F501-L544 HydrophobicContact CE2-CB 4.12Å; F501-L544 HydrophobicContact CE2-CD1 4.3Å; F501-L544 HydrophobicContact CZ-CB 4.39Å; F501-L544 HydrophobicContact CZ-CD1 3.75Å; F501-L544 HydrophobicContact CZ-CD2 4.23Å; F501-L544 HydrophobicContact CZ-CG 4.36Å; F501-V547 HydrophobicContact CD2-CG2 4.43Å
502	Y	88.6	Confident	86.2	Confident	65 Å²	65	67.2 Å²	67.2	26%	0.255	34%	0.344	S	S	.	.			trans	-152.8	138.5	174.8	54.5	-103.8	0	0	0	111.6	R505 V547	Y502-R505 HydrophobicContact CD2-CG 4.23Å; Y502-R505 HydrophobicContact CE2-CB 4.15Å; Y502-R505 HydrophobicContact CE2-CG 3.38Å; Y502-V547 HydrophobicContact CD1-CG2 4.21Å; Y502-V547 HydrophobicContact CD2-CG2 4.45Å; Y502-V547 HydrophobicContact CE1-CB 4.1Å; Y502-V547 HydrophobicContact CE1-CG1 3.65Å; Y502-V547 HydrophobicContact CE1-CG2 4.08Å; Y502-V547 HydrophobicContact CE2-CG1 4.48Å; Y502-V547 HydrophobicContact CE2-CG2 4.3Å; Y502-V547 HydrophobicContact CG-CG2 4.41Å; Y502-V547 WeakPolarHBondContact OH-CG1 3.4Å
503	Y	84.4	Confident	86.4	Confident	137 Å²	137	64.4 Å²	64.4	54%	0.537	33%	0.325	S	S	.	.	S	Bend	trans	-75	-30.6	172.5	-71	-76	0	0	0	111.9	F501 L509 T535 L544	F501-Y503 HydrophobicContact CE1-CD1 4.15Å; F501-Y503 AromaticContact CE1-CD2 3.96Å; F501-Y503 HydrophobicContact CE1-CD2 3.96Å; F501-Y503 AromaticContact CE1-CE1 3.99Å; F501-Y503 HydrophobicContact CE1-CE1 3.99Å; F501-Y503 AromaticContact CE1-CE2 3.8Å; F501-Y503 HydrophobicContact CE1-CE2 3.8Å; F501-Y503 HydrophobicContact CE1-CG 4.13Å; F501-Y503 AromaticContact CE1-CZ 3.82Å; F501-Y503 HydrophobicContact CZ-CD1 4.15Å; F501-Y503 HydrophobicContact CZ-CE1 4.01Å; Y503-L509 HydrophobicContact CD2-CD2 4.48Å; Y503-L509 HydrophobicContact CE2-CD2 4.07Å; Y503-T535 HydrophobicContact CE2-CG2 4.07Å; Y503-T535 PolarHBondContact OH-OG1 3.03Å; Y503-L544 HydrophobicContact CE1-CD1 4.4Å
504	S	82.3	Confident	86.4	Confident	75 Å²	75	68.9 Å²	68.9	52%	0.524	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-138.3	135.3	177.5	-72.2	0	0	0	0	108.4	N506 Q507	S504-N506 PolarHBondContact O-N 2.89Å; S504-Q507 CarbonylContact O-C 3.56Å; S504-Q507 PolarHBondContact O-N 3.18Å
505	R	75.8	Confident	86.4	Confident	205 Å²	205	69.4 Å²	69.4	77%	0.774	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-27.3	-176.8	-85	-175.5	175.9	176.1	0.8	114.4	Y502 Q507	Y502-R505 HydrophobicContact CD2-CG 4.23Å; Y502-R505 HydrophobicContact CE2-CB 4.15Å; Y502-R505 HydrophobicContact CE2-CG 3.38Å; R505-Q507 VanDerWaalsContact C-N 3.33Å
506	N	75.3	Confident	86.3	Confident	155 Å²	155	70.2 Å²	70.2	83%	0.829	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-7.4	-176	-61.1	-8.1	0	0	0	113.5	S504	S504-N506 PolarHBondContact O-N 2.89Å
507	Q	78.3	Confident	86.2	Confident	141 Å²	141	70.2 Å²	70.2	66%	0.659	36%	0.364	S	S	*	.	B	Isolated β-bridge	trans	-138.6	84.3	-178.4	-69.3	-176.7	-7.3	0	0	109.6	S504 R505 L509	S504-Q507 CarbonylContact O-C 3.56Å; S504-Q507 PolarHBondContact O-N 3.18Å; R505-Q507 VanDerWaalsContact C-N 3.33Å; Q507-L509 PolarHBondContact O-N 3.49Å
508	P	80.8	Confident	86.2	Confident	96 Å²	96	71.9 Å²	71.9	62%	0.623	37%	0.373	S	S	*	.			trans	-60.8	121.5	172.3	25.3	-31.7	0	0	0	110.2
509	L	84.9	Confident	86	Confident	38 Å²	38	66 Å²	66	20%	0.199	35%	0.346	C	S	.	.	S	Bend	trans	-84.1	-41.6	177.2	-174.7	68.3	0	0	0	110.2	F501 Y503 Q507 T535 G685	F501-L509 HydrophobicContact CD1-CD2 4.42Å; F501-L509 PolarHBondContact O-N 3.28Å; Y503-L509 HydrophobicContact CD2-CD2 4.48Å; Y503-L509 HydrophobicContact CE2-CD2 4.07Å; Q507-L509 PolarHBondContact O-N 3.49Å; L509-T535 HydrophobicContact CD2-CG2 3.73Å; L509-G685 WeakPolarHBondContact O-CA 3.35Å
510	F	87.6	Confident	85.9	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.009	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.9	-179.4	-63.6	-55.8	0	0	0	111.8	E500 F501 L513 G532 T535 I536 L539 G685 V687	E500-F510 WeakPolarHBondContact CA-O 3.41Å; F501-F510 HydrophobicContact CB-CD2 4.26Å; F501-F510 PolarHBondContact N-O 3.36Å; F501-F510 VanDerWaalsContact N-O 3.12Å; F501-F510 PolarHBondContact O-N 2.88Å; F510-L513 HydrophobicContact CB-CD1 3.51Å; F510-L513 HydrophobicContact CB-CG 3.84Å; F510-L513 HydrophobicContact CD1-CD1 3.86Å; F510-L513 HydrophobicContact CD1-CD2 4.14Å; F510-L513 HydrophobicContact CD1-CG 4.29Å; F510-L513 HydrophobicContact CD2-CD1 3.78Å; F510-L513 HydrophobicContact CE2-CD1 4.47Å; F510-L513 HydrophobicContact CG-CD1 3.45Å; F510-L513 VanDerWaalsContact CG-CD1 3.45Å; F510-L513 HydrophobicContact CG-CD2 4.48Å; F510-L513 HydrophobicContact CG-CG 4.13Å; F510-G532 WeakPolarHBondContact CZ-O 3.5Å; F510-T535 HydrophobicContact CE2-CG2 3.99Å; F510-I536 HydrophobicContact CE1-CD1 3.98Å; F510-I536 HydrophobicContact CE1-CG1 4.02Å; F510-I536 HydrophobicContact CE2-CD1 4.46Å; F510-I536 HydrophobicContact CE2-CG1 3.64Å; F510-I536 HydrophobicContact CZ-CD1 3.68Å; F510-I536 HydrophobicContact CZ-CG1 3.33Å; F510-L539 HydrophobicContact CD2-CD1 4.2Å; F510-L539 HydrophobicContact CE2-CD1 4.48Å; F510-G685 WeakPolarHBondContact CA-O 3.41Å; F510-V687 HydrophobicContact CE1-CG2 4.41Å
511	S	85.3	Confident	85.9	Confident	57 Å²	57	69.7 Å²	69.7	40%	0.399	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	114.8	175.3	61.9	0	0	0	0	110.9	G685	S511-G685 PolarHBondContact N-O 3.41Å
512	G	84.9	Confident	86	Confident	37 Å²	37	70.2 Å²	70.2	38%	0.381	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	66.9	47.8	172.7	0	0	0	0	0	114.6	V499 N514	V499-G512 PolarHBondContact O-N 2.93Å; G512-N514 PolarHBondContact O-N 3.35Å
513	L	88.3	Confident	86.1	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.016	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	121.8	176.9	-71	174.6	0	0	0	111.5	E498 V499 F510 V687	E498-L513 PolarHBondContact N-O 2.95Å; E498-L513 VanDerWaalsContact N-O 3.16Å; V499-L513 HydrophobicContact CB-CB 4.12Å; V499-L513 PolarHBondContact N-O 3.15Å; V499-L513 PolarHBondContact O-N 2.62Å; F510-L513 HydrophobicContact CB-CD1 3.51Å; F510-L513 HydrophobicContact CB-CG 3.84Å; F510-L513 HydrophobicContact CD1-CD1 3.86Å; F510-L513 HydrophobicContact CD1-CD2 4.14Å; F510-L513 HydrophobicContact CD1-CG 4.29Å; F510-L513 HydrophobicContact CD2-CD1 3.78Å; F510-L513 HydrophobicContact CE2-CD1 4.47Å; F510-L513 HydrophobicContact CG-CD1 3.45Å; F510-L513 VanDerWaalsContact CG-CD1 3.45Å; F510-L513 HydrophobicContact CG-CD2 4.48Å; F510-L513 HydrophobicContact CG-CG 4.13Å; L513-V687 HydrophobicContact CD2-CB 3.66Å; L513-V687 HydrophobicContact CD2-CG2 3.44Å; L513-V687 VanDerWaalsContact CD2-CG2 3.44Å
514	N	89.3	Confident	86.5	Confident	100 Å²	100	60.6 Å²	60.6	54%	0.535	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	103.7	173.6	-67.6	-36.9	0	0	0	109	L496 E498 G512	L496-N514 CarbonylContact O-C 3.55Å; L496-N514 VanDerWaalsContact O-CA 3.31Å; L496-N514 WeakPolarHBondContact O-CA 3.44Å; E498-N514 WeakPolarHBondContact CA-OD1 3.43Å; E498-N514 PolarHBondContact N-OD1 2.87Å; G512-N514 PolarHBondContact O-N 3.35Å
515	L	89.8	Confident	86.9	Confident	13 Å²	13	57.1 Å²	57.1	7%	0.068	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.3	-175.3	-63.4	174.4	0	0	0	109.9	Q495 L496 I536 W680 V687	Q495-L515 CarbonylContact C-O 3.58Å; Q495-L515 VanDerWaalsContact CA-O 3.3Å; Q495-L515 WeakPolarHBondContact CA-O 3.5Å; L496-L515 HydrophobicContact CB-CB 4.37Å; L496-L515 HydrophobicContact CD1-CD1 4.31Å; L496-L515 PolarHBondContact N-O 3.33Å; L496-L515 PolarHBondContact O-N 2.85Å; L515-I536 HydrophobicContact CD1-CG2 4.21Å; L515-W680 HydrophobicContact CB-CH2 3.78Å; L515-W680 HydrophobicContact CB-CZ2 4.44Å; L515-W680 HydrophobicContact CB-CZ3 3.93Å; L515-W680 HydrophobicContact CD1-CE3 4Å; L515-W680 HydrophobicContact CD1-CH2 4.48Å; L515-W680 HydrophobicContact CD1-CZ3 3.78Å; L515-W680 HydrophobicContact CD2-CD2 3.92Å; L515-W680 HydrophobicContact CD2-CE3 3.8Å; L515-W680 HydrophobicContact CD2-CH2 4.07Å; L515-W680 HydrophobicContact CD2-CZ2 4.18Å; L515-W680 HydrophobicContact CD2-CZ3 3.89Å; L515-W680 HydrophobicContact CG-CE3 4.38Å; L515-W680 HydrophobicContact CG-CH2 4.32Å; L515-W680 HydrophobicContact CG-CZ3 4.07Å; L515-V687 HydrophobicContact CD1-CB 4.49Å; L515-V687 HydrophobicContact CD1-CG1 4.27Å; L515-V687 HydrophobicContact CD2-CB 4.33Å; L515-V687 HydrophobicContact CD2-CG1 3.82Å
516	S	90.4	Very high	87.6	Confident	70 Å²	70	47.4 Å²	47.4	49%	0.49	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.1	175	56.9	0	0	0	0	110.3	W680	S516-W680 WeakPolarHBondContact O-CZ2 3.41Å
517	A	90.7	Very high	88	Confident	2 Å²	2	40.2 Å²	40.2	2%	0.017	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	129.2	177.3	0	0	0	0	0	110.6	I493 L494 I523 F633	I493-A517 WeakPolarHBondContact CB-O 3.47Å; L494-A517 HydrophobicContact CB-CB 4.42Å; L494-A517 PolarHBondContact N-O 3.47Å; L494-A517 PolarHBondContact O-N 3.07Å; A517-I523 HydrophobicContact CB-CD1 3.63Å; A517-F633 HydrophobicContact CB-CE2 4.2Å; A517-F633 HydrophobicContact CB-CZ 3.95Å
518	D	90.8	Very high	88.1	Confident	79 Å²	79	37.6 Å²	37.6	42%	0.422	22%	0.217	S	C	.	.			trans	-103	174.3	178.2	-67.2	-39.3	0	0	0	111.6	E520 S521	D518-E520 PolarHBondContact O-N 3.38Å; D518-S521 PolarHBondContact N-OG 2.96Å; D518-S521 WeakPolarHBondContact O-CB 3.36Å; D518-S521 PolarHBondContact O-N 2.82Å; D518-S521 PolarHBondContact O-OG 3.13Å
519	L	87.9	Confident	88	Confident	18 Å²	18	35.6 Å²	35.6	9%	0.094	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-23.4	-179.5	-145	69.2	0	0	0	112.3	F486 L489 I493 G660 G661	F486-L519 HydrophobicContact CE2-CD2 3.88Å; F486-L519 HydrophobicContact CE2-CG 4.37Å; L489-L519 HydrophobicContact CD1-CD1 4.17Å; L489-L519 HydrophobicContact CG-CD1 4.41Å; I493-L519 HydrophobicContact CD1-CB 3.49Å; I493-L519 VanDerWaalsContact CD1-CB 3.49Å; I493-L519 HydrophobicContact CD1-CD1 3.94Å; I493-L519 HydrophobicContact CD1-CG 4.26Å; L519-G660 CarbonylContact O-C 3.6Å; L519-G660 WeakPolarHBondContact O-CA 3.42Å; L519-G660 VanDerWaalsContact O-O 3.07Å; L519-G661 VanDerWaalsContact O-CA 3.25Å; L519-G661 WeakPolarHBondContact O-CA 3.36Å; L519-G661 PolarHBondContact O-N 3.31Å
520	E	87.7	Confident	87.4	Confident	148 Å²	148	37.2 Å²	37.2	69%	0.692	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-5	178.3	-61.9	-174.1	179.8	0	0	112	D518 R522	D518-E520 PolarHBondContact O-N 3.38Å; E520-R522 PolarHBondContact O-N 3.25Å; E520-R522 PolarHBondContact O-NH1 3.42Å
521	S	90.1	Very high	87.1	Confident	12 Å²	12	38.2 Å²	38.2	8%	0.084	24%	0.236	C	C	.	.			trans	-63	136.2	179.9	-63.8	0	0	0	0	110.9	D518 V662	D518-S521 PolarHBondContact N-OG 2.96Å; D518-S521 WeakPolarHBondContact O-CB 3.36Å; D518-S521 PolarHBondContact O-N 2.82Å; D518-S521 PolarHBondContact O-OG 3.13Å; S521-V662 PolarHBondContact O-N 3.33Å
522	R	92.4	Very high	86.9	Confident	22 Å²	22	35.9 Å²	35.9	8%	0.083	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	85.4	175.3	-65.9	-70.3	175.9	-77.4	3	107.2	E520 F658 G660 V675 K677 E678	E520-R522 PolarHBondContact O-N 3.25Å; E520-R522 PolarHBondContact O-NH1 3.42Å; R522-F658 PolarHBondContact NH2-O 2.85Å; R522-G660 PolarHBondContact NH1-O 3.49Å; R522-G660 PolarHBondContact NH2-O 3.35Å; R522-V675 VanDerWaalsContact CB-O 3.25Å; R522-V675 WeakPolarHBondContact CB-O 3.42Å; R522-V675 WeakPolarHBondContact CG-O 3.24Å; R522-K677 HydrophobicContact CB-CB 4.33Å; R522-K677 HydrophobicContact CB-CG 4.19Å; R522-K677 PolarHBondContact O-N 3.41Å; R522-E678 PolarHBondContact O-N 3.03Å; R522-E678 VanDerWaalsContact O-N 3.07Å
523	I	92.3	Very high	87.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.5	-168.7	-64.3	153.9	0	0	0	108.6	A517 I525 V662 I663 L664 E678 W680	A517-I523 HydrophobicContact CB-CD1 3.63Å; I523-I525 HydrophobicContact CG2-CG1 4.32Å; I523-V662 PolarHBondContact N-O 2.91Å; I523-I663 HydrophobicContact CB-CG1 4.2Å; I523-I663 HydrophobicContact CD1-CG1 4.21Å; I523-I663 CarbonylContact O-C 3.56Å; I523-I663 WeakPolarHBondContact O-CA 3.38Å; I523-L664 PolarHBondContact O-N 3.47Å; I523-E678 WeakPolarHBondContact CA-O 3.4Å; I523-E678 HydrophobicContact CG1-CB 4.31Å; I523-W680 HydrophobicContact CD1-CH2 3.7Å; I523-W680 HydrophobicContact CD1-CZ2 3.48Å; I523-W680 VanDerWaalsContact CD1-CZ2 3.48Å; I523-W680 HydrophobicContact CD1-CZ3 4.45Å; I523-W680 HydrophobicContact CG1-CZ2 4.03Å; I523-W680 HydrophobicContact CG2-CB 4.41Å; I523-W680 HydrophobicContact CG2-CD2 3.39Å; I523-W680 HydrophobicContact CG2-CE3 3.69Å; I523-W680 HydrophobicContact CG2-CG 3.73Å; I523-W680 HydrophobicContact CG2-CH2 4.32Å; I523-W680 HydrophobicContact CG2-CZ2 4.07Å; I523-W680 HydrophobicContact CG2-CZ3 4.14Å
524	C	92.5	Very high	87	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.9	164.4	-174.8	0	0	0	0	109.7	L664 I672 C676 E678 L679 W680	C524-L664 CarbonylContact C-O 3.52Å; C524-L664 VanDerWaalsContact CA-O 3.23Å; C524-L664 WeakPolarHBondContact CA-O 3.31Å; C524-I672 HydrophobicContact CB-CG2 3.96Å; C524-I672 VanDerWaalsContact SG-CG1 3.59Å; C524-C676 HydrophobicContact CB-CB 3.74Å; C524-C676 VanDerWaalsContact CB-SG 3.58Å; C524-E678 PolarHBondContact N-O 3.12Å; C524-L679 HydrophobicContact CB-CD1 3.68Å; C524-L679 CarbonylContact O-C 3.55Å; C524-L679 WeakPolarHBondContact O-CA 3.35Å; C524-W680 PolarHBondContact O-N 3.36Å
525	I	91.1	Very high	86.9	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.9	170.4	-52.3	176	0	0	0	108.2	I523 K533 I536 L537 I663 L664 V665 W680 C682	I523-I525 HydrophobicContact CG2-CG1 4.32Å; I525-K533 HydrophobicContact CG2-CG 4.25Å; I525-I536 HydrophobicContact CD1-CG2 4.28Å; I525-L537 HydrophobicContact CD1-CD2 3.78Å; I525-I663 HydrophobicContact CD1-CG2 3.71Å; I525-I663 HydrophobicContact CG1-CG2 4.07Å; I525-L664 PolarHBondContact N-O 3.27Å; I525-V665 HydrophobicContact CB-CG2 4.18Å; I525-W680 CarbonylContact C-O 3.56Å; I525-W680 WeakPolarHBondContact CA-O 3.31Å; I525-W680 HydrophobicContact CD1-CE3 4.3Å; I525-W680 HydrophobicContact CG1-CB 4.33Å; I525-W680 HydrophobicContact CG1-CE3 4.15Å; I525-C682 HydrophobicContact CG2-CB 4.46Å
526	V	88.6	Confident	86.9	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	155.5	176.8	-65.2	0	0	0	0	110.6	I362 I672 L679 W680 V681 C682 Y697	I362-V526 HydrophobicContact CD1-CB 4.23Å; I362-V526 HydrophobicContact CD1-CG1 3.8Å; V526-I672 HydrophobicContact CG1-CD1 4.38Å; V526-L679 HydrophobicContact CB-CD1 4.26Å; V526-L679 HydrophobicContact CG1-CD1 3.6Å; V526-L679 HydrophobicContact CG2-CD1 3.66Å; V526-L679 HydrophobicContact CG2-CD2 3.99Å; V526-L679 HydrophobicContact CG2-CG 3.76Å; V526-W680 PolarHBondContact N-O 2.97Å; V526-V681 HydrophobicContact CG2-CB 4.45Å; V526-V681 HydrophobicContact CG2-CG2 3.82Å; V526-V681 WeakPolarHBondContact O-CA 3.32Å; V526-C682 PolarHBondContact O-N 3.07Å; V526-Y697 HydrophobicContact CB-CE1 4.06Å; V526-Y697 HydrophobicContact CG2-CD1 4.13Å; V526-Y697 HydrophobicContact CG2-CD2 4.36Å; V526-Y697 HydrophobicContact CG2-CE1 3.74Å; V526-Y697 HydrophobicContact CG2-CE2 4.01Å; V526-Y697 HydrophobicContact CG2-CG 4.42Å
527	G	84.7	Confident	86.9	Confident	4 Å²	4	28.6 Å²	28.6	4%	0.041	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.1	167.3	-178.3	0	0	0	0	0	110.9	K533 C682	G527-K533 WeakPolarHBondContact O-CE 3.12Å; G527-K533 PolarHBondContact O-NZ 3.33Å; G527-C682 WeakPolarHBondContact CA-O 3.44Å
528	E	79.6	Confident	86.9	Confident	86 Å²	86	32.3 Å²	32.3	40%	0.402	19%	0.187	S	C	.	.			trans	-63.6	153.3	177.7	-59.4	-168.8	153.1	0	0	111.6	R363 G530 A531	R363-E528 WeakPolarHBondContact CD-OE1 3.49Å; R363-E528 IonicContact CZ-OE1 3.92Å; R363-E528 IonicContact NE-OE1 2.97Å; R363-E528 IonicContact NH1-OE1 3.66Å; R363-E528 PolarHBondContact NH1-OE1 3.42Å; E528-G530 PolarHBondContact O-N 3.27Å; E528-A531 WeakPolarHBondContact O-CB 3.38Å; E528-A531 PolarHBondContact O-N 3.42Å
529	N	78.4	Confident	86.9	Confident	54 Å²	54	28.6 Å²	28.6	29%	0.289	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	126.5	175	-83.7	-19.9	0	0	0	110.4	R337 D361 K533	R337-N529 PolarHBondContact NH2-ND2 3.41Å; D361-N529 VanDerWaalsContact CG-CG 3.45Å; D361-N529 PolarHBondContact OD1-N 3.45Å; D361-N529 PolarHBondContact OD1-ND2 3.46Å; D361-N529 PolarHBondContact OD1-OD1 3.47Å; D361-N529 VanDerWaalsContact OD2-CB 3.24Å; D361-N529 WeakPolarHBondContact OD2-CB 3.4Å; D361-N529 VanDerWaalsContact OD2-CG 3.32Å; D361-N529 PolarHBondContact OD2-N 2.89Å; N529-K533 PolarHBondContact OD1-NZ 2.94Å
530	G	74.2	Confident	87	Confident	73 Å²	73	27.9 Å²	27.9	75%	0.753	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	91	-2.8	-172.4	0	0	0	0	0	114.8	E528 G532	E528-G530 PolarHBondContact O-N 3.27Å; G530-G532 PolarHBondContact O-N 3.19Å; G530-G532 VanDerWaalsContact O-N 3.13Å
531	A	81.1	Confident	87.1	Confident	23 Å²	23	22.2 Å²	22.2	19%	0.19	14%	0.137	C	C	.	.	S	Bend	trans	-65.1	-14	175.2	0	0	0	0	0	113.8	E528 C682	E528-A531 WeakPolarHBondContact O-CB 3.38Å; E528-A531 PolarHBondContact O-N 3.42Å; A531-C682 PolarHBondContact O-SG 2.89Å
532	G	81.4	Confident	87	Confident	8 Å²	8	26 Å²	26	8%	0.082	16%	0.157	C	C	.	.	S	Bend	trans	107.5	13	177.5	0	0	0	0	0	115.3	F510 G530 S534 T535 I536	F510-G532 WeakPolarHBondContact CZ-O 3.5Å; G530-G532 PolarHBondContact O-N 3.19Å; G530-G532 VanDerWaalsContact O-N 3.13Å; G532-S534 PolarHBondContact O-N 2.88Å; G532-T535 CarbonylContact O-C 3.59Å; G532-T535 WeakPolarHBondContact O-CA 3.21Å; G532-T535 VanDerWaalsContact O-CB 3.26Å; G532-T535 WeakPolarHBondContact O-CB 3.41Å; G532-T535 PolarHBondContact O-N 3.17Å; G532-I536 PolarHBondContact O-N 3.29Å
533	K	87.3	Confident	86.8	Confident	12 Å²	12	30.1 Å²	30.1	5%	0.052	18%	0.181	C	C	.	.	H	α-helix	trans	-43	-58.9	176.4	-62.9	177.3	-73.3	-171.3	0	112.7	D361 I525 G527 N529 T535 I536 L537 V665 H667	D361-K533 IonicContact OD1-NZ 3.91Å; D361-K533 PolarHBondContact OD1-NZ 2.85Å; I525-K533 HydrophobicContact CG2-CG 4.25Å; G527-K533 WeakPolarHBondContact O-CE 3.12Å; G527-K533 PolarHBondContact O-NZ 3.33Å; N529-K533 PolarHBondContact OD1-NZ 2.94Å; K533-T535 VanDerWaalsContact C-N 3.26Å; K533-T535 PolarHBondContact O-N 3Å; K533-I536 WeakPolarHBondContact O-CB 3.46Å; K533-I536 PolarHBondContact O-N 3.3Å; K533-I536 VanDerWaalsContact O-N 3.13Å; K533-L537 PolarHBondContact O-N 2.88Å; K533-V665 HydrophobicContact CB-CG1 4.25Å; K533-V665 HydrophobicContact CD-CG1 3.92Å; K533-H667 PolarHBondContact NZ-CE1 3.11Å; K533-H667 PolarHBondContact NZ-NE2 3.16Å
534	S	86.2	Confident	86.6	Confident	44 Å²	44	32 Å²	32	31%	0.308	19%	0.19	S	C	.	.	H	α-helix	trans	-66.6	-25.3	178.7	-47.5	0	0	0	0	113.5	G532 L537 K538 D637	G532-S534 PolarHBondContact O-N 2.88Å; S534-L537 PolarHBondContact O-N 3.42Å; S534-K538 VanDerWaalsContact O-CG 3.32Å; S534-K538 WeakPolarHBondContact O-CG 3.47Å; S534-K538 PolarHBondContact O-N 3.27Å; S534-D637 PolarHBondContact OG-OD2 3.09Å
535	T	88.4	Confident	86.4	Confident	12 Å²	12	37.2 Å²	37.2	7%	0.074	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-39.2	173.5	-53.3	0	0	0	0	110.9	F501 Y503 L509 F510 G532 K533 L537 K538 L539 L544	F501-T535 HydrophobicContact CD1-CG2 3.55Å; F501-T535 HydrophobicContact CE1-CG2 3.44Å; F501-T535 VanDerWaalsContact CE1-CG2 3.44Å; F501-T535 HydrophobicContact CG-CG2 4.49Å; F501-T535 HydrophobicContact CZ-CG2 4.31Å; Y503-T535 HydrophobicContact CE2-CG2 4.07Å; Y503-T535 PolarHBondContact OH-OG1 3.03Å; L509-T535 HydrophobicContact CD2-CG2 3.73Å; F510-T535 HydrophobicContact CE2-CG2 3.99Å; G532-T535 CarbonylContact O-C 3.59Å; G532-T535 WeakPolarHBondContact O-CA 3.21Å; G532-T535 VanDerWaalsContact O-CB 3.26Å; G532-T535 WeakPolarHBondContact O-CB 3.41Å; G532-T535 PolarHBondContact O-N 3.17Å; K533-T535 VanDerWaalsContact C-N 3.26Å; K533-T535 PolarHBondContact O-N 3Å; T535-L537 VanDerWaalsContact C-N 3.33Å; T535-L537 PolarHBondContact O-N 3.23Å; T535-K538 PolarHBondContact O-N 2.84Å; T535-L539 WeakPolarHBondContact O-CG 3.37Å; T535-L539 PolarHBondContact O-N 2.75Å; T535-L544 HydrophobicContact CG2-CD1 3.85Å
536	I	89.7	Confident	86.4	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-45.6	172.9	-62.4	164	0	0	0	109.9	F510 L515 I525 G532 K533 K538 L539 L540 C682 V687	F510-I536 HydrophobicContact CE1-CD1 3.98Å; F510-I536 HydrophobicContact CE1-CG1 4.02Å; F510-I536 HydrophobicContact CE2-CD1 4.46Å; F510-I536 HydrophobicContact CE2-CG1 3.64Å; F510-I536 HydrophobicContact CZ-CD1 3.68Å; F510-I536 HydrophobicContact CZ-CG1 3.33Å; L515-I536 HydrophobicContact CD1-CG2 4.21Å; I525-I536 HydrophobicContact CD1-CG2 4.28Å; G532-I536 PolarHBondContact O-N 3.29Å; K533-I536 WeakPolarHBondContact O-CB 3.46Å; K533-I536 PolarHBondContact O-N 3.3Å; K533-I536 VanDerWaalsContact O-N 3.13Å; I536-K538 VanDerWaalsContact C-N 3.32Å; I536-K538 PolarHBondContact O-N 3.23Å; I536-L539 WeakPolarHBondContact O-CB 3.45Å; I536-L539 PolarHBondContact O-N 3.09Å; I536-L540 HydrophobicContact CG2-CD1 4.01Å; I536-L540 HydrophobicContact CG2-CG 4.34Å; I536-L540 WeakPolarHBondContact O-CG 3.4Å; I536-L540 PolarHBondContact O-N 2.74Å; I536-C682 HydrophobicContact CD1-CB 4.27Å; I536-V687 HydrophobicContact CD1-CG2 3.53Å
537	L	90.9	Very high	86.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-44.3	177.6	-58.4	-172.9	0	0	0	111.8	I525 K533 S534 T535 L539 L540 M541 Y561 I635 D637 I663 V665	I525-L537 HydrophobicContact CD1-CD2 3.78Å; K533-L537 PolarHBondContact O-N 2.88Å; S534-L537 PolarHBondContact O-N 3.42Å; T535-L537 VanDerWaalsContact C-N 3.33Å; T535-L537 PolarHBondContact O-N 3.23Å; L537-L539 PolarHBondContact O-N 2.89Å; L537-L540 WeakPolarHBondContact O-CB 3.3Å; L537-L540 PolarHBondContact O-N 2.88Å; L537-M541 HydrophobicContact CB-CE 4.43Å; L537-M541 VanDerWaalsContact O-CG 3.3Å; L537-M541 WeakPolarHBondContact O-CG 3.23Å; L537-M541 PolarHBondContact O-N 3Å; L537-Y561 HydrophobicContact CD1-CE2 4.07Å; L537-I635 HydrophobicContact CB-CG2 4.24Å; L537-I635 HydrophobicContact CD1-CG2 3.84Å; L537-I635 HydrophobicContact CD2-CG2 3.6Å; L537-I635 HydrophobicContact CG-CG2 4.09Å; L537-D637 HydrophobicContact CD1-CB 3.62Å; L537-I663 HydrophobicContact CD2-CG2 3.93Å; L537-V665 HydrophobicContact CD1-CG2 3.73Å; L537-V665 HydrophobicContact CD2-CG2 4.11Å; L537-V665 HydrophobicContact CG-CG2 4.21Å
538	K	89.9	Confident	86.7	Confident	80 Å²	80	44.9 Å²	44.9	35%	0.348	27%	0.271	S	S	.	.	H	α-helix	trans	-63.9	-38.6	176.7	-73.8	174.9	-177.4	-178.6	0	112.9	S534 T535 I536 M541 D542 D543 L544	S534-K538 VanDerWaalsContact O-CG 3.32Å; S534-K538 WeakPolarHBondContact O-CG 3.47Å; S534-K538 PolarHBondContact O-N 3.27Å; T535-K538 PolarHBondContact O-N 2.84Å; I536-K538 VanDerWaalsContact C-N 3.32Å; I536-K538 PolarHBondContact O-N 3.23Å; K538-M541 HydrophobicContact CG-CE 4.32Å; K538-M541 PolarHBondContact O-N 3.33Å; K538-D542 PolarHBondContact O-N 3.39Å; K538-D543 HydrophobicContact CB-CB 4.11Å; K538-D543 HydrophobicContact CG-CB 4.32Å; K538-D543 PolarHBondContact O-N 3.23Å; K538-L544 HydrophobicContact CB-CB 4.35Å; K538-L544 HydrophobicContact CB-CD1 3.66Å; K538-L544 HydrophobicContact CB-CG 3.87Å; K538-L544 HydrophobicContact CD-CD1 3.92Å; K538-L544 HydrophobicContact CD-CG 4.36Å; K538-L544 HydrophobicContact CG-CD1 4.46Å; K538-L544 PolarHBondContact O-N 2.93Å
539	L	90.6	Very high	87.2	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-46.3	171.7	-71.3	168.4	0	0	0	110.2	V499 F501 F510 T535 I536 L537 M541 D542 L544 P546 R551	V499-L539 HydrophobicContact CG1-CD1 4.35Å; F501-L539 HydrophobicContact CB-CD1 4.03Å; F501-L539 HydrophobicContact CB-CD2 4.44Å; F501-L539 HydrophobicContact CD2-CD2 3.81Å; F501-L539 HydrophobicContact CE2-CD2 4.36Å; F501-L539 HydrophobicContact CG-CD1 4.21Å; F501-L539 HydrophobicContact CG-CD2 4.17Å; F510-L539 HydrophobicContact CD2-CD1 4.2Å; F510-L539 HydrophobicContact CE2-CD1 4.48Å; T535-L539 WeakPolarHBondContact O-CG 3.37Å; T535-L539 PolarHBondContact O-N 2.75Å; I536-L539 WeakPolarHBondContact O-CB 3.45Å; I536-L539 PolarHBondContact O-N 3.09Å; L537-L539 PolarHBondContact O-N 2.89Å; L539-M541 VanDerWaalsContact C-N 3.27Å; L539-M541 PolarHBondContact O-N 3.39Å; L539-D542 PolarHBondContact O-N 2.82Å; L539-L544 HydrophobicContact CD2-CB 3.92Å; L539-L544 WeakPolarHBondContact CD2-O 3.33Å; L539-L544 HydrophobicContact CG-CB 4.39Å; L539-P546 HydrophobicContact CD2-CB 4.44Å; L539-R551 WeakPolarHBondContact O-CD 3.31Å; L539-R551 PolarHBondContact O-NE 3.17Å; L539-R551 VanDerWaalsContact O-NE 3.14Å
540	L	90	Very high	87.8	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-31.7	178	-72.1	173.5	0	0	0	113.2	L494 L496 I536 L537 R551 I635 I663	L494-L540 HydrophobicContact CD1-CD2 4.33Å; L494-L540 HydrophobicContact CD2-CB 4.11Å; L494-L540 HydrophobicContact CD2-CD2 3.71Å; L494-L540 HydrophobicContact CD2-CG 4.33Å; L494-L540 HydrophobicContact CG-CD2 3.84Å; L496-L540 HydrophobicContact CD1-CD2 3.58Å; L496-L540 HydrophobicContact CD1-CG 4.12Å; L496-L540 HydrophobicContact CD2-CD2 4.3Å; L496-L540 HydrophobicContact CG-CD2 3.76Å; I536-L540 HydrophobicContact CG2-CD1 4.01Å; I536-L540 HydrophobicContact CG2-CG 4.34Å; I536-L540 WeakPolarHBondContact O-CG 3.4Å; I536-L540 PolarHBondContact O-N 2.74Å; L537-L540 WeakPolarHBondContact O-CB 3.3Å; L537-L540 PolarHBondContact O-N 2.88Å; L540-R551 VanDerWaalsContact O-CZ 3.27Å; L540-R551 PolarHBondContact O-NE 3.3Å; L540-R551 PolarHBondContact O-NH2 2.89Å; L540-I635 HydrophobicContact CB-CD1 4.39Å; L540-I663 HydrophobicContact CD1-CD1 3.71Å
541	M	89.6	Confident	88.7	Confident	29 Å²	29	43.6 Å²	43.6	14%	0.143	25%	0.253	C	S	.	.	H	α-helix	trans	-85.2	-6.5	179.4	-68.7	-175.9	-58.9	0	0	115.1	L537 K538 L539 D543 I559 Y561 I635	L537-M541 HydrophobicContact CB-CE 4.43Å; L537-M541 VanDerWaalsContact O-CG 3.3Å; L537-M541 WeakPolarHBondContact O-CG 3.23Å; L537-M541 PolarHBondContact O-N 3Å; K538-M541 HydrophobicContact CG-CE 4.32Å; K538-M541 PolarHBondContact O-N 3.33Å; L539-M541 VanDerWaalsContact C-N 3.27Å; L539-M541 PolarHBondContact O-N 3.39Å; M541-D543 VanDerWaalsContact C-N 3.29Å; M541-I559 HydrophobicContact CG-CG2 4.41Å; M541-Y561 HydrophobicContact CE-CD1 3.75Å; M541-Y561 HydrophobicContact CE-CD2 3.88Å; M541-Y561 HydrophobicContact CE-CE1 3.65Å; M541-Y561 HydrophobicContact CE-CE2 3.82Å; M541-Y561 HydrophobicContact CE-CG 3.87Å; M541-Y561 VanDerWaalsContact SD-CB 3.51Å; M541-Y561 HydrophobicContact SD-CD1 3.63Å; M541-Y561 HydrophobicContact SD-CD2 3.44Å; M541-Y561 WeakPolarHBondContact SD-CD2 3.24Å; M541-Y561 HydrophobicContact SD-CE1 4.16Å; M541-Y561 HydrophobicContact SD-CE2 4.02Å; M541-Y561 HydrophobicContact SD-CG 3.23Å; M541-I635 HydrophobicContact CG-CD1 3.78Å; M541-I635 HydrophobicContact SD-CD1 4.41Å
542	D	88.5	Confident	89.2	Confident	92 Å²	92	46.2 Å²	46.2	49%	0.492	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	10.5	-171.9	-136.1	34	0	0	0	115.4	K538 L539 L544 R551	K538-D542 PolarHBondContact O-N 3.39Å; L539-D542 PolarHBondContact O-N 2.82Å; D542-L544 VanDerWaalsContact C-N 3.28Å; D542-R551 VanDerWaalsContact CB-NH1 3.27Å; D542-R551 IonicContact OD1-CZ 3.16Å; D542-R551 IonicContact OD1-NE 3.96Å; D542-R551 IonicContact OD1-NH1 3.19Å; D542-R551 PolarHBondContact OD1-NH1 3.3Å; D542-R551 IonicContact OD2-NH1 3.34Å; D542-R551 PolarHBondContact OD2-NH1 2.84Å
543	D	88.4	Confident	89.6	Confident	109 Å²	109	47.9 Å²	47.9	58%	0.583	27%	0.274	S	S	*	.	S	Bend	trans	-71	-28.9	175.5	-72.4	-15.5	0	0	0	111.7	K538 M541	K538-D543 HydrophobicContact CB-CB 4.11Å; K538-D543 HydrophobicContact CG-CB 4.32Å; K538-D543 PolarHBondContact O-N 3.23Å; M541-D543 VanDerWaalsContact C-N 3.29Å
544	L	88.6	Confident	89.8	Confident	38 Å²	38	49.4 Å²	49.4	20%	0.199	28%	0.281	C	S	.	.	S	Bend	trans	-119.8	130.9	174.3	-68.9	175.1	0	0	0	109.2	F501 Y503 T535 K538 L539 D542	F501-L544 HydrophobicContact CE1-CD1 4.21Å; F501-L544 HydrophobicContact CE2-CB 4.12Å; F501-L544 HydrophobicContact CE2-CD1 4.3Å; F501-L544 HydrophobicContact CZ-CB 4.39Å; F501-L544 HydrophobicContact CZ-CD1 3.75Å; F501-L544 HydrophobicContact CZ-CD2 4.23Å; F501-L544 HydrophobicContact CZ-CG 4.36Å; Y503-L544 HydrophobicContact CE1-CD1 4.4Å; T535-L544 HydrophobicContact CG2-CD1 3.85Å; K538-L544 HydrophobicContact CB-CB 4.35Å; K538-L544 HydrophobicContact CB-CD1 3.66Å; K538-L544 HydrophobicContact CB-CG 3.87Å; K538-L544 HydrophobicContact CD-CD1 3.92Å; K538-L544 HydrophobicContact CD-CG 4.36Å; K538-L544 HydrophobicContact CG-CD1 4.46Å; K538-L544 PolarHBondContact O-N 2.93Å; L539-L544 HydrophobicContact CD2-CB 3.92Å; L539-L544 WeakPolarHBondContact CD2-O 3.33Å; L539-L544 HydrophobicContact CG-CB 4.39Å; D542-L544 VanDerWaalsContact C-N 3.28Å
545	T	88.3	Confident	89.9	Confident	110 Å²	110	59 Å²	59	68%	0.675	31%	0.31	S	S	*	.			trans	-83.2	131.5	172.8	53.7	0	0	0	0	109.7
546	P	90.1	Very high	89.9	Confident	34 Å²	34	63.5 Å²	63.5	22%	0.221	33%	0.334	C	S	.	.			trans	-62.1	148.4	173.5	29.5	-35.7	0	0	0	110.4	V499 L539	V499-P546 HydrophobicContact CB-CB 4.48Å; V499-P546 HydrophobicContact CG1-CB 3.62Å; V499-P546 HydrophobicContact CG2-CB 4.22Å; L539-P546 HydrophobicContact CD2-CB 4.44Å
547	V	90.1	Very high	89.9	Confident	72 Å²	72	64.7 Å²	64.7	44%	0.436	34%	0.34	S	S	.	.	S	Bend	trans	-78.3	-38	177	179.3	0	0	0	0	110.5	E500 F501 Y502	E500-V547 PolarHBondContact O-N 2.92Å; F501-V547 HydrophobicContact CD2-CG2 4.43Å; Y502-V547 HydrophobicContact CD1-CG2 4.21Å; Y502-V547 HydrophobicContact CD2-CG2 4.45Å; Y502-V547 HydrophobicContact CE1-CB 4.1Å; Y502-V547 HydrophobicContact CE1-CG1 3.65Å; Y502-V547 HydrophobicContact CE1-CG2 4.08Å; Y502-V547 HydrophobicContact CE2-CG1 4.48Å; Y502-V547 HydrophobicContact CE2-CG2 4.3Å; Y502-V547 HydrophobicContact CG-CG2 4.41Å; Y502-V547 WeakPolarHBondContact OH-CG1 3.4Å
548	S	90.1	Very high	89.8	Confident	61 Å²	61	70.7 Å²	70.7	43%	0.427	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	159.5	173	-170.7	0	0	0	0	108.9	V499 E500	V499-S548 VanDerWaalsContact CA-O 3.32Å; V499-S548 WeakPolarHBondContact CA-O 3.27Å; E500-S548 PolarHBondContact N-O 3.5Å; E500-S548 PolarHBondContact O-N 3.21Å
549	G	90.3	Very high	89.9	Confident	31 Å²	31	69.3 Å²	69.3	32%	0.32	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	86.9	-177.7	-175.9	0	0	0	0	0	114	D497 E498	D497-G549 CarbonylContact O-C 3.58Å; D497-G549 VanDerWaalsContact O-CA 3.24Å; D497-G549 WeakPolarHBondContact O-CA 3.5Å; E498-G549 WeakPolarHBondContact O-CA 3.32Å
550	I	90.8	Very high	89.9	Confident	103 Å²	103	69.5 Å²	69.5	53%	0.528	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.7	-171.5	-58.4	169.8	0	0	0	110	D497 Q552	D497-I550 PolarHBondContact N-O 3.48Å; D497-I550 PolarHBondContact O-N 2.88Å; I550-Q552 HydrophobicContact CG2-CG 3.88Å
551	R	92.2	Very high	90	Very high	53 Å²	53	72 Å²	72	20%	0.2	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.8	165.2	175	-179.6	174.7	-89.4	-3.9	109.4	Q495 L496 L539 L540 D542	Q495-R551 CarbonylContact O-C 3.55Å; Q495-R551 WeakPolarHBondContact O-CA 3.29Å; L496-R551 HydrophobicContact CD2-CB 3.75Å; L496-R551 HydrophobicContact CD2-CG 3.77Å; L539-R551 WeakPolarHBondContact O-CD 3.31Å; L539-R551 PolarHBondContact O-NE 3.17Å; L539-R551 VanDerWaalsContact O-NE 3.14Å; L540-R551 VanDerWaalsContact O-CZ 3.27Å; L540-R551 PolarHBondContact O-NE 3.3Å; L540-R551 PolarHBondContact O-NH2 2.89Å; D542-R551 VanDerWaalsContact CB-NH1 3.27Å; D542-R551 IonicContact OD1-CZ 3.16Å; D542-R551 IonicContact OD1-NE 3.96Å; D542-R551 IonicContact OD1-NH1 3.19Å; D542-R551 PolarHBondContact OD1-NH1 3.3Å; D542-R551 IonicContact OD2-NH1 3.34Å; D542-R551 PolarHBondContact OD2-NH1 2.84Å
552	Q	91.1	Very high	90	Very high	77 Å²	77	71 Å²	71	36%	0.36	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128	173.3	-53.6	-172.4	23.5	0	0	109.8	L494 Q495 D497 I550	L494-Q552 CarbonylContact C-O 3.58Å; L494-Q552 WeakPolarHBondContact CA-O 3.41Å; Q495-Q552 HydrophobicContact CB-CB 4.35Å; Q495-Q552 PolarHBondContact N-O 3.13Å; Q495-Q552 PolarHBondContact O-N 2.82Å; D497-Q552 PolarHBondContact OD2-NE2 2.96Å; I550-Q552 HydrophobicContact CG2-CG 3.88Å
553	A	91.7	Very high	89.7	Confident	43 Å²	43	67 Å²	67	36%	0.355	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142	175.6	0	0	0	0	0	110.4	I493 L494 L557	I493-A553 CarbonylContact O-C 3.59Å; I493-A553 WeakPolarHBondContact O-CA 3.33Å; L494-A553 HydrophobicContact CD1-CB 4.05Å; A553-L557 HydrophobicContact CB-CD2 4.2Å
554	H	91.5	Very high	89.1	Confident	45 Å²	45	65.4 Å²	65.4	21%	0.208	34%	0.337	C	S	.	.			trans	-65.6	138.7	177.4	-171.8	-86.7	0	0	0	111	S490 I493 N556 L557	S490-H554 PolarHBondContact O-CD2 3.34Å; S490-H554 VanDerWaalsContact O-CD2 3.3Å; I493-H554 PolarHBondContact O-N 3.28Å; H554-N556 VanDerWaalsContact C-N 3.27Å; H554-N556 PolarHBondContact ND1-N 3.47Å; H554-N556 VanDerWaalsContact ND1-N 3.19Å; H554-N556 PolarHBondContact O-N 3.18Å; H554-L557 HydrophobicContact CB-CB 4.39Å; H554-L557 WeakPolarHBondContact O-CB 3.46Å; H554-L557 PolarHBondContact O-N 2.89Å
555	R	87.4	Confident	88.3	Confident	244 Å²	244	69 Å²	69	92%	0.921	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-32.6	-173.3	-65	-176.8	-179.3	-170.9	-0	114.4
556	N	87.9	Confident	87.3	Confident	107 Å²	107	64.4 Å²	64.4	57%	0.572	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	11.5	179.3	-61.8	-12.8	0	0	0	113.1	L489 H554 K558 N632	L489-N556 HydrophobicContact CD2-CB 3.92Å; H554-N556 VanDerWaalsContact C-N 3.27Å; H554-N556 PolarHBondContact ND1-N 3.47Å; H554-N556 VanDerWaalsContact ND1-N 3.19Å; H554-N556 PolarHBondContact O-N 3.18Å; N556-K558 PolarHBondContact O-N 3.13Å; N556-N632 PolarHBondContact O-ND2 2.9Å
557	L	89.4	Confident	86.2	Confident	27 Å²	27	63.8 Å²	63.8	14%	0.141	32%	0.319	C	S	.	.			trans	-66.9	126.3	176.1	-173.6	67	0	0	0	109.6	L489 I493 L494 A553 H554 I559 N632 F633	L489-L557 HydrophobicContact CD1-CD1 4.16Å; I493-L557 HydrophobicContact CG2-CD1 3.72Å; L494-L557 HydrophobicContact CB-CD2 4.43Å; L494-L557 HydrophobicContact CD1-CD2 4.28Å; A553-L557 HydrophobicContact CB-CD2 4.2Å; H554-L557 HydrophobicContact CB-CB 4.39Å; H554-L557 WeakPolarHBondContact O-CB 3.46Å; H554-L557 PolarHBondContact O-N 2.89Å; L557-I559 HydrophobicContact CD2-CD1 3.88Å; L557-I559 HydrophobicContact CD2-CG1 3.95Å; L557-I559 HydrophobicContact CG-CD1 4.37Å; L557-I559 HydrophobicContact CG-CG1 3.89Å; L557-N632 WeakPolarHBondContact CD1-OD1 3.49Å; L557-F633 HydrophobicContact CD1-CB 3.75Å; L557-F633 HydrophobicContact CD1-CD2 4.37Å; L557-F633 HydrophobicContact CD1-CG 4.31Å
558	K	90.2	Very high	85.2	Confident	125 Å²	125	66.2 Å²	66.2	54%	0.543	33%	0.33	S	S	.	.			trans	-119.3	110.6	174	-70.5	-178.2	-179.3	177.5	0	107.5	N556 P631 N632 F633	N556-K558 PolarHBondContact O-N 3.13Å; K558-P631 HydrophobicContact CB-CB 4.21Å; K558-P631 WeakPolarHBondContact O-CA 3.35Å; K558-P631 WeakPolarHBondContact O-CB 3.25Å; K558-N632 PolarHBondContact N-OD1 3.29Å; K558-N632 PolarHBondContact O-N 3.44Å; K558-N632 PolarHBondContact O-OD1 2.72Å; K558-F633 PolarHBondContact O-N 3.48Å
559	I	91.1	Very high	84.4	Confident	51 Å²	51	69.7 Å²	69.7	26%	0.262	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125	-177.9	-56.5	177	0	0	0	109.3	M541 L557 F633 I635	M541-I559 HydrophobicContact CG-CG2 4.41Å; L557-I559 HydrophobicContact CD2-CD1 3.88Å; L557-I559 HydrophobicContact CD2-CG1 3.95Å; L557-I559 HydrophobicContact CG-CD1 4.37Å; L557-I559 HydrophobicContact CG-CG1 3.89Å; I559-F633 CarbonylContact C-O 3.58Å; I559-F633 VanDerWaalsContact CA-O 3.3Å; I559-F633 WeakPolarHBondContact CA-O 3.08Å; I559-I635 HydrophobicContact CD1-CD1 4.49Å; I559-I635 HydrophobicContact CG2-CB 4.37Å; I559-I635 HydrophobicContact CG2-CD1 3.7Å; I559-I635 HydrophobicContact CG2-CG1 3.81Å
560	G	91.5	Very high	84	Confident	5 Å²	5	68.6 Å²	68.6	5%	0.052	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.6	164.7	0	0	0	0	0	109.2	F633 Y634 I635	G560-F633 PolarHBondContact N-O 2.87Å; G560-Y634 CarbonylContact O-C 3.46Å; G560-Y634 WeakPolarHBondContact O-CA 3.45Å; G560-I635 PolarHBondContact O-N 3.07Å
561	Y	91.2	Very high	83.5	Confident	56 Å²	56	67.8 Å²	67.8	22%	0.22	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.4	179.9	179.1	-128.8	0	0	0	111.6	L537 M541 S563 I635 D637	L537-Y561 HydrophobicContact CD1-CE2 4.07Å; M541-Y561 HydrophobicContact CE-CD1 3.75Å; M541-Y561 HydrophobicContact CE-CD2 3.88Å; M541-Y561 HydrophobicContact CE-CE1 3.65Å; M541-Y561 HydrophobicContact CE-CE2 3.82Å; M541-Y561 HydrophobicContact CE-CG 3.87Å; M541-Y561 VanDerWaalsContact SD-CB 3.51Å; M541-Y561 HydrophobicContact SD-CD1 3.63Å; M541-Y561 HydrophobicContact SD-CD2 3.44Å; M541-Y561 WeakPolarHBondContact SD-CD2 3.24Å; M541-Y561 HydrophobicContact SD-CE1 4.16Å; M541-Y561 HydrophobicContact SD-CE2 4.02Å; M541-Y561 HydrophobicContact SD-CG 3.23Å; Y561-S563 VanDerWaalsContact CE1-CB 3.49Å; Y561-I635 WeakPolarHBondContact CA-O 3.34Å; Y561-I635 HydrophobicContact CD2-CB 4Å; Y561-I635 HydrophobicContact CD2-CG2 3.76Å; Y561-I635 HydrophobicContact CE2-CG2 4.03Å; Y561-D637 HydrophobicContact CE2-CB 4.11Å
562	F	89.5	Confident	83.2	Confident	7 Å²	7	68.4 Å²	68.4	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	111.6	169.1	-169.7	-88.2	0	0	0	108.4	A622 F623 M626 I635 L636 D637 P639	F562-A622 HydrophobicContact CD2-CB 4.45Å; F562-A622 HydrophobicContact CE2-CB 3.73Å; F562-F623 AromaticContact CD2-CD1 3.97Å; F562-F623 HydrophobicContact CD2-CD1 3.97Å; F562-F623 AromaticContact CD2-CE1 3.7Å; F562-F623 HydrophobicContact CD2-CE1 3.7Å; F562-F623 HydrophobicContact CD2-CZ 4.05Å; F562-F623 HydrophobicContact CE1-CZ 4.29Å; F562-F623 HydrophobicContact CE2-CD1 4.1Å; F562-F623 HydrophobicContact CE2-CD2 4.22Å; F562-F623 AromaticContact CE2-CE1 3.84Å; F562-F623 HydrophobicContact CE2-CE1 3.84Å; F562-F623 AromaticContact CE2-CE2 3.95Å; F562-F623 HydrophobicContact CE2-CE2 3.95Å; F562-F623 HydrophobicContact CE2-CG 4.26Å; F562-F623 AromaticContact CE2-CZ 3.75Å; F562-F623 HydrophobicContact CE2-CZ 3.75Å; F562-F623 HydrophobicContact CG-CE1 4.1Å; F562-F623 HydrophobicContact CG-CZ 4.42Å; F562-F623 HydrophobicContact CZ-CE1 4.38Å; F562-F623 HydrophobicContact CZ-CE2 4.08Å; F562-F623 AromaticContact CZ-CZ 3.89Å; F562-F623 HydrophobicContact CZ-CZ 3.89Å; F562-M626 HydrophobicContact CB-SD 3.8Å; F562-I635 PolarHBondContact N-O 2.76Å; F562-L636 HydrophobicContact CB-CD2 3.55Å; F562-L636 HydrophobicContact CG-CD2 4.43Å; F562-D637 WeakPolarHBondContact O-CB 3.31Å; F562-D637 PolarHBondContact O-N 3.29Å; F562-P639 HydrophobicContact CD1-CB 4.16Å; F562-P639 HydrophobicContact CE1-CB 4.29Å
563	S	83.1	Confident	82.9	Confident	8 Å²	8	71.5 Å²	71.5	6%	0.056	35%	0.349	C	S	.	.			trans	-92.3	156	178.9	59	0	0	0	0	112.2	Y561 H565 H566	Y561-S563 VanDerWaalsContact CE1-CB 3.49Å; S563-H565 VanDerWaalsContact C-N 3.28Å; S563-H565 PolarHBondContact O-N 2.88Å; S563-H566 WeakPolarHBondContact O-CB 3.35Å; S563-H566 PolarHBondContact O-N 2.98Å; S563-H566 WeakPolarHBondContact OG-CA 3.44Å; S563-H566 WeakPolarHBondContact OG-CB 3.49Å; S563-H566 PolarHBondContact OG-N 2.85Å
564	Q	75.2	Confident	82.8	Confident	76 Å²	76	70.6 Å²	70.6	36%	0.355	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-40.3	172.8	-169.8	176	13.3	0	0	113.1	H566 D637	Q564-H566 VanDerWaalsContact C-N 3.32Å; Q564-H566 PolarHBondContact O-N 2.85Å; Q564-D637 PolarHBondContact N-O 3.07Å
565	H	72.1	Confident	82.6	Confident	114 Å²	114	69.7 Å²	69.7	53%	0.528	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	20.9	177.5	-63.7	-67.3	0	0	0	113.9	S563 V567 D568 Q569	S563-H565 VanDerWaalsContact C-N 3.28Å; S563-H565 PolarHBondContact O-N 2.88Å; H565-V567 PolarHBondContact O-N 2.9Å; H565-D568 IonicContact CG-OD2 3.92Å; H565-D568 IonicContact ND1-OD2 3.18Å; H565-D568 PolarHBondContact ND1-OD2 2.76Å; H565-D568 PolarHBondContact O-N 2.99Å; H565-D568 VanDerWaalsContact O-N 3.14Å; H565-Q569 PolarHBondContact O-N 3.3Å
566	H	68	Low	82.7	Confident	13 Å²	13	58 Å²	58	6%	0.06	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-28.5	-174.5	-155.1	88.2	0	0	0	112.5	S563 Q564 D568 Q569 A622 Q625	S563-H566 WeakPolarHBondContact O-CB 3.35Å; S563-H566 PolarHBondContact O-N 2.98Å; S563-H566 WeakPolarHBondContact OG-CA 3.44Å; S563-H566 WeakPolarHBondContact OG-CB 3.49Å; S563-H566 PolarHBondContact OG-N 2.85Å; Q564-H566 VanDerWaalsContact C-N 3.32Å; Q564-H566 PolarHBondContact O-N 2.85Å; H566-D568 VanDerWaalsContact C-N 3.32Å; H566-Q569 PolarHBondContact O-N 3.24Å; H566-A622 WeakPolarHBondContact CD2-CB 3.47Å; H566-Q625 PolarHBondContact NE2-NE2 2.77Å
567	V	66.8	Low	82.8	Confident	22 Å²	22	53.4 Å²	53.4	13%	0.133	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-37.2	175.9	176.9	0	0	0	0	111.3	H565 Q569 L570 K618	H565-V567 PolarHBondContact O-N 2.9Å; V567-Q569 VanDerWaalsContact C-N 3.25Å; V567-Q569 PolarHBondContact O-N 3.34Å; V567-L570 PolarHBondContact O-N 3.18Å; V567-K618 HydrophobicContact CG1-CB 3.74Å; V567-K618 HydrophobicContact CG1-CD 3.52Å; V567-K618 HydrophobicContact CG1-CG 4.26Å; V567-K618 HydrophobicContact CG2-CB 4.26Å
568	D	67.5	Low	82.8	Confident	122 Å²	122	56.5 Å²	56.5	65%	0.652	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-20.8	179	-55.7	-34	0	0	0	112.2	H565 H566	H565-D568 IonicContact CG-OD2 3.92Å; H565-D568 IonicContact ND1-OD2 3.18Å; H565-D568 PolarHBondContact ND1-OD2 2.76Å; H565-D568 PolarHBondContact O-N 2.99Å; H565-D568 VanDerWaalsContact O-N 3.14Å; H566-D568 VanDerWaalsContact C-N 3.32Å
569	Q	73.8	Confident	82.7	Confident	134 Å²	134	51.1 Å²	51.1	63%	0.626	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-13.2	175.9	-65.3	175.4	9.8	0	0	113.4	H565 H566 V567	H565-Q569 PolarHBondContact O-N 3.3Å; H566-Q569 PolarHBondContact O-N 3.24Å; V567-Q569 VanDerWaalsContact C-N 3.25Å; V567-Q569 PolarHBondContact O-N 3.34Å
570	L	81.1	Confident	82.6	Confident	9 Å²	9	48.7 Å²	48.7	5%	0.047	25%	0.247	C	C	.	.	S	Bend	trans	-74.2	138	178.3	-65.5	172.7	0	0	0	110.1	V567 L572 L579 V610 K618 A622	V567-L570 PolarHBondContact O-N 3.18Å; L570-L572 PolarHBondContact O-N 3.16Å; L570-L572 VanDerWaalsContact O-N 3.07Å; L570-L579 HydrophobicContact CB-CD1 4.12Å; L570-L579 HydrophobicContact CD2-CD1 3.85Å; L570-L579 HydrophobicContact CD2-CD2 4.04Å; L570-V610 HydrophobicContact CB-CG1 4.28Å; L570-V610 HydrophobicContact CD1-CG1 4.25Å; L570-K618 HydrophobicContact CD1-CB 4.39Å; L570-A622 HydrophobicContact CD1-CB 4.42Å
571	D	81.4	Confident	82.6	Confident	85 Å²	85	52 Å²	52	46%	0.455	26%	0.263	S	S	.	.			trans	-69.1	108.6	170.5	-167.3	-17.3	0	0	0	109.5	N573 V574	D571-N573 VanDerWaalsContact C-N 3.29Å; D571-N573 PolarHBondContact O-N 2.87Å; D571-N573 PolarHBondContact OD1-N 3.19Å; D571-V574 HydrophobicContact CB-CB 4.49Å; D571-V574 HydrophobicContact CB-CG2 4.27Å; D571-V574 WeakPolarHBondContact OD2-CG2 3.33Å
572	L	84.8	Confident	82.5	Confident	66 Å²	66	54.8 Å²	54.8	35%	0.346	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-22.1	-173.1	-60.7	-178.7	0	0	0	112.7	L570 V574 V610 A611	L570-L572 PolarHBondContact O-N 3.16Å; L570-L572 VanDerWaalsContact O-N 3.07Å; L572-V574 VanDerWaalsContact C-N 3.33Å; L572-V610 HydrophobicContact CD2-CG1 4.04Å; L572-A611 HydrophobicContact CB-CB 3.99Å; L572-A611 WeakPolarHBondContact O-CB 3.32Å; L572-A611 PolarHBondContact O-N 2.81Å
573	N	86.1	Confident	82.4	Confident	143 Å²	143	59.6 Å²	59.6	77%	0.765	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-8.4	-173.8	-66.2	-38.2	0	0	0	113.5	D571	D571-N573 VanDerWaalsContact C-N 3.29Å; D571-N573 PolarHBondContact O-N 2.87Å; D571-N573 PolarHBondContact OD1-N 3.19Å
574	V	88.4	Confident	82.7	Confident	23 Å²	23	61.7 Å²	61.7	14%	0.139	31%	0.311	C	S	.	.	S	Bend	trans	-105.9	154.9	-172.4	179.2	0	0	0	0	110	D571 L572 E578 V610	D571-V574 HydrophobicContact CB-CB 4.49Å; D571-V574 HydrophobicContact CB-CG2 4.27Å; D571-V574 WeakPolarHBondContact OD2-CG2 3.33Å; L572-V574 VanDerWaalsContact C-N 3.33Å; V574-E578 HydrophobicContact CG1-CB 3.28Å; V574-E578 HydrophobicContact CG1-CG 4.4Å; V574-E578 WeakPolarHBondContact CG1-OE2 3.26Å; V574-V610 WeakPolarHBondContact O-CG2 3.4Å; V574-V610 PolarHBondContact O-N 3.42Å
575	C	88.6	Confident	83.3	Confident	26 Å²	26	63.1 Å²	63.1	18%	0.176	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-72.5	153.9	175.6	-57.4	0	0	0	0	111.4	V577 E578 L579 T607	C575-V577 VanDerWaalsContact C-N 3.26Å; C575-V577 PolarHBondContact O-N 3.07Å; C575-E578 HydrophobicContact CB-CB 4.27Å; C575-E578 HydrophobicContact CB-CG 4.08Å; C575-E578 WeakPolarHBondContact CB-OE2 3.36Å; C575-E578 PolarHBondContact N-OE2 3.04Å; C575-E578 PolarHBondContact O-N 3.17Å; C575-E578 VanDerWaalsContact O-N 3.13Å; C575-E578 PolarHBondContact SG-OE2 3.1Å; C575-L579 WeakPolarHBondContact O-CB 3.41Å; C575-L579 PolarHBondContact O-N 2.92Å; C575-T607 PolarHBondContact SG-O 3.34Å
576	A	88.6	Confident	83.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-59.1	-35.9	-178.5	0	0	0	0	0	113.4	L580 L596 A606 V610 V621	A576-L580 PolarHBondContact O-N 2.9Å; A576-L596 HydrophobicContact CB-CD1 4.06Å; A576-L596 HydrophobicContact CB-CD2 4.36Å; A576-A606 PolarHBondContact N-O 3.31Å; A576-V610 HydrophobicContact CB-CG2 4.35Å; A576-V621 HydrophobicContact CB-CG1 4.36Å; A576-V621 HydrophobicContact CB-CG2 4.04Å
577	V	89.9	Confident	84.9	Confident	9 Å²	9	66.1 Å²	66.1	6%	0.055	36%	0.358	C	S	.	.	H	α-helix	trans	-67.4	-47.3	175.2	175.5	0	0	0	0	111.4	C575 L579 L580 L581 E589 R593 L596 A606	C575-V577 VanDerWaalsContact C-N 3.26Å; C575-V577 PolarHBondContact O-N 3.07Å; V577-L579 PolarHBondContact O-N 2.86Å; V577-L580 PolarHBondContact O-N 2.9Å; V577-L581 PolarHBondContact O-N 3.23Å; V577-E589 HydrophobicContact CG1-CG 3.57Å; V577-R593 HydrophobicContact CG2-CG 3.86Å; V577-L596 HydrophobicContact CB-CD1 4.45Å; V577-L596 HydrophobicContact CG2-CD1 3.69Å; V577-A606 HydrophobicContact CG2-CB 3.97Å; V577-A606 PolarHBondContact N-O 2.85Å
578	E	89.6	Confident	86	Confident	92 Å²	92	68.5 Å²	68.5	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-33.6	178.7	-69.1	173.2	161.4	0	0	111.6	V574 C575 L580 L581 N582	V574-E578 HydrophobicContact CG1-CB 3.28Å; V574-E578 HydrophobicContact CG1-CG 4.4Å; V574-E578 WeakPolarHBondContact CG1-OE2 3.26Å; C575-E578 HydrophobicContact CB-CB 4.27Å; C575-E578 HydrophobicContact CB-CG 4.08Å; C575-E578 WeakPolarHBondContact CB-OE2 3.36Å; C575-E578 PolarHBondContact N-OE2 3.04Å; C575-E578 PolarHBondContact O-N 3.17Å; C575-E578 VanDerWaalsContact O-N 3.13Å; C575-E578 PolarHBondContact SG-OE2 3.1Å; E578-L580 PolarHBondContact O-N 3.31Å; E578-L581 WeakPolarHBondContact O-CB 3.43Å; E578-L581 PolarHBondContact O-N 3.17Å; E578-N582 WeakPolarHBondContact O-CB 3.41Å; E578-N582 PolarHBondContact O-N 3.25Å; E578-N582 PolarHBondContact O-ND2 3.48Å
579	L	89.1	Confident	87	Confident	13 Å²	13	67.5 Å²	67.5	7%	0.068	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-45.4	176	-160.5	162	0	0	0	111.1	L570 C575 V577 K583 V610	L570-L579 HydrophobicContact CB-CD1 4.12Å; L570-L579 HydrophobicContact CD2-CD1 3.85Å; L570-L579 HydrophobicContact CD2-CD2 4.04Å; C575-L579 WeakPolarHBondContact O-CB 3.41Å; C575-L579 PolarHBondContact O-N 2.92Å; V577-L579 PolarHBondContact O-N 2.86Å; L579-K583 PolarHBondContact O-N 3.13Å; L579-V610 HydrophobicContact CD1-CG2 3.85Å
580	L	89.3	Confident	87.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-68	-39	174.6	-65.2	-178.8	0	0	0	112.5	A576 V577 E578 K583 F584 Y592 L596 Q625	A576-L580 PolarHBondContact O-N 2.9Å; V577-L580 PolarHBondContact O-N 2.9Å; E578-L580 PolarHBondContact O-N 3.31Å; L580-K583 PolarHBondContact O-N 3.09Å; L580-F584 PolarHBondContact O-N 3.41Å; L580-Y592 HydrophobicContact CB-CD1 3.48Å; L580-Y592 VanDerWaalsContact CB-CD1 3.48Å; L580-Y592 HydrophobicContact CB-CE1 4.01Å; L580-Y592 HydrophobicContact CB-CG 4.13Å; L580-Y592 HydrophobicContact CD1-CD1 4.21Å; L580-Y592 HydrophobicContact CG-CD1 4.5Å; L580-L596 HydrophobicContact CD1-CD1 4.12Å; L580-L596 HydrophobicContact CD1-CD2 3.92Å; L580-L596 HydrophobicContact CD1-CG 3.7Å; L580-Q625 HydrophobicContact CD2-CB 3.8Å; L580-Q625 HydrophobicContact CD2-CG 4.19Å
581	L	90	Very high	88.1	Confident	75 Å²	75	72.6 Å²	72.6	39%	0.393	39%	0.387	S	S	.	.	H	α-helix	trans	-60.9	-47	177.5	-178.6	73.2	0	0	0	111.6	V577 E578 K583 F584 P585 Y592	V577-L581 PolarHBondContact O-N 3.23Å; E578-L581 WeakPolarHBondContact O-CB 3.43Å; E578-L581 PolarHBondContact O-N 3.17Å; L581-K583 VanDerWaalsContact C-N 3.34Å; L581-K583 PolarHBondContact O-N 3.35Å; L581-F584 CarbonylContact O-C 3.6Å; L581-P585 WeakPolarHBondContact O-CA 3.44Å; L581-Y592 HydrophobicContact CB-CE2 4.13Å; L581-Y592 HydrophobicContact CD1-CD2 4.34Å; L581-Y592 HydrophobicContact CD1-CE2 3.46Å; L581-Y592 VanDerWaalsContact CD1-CE2 3.46Å; L581-Y592 HydrophobicContact CG-CE2 4.42Å
582	N	89.6	Confident	88.5	Confident	113 Å²	113	68.6 Å²	68.6	60%	0.604	37%	0.366	S	S	*	.	H	α-helix	trans	-64.5	-38.5	-179.5	-72	-16.4	0	0	0	111.8	E578	E578-N582 WeakPolarHBondContact O-CB 3.41Å; E578-N582 PolarHBondContact O-N 3.25Å; E578-N582 PolarHBondContact O-ND2 3.48Å
583	K	87.5	Confident	88.7	Confident	109 Å²	109	71 Å²	71	47%	0.474	37%	0.371	S	S	.	.	H	α-helix	trans	-80.5	-34.4	-178.4	-162.3	172.2	-169.1	175.4	0	113.3	L579 L580 L581 Q625	L579-K583 PolarHBondContact O-N 3.13Å; L580-K583 PolarHBondContact O-N 3.09Å; L581-K583 VanDerWaalsContact C-N 3.34Å; L581-K583 PolarHBondContact O-N 3.35Å; K583-Q625 VanDerWaalsContact CD-CD 3.45Å; K583-Q625 HydrophobicContact CD-CG 3.74Å; K583-Q625 VanDerWaalsContact NZ-CD 3.32Å
584	F	89.3	Confident	88.9	Confident	52 Å²	52	70.7 Å²	70.7	23%	0.228	36%	0.364	C	S	.	.	S	Bend	trans	-130.6	68.2	-175.6	-56.7	-71.8	0	0	0	111.2	L580 L581 Y592 Q625 M628 P629	L580-F584 PolarHBondContact O-N 3.41Å; L581-F584 CarbonylContact O-C 3.6Å; F584-Y592 PolarHBondContact O-OH 2.93Å; F584-Q625 HydrophobicContact CE2-CG 3.99Å; F584-Q625 WeakPolarHBondContact CE2-O 3.36Å; F584-M628 HydrophobicContact CB-CG 4.46Å; F584-M628 HydrophobicContact CD2-CB 4.01Å; F584-M628 HydrophobicContact CD2-CG 3.65Å; F584-M628 HydrophobicContact CE2-CB 3.75Å; F584-M628 HydrophobicContact CE2-CG 3.94Å; F584-M628 HydrophobicContact CG-CG 4.02Å; F584-M628 HydrophobicContact CZ-CB 4.21Å; F584-P629 HydrophobicContact CE1-CB 4.49Å; F584-P629 HydrophobicContact CE1-CG 4.43Å; F584-P629 HydrophobicContact CZ-CG 4.39Å
585	P	87.6	Confident	88.9	Confident	105 Å²	105	71.5 Å²	71.5	68%	0.682	37%	0.366	S	S	*	.			trans	-64	150.4	-176.5	27.5	-35.4	0	0	0	111.9	L581	L581-P585 WeakPolarHBondContact O-CA 3.44Å
586	G	85.8	Confident	89	Confident	80 Å²	80	70.3 Å²	70.3	83%	0.825	36%	0.358	S	S	*	.	S	Bend	trans	108.8	7.3	172.9	0	0	0	0	0	116.1
587	R	88.8	Confident	89	Confident	111 Å²	111	71.5 Å²	71.5	42%	0.419	37%	0.371	S	S	.	.	S	Bend	trans	-111.8	164.7	170.7	-62	-168.1	-164.5	177.5	5.9	111.6	E591 Y592 M628	R587-E591 HydrophobicContact CB-CB 4.44Å; R587-E591 VanDerWaalsContact CB-OE2 3.31Å; R587-E591 WeakPolarHBondContact CB-OE2 3.47Å; R587-E591 VanDerWaalsContact CD-OE2 3.28Å; R587-E591 WeakPolarHBondContact CD-OE2 3.47Å; R587-E591 WeakPolarHBondContact CG-OE2 3.36Å; R587-Y592 HydrophobicContact CB-CE1 4.14Å; R587-Y592 HydrophobicContact CB-CE2 4.01Å; R587-Y592 PolarHBondContact N-OH 3.02Å; R587-Y592 WeakPolarHBondContact O-CE2 3.25Å; R587-M628 PolarHBondContact NH1-SD 2.84Å; R587-M628 PolarHBondContact NH2-O 3.36Å
588	T	89.6	Confident	88.8	Confident	71 Å²	71	71.5 Å²	71.5	44%	0.436	37%	0.372	S	S	.	.			trans	-77.9	155.1	179	62.4	0	0	0	0	111.5	E590 E591 Y592	T588-E590 PolarHBondContact O-N 3.4Å; T588-E591 WeakPolarHBondContact O-CB 3.36Å; T588-E591 PolarHBondContact O-N 3.42Å; T588-E591 VanDerWaalsContact O-N 3.14Å; T588-E591 VanDerWaalsContact OG1-CG 3.32Å; T588-E591 WeakPolarHBondContact OG1-CG 3.24Å; T588-E591 PolarHBondContact OG1-N 2.9Å; T588-E591 PolarHBondContact OG1-OE1 2.99Å; T588-Y592 WeakPolarHBondContact O-CD2 3.29Å; T588-Y592 PolarHBondContact O-N 2.78Å
589	E	87.7	Confident	88.7	Confident	102 Å²	102	67.2 Å²	67.2	48%	0.477	35%	0.352	S	S	.	.	H	α-helix	trans	-59.1	-36.4	177.3	-157.3	-169.9	155.6	0	0	112.4	V577 E591 Y592 R593	V577-E589 HydrophobicContact CG1-CG 3.57Å; E589-E591 VanDerWaalsContact C-N 3.31Å; E589-E591 PolarHBondContact O-N 3.48Å; E589-Y592 PolarHBondContact O-N 3.21Å; E589-R593 WeakPolarHBondContact O-CG 3.39Å; E589-R593 PolarHBondContact O-N 3.29Å; E589-R593 IonicContact OE1-CZ 2.65Å; E589-R593 IonicContact OE1-NE 2.93Å; E589-R593 PolarHBondContact OE1-NE 2.99Å; E589-R593 IonicContact OE1-NH2 3.34Å; E589-R593 PolarHBondContact OE1-NH2 2.91Å; E589-R593 IonicContact OE2-NH2 3.13Å
590	E	88.7	Confident	88.5	Confident	157 Å²	157	68 Å²	68	73%	0.734	36%	0.363	S	S	*	.	H	α-helix	trans	-61.1	-39.1	176.9	-64.4	-177.7	175.2	0	0	112.1	T588 R593 H594	T588-E590 PolarHBondContact O-N 3.4Å; E590-R593 PolarHBondContact O-N 3.43Å; E590-H594 VanDerWaalsContact O-CB 3.32Å; E590-H594 WeakPolarHBondContact O-CB 3.42Å; E590-H594 PolarHBondContact O-N 3.49Å
591	E	89.3	Confident	88.3	Confident	93 Å²	93	68.2 Å²	68.2	44%	0.435	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-41.2	176.3	-75.4	170.6	-146.3	0	0	112.1	R587 T588 E589 H594 Q595	R587-E591 HydrophobicContact CB-CB 4.44Å; R587-E591 VanDerWaalsContact CB-OE2 3.31Å; R587-E591 WeakPolarHBondContact CB-OE2 3.47Å; R587-E591 VanDerWaalsContact CD-OE2 3.28Å; R587-E591 WeakPolarHBondContact CD-OE2 3.47Å; R587-E591 WeakPolarHBondContact CG-OE2 3.36Å; T588-E591 WeakPolarHBondContact O-CB 3.36Å; T588-E591 PolarHBondContact O-N 3.42Å; T588-E591 VanDerWaalsContact O-N 3.14Å; T588-E591 VanDerWaalsContact OG1-CG 3.32Å; T588-E591 WeakPolarHBondContact OG1-CG 3.24Å; T588-E591 PolarHBondContact OG1-N 2.9Å; T588-E591 PolarHBondContact OG1-OE1 2.99Å; E589-E591 VanDerWaalsContact C-N 3.31Å; E589-E591 PolarHBondContact O-N 3.48Å; E591-H594 PolarHBondContact O-N 2.94Å; E591-Q595 WeakPolarHBondContact O-CB 3.18Å; E591-Q595 PolarHBondContact O-N 3.1Å
592	Y	90.6	Very high	88	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-66.1	-40.6	175.1	-60.4	-64.5	0	0	0	111.7	L580 L581 F584 R587 T588 E589 H594 Q595 L596 M628	L580-Y592 HydrophobicContact CB-CD1 3.48Å; L580-Y592 VanDerWaalsContact CB-CD1 3.48Å; L580-Y592 HydrophobicContact CB-CE1 4.01Å; L580-Y592 HydrophobicContact CB-CG 4.13Å; L580-Y592 HydrophobicContact CD1-CD1 4.21Å; L580-Y592 HydrophobicContact CG-CD1 4.5Å; L581-Y592 HydrophobicContact CB-CE2 4.13Å; L581-Y592 HydrophobicContact CD1-CD2 4.34Å; L581-Y592 HydrophobicContact CD1-CE2 3.46Å; L581-Y592 VanDerWaalsContact CD1-CE2 3.46Å; L581-Y592 HydrophobicContact CG-CE2 4.42Å; F584-Y592 PolarHBondContact O-OH 2.93Å; R587-Y592 HydrophobicContact CB-CE1 4.14Å; R587-Y592 HydrophobicContact CB-CE2 4.01Å; R587-Y592 PolarHBondContact N-OH 3.02Å; R587-Y592 WeakPolarHBondContact O-CE2 3.25Å; T588-Y592 WeakPolarHBondContact O-CD2 3.29Å; T588-Y592 PolarHBondContact O-N 2.78Å; E589-Y592 PolarHBondContact O-N 3.21Å; Y592-H594 VanDerWaalsContact C-N 3.33Å; Y592-Q595 PolarHBondContact O-N 2.86Å; Y592-L596 WeakPolarHBondContact O-CB 3.27Å; Y592-L596 WeakPolarHBondContact O-CG 3.44Å; Y592-L596 PolarHBondContact O-N 3.33Å; Y592-M628 HydrophobicContact CD1-CE 3.52Å; Y592-M628 HydrophobicContact CE1-CE 3.48Å; Y592-M628 VanDerWaalsContact CE1-CE 3.48Å
593	R	89.8	Confident	87.7	Confident	118 Å²	118	66.5 Å²	66.5	45%	0.445	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-39.3	174.2	-71.9	177.6	-178.6	-171.2	-0.1	111.5	V577 E589 E590 G597	V577-R593 HydrophobicContact CG2-CG 3.86Å; E589-R593 WeakPolarHBondContact O-CG 3.39Å; E589-R593 PolarHBondContact O-N 3.29Å; E589-R593 IonicContact OE1-CZ 2.65Å; E589-R593 IonicContact OE1-NE 2.93Å; E589-R593 PolarHBondContact OE1-NE 2.99Å; E589-R593 IonicContact OE1-NH2 3.34Å; E589-R593 PolarHBondContact OE1-NH2 2.91Å; E589-R593 IonicContact OE2-NH2 3.13Å; E590-R593 PolarHBondContact O-N 3.43Å; R593-G597 PolarHBondContact O-N 2.92Å
594	H	89.5	Confident	87.3	Confident	136 Å²	136	69 Å²	69	63%	0.63	39%	0.387	S	S	*	.	H	α-helix	trans	-65	-43.5	175.3	-171.2	78.7	0	0	0	111.6	E590 E591 Y592 G597 G598	E590-H594 VanDerWaalsContact O-CB 3.32Å; E590-H594 WeakPolarHBondContact O-CB 3.42Å; E590-H594 PolarHBondContact O-N 3.49Å; E591-H594 PolarHBondContact O-N 2.94Å; Y592-H594 VanDerWaalsContact C-N 3.33Å; H594-G597 PolarHBondContact O-N 3.45Å; H594-G598 PolarHBondContact O-N 2.87Å
595	Q	88.8	Confident	87	Confident	40 Å²	40	69.1 Å²	69.1	19%	0.187	39%	0.39	C	S	.	.	H	α-helix	trans	-58.1	-53.9	175	-175.8	70.2	1	0	0	110.2	E591 Y592 G597 G598 Y599 A624 T627 M628	E591-Q595 WeakPolarHBondContact O-CB 3.18Å; E591-Q595 PolarHBondContact O-N 3.1Å; Y592-Q595 PolarHBondContact O-N 2.86Å; Q595-G597 VanDerWaalsContact C-N 3.3Å; Q595-G597 PolarHBondContact O-N 3.32Å; Q595-G598 WeakPolarHBondContact O-CA 3.32Å; Q595-G598 PolarHBondContact O-N 3.03Å; Q595-Y599 HydrophobicContact CG-CE2 4.43Å; Q595-Y599 WeakPolarHBondContact O-CD2 3.37Å; Q595-A624 HydrophobicContact CG-CB 4.5Å; Q595-A624 PolarHBondContact NE2-O 3.46Å; Q595-T627 PolarHBondContact NE2-OG1 3.22Å; Q595-M628 HydrophobicContact CB-SD 4.37Å; Q595-M628 HydrophobicContact CG-SD 3.82Å
596	L	89.9	Confident	86.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-58.3	-39.5	177.1	-72.6	168.7	0	0	0	112.7	A576 V577 L580 Y592 G598 Y599 G600 I601 A606 A624	A576-L596 HydrophobicContact CB-CD1 4.06Å; A576-L596 HydrophobicContact CB-CD2 4.36Å; V577-L596 HydrophobicContact CB-CD1 4.45Å; V577-L596 HydrophobicContact CG2-CD1 3.69Å; L580-L596 HydrophobicContact CD1-CD1 4.12Å; L580-L596 HydrophobicContact CD1-CD2 3.92Å; L580-L596 HydrophobicContact CD1-CG 3.7Å; Y592-L596 WeakPolarHBondContact O-CB 3.27Å; Y592-L596 WeakPolarHBondContact O-CG 3.44Å; Y592-L596 PolarHBondContact O-N 3.33Å; L596-G598 PolarHBondContact O-N 3.05Å; L596-Y599 CarbonylContact O-C 3.6Å; L596-Y599 PolarHBondContact O-N 3.11Å; L596-G600 PolarHBondContact O-N 3.12Å; L596-I601 CarbonylContact C-O 3.59Å; L596-I601 VanDerWaalsContact C-O 3.26Å; L596-I601 HydrophobicContact CB-CB 4.18Å; L596-I601 HydrophobicContact CB-CG2 4.36Å; L596-I601 HydrophobicContact CD2-CD1 4.09Å; L596-I601 PolarHBondContact O-N 3.25Å; L596-I601 VanDerWaalsContact O-N 3.07Å; L596-A606 HydrophobicContact CD1-CB 4.27Å; L596-A624 HydrophobicContact CD2-CB 3.89Å
597	G	88.1	Confident	86.8	Confident	26 Å²	26	63.9 Å²	63.9	27%	0.268	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-33.5	175.1	0	0	0	0	0	112.9	R593 H594 Q595 Y599 G600 I601	R593-G597 PolarHBondContact O-N 2.92Å; H594-G597 PolarHBondContact O-N 3.45Å; Q595-G597 VanDerWaalsContact C-N 3.3Å; Q595-G597 PolarHBondContact O-N 3.32Å; G597-Y599 PolarHBondContact O-N 3Å; G597-G600 PolarHBondContact O-N 3.49Å; G597-I601 WeakPolarHBondContact CA-O 3.24Å; G597-I601 PolarHBondContact N-O 3.27Å
598	G	86.3	Confident	86.6	Confident	8 Å²	8	64.4 Å²	64.4	8%	0.082	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.6	172.9	0	0	0	0	0	115.3	H594 Q595 L596	H594-G598 PolarHBondContact O-N 2.87Å; Q595-G598 WeakPolarHBondContact O-CA 3.32Å; Q595-G598 PolarHBondContact O-N 3.03Å; L596-G598 PolarHBondContact O-N 3.05Å
599	Y	87.8	Confident	86.5	Confident	3 Å²	3	63.8 Å²	63.8	1%	0.012	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116	14.4	173.7	-59.6	-94.9	0	0	0	112	L480 K481 Q595 L596 G597 R620 F623 A624 T627	L480-Y599 HydrophobicContact CD2-CD1 3.47Å; L480-Y599 VanDerWaalsContact CD2-CD1 3.47Å; L480-Y599 HydrophobicContact CD2-CE1 4.3Å; L480-Y599 HydrophobicContact CD2-CG 4.22Å; K481-Y599 WeakPolarHBondContact O-CE1 3.38Å; K481-Y599 PolarHBondContact O-OH 3.34Å; Q595-Y599 HydrophobicContact CG-CE2 4.43Å; Q595-Y599 WeakPolarHBondContact O-CD2 3.37Å; L596-Y599 CarbonylContact O-C 3.6Å; L596-Y599 PolarHBondContact O-N 3.11Å; G597-Y599 PolarHBondContact O-N 3Å; Y599-R620 WeakPolarHBondContact O-CD 3.45Å; Y599-F623 HydrophobicContact CD1-CB 3.6Å; Y599-F623 HydrophobicContact CE1-CB 3.8Å; Y599-A624 HydrophobicContact CD2-CB 3.36Å; Y599-A624 VanDerWaalsContact CE2-CA 3.5Å; Y599-A624 HydrophobicContact CE2-CB 3.81Å; Y599-A624 HydrophobicContact CG-CB 3.84Å; Y599-T627 HydrophobicContact CE1-CG2 4.25Å; Y599-T627 VanDerWaalsContact CZ-OG1 3.22Å; Y599-T627 WeakPolarHBondContact OH-CB 3.34Å; Y599-T627 WeakPolarHBondContact OH-CG2 3.18Å; Y599-T627 PolarHBondContact OH-OG1 2.87Å
600	G	84.3	Confident	86.4	Confident	28 Å²	28	58.9 Å²	58.9	29%	0.289	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	19.9	176.9	0	0	0	0	0	115.1	L596 G597	L596-G600 PolarHBondContact O-N 3.12Å; G597-G600 PolarHBondContact O-N 3.49Å
601	I	86.1	Confident	86.1	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	30%	0.302	C	S	.	.			trans	-103.8	100.3	171.7	-61.6	159.9	0	0	0	107.6	L596 G597 L605 A606 R620 V621	L596-I601 CarbonylContact C-O 3.59Å; L596-I601 VanDerWaalsContact C-O 3.26Å; L596-I601 HydrophobicContact CB-CB 4.18Å; L596-I601 HydrophobicContact CB-CG2 4.36Å; L596-I601 HydrophobicContact CD2-CD1 4.09Å; L596-I601 PolarHBondContact O-N 3.25Å; L596-I601 VanDerWaalsContact O-N 3.07Å; G597-I601 WeakPolarHBondContact CA-O 3.24Å; G597-I601 PolarHBondContact N-O 3.27Å; I601-L605 HydrophobicContact CG2-CB 4.17Å; I601-A606 HydrophobicContact CG2-CB 4.13Å; I601-R620 HydrophobicContact CD1-CB 3.82Å; I601-R620 HydrophobicContact CG1-CB 4.25Å; I601-V621 HydrophobicContact CD1-CB 4.12Å; I601-V621 HydrophobicContact CD1-CG2 3.35Å
602	T	83.8	Confident	85.8	Confident	89 Å²	89	52 Å²	52	55%	0.546	30%	0.299	S	S	.	.			trans	-127.1	159.1	-173.8	56.8	0	0	0	0	112	E604 L605	T602-E604 PolarHBondContact O-N 3.41Å; T602-L605 PolarHBondContact O-N 3.34Å
603	G	82.3	Confident	85.4	Confident	63 Å²	63	52.4 Å²	52.4	65%	0.649	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	-132.9	174.5	0	0	0	0	0	113	L605 A606	G603-L605 PolarHBondContact O-N 3.06Å; G603-A606 PolarHBondContact O-N 2.9Å
604	E	80.5	Confident	84.9	Confident	161 Å²	161	48.3 Å²	48.3	75%	0.752	29%	0.291	S	S	*	.	H	α-helix	trans	-61.7	-24.9	-178	-66.4	-179.3	178.8	0	0	113.6	T602 A606 T607 R608	T602-E604 PolarHBondContact O-N 3.41Å; E604-A606 PolarHBondContact O-N 2.97Å; E604-T607 PolarHBondContact O-N 3.34Å; E604-T607 PolarHBondContact O-OG1 2.84Å; E604-R608 WeakPolarHBondContact O-CG 3.37Å; E604-R608 PolarHBondContact O-N 3.23Å
605	L	82.2	Confident	84.4	Confident	56 Å²	56	43.2 Å²	43.2	29%	0.293	28%	0.275	S	S	.	.	H	α-helix	trans	-65	-29.9	178.6	-68.8	172.7	0	0	0	112.3	I601 T602 G603 T607 L613	I601-L605 HydrophobicContact CG2-CB 4.17Å; T602-L605 PolarHBondContact O-N 3.34Å; G603-L605 PolarHBondContact O-N 3.06Å; L605-T607 VanDerWaalsContact C-N 3.34Å; L605-L613 HydrophobicContact CD2-CD2 4.32Å
606	A	84.4	Confident	84	Confident	5 Å²	5	41.5 Å²	41.5	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-74.2	-27.5	179.4	0	0	0	0	0	112.5	A576 V577 L596 I601 G603 E604	A576-A606 PolarHBondContact N-O 3.31Å; V577-A606 HydrophobicContact CG2-CB 3.97Å; V577-A606 PolarHBondContact N-O 2.85Å; L596-A606 HydrophobicContact CD1-CB 4.27Å; I601-A606 HydrophobicContact CG2-CB 4.13Å; G603-A606 PolarHBondContact O-N 2.9Å; E604-A606 PolarHBondContact O-N 2.97Å
607	T	85	Confident	83.7	Confident	70 Å²	70	43.9 Å²	43.9	43%	0.429	28%	0.279	S	S	.	.	H	α-helix	trans	-94.6	-2.6	-179	54.1	0	0	0	0	113.1	C575 E604 L605	C575-T607 PolarHBondContact SG-O 3.34Å; E604-T607 PolarHBondContact O-N 3.34Å; E604-T607 PolarHBondContact O-OG1 2.84Å; L605-T607 VanDerWaalsContact C-N 3.34Å
608	R	85.1	Confident	83.7	Confident	121 Å²	121	44.3 Å²	44.3	46%	0.457	27%	0.273	S	S	.	.	S	Bend	trans	-82	149.4	175.8	-79.3	177	74.7	151.6	10.4	111.1	E604 S612	E604-R608 WeakPolarHBondContact O-CG 3.37Å; E604-R608 PolarHBondContact O-N 3.23Å; R608-S612 PolarHBondContact NE-OG 3.23Å
609	P	86.3	Confident	83.8	Confident	58 Å²	58	44 Å²	44	38%	0.377	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-58.7	139.2	170.2	-22.6	32.9	0	0	0	111.1	A611 S612	P609-A611 PolarHBondContact O-N 3.01Å; P609-S612 PolarHBondContact O-N 3.48Å; P609-S612 PolarHBondContact O-OG 3.4Å
610	V	85.7	Confident	83.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-59.9	-32	-178.3	174	0	0	0	0	111.6	L570 L572 V574 A576 L579 S612 L613 K618	L570-V610 HydrophobicContact CB-CG1 4.28Å; L570-V610 HydrophobicContact CD1-CG1 4.25Å; L572-V610 HydrophobicContact CD2-CG1 4.04Å; V574-V610 WeakPolarHBondContact O-CG2 3.4Å; V574-V610 PolarHBondContact O-N 3.42Å; A576-V610 HydrophobicContact CB-CG2 4.35Å; L579-V610 HydrophobicContact CD1-CG2 3.85Å; V610-S612 PolarHBondContact O-N 3.44Å; V610-S612 VanDerWaalsContact O-N 3.17Å; V610-L613 HydrophobicContact CG2-CD1 4.4Å; V610-L613 WeakPolarHBondContact O-CB 3.32Å; V610-L613 PolarHBondContact O-N 2.94Å; V610-L613 VanDerWaalsContact O-N 3.1Å; V610-K618 HydrophobicContact CG1-CG 4.12Å; V610-K618 WeakPolarHBondContact O-CE 3.38Å
611	A	83.5	Confident	84	Confident	51 Å²	51	43.6 Å²	43.6	42%	0.421	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-51.2	-38.6	173.5	0	0	0	0	0	113.2	L572 P609 L613	L572-A611 HydrophobicContact CB-CB 3.99Å; L572-A611 WeakPolarHBondContact O-CB 3.32Å; L572-A611 PolarHBondContact O-N 2.81Å; P609-A611 PolarHBondContact O-N 3.01Å; A611-L613 VanDerWaalsContact C-N 3.33Å
612	S	82.8	Confident	84.2	Confident	54 Å²	54	43.3 Å²	43.3	38%	0.378	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-81.4	-10.5	-175.2	75.3	0	0	0	0	114.3	R608 P609 V610	R608-S612 PolarHBondContact NE-OG 3.23Å; P609-S612 PolarHBondContact O-N 3.48Å; P609-S612 PolarHBondContact O-OG 3.4Å; V610-S612 PolarHBondContact O-N 3.44Å; V610-S612 VanDerWaalsContact O-N 3.17Å
613	L	81.9	Confident	84.5	Confident	9 Å²	9	39.1 Å²	39.1	5%	0.047	23%	0.233	C	C	.	.	S	Bend	trans	-75.9	149.5	179.6	-61.8	179.7	0	0	0	110.8	L605 V610 A611 Q617 K618 V621	L605-L613 HydrophobicContact CD2-CD2 4.32Å; V610-L613 HydrophobicContact CG2-CD1 4.4Å; V610-L613 WeakPolarHBondContact O-CB 3.32Å; V610-L613 PolarHBondContact O-N 2.94Å; V610-L613 VanDerWaalsContact O-N 3.1Å; A611-L613 VanDerWaalsContact C-N 3.33Å; L613-Q617 HydrophobicContact CB-CB 3.86Å; L613-Q617 HydrophobicContact CD2-CB 4.42Å; L613-K618 HydrophobicContact CB-CG 3.88Å; L613-K618 WeakPolarHBondContact O-CE 3.37Å; L613-V621 HydrophobicContact CD1-CG2 3.78Å
614	S	78.6	Confident	84.9	Confident	31 Å²	31	36.1 Å²	36.1	22%	0.217	20%	0.202	C	C	.	.			trans	-67.6	159.6	171.3	73	0	0	0	0	111.1	G616 Q617 K618	S614-G616 VanDerWaalsContact C-N 3.3Å; S614-G616 PolarHBondContact O-N 2.85Å; S614-Q617 WeakPolarHBondContact O-CA 3.44Å; S614-Q617 WeakPolarHBondContact O-CB 3.43Å; S614-Q617 PolarHBondContact O-N 3.11Å; S614-Q617 VanDerWaalsContact OG-CG 3.32Å; S614-Q617 WeakPolarHBondContact OG-CG 3.23Å; S614-Q617 PolarHBondContact OG-N 3.43Å; S614-K618 WeakPolarHBondContact O-CG 3.25Å; S614-K618 PolarHBondContact O-N 3.48Å
615	G	78.6	Confident	85.4	Confident	30 Å²	30	29 Å²	29	31%	0.309	17%	0.169	S	C	.	.	H	α-helix	trans	-50.4	-47.8	177.5	0	0	0	0	0	113	Q617 K618 S619	G615-Q617 VanDerWaalsContact C-N 3.34Å; G615-Q617 PolarHBondContact O-N 2.94Å; G615-K618 WeakPolarHBondContact O-CB 3.32Å; G615-K618 PolarHBondContact O-N 2.99Å; G615-S619 PolarHBondContact O-N 3.02Å; G615-S619 PolarHBondContact O-OG 3.11Å
616	G	80.5	Confident	85.8	Confident	3 Å²	3	26.9 Å²	26.9	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-65.1	-32.7	176.6	0	0	0	0	0	114.4	S614 R620 H642	S614-G616 VanDerWaalsContact C-N 3.3Å; S614-G616 PolarHBondContact O-N 2.85Å; G616-R620 WeakPolarHBondContact O-CG 3.3Å; G616-R620 PolarHBondContact O-N 3.36Å; G616-R620 VanDerWaalsContact O-N 3.12Å; G616-H642 WeakPolarHBondContact CA-O 3.14Å; G616-H642 PolarHBondContact N-O 3.33Å
617	Q	84.9	Confident	86.1	Confident	50 Å²	50	26.7 Å²	26.7	23%	0.234	16%	0.155	C	C	.	.	H	α-helix	trans	-68.9	-41.3	172.5	-72.7	170.6	-13.6	0	0	111.3	L613 S614 G615 S619 R620 V621	L613-Q617 HydrophobicContact CB-CB 3.86Å; L613-Q617 HydrophobicContact CD2-CB 4.42Å; S614-Q617 WeakPolarHBondContact O-CA 3.44Å; S614-Q617 WeakPolarHBondContact O-CB 3.43Å; S614-Q617 PolarHBondContact O-N 3.11Å; S614-Q617 VanDerWaalsContact OG-CG 3.32Å; S614-Q617 WeakPolarHBondContact OG-CG 3.23Å; S614-Q617 PolarHBondContact OG-N 3.43Å; G615-Q617 VanDerWaalsContact C-N 3.34Å; G615-Q617 PolarHBondContact O-N 2.94Å; Q617-S619 VanDerWaalsContact C-N 3.35Å; Q617-S619 PolarHBondContact O-N 3.27Å; Q617-R620 WeakPolarHBondContact O-CB 3.34Å; Q617-R620 PolarHBondContact O-N 3.45Å; Q617-R620 VanDerWaalsContact O-N 3.17Å; Q617-V621 PolarHBondContact O-N 2.91Å
618	K	87.3	Confident	86.2	Confident	35 Å²	35	23.4 Å²	23.4	15%	0.152	14%	0.135	C	C	.	.	H	α-helix	trans	-60.8	-43.2	173.8	-65	178.1	179.9	173.4	0	111.3	V567 L570 V610 L613 S614 G615 R620 V621 A622	V567-K618 HydrophobicContact CG1-CB 3.74Å; V567-K618 HydrophobicContact CG1-CD 3.52Å; V567-K618 HydrophobicContact CG1-CG 4.26Å; V567-K618 HydrophobicContact CG2-CB 4.26Å; L570-K618 HydrophobicContact CD1-CB 4.39Å; V610-K618 HydrophobicContact CG1-CG 4.12Å; V610-K618 WeakPolarHBondContact O-CE 3.38Å; L613-K618 HydrophobicContact CB-CG 3.88Å; L613-K618 WeakPolarHBondContact O-CE 3.37Å; S614-K618 WeakPolarHBondContact O-CG 3.25Å; S614-K618 PolarHBondContact O-N 3.48Å; G615-K618 WeakPolarHBondContact O-CB 3.32Å; G615-K618 PolarHBondContact O-N 2.99Å; K618-R620 VanDerWaalsContact C-N 3.29Å; K618-R620 PolarHBondContact O-N 3.21Å; K618-V621 WeakPolarHBondContact O-CB 3.36Å; K618-V621 PolarHBondContact O-N 3.29Å; K618-V621 VanDerWaalsContact O-N 3.13Å; K618-A622 PolarHBondContact O-N 2.91Å
619	S	88.2	Confident	86.3	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.014	13%	0.132	C	C	.	.	H	α-helix	trans	-60.1	-37.5	174.5	-60	0	0	0	0	112.2	G615 Q617 A622 F623	G615-S619 PolarHBondContact O-N 3.02Å; G615-S619 PolarHBondContact O-OG 3.11Å; Q617-S619 VanDerWaalsContact C-N 3.35Å; Q617-S619 PolarHBondContact O-N 3.27Å; S619-A622 WeakPolarHBondContact O-CB 3.44Å; S619-A622 PolarHBondContact O-N 2.88Å; S619-F623 WeakPolarHBondContact O-CD2 3.46Å; S619-F623 PolarHBondContact O-N 3.43Å
620	R	87.9	Confident	86.4	Confident	22 Å²	22	19.9 Å²	19.9	8%	0.083	13%	0.128	C	C	.	.	H	α-helix	trans	-66.9	-38	174.2	-69.2	171.4	-169.6	179.1	12	112.9	Y599 I601 G616 Q617 K618 A622 F623 A624 D644 T647	Y599-R620 WeakPolarHBondContact O-CD 3.45Å; I601-R620 HydrophobicContact CD1-CB 3.82Å; I601-R620 HydrophobicContact CG1-CB 4.25Å; G616-R620 WeakPolarHBondContact O-CG 3.3Å; G616-R620 PolarHBondContact O-N 3.36Å; G616-R620 VanDerWaalsContact O-N 3.12Å; Q617-R620 WeakPolarHBondContact O-CB 3.34Å; Q617-R620 PolarHBondContact O-N 3.45Å; Q617-R620 VanDerWaalsContact O-N 3.17Å; K618-R620 VanDerWaalsContact C-N 3.29Å; K618-R620 PolarHBondContact O-N 3.21Å; R620-A622 VanDerWaalsContact C-N 3.3Å; R620-F623 PolarHBondContact O-N 2.73Å; R620-A624 PolarHBondContact O-N 2.95Å; R620-D644 IonicContact NH2-OD2 2.91Å; R620-T647 HydrophobicContact CG-CG2 4.36Å; R620-T647 PolarHBondContact NH2-OG1 3.33Å
621	V	89.6	Confident	86.7	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-44.1	171.7	178	0	0	0	0	109.6	A576 I601 L613 Q617 K618 F623 A624 Q625	A576-V621 HydrophobicContact CB-CG1 4.36Å; A576-V621 HydrophobicContact CB-CG2 4.04Å; I601-V621 HydrophobicContact CD1-CB 4.12Å; I601-V621 HydrophobicContact CD1-CG2 3.35Å; L613-V621 HydrophobicContact CD1-CG2 3.78Å; Q617-V621 PolarHBondContact O-N 2.91Å; K618-V621 WeakPolarHBondContact O-CB 3.36Å; K618-V621 PolarHBondContact O-N 3.29Å; K618-V621 VanDerWaalsContact O-N 3.13Å; V621-F623 PolarHBondContact O-N 2.9Å; V621-A624 WeakPolarHBondContact O-CB 3.33Å; V621-A624 PolarHBondContact O-N 3.12Å; V621-Q625 PolarHBondContact O-N 3.03Å
622	A	89.7	Confident	87.1	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.4	-44.3	177.1	0	0	0	0	0	112.5	F562 H566 L570 K618 S619 R620 A624 Q625 M626	F562-A622 HydrophobicContact CD2-CB 4.45Å; F562-A622 HydrophobicContact CE2-CB 3.73Å; H566-A622 WeakPolarHBondContact CD2-CB 3.47Å; L570-A622 HydrophobicContact CD1-CB 4.42Å; K618-A622 PolarHBondContact O-N 2.91Å; S619-A622 WeakPolarHBondContact O-CB 3.44Å; S619-A622 PolarHBondContact O-N 2.88Å; R620-A622 VanDerWaalsContact C-N 3.3Å; A622-A624 VanDerWaalsContact C-N 3.35Å; A622-A624 PolarHBondContact O-N 3.34Å; A622-Q625 WeakPolarHBondContact O-CB 3.38Å; A622-Q625 PolarHBondContact O-N 2.92Å; A622-M626 WeakPolarHBondContact O-CB 3.41Å; A622-M626 PolarHBondContact O-N 2.78Å
623	F	90.6	Very high	87.5	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-45	172.7	-75.4	-62.5	0	0	0	111.7	F482 F562 Y599 S619 R620 V621 Q625 M626 T627 L636 P639 L643 L651	F482-F623 HydrophobicContact CZ-CD1 4.23Å; F562-F623 AromaticContact CD2-CD1 3.97Å; F562-F623 HydrophobicContact CD2-CD1 3.97Å; F562-F623 AromaticContact CD2-CE1 3.7Å; F562-F623 HydrophobicContact CD2-CE1 3.7Å; F562-F623 HydrophobicContact CD2-CZ 4.05Å; F562-F623 HydrophobicContact CE1-CZ 4.29Å; F562-F623 HydrophobicContact CE2-CD1 4.1Å; F562-F623 HydrophobicContact CE2-CD2 4.22Å; F562-F623 AromaticContact CE2-CE1 3.84Å; F562-F623 HydrophobicContact CE2-CE1 3.84Å; F562-F623 AromaticContact CE2-CE2 3.95Å; F562-F623 HydrophobicContact CE2-CE2 3.95Å; F562-F623 HydrophobicContact CE2-CG 4.26Å; F562-F623 AromaticContact CE2-CZ 3.75Å; F562-F623 HydrophobicContact CE2-CZ 3.75Å; F562-F623 HydrophobicContact CG-CE1 4.1Å; F562-F623 HydrophobicContact CG-CZ 4.42Å; F562-F623 HydrophobicContact CZ-CE1 4.38Å; F562-F623 HydrophobicContact CZ-CE2 4.08Å; F562-F623 AromaticContact CZ-CZ 3.89Å; F562-F623 HydrophobicContact CZ-CZ 3.89Å; Y599-F623 HydrophobicContact CD1-CB 3.6Å; Y599-F623 HydrophobicContact CE1-CB 3.8Å; S619-F623 WeakPolarHBondContact O-CD2 3.46Å; S619-F623 PolarHBondContact O-N 3.43Å; R620-F623 PolarHBondContact O-N 2.73Å; V621-F623 PolarHBondContact O-N 2.9Å; F623-Q625 VanDerWaalsContact C-N 3.28Å; F623-Q625 PolarHBondContact O-N 3.26Å; F623-M626 HydrophobicContact CD1-CE 3.81Å; F623-M626 HydrophobicContact CE1-CE 4.34Å; F623-M626 PolarHBondContact O-N 2.83Å; F623-T627 WeakPolarHBondContact O-CG2 3.34Å; F623-T627 PolarHBondContact O-N 3.01Å; F623-T627 VanDerWaalsContact O-N 3.1Å; F623-T627 PolarHBondContact O-OG1 3.26Å; F623-T627 VanDerWaalsContact O-OG1 3.05Å; F623-L636 HydrophobicContact CE1-CD2 4.38Å; F623-P639 HydrophobicContact CE1-CB 4.45Å; F623-P639 HydrophobicContact CZ-CB 3.92Å; F623-L643 HydrophobicContact CE2-CD1 3.98Å; F623-L643 HydrophobicContact CE2-CD2 4.31Å; F623-L643 HydrophobicContact CZ-CD1 4.42Å; F623-L651 HydrophobicContact CE1-CD1 4.24Å; F623-L651 HydrophobicContact CZ-CD1 4.35Å; F623-L651 HydrophobicContact CZ-CD2 4.27Å
624	A	90.4	Very high	88	Confident	0 Å²	0	15 Å²	15	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60	-38.6	177.8	0	0	0	0	0	112.8	Q595 L596 Y599 R620 V621 A622 T627 M628	Q595-A624 HydrophobicContact CG-CB 4.5Å; Q595-A624 PolarHBondContact NE2-O 3.46Å; L596-A624 HydrophobicContact CD2-CB 3.89Å; Y599-A624 HydrophobicContact CD2-CB 3.36Å; Y599-A624 VanDerWaalsContact CE2-CA 3.5Å; Y599-A624 HydrophobicContact CE2-CB 3.81Å; Y599-A624 HydrophobicContact CG-CB 3.84Å; R620-A624 PolarHBondContact O-N 2.95Å; V621-A624 WeakPolarHBondContact O-CB 3.33Å; V621-A624 PolarHBondContact O-N 3.12Å; A622-A624 VanDerWaalsContact C-N 3.35Å; A622-A624 PolarHBondContact O-N 3.34Å; A624-T627 PolarHBondContact O-OG1 2.93Å; A624-M628 PolarHBondContact O-N 3.01Å
625	Q	90	Very high	88.8	Confident	12 Å²	12	13.5 Å²	13.5	6%	0.056	8%	0.081	C	C	.	.	H	α-helix	trans	-67.6	-44.6	175.7	-178.4	-177.2	-96.7	0	0	112.2	H566 L580 K583 F584 V621 A622 F623 T627 M628	H566-Q625 PolarHBondContact NE2-NE2 2.77Å; L580-Q625 HydrophobicContact CD2-CB 3.8Å; L580-Q625 HydrophobicContact CD2-CG 4.19Å; K583-Q625 VanDerWaalsContact CD-CD 3.45Å; K583-Q625 HydrophobicContact CD-CG 3.74Å; K583-Q625 VanDerWaalsContact NZ-CD 3.32Å; F584-Q625 HydrophobicContact CE2-CG 3.99Å; F584-Q625 WeakPolarHBondContact CE2-O 3.36Å; V621-Q625 PolarHBondContact O-N 3.03Å; A622-Q625 WeakPolarHBondContact O-CB 3.38Å; A622-Q625 PolarHBondContact O-N 2.92Å; F623-Q625 VanDerWaalsContact C-N 3.28Å; F623-Q625 PolarHBondContact O-N 3.26Å; Q625-T627 PolarHBondContact O-N 2.81Å; Q625-M628 WeakPolarHBondContact O-CB 3.49Å; Q625-M628 PolarHBondContact O-N 3.18Å
626	M	90.3	Very high	89.4	Confident	12 Å²	12	12 Å²	12	6%	0.059	7%	0.066	C	C	.	.	H	α-helix	trans	-65.9	-37.1	-176.8	179.4	-167.6	62.7	0	0	112.4	F482 F562 A622 F623 P629 Y634 L636	F482-M626 HydrophobicContact CE1-CE 3.88Å; F562-M626 HydrophobicContact CB-SD 3.8Å; A622-M626 WeakPolarHBondContact O-CB 3.41Å; A622-M626 PolarHBondContact O-N 2.78Å; F623-M626 HydrophobicContact CD1-CE 3.81Å; F623-M626 HydrophobicContact CE1-CE 4.34Å; F623-M626 PolarHBondContact O-N 2.83Å; M626-P629 WeakPolarHBondContact O-CD 3.4Å; M626-Y634 HydrophobicContact CE-CD1 3.53Å; M626-Y634 HydrophobicContact CE-CE1 3.55Å; M626-Y634 HydrophobicContact CG-CD1 4.34Å; M626-Y634 HydrophobicContact CG-CE1 4.17Å; M626-Y634 HydrophobicContact SD-CD1 3.78Å; M626-Y634 HydrophobicContact SD-CE1 4.09Å; M626-L636 HydrophobicContact CE-CD2 3.91Å; M626-L636 HydrophobicContact SD-CD2 3.94Å
627	T	90.4	Very high	89.9	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-84.5	-14.4	-177.4	57.7	0	0	0	0	113.9	F482 Q595 Y599 F623 A624 Q625 C630 Y634	F482-T627 HydrophobicContact CD1-CG2 4.02Å; F482-T627 HydrophobicContact CE1-CG2 4.15Å; Q595-T627 PolarHBondContact NE2-OG1 3.22Å; Y599-T627 HydrophobicContact CE1-CG2 4.25Å; Y599-T627 VanDerWaalsContact CZ-OG1 3.22Å; Y599-T627 WeakPolarHBondContact OH-CB 3.34Å; Y599-T627 WeakPolarHBondContact OH-CG2 3.18Å; Y599-T627 PolarHBondContact OH-OG1 2.87Å; F623-T627 WeakPolarHBondContact O-CG2 3.34Å; F623-T627 PolarHBondContact O-N 3.01Å; F623-T627 VanDerWaalsContact O-N 3.1Å; F623-T627 PolarHBondContact O-OG1 3.26Å; F623-T627 VanDerWaalsContact O-OG1 3.05Å; A624-T627 PolarHBondContact O-OG1 2.93Å; Q625-T627 PolarHBondContact O-N 2.81Å; T627-C630 WeakPolarHBondContact O-CA 3.43Å; T627-C630 PolarHBondContact O-N 2.93Å; T627-Y634 HydrophobicContact CG2-CE1 4.03Å; T627-Y634 WeakPolarHBondContact CG2-OH 3.49Å
628	M	88.6	Confident	89.9	Confident	2 Å²	2	10.4 Å²	10.4	1%	0.01	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-41.5	-179.9	-168.8	61.8	164.3	0	0	115.3	F584 R587 Y592 Q595 A624 Q625 C630	F584-M628 HydrophobicContact CB-CG 4.46Å; F584-M628 HydrophobicContact CD2-CB 4.01Å; F584-M628 HydrophobicContact CD2-CG 3.65Å; F584-M628 HydrophobicContact CE2-CB 3.75Å; F584-M628 HydrophobicContact CE2-CG 3.94Å; F584-M628 HydrophobicContact CG-CG 4.02Å; F584-M628 HydrophobicContact CZ-CB 4.21Å; R587-M628 PolarHBondContact NH1-SD 2.84Å; R587-M628 PolarHBondContact NH2-O 3.36Å; Y592-M628 HydrophobicContact CD1-CE 3.52Å; Y592-M628 HydrophobicContact CE1-CE 3.48Å; Y592-M628 VanDerWaalsContact CE1-CE 3.48Å; Q595-M628 HydrophobicContact CB-SD 4.37Å; Q595-M628 HydrophobicContact CG-SD 3.82Å; A624-M628 PolarHBondContact O-N 3.01Å; Q625-M628 WeakPolarHBondContact O-CB 3.49Å; Q625-M628 PolarHBondContact O-N 3.18Å; M628-C630 PolarHBondContact O-N 3.17Å
629	P	87.4	Confident	89.8	Confident	59 Å²	59	8.7 Å²	8.7	38%	0.383	5%	0.05	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	2.6	175	29.1	-34.7	0	0	0	114.8	F584 M626	F584-P629 HydrophobicContact CE1-CB 4.49Å; F584-P629 HydrophobicContact CE1-CG 4.43Å; F584-P629 HydrophobicContact CZ-CG 4.39Å; M626-P629 WeakPolarHBondContact O-CD 3.4Å
630	C	88.5	Confident	89.5	Confident	45 Å²	45	9.3 Å²	9.3	30%	0.304	5%	0.054	S	C	.	.			trans	50.8	60.8	-175.9	-60.6	0	0	0	0	113.4	P483 T627 M628	P483-C630 HydrophobicContact CB-CB 4.49Å; P483-C630 HydrophobicContact CG-CB 4.23Å; T627-C630 WeakPolarHBondContact O-CA 3.43Å; T627-C630 PolarHBondContact O-N 2.93Å; M628-C630 PolarHBondContact O-N 3.17Å
631	P	90.6	Very high	89.1	Confident	3 Å²	3	8.7 Å²	8.7	2%	0.019	5%	0.052	C	C	.	.			trans	-66.4	152	177.2	30.5	-35	0	0	0	111.4	K558 Y634	K558-P631 HydrophobicContact CB-CB 4.21Å; K558-P631 WeakPolarHBondContact O-CA 3.35Å; K558-P631 WeakPolarHBondContact O-CB 3.25Å; P631-Y634 HydrophobicContact CB-CE1 4.44Å; P631-Y634 WeakPolarHBondContact CD-OH 3.25Å; P631-Y634 HydrophobicContact CG-CD1 3.98Å; P631-Y634 HydrophobicContact CG-CE1 3.22Å; P631-Y634 HydrophobicContact CG-CE2 4.21Å; P631-Y634 WeakPolarHBondContact CG-OH 3.43Å
632	N	91.5	Very high	88.3	Confident	8 Å²	8	12.5 Å²	12.5	4%	0.043	7%	0.07	C	C	.	.	S	Bend	trans	-95.9	-11	-178.7	49.6	30.9	0	0	0	112.7	F486 N556 L557 K558 G660 G661	F486-N632 HydrophobicContact CB-CB 4.17Å; F486-N632 HydrophobicContact CD1-CB 3.91Å; F486-N632 HydrophobicContact CD2-CB 3.68Å; F486-N632 HydrophobicContact CE1-CB 4.26Å; F486-N632 HydrophobicContact CE2-CB 4.07Å; F486-N632 HydrophobicContact CG-CB 3.62Å; F486-N632 HydrophobicContact CZ-CB 4.35Å; N556-N632 PolarHBondContact O-ND2 2.9Å; L557-N632 WeakPolarHBondContact CD1-OD1 3.49Å; K558-N632 PolarHBondContact N-OD1 3.29Å; K558-N632 PolarHBondContact O-N 3.44Å; K558-N632 PolarHBondContact O-OD1 2.72Å; N632-G660 VanDerWaalsContact O-CA 3.28Å; N632-G660 WeakPolarHBondContact O-CA 3.33Å; N632-G661 PolarHBondContact O-N 3.27Å
633	F	92.1	Very high	87.8	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	131.2	176.7	-157.8	-77	0	0	0	109.5	I493 A517 L557 K558 I559 G560 I635 G661 I663	I493-F633 HydrophobicContact CG2-CD2 4.25Å; A517-F633 HydrophobicContact CB-CE2 4.2Å; A517-F633 HydrophobicContact CB-CZ 3.95Å; L557-F633 HydrophobicContact CD1-CB 3.75Å; L557-F633 HydrophobicContact CD1-CD2 4.37Å; L557-F633 HydrophobicContact CD1-CG 4.31Å; K558-F633 PolarHBondContact O-N 3.48Å; I559-F633 CarbonylContact C-O 3.58Å; I559-F633 VanDerWaalsContact CA-O 3.3Å; I559-F633 WeakPolarHBondContact CA-O 3.08Å; G560-F633 PolarHBondContact N-O 2.87Å; F633-I635 HydrophobicContact CD1-CG1 4.1Å; F633-I635 HydrophobicContact CE1-CG1 4.08Å; F633-G661 CarbonylContact C-O 2.82Å; F633-G661 WeakPolarHBondContact CA-O 3.49Å; F633-I663 HydrophobicContact CE1-CB 4.29Å; F633-I663 HydrophobicContact CE1-CD1 3.57Å; F633-I663 HydrophobicContact CE1-CG1 3.6Å; F633-I663 HydrophobicContact CZ-CD1 3.72Å; F633-I663 HydrophobicContact CZ-CG1 3.72Å
634	Y	93.4	Very high	87.3	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.5	177.1	-71.4	-77.2	0	0	0	111.3	F482 G560 M626 T627 P631 F658 G661 V662 I663	F482-Y634 HydrophobicContact CB-CE2 4.49Å; F482-Y634 HydrophobicContact CD1-CD1 4.48Å; F482-Y634 AromaticContact CD1-CD2 3.93Å; F482-Y634 HydrophobicContact CD1-CD2 3.93Å; F482-Y634 HydrophobicContact CD1-CE1 4.13Å; F482-Y634 AromaticContact CD1-CE2 3.56Å; F482-Y634 HydrophobicContact CD1-CE2 3.56Å; F482-Y634 HydrophobicContact CD1-CG 4.39Å; F482-Y634 AromaticContact CD1-CZ 3.65Å; F482-Y634 HydrophobicContact CE1-CD1 4.38Å; F482-Y634 HydrophobicContact CE1-CD2 4.42Å; F482-Y634 HydrophobicContact CE1-CE1 4.27Å; F482-Y634 HydrophobicContact CE1-CE2 4.35Å; F482-Y634 HydrophobicContact CE1-CG 4.44Å; G560-Y634 CarbonylContact O-C 3.46Å; G560-Y634 WeakPolarHBondContact O-CA 3.45Å; M626-Y634 HydrophobicContact CE-CD1 3.53Å; M626-Y634 HydrophobicContact CE-CE1 3.55Å; M626-Y634 HydrophobicContact CG-CD1 4.34Å; M626-Y634 HydrophobicContact CG-CE1 4.17Å; M626-Y634 HydrophobicContact SD-CD1 3.78Å; M626-Y634 HydrophobicContact SD-CE1 4.09Å; T627-Y634 HydrophobicContact CG2-CE1 4.03Å; T627-Y634 WeakPolarHBondContact CG2-OH 3.49Å; P631-Y634 HydrophobicContact CB-CE1 4.44Å; P631-Y634 WeakPolarHBondContact CD-OH 3.25Å; P631-Y634 HydrophobicContact CG-CD1 3.98Å; P631-Y634 HydrophobicContact CG-CE1 3.22Å; P631-Y634 HydrophobicContact CG-CE2 4.21Å; P631-Y634 WeakPolarHBondContact CG-OH 3.43Å; Y634-F658 HydrophobicContact CD2-CD1 4.03Å; Y634-F658 AromaticContact CD2-CE1 3.41Å; Y634-F658 HydrophobicContact CD2-CE1 3.41Å; Y634-F658 VanDerWaalsContact CD2-CE1 3.41Å; Y634-F658 HydrophobicContact CD2-CE2 4.09Å; Y634-F658 AromaticContact CD2-CZ 3.47Å; Y634-F658 HydrophobicContact CD2-CZ 3.47Å; Y634-F658 VanDerWaalsContact CD2-CZ 3.47Å; Y634-F658 HydrophobicContact CE2-CD1 4.34Å; Y634-F658 HydrophobicContact CE2-CD2 4.14Å; Y634-F658 AromaticContact CE2-CE1 3.76Å; Y634-F658 HydrophobicContact CE2-CE1 3.76Å; Y634-F658 AromaticContact CE2-CE2 3.52Å; Y634-F658 HydrophobicContact CE2-CE2 3.52Å; Y634-F658 AromaticContact CE2-CZ 3.32Å; Y634-F658 HydrophobicContact CE2-CZ 3.32Å; Y634-G661 PolarHBondContact N-O 3.06Å; Y634-V662 WeakPolarHBondContact O-CA 3.39Å; Y634-I663 PolarHBondContact O-N 2.97Å
635	I	93.6	Very high	86.8	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.6	170.6	-60.9	-178.4	0	0	0	107.2	L537 L540 M541 I559 G560 Y561 F562 F633 I663	L537-I635 HydrophobicContact CB-CG2 4.24Å; L537-I635 HydrophobicContact CD1-CG2 3.84Å; L537-I635 HydrophobicContact CD2-CG2 3.6Å; L537-I635 HydrophobicContact CG-CG2 4.09Å; L540-I635 HydrophobicContact CB-CD1 4.39Å; M541-I635 HydrophobicContact CG-CD1 3.78Å; M541-I635 HydrophobicContact SD-CD1 4.41Å; I559-I635 HydrophobicContact CD1-CD1 4.49Å; I559-I635 HydrophobicContact CG2-CB 4.37Å; I559-I635 HydrophobicContact CG2-CD1 3.7Å; I559-I635 HydrophobicContact CG2-CG1 3.81Å; G560-I635 PolarHBondContact O-N 3.07Å; Y561-I635 WeakPolarHBondContact CA-O 3.34Å; Y561-I635 HydrophobicContact CD2-CB 4Å; Y561-I635 HydrophobicContact CD2-CG2 3.76Å; Y561-I635 HydrophobicContact CE2-CG2 4.03Å; F562-I635 PolarHBondContact N-O 2.76Å; F633-I635 HydrophobicContact CD1-CG1 4.1Å; F633-I635 HydrophobicContact CE1-CG1 4.08Å; I635-I663 CarbonylContact C-O 3.56Å; I635-I663 WeakPolarHBondContact CA-O 3.32Å; I635-I663 HydrophobicContact CG1-CB 4.31Å
636	L	92.6	Very high	86.3	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	110	-175.2	-53.4	179.3	0	0	0	109.8	F562 F623 M626 P639 L655 I663 L664 V665	F562-L636 HydrophobicContact CB-CD2 3.55Å; F562-L636 HydrophobicContact CG-CD2 4.43Å; F623-L636 HydrophobicContact CE1-CD2 4.38Å; M626-L636 HydrophobicContact CE-CD2 3.91Å; M626-L636 HydrophobicContact SD-CD2 3.94Å; L636-P639 HydrophobicContact CB-CB 4.12Å; L636-P639 HydrophobicContact CB-CG 3.87Å; L636-P639 HydrophobicContact CD1-CG 4.4Å; L636-L655 HydrophobicContact CD1-CD1 3.78Å; L636-L655 HydrophobicContact CD1-CD2 3.96Å; L636-I663 PolarHBondContact N-O 2.96Å; L636-L664 HydrophobicContact CB-CD1 3.9Å; L636-L664 HydrophobicContact CD1-CD1 4.34Å; L636-L664 CarbonylContact O-C 3.51Å; L636-V665 PolarHBondContact O-N 3.39Å
637	D	89.6	Confident	86.1	Confident	6 Å²	6	15.6 Å²	15.6	3%	0.032	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	105	178.7	-159.9	5.4	0	0	0	109.9	S534 L537 Y561 F562 Q564	S534-D637 PolarHBondContact OG-OD2 3.09Å; L537-D637 HydrophobicContact CD1-CB 3.62Å; Y561-D637 HydrophobicContact CE2-CB 4.11Å; F562-D637 WeakPolarHBondContact O-CB 3.31Å; F562-D637 PolarHBondContact O-N 3.29Å; Q564-D637 PolarHBondContact N-O 3.07Å
638	E	86.1	Confident	85.9	Confident	12 Å²	12	16.2 Å²	16.2	6%	0.056	9%	0.088	C	C	.	.	S	Bend	trans	49.3	57.7	-175.8	-62.3	-64.7	157.3	0	0	114.1	T640 N641 V665 H667	E638-T640 PolarHBondContact O-N 3.25Å; E638-N641 VanDerWaalsContact CB-ND2 3.28Å; E638-N641 WeakPolarHBondContact CB-ND2 3.42Å; E638-N641 WeakPolarHBondContact O-CB 3.05Å; E638-N641 PolarHBondContact O-N 3.46Å; E638-V665 VanDerWaalsContact CA-O 3.24Å; E638-V665 WeakPolarHBondContact CA-O 3.42Å; E638-V665 PolarHBondContact N-O 2.89Å; E638-H667 IonicContact OE1-CD2 3.72Å; E638-H667 PolarHBondContact OE1-CD2 3.25Å; E638-H667 IonicContact OE1-CE1 2.92Å; E638-H667 IonicContact OE1-CG 3.69Å; E638-H667 IonicContact OE1-NE2 2.9Å; E638-H667 PolarHBondContact OE1-NE2 2.94Å; E638-H667 IonicContact OE2-CD2 3.16Å; E638-H667 PolarHBondContact OE2-N 2.94Å
639	P	84.8	Confident	85.7	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.9	-174.5	31.1	-36.6	0	0	0	113.9	F562 F623 L636 N641 L643 L651 L664 V665 L671	F562-P639 HydrophobicContact CD1-CB 4.16Å; F562-P639 HydrophobicContact CE1-CB 4.29Å; F623-P639 HydrophobicContact CE1-CB 4.45Å; F623-P639 HydrophobicContact CZ-CB 3.92Å; L636-P639 HydrophobicContact CB-CB 4.12Å; L636-P639 HydrophobicContact CB-CG 3.87Å; L636-P639 HydrophobicContact CD1-CG 4.4Å; P639-N641 VanDerWaalsContact C-N 3.27Å; P639-L643 WeakPolarHBondContact O-CD1 3.3Å; P639-L643 VanDerWaalsContact O-CG 3.31Å; P639-L643 WeakPolarHBondContact O-CG 3.42Å; P639-L651 HydrophobicContact CB-CD2 4.02Å; P639-L651 HydrophobicContact CG-CD2 4.22Å; P639-L664 HydrophobicContact CG-CD1 3.34Å; P639-V665 VanDerWaalsContact CD-O 3.3Å; P639-V665 WeakPolarHBondContact CD-O 3.38Å; P639-L671 HydrophobicContact CG-CD2 4.26Å
640	T	81.7	Confident	85.7	Confident	14 Å²	14	16 Å²	16	9%	0.086	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-15.4	179.1	49.7	0	0	0	0	112.7	E638 H642 L643 I648 D668 L671	E638-T640 PolarHBondContact O-N 3.25Å; T640-H642 PolarHBondContact O-N 3.33Å; T640-L643 WeakPolarHBondContact O-CB 3.44Å; T640-L643 PolarHBondContact O-N 2.95Å; T640-I648 HydrophobicContact CG2-CD1 4.11Å; T640-I648 HydrophobicContact CG2-CG1 4.14Å; T640-I648 HydrophobicContact CG2-CG2 4.14Å; T640-D668 HydrophobicContact CG2-CB 3.93Å; T640-L671 HydrophobicContact CG2-CD2 3.5Å; T640-L671 VanDerWaalsContact CG2-CD2 3.5Å
641	N	79.3	Confident	85.8	Confident	10 Å²	10	13.9 Å²	13.9	5%	0.053	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	127.2	179.2	-74.8	-19.5	0	0	0	111.3	E638 P639 L643	E638-N641 VanDerWaalsContact CB-ND2 3.28Å; E638-N641 WeakPolarHBondContact CB-ND2 3.42Å; E638-N641 WeakPolarHBondContact O-CB 3.05Å; E638-N641 PolarHBondContact O-N 3.46Å; P639-N641 VanDerWaalsContact C-N 3.27Å; N641-L643 PolarHBondContact O-N 2.9Å; N641-L643 VanDerWaalsContact O-N 3.12Å
642	H	73.3	Confident	85.8	Confident	79 Å²	79	13.9 Å²	13.9	37%	0.366	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	8.9	-177.6	-44.3	-70.6	0	0	0	115.4	N214 G616 T640	N214-H642 PolarHBondContact ND2-O 3.12Å; G616-H642 WeakPolarHBondContact CA-O 3.14Å; G616-H642 PolarHBondContact N-O 3.33Å; T640-H642 PolarHBondContact O-N 3.33Å
643	L	79.8	Confident	85.8	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.005	10%	0.098	C	C	.	.			trans	-86.8	141.6	174.2	-66.5	-169.9	0	0	0	111.6	F623 P639 T640 N641 T647 I648 L651	F623-L643 HydrophobicContact CE2-CD1 3.98Å; F623-L643 HydrophobicContact CE2-CD2 4.31Å; F623-L643 HydrophobicContact CZ-CD1 4.42Å; P639-L643 WeakPolarHBondContact O-CD1 3.3Å; P639-L643 VanDerWaalsContact O-CG 3.31Å; P639-L643 WeakPolarHBondContact O-CG 3.42Å; T640-L643 WeakPolarHBondContact O-CB 3.44Å; T640-L643 PolarHBondContact O-N 2.95Å; N641-L643 PolarHBondContact O-N 2.9Å; N641-L643 VanDerWaalsContact O-N 3.12Å; L643-T647 HydrophobicContact CD1-CG2 4.22Å; L643-T647 HydrophobicContact CD2-CG2 3.95Å; L643-I648 HydrophobicContact CB-CD1 4.37Å; L643-I648 HydrophobicContact CB-CG1 3.78Å; L643-I648 HydrophobicContact CD1-CG1 4.39Å; L643-L651 HydrophobicContact CD1-CD2 4.23Å
644	D	79.6	Confident	85.7	Confident	10 Å²	10	21 Å²	21	5%	0.053	10%	0.102	C	C	.	.			trans	-69.9	151.3	168.1	-71.7	-47.8	0	0	0	110.7	R213 N214 H384 R620 E646 T647 I648	R213-D644 WeakPolarHBondContact CA-OD1 3.21Å; N214-D644 VanDerWaalsContact CB-OD1 3.26Å; N214-D644 WeakPolarHBondContact CB-OD1 3.46Å; N214-D644 VanDerWaalsContact N-CG 3.28Å; N214-D644 PolarHBondContact N-OD1 3.35Å; N214-D644 PolarHBondContact N-OD2 3.49Å; N214-D644 VanDerWaalsContact N-OD2 3.12Å; N214-D644 PolarHBondContact ND2-OD1 3.47Å; N214-D644 VanDerWaalsContact ND2-OD1 3.12Å; N214-D644 PolarHBondContact OD1-OD1 3.23Å; H384-D644 IonicContact CE1-OD1 3.64Å; H384-D644 PolarHBondContact CE1-OD1 3.1Å; H384-D644 IonicContact NE2-OD1 3.39Å; R620-D644 IonicContact NH2-OD2 2.91Å; D644-E646 PolarHBondContact O-N 2.89Å; D644-T647 CarbonylContact O-C 3.35Å; D644-T647 WeakPolarHBondContact O-CA 3.43Å; D644-T647 WeakPolarHBondContact O-CB 2.99Å; D644-T647 PolarHBondContact O-N 3.39Å; D644-I648 WeakPolarHBondContact O-CG1 3.4Å; D644-I648 PolarHBondContact O-N 2.6Å
645	M	79	Confident	85.6	Confident	25 Å²	25	21 Å²	21	12%	0.123	10%	0.102	C	C	.	.	H	α-helix	trans	-52.1	-39.9	176.1	-170.2	-174.5	-78.6	0	0	113.7	H384 R386 Y411 T647 I648 E649	H384-M645 WeakPolarHBondContact O-CE 3.46Å; R386-M645 HydrophobicContact CB-CE 4.48Å; R386-M645 HydrophobicContact CG-CE 3.37Å; R386-M645 HydrophobicContact CG-CG 4.22Å; R386-M645 HydrophobicContact CG-SD 3.67Å; R386-M645 VanDerWaalsContact NE-CG 3.34Å; R386-M645 PolarHBondContact NE-SD 3.36Å; Y411-M645 HydrophobicContact CE1-CE 4.44Å; Y411-M645 HydrophobicContact CE1-SD 4.28Å; Y411-M645 HydrophobicContact CE2-CE 3.99Å; Y411-M645 HydrophobicContact CE2-SD 4.22Å; Y411-M645 VanDerWaalsContact CZ-SD 3.57Å; Y411-M645 PolarHBondContact OH-SD 2.91Å; M645-T647 VanDerWaalsContact C-N 3.3Å; M645-T647 PolarHBondContact O-N 3.11Å; M645-I648 PolarHBondContact O-N 3.41Å; M645-E649 WeakPolarHBondContact O-CG 3.47Å; M645-E649 PolarHBondContact O-N 3.24Å; M645-E649 VanDerWaalsContact O-N 3.1Å
646	E	81.1	Confident	85.5	Confident	53 Å²	53	24.9 Å²	24.9	25%	0.248	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-38	174	-63.9	174	173.5	0	0	112.2	R213 T478 D644 E649 A650	R213-E646 IonicContact CZ-OE2 2.7Å; R213-E646 IonicContact NE-OE1 3.89Å; R213-E646 IonicContact NE-OE2 2.7Å; R213-E646 PolarHBondContact NE-OE2 2.88Å; R213-E646 IonicContact NH2-OE2 3.53Å; R213-E646 PolarHBondContact NH2-OE2 2.93Å; T478-E646 PolarHBondContact OG1-O 3.01Å; D644-E646 PolarHBondContact O-N 2.89Å; E646-E649 PolarHBondContact O-N 2.87Å; E646-A650 WeakPolarHBondContact O-CB 3.42Å; E646-A650 PolarHBondContact O-N 3.36Å
647	T	84.4	Confident	85.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-74.9	-35.7	-179.1	-49.4	0	0	0	0	111.1	L480 R620 L643 D644 M645 E649 A650 L651	L480-T647 HydrophobicContact CD1-CG2 3.97Å; R620-T647 HydrophobicContact CG-CG2 4.36Å; R620-T647 PolarHBondContact NH2-OG1 3.33Å; L643-T647 HydrophobicContact CD1-CG2 4.22Å; L643-T647 HydrophobicContact CD2-CG2 3.95Å; D644-T647 CarbonylContact O-C 3.35Å; D644-T647 WeakPolarHBondContact O-CA 3.43Å; D644-T647 WeakPolarHBondContact O-CB 2.99Å; D644-T647 PolarHBondContact O-N 3.39Å; M645-T647 VanDerWaalsContact C-N 3.3Å; M645-T647 PolarHBondContact O-N 3.11Å; T647-E649 VanDerWaalsContact C-N 3.32Å; T647-A650 WeakPolarHBondContact O-CB 3.35Å; T647-A650 PolarHBondContact O-N 3.44Å; T647-L651 WeakPolarHBondContact O-CB 3.48Å; T647-L651 PolarHBondContact O-N 3.09Å
648	I	86.3	Confident	85.5	Confident	13 Å²	13	33.1 Å²	33.1	7%	0.067	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-42.7	172.5	-62.5	172.1	0	0	0	110	T640 L643 D644 M645 L651 A652 L671	T640-I648 HydrophobicContact CG2-CD1 4.11Å; T640-I648 HydrophobicContact CG2-CG1 4.14Å; T640-I648 HydrophobicContact CG2-CG2 4.14Å; L643-I648 HydrophobicContact CB-CD1 4.37Å; L643-I648 HydrophobicContact CB-CG1 3.78Å; L643-I648 HydrophobicContact CD1-CG1 4.39Å; D644-I648 WeakPolarHBondContact O-CG1 3.4Å; D644-I648 PolarHBondContact O-N 2.6Å; M645-I648 PolarHBondContact O-N 3.41Å; I648-L651 WeakPolarHBondContact O-CB 3.39Å; I648-L651 PolarHBondContact O-N 2.93Å; I648-A652 PolarHBondContact O-N 3.44Å; I648-L671 HydrophobicContact CG2-CB 4.44Å
649	E	85.4	Confident	85.7	Confident	47 Å²	47	39 Å²	39	22%	0.22	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-40.4	174.7	-71.1	-169.7	134.8	0	0	112.9	R386 M645 E646 T647 L651 A652 K653 R670	R386-E649 IonicContact CZ-OE1 3.97Å; R386-E649 IonicContact CZ-OE2 3.27Å; R386-E649 IonicContact NH1-OE1 3.49Å; R386-E649 PolarHBondContact NH1-OE1 3.34Å; R386-E649 IonicContact NH2-OE1 3Å; R386-E649 PolarHBondContact NH2-OE1 2.91Å; R386-E649 IonicContact NH2-OE2 2.84Å; R386-E649 PolarHBondContact NH2-OE2 3.46Å; M645-E649 WeakPolarHBondContact O-CG 3.47Å; M645-E649 PolarHBondContact O-N 3.24Å; M645-E649 VanDerWaalsContact O-N 3.1Å; E646-E649 PolarHBondContact O-N 2.87Å; T647-E649 VanDerWaalsContact C-N 3.32Å; E649-L651 VanDerWaalsContact C-N 3.27Å; E649-L651 PolarHBondContact O-N 3.37Å; E649-A652 PolarHBondContact O-N 3.06Å; E649-K653 WeakPolarHBondContact O-CG 3.44Å; E649-K653 PolarHBondContact O-N 3.25Å; E649-R670 IonicContact OE1-CZ 3.63Å; E649-R670 IonicContact OE1-NE 2.76Å; E649-R670 IonicContact OE1-NH2 3.81Å; E649-R670 PolarHBondContact OE1-NH2 3.48Å
650	A	88.4	Confident	85.9	Confident	10 Å²	10	39 Å²	39	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-61.2	-39.3	173.7	0	0	0	0	0	111.4	T478 L480 E646 T647 A654	T478-A650 WeakPolarHBondContact O-CB 3.25Å; L480-A650 HydrophobicContact CD1-CB 4.12Å; L480-A650 HydrophobicContact CG-CB 4.11Å; E646-A650 WeakPolarHBondContact O-CB 3.42Å; E646-A650 PolarHBondContact O-N 3.36Å; T647-A650 WeakPolarHBondContact O-CB 3.35Å; T647-A650 PolarHBondContact O-N 3.44Å; A650-A654 VanDerWaalsContact O-CB 3.27Å; A650-A654 WeakPolarHBondContact O-CB 3.44Å; A650-A654 PolarHBondContact O-N 3.29Å
651	L	90.4	Very high	86.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-48.5	178.9	178.8	64.1	0	0	0	110	L480 F482 F623 P639 L643 T647 I648 E649 K653 A654 L655 L671	L480-L651 HydrophobicContact CD1-CB 3.65Å; L480-L651 HydrophobicContact CD1-CD1 4.17Å; F482-L651 HydrophobicContact CE2-CD1 3.67Å; F482-L651 HydrophobicContact CZ-CD1 3.53Å; F623-L651 HydrophobicContact CE1-CD1 4.24Å; F623-L651 HydrophobicContact CZ-CD1 4.35Å; F623-L651 HydrophobicContact CZ-CD2 4.27Å; P639-L651 HydrophobicContact CB-CD2 4.02Å; P639-L651 HydrophobicContact CG-CD2 4.22Å; L643-L651 HydrophobicContact CD1-CD2 4.23Å; T647-L651 WeakPolarHBondContact O-CB 3.48Å; T647-L651 PolarHBondContact O-N 3.09Å; I648-L651 WeakPolarHBondContact O-CB 3.39Å; I648-L651 PolarHBondContact O-N 2.93Å; E649-L651 VanDerWaalsContact C-N 3.27Å; E649-L651 PolarHBondContact O-N 3.37Å; L651-K653 PolarHBondContact O-N 2.9Å; L651-A654 PolarHBondContact O-N 3.28Å; L651-A654 VanDerWaalsContact O-N 3.13Å; L651-L655 HydrophobicContact CD1-CD1 3.95Å; L651-L655 HydrophobicContact CD1-CD2 4.49Å; L651-L655 HydrophobicContact CD1-CG 4.02Å; L651-L655 HydrophobicContact CG-CD1 3.87Å; L651-L655 HydrophobicContact CG-CG 4.32Å; L651-L655 WeakPolarHBondContact O-CB 3.41Å; L651-L655 WeakPolarHBondContact O-CG 3.24Å; L651-L655 PolarHBondContact O-N 3.26Å; L651-L671 HydrophobicContact CD2-CD2 4.44Å
652	A	90.3	Very high	87.1	Confident	3 Å²	3	37.9 Å²	37.9	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-56.9	-47.6	177.1	0	0	0	0	0	111.8	I648 E649 A654 L655 N656 L671 L674 V675	I648-A652 PolarHBondContact O-N 3.44Å; E649-A652 PolarHBondContact O-N 3.06Å; A652-A654 VanDerWaalsContact C-N 3.31Å; A652-A654 PolarHBondContact O-N 3.33Å; A652-L655 PolarHBondContact O-N 3.03Å; A652-N656 WeakPolarHBondContact O-CB 3.23Å; A652-N656 PolarHBondContact O-N 3.25Å; A652-L671 HydrophobicContact CB-CD1 3.72Å; A652-L674 HydrophobicContact CB-CB 4.19Å; A652-L674 HydrophobicContact CB-CD1 3.87Å; A652-V675 HydrophobicContact CB-CG2 4.14Å
653	K	90.6	Very high	88.1	Confident	148 Å²	148	34.2 Å²	34.2	64%	0.643	16%	0.16	S	C	*	.	H	α-helix	trans	-61	-40.6	176.5	-73.5	175.1	-178.4	175	0	112	E649 L651 K657	E649-K653 WeakPolarHBondContact O-CG 3.44Å; E649-K653 PolarHBondContact O-N 3.25Å; L651-K653 PolarHBondContact O-N 2.9Å; K653-K657 PolarHBondContact O-N 2.93Å
654	A	91.3	Very high	88.7	Confident	11 Å²	11	34.1 Å²	34.1	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-72.4	-41	-177.6	0	0	0	0	0	112.5	L480 F482 A650 L651 A652 N656 K657 F658	L480-A654 HydrophobicContact CB-CB 4.09Å; L480-A654 WeakPolarHBondContact O-CB 3.23Å; F482-A654 HydrophobicContact CD2-CB 3.55Å; F482-A654 HydrophobicContact CE2-CB 3.93Å; A650-A654 VanDerWaalsContact O-CB 3.27Å; A650-A654 WeakPolarHBondContact O-CB 3.44Å; A650-A654 PolarHBondContact O-N 3.29Å; L651-A654 PolarHBondContact O-N 3.28Å; L651-A654 VanDerWaalsContact O-N 3.13Å; A652-A654 VanDerWaalsContact C-N 3.31Å; A652-A654 PolarHBondContact O-N 3.33Å; A654-N656 VanDerWaalsContact C-N 3.32Å; A654-N656 PolarHBondContact O-N 3.31Å; A654-K657 PolarHBondContact O-N 3.48Å; A654-F658 PolarHBondContact O-N 3.35Å
655	L	91.4	Very high	89.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.8	-34.2	175	-67.7	175.7	0	0	0	112.4	F482 L636 L651 A652 K657 F658 V662 V675	F482-L655 HydrophobicContact CD1-CD2 4.16Å; F482-L655 HydrophobicContact CE1-CD2 3.87Å; F482-L655 HydrophobicContact CE2-CD2 4.28Å; F482-L655 HydrophobicContact CG-CD2 4.49Å; F482-L655 HydrophobicContact CZ-CD2 3.93Å; L636-L655 HydrophobicContact CD1-CD1 3.78Å; L636-L655 HydrophobicContact CD1-CD2 3.96Å; L651-L655 HydrophobicContact CD1-CD1 3.95Å; L651-L655 HydrophobicContact CD1-CD2 4.49Å; L651-L655 HydrophobicContact CD1-CG 4.02Å; L651-L655 HydrophobicContact CG-CD1 3.87Å; L651-L655 HydrophobicContact CG-CG 4.32Å; L651-L655 WeakPolarHBondContact O-CB 3.41Å; L651-L655 WeakPolarHBondContact O-CG 3.24Å; L651-L655 PolarHBondContact O-N 3.26Å; A652-L655 PolarHBondContact O-N 3.03Å; L655-K657 VanDerWaalsContact C-N 3.35Å; L655-F658 PolarHBondContact O-N 3.46Å; L655-V662 HydrophobicContact CD2-CG1 4.29Å; L655-V662 HydrophobicContact CD2-CG2 4.32Å; L655-V675 HydrophobicContact CB-CG1 3.87Å; L655-V675 HydrophobicContact CB-CG2 4.05Å; L655-V675 HydrophobicContact CD1-CG1 4.26Å; L655-V675 HydrophobicContact CD1-CG2 4.3Å
656	N	90.8	Very high	89.6	Confident	81 Å²	81	32.5 Å²	32.5	43%	0.433	15%	0.152	S	C	.	.	H	α-helix	trans	-68	-33.3	173.4	-83.7	-16	0	0	0	113.5	A652 A654 L674 V675	A652-N656 WeakPolarHBondContact O-CB 3.23Å; A652-N656 PolarHBondContact O-N 3.25Å; A654-N656 VanDerWaalsContact C-N 3.32Å; A654-N656 PolarHBondContact O-N 3.31Å; N656-L674 PolarHBondContact ND2-O 2.99Å; N656-L674 PolarHBondContact OD1-O 3.16Å; N656-V675 WeakPolarHBondContact OD1-CA 3.42Å
657	K	90.7	Very high	89.6	Confident	173 Å²	173	31 Å²	31	75%	0.752	15%	0.145	S	C	*	.	H	α-helix	trans	-77.8	-28.1	176.5	-171.8	176.1	178.4	-179	0	112.5	K653 A654 L655	K653-K657 PolarHBondContact O-N 2.93Å; A654-K657 PolarHBondContact O-N 3.48Å; L655-K657 VanDerWaalsContact C-N 3.35Å
658	F	91.3	Very high	89.5	Confident	5 Å²	5	32.1 Å²	32.1	2%	0.022	15%	0.151	C	C	.	.			trans	-62	139.3	179.2	-179.8	-115.4	0	0	0	111.1	F482 P483 D484 F486 R522 Y634 A654 L655 G660 V662	F482-F658 HydrophobicContact CB-CB 4.16Å; F482-F658 HydrophobicContact CB-CD2 3.92Å; F482-F658 HydrophobicContact CB-CG 4.23Å; P483-F658 WeakPolarHBondContact O-CE2 3.44Å; D484-F658 HydrophobicContact CB-CD2 4.32Å; F486-F658 AromaticContact CE1-CE2 3.55Å; F486-F658 HydrophobicContact CE1-CE2 3.55Å; F486-F658 AromaticContact CE1-CZ 3.75Å; F486-F658 HydrophobicContact CE1-CZ 3.75Å; F486-F658 HydrophobicContact CZ-CE2 4.22Å; F486-F658 HydrophobicContact CZ-CZ 4.15Å; R522-F658 PolarHBondContact NH2-O 2.85Å; Y634-F658 HydrophobicContact CD2-CD1 4.03Å; Y634-F658 AromaticContact CD2-CE1 3.41Å; Y634-F658 HydrophobicContact CD2-CE1 3.41Å; Y634-F658 VanDerWaalsContact CD2-CE1 3.41Å; Y634-F658 HydrophobicContact CD2-CE2 4.09Å; Y634-F658 AromaticContact CD2-CZ 3.47Å; Y634-F658 HydrophobicContact CD2-CZ 3.47Å; Y634-F658 VanDerWaalsContact CD2-CZ 3.47Å; Y634-F658 HydrophobicContact CE2-CD1 4.34Å; Y634-F658 HydrophobicContact CE2-CD2 4.14Å; Y634-F658 AromaticContact CE2-CE1 3.76Å; Y634-F658 HydrophobicContact CE2-CE1 3.76Å; Y634-F658 AromaticContact CE2-CE2 3.52Å; Y634-F658 HydrophobicContact CE2-CE2 3.52Å; Y634-F658 AromaticContact CE2-CZ 3.32Å; Y634-F658 HydrophobicContact CE2-CZ 3.32Å; A654-F658 PolarHBondContact O-N 3.35Å; L655-F658 PolarHBondContact O-N 3.46Å; F658-G660 WeakPolarHBondContact CD1-O 3.36Å; F658-G660 VanDerWaalsContact CE1-N 3.26Å; F658-G660 WeakPolarHBondContact CE1-O 3.44Å; F658-G660 VanDerWaalsContact CZ-CA 3.47Å; F658-V662 HydrophobicContact CD1-CG2 3.73Å; F658-V662 HydrophobicContact CE1-CG2 4.1Å
659	K	89.6	Confident	89.3	Confident	136 Å²	136	32.8 Å²	32.8	59%	0.591	15%	0.154	S	C	*	.			trans	-98.9	-3.7	-176.1	-65.8	177.9	-172.3	140.1	0	114.5	D484	D484-K659 HydrophobicContact CB-CB 4.35Å; D484-K659 HydrophobicContact CB-CG 4.47Å; D484-K659 WeakPolarHBondContact OD2-CD 3.08Å; D484-K659 VanDerWaalsContact OD2-CE 3.31Å; D484-K659 WeakPolarHBondContact OD2-CE 3.2Å; D484-K659 IonicContact OD2-NZ 3.6Å; D484-K659 PolarHBondContact OD2-NZ 3.2Å
660	G	90.4	Very high	89.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-93.2	-179.9	-179.2	0	0	0	0	0	111.9	F486 L519 R522 N632 F658	F486-G660 VanDerWaalsContact CZ-CA 3.44Å; L519-G660 CarbonylContact O-C 3.6Å; L519-G660 WeakPolarHBondContact O-CA 3.42Å; L519-G660 VanDerWaalsContact O-O 3.07Å; R522-G660 PolarHBondContact NH1-O 3.49Å; R522-G660 PolarHBondContact NH2-O 3.35Å; N632-G660 VanDerWaalsContact O-CA 3.28Å; N632-G660 WeakPolarHBondContact O-CA 3.33Å; F658-G660 WeakPolarHBondContact CD1-O 3.36Å; F658-G660 VanDerWaalsContact CE1-N 3.26Å; F658-G660 WeakPolarHBondContact CE1-O 3.44Å; F658-G660 VanDerWaalsContact CZ-CA 3.47Å
661	G	91.8	Very high	89.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	143.6	-178.3	0	0	0	0	0	111	L519 N632 F633 Y634	L519-G661 VanDerWaalsContact O-CA 3.25Å; L519-G661 WeakPolarHBondContact O-CA 3.36Å; L519-G661 PolarHBondContact O-N 3.31Å; N632-G661 PolarHBondContact O-N 3.27Å; F633-G661 CarbonylContact C-O 2.82Å; F633-G661 WeakPolarHBondContact CA-O 3.49Å; Y634-G661 PolarHBondContact N-O 3.06Å
662	V	93.8	Very high	89	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	125.2	178.4	-175.5	0	0	0	0	109.7	S521 I523 Y634 L655 F658	S521-V662 PolarHBondContact O-N 3.33Å; I523-V662 PolarHBondContact N-O 2.91Å; Y634-V662 WeakPolarHBondContact O-CA 3.39Å; L655-V662 HydrophobicContact CD2-CG1 4.29Å; L655-V662 HydrophobicContact CD2-CG2 4.32Å; F658-V662 HydrophobicContact CD1-CG2 3.73Å; F658-V662 HydrophobicContact CE1-CG2 4.1Å
663	I	93.7	Very high	88.8	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.2	165	-64.9	172.1	0	0	0	107.6	I523 I525 L537 L540 F633 Y634 I635 L636	I523-I663 HydrophobicContact CB-CG1 4.2Å; I523-I663 HydrophobicContact CD1-CG1 4.21Å; I523-I663 CarbonylContact O-C 3.56Å; I523-I663 WeakPolarHBondContact O-CA 3.38Å; I525-I663 HydrophobicContact CD1-CG2 3.71Å; I525-I663 HydrophobicContact CG1-CG2 4.07Å; L537-I663 HydrophobicContact CD2-CG2 3.93Å; L540-I663 HydrophobicContact CD1-CD1 3.71Å; F633-I663 HydrophobicContact CE1-CB 4.29Å; F633-I663 HydrophobicContact CE1-CD1 3.57Å; F633-I663 HydrophobicContact CE1-CG1 3.6Å; F633-I663 HydrophobicContact CZ-CD1 3.72Å; F633-I663 HydrophobicContact CZ-CG1 3.72Å; Y634-I663 PolarHBondContact O-N 2.97Å; I635-I663 CarbonylContact C-O 3.56Å; I635-I663 WeakPolarHBondContact CA-O 3.32Å; I635-I663 HydrophobicContact CG1-CB 4.31Å; L636-I663 PolarHBondContact N-O 2.96Å
664	L	92.6	Very high	88.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.1	-179.5	-179.5	68.3	0	0	0	109.3	I523 C524 I525 L636 P639 L671	I523-L664 PolarHBondContact O-N 3.47Å; C524-L664 CarbonylContact C-O 3.52Å; C524-L664 VanDerWaalsContact CA-O 3.23Å; C524-L664 WeakPolarHBondContact CA-O 3.31Å; I525-L664 PolarHBondContact N-O 3.27Å; L636-L664 HydrophobicContact CB-CD1 3.9Å; L636-L664 HydrophobicContact CD1-CD1 4.34Å; L636-L664 CarbonylContact O-C 3.51Å; P639-L664 HydrophobicContact CG-CD1 3.34Å; L664-L671 HydrophobicContact CD1-CD2 4.06Å; L664-L671 HydrophobicContact CD2-CD2 3.78Å; L664-L671 HydrophobicContact CD2-CG 3.79Å
665	V	90.6	Very high	88.6	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.1	160.3	-170.7	0	0	0	0	105.6	I525 K533 L537 L636 E638 P639	I525-V665 HydrophobicContact CB-CG2 4.18Å; K533-V665 HydrophobicContact CB-CG1 4.25Å; K533-V665 HydrophobicContact CD-CG1 3.92Å; L537-V665 HydrophobicContact CD1-CG2 3.73Å; L537-V665 HydrophobicContact CD2-CG2 4.11Å; L537-V665 HydrophobicContact CG-CG2 4.21Å; L636-V665 PolarHBondContact O-N 3.39Å; E638-V665 VanDerWaalsContact CA-O 3.24Å; E638-V665 WeakPolarHBondContact CA-O 3.42Å; E638-V665 PolarHBondContact N-O 2.89Å; P639-V665 VanDerWaalsContact CD-O 3.3Å; P639-V665 WeakPolarHBondContact CD-O 3.38Å
666	S	86.8	Confident	88.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.169	C	C	.	.			trans	-156.2	147.7	-176.5	177.5	0	0	0	0	109.4	D668 I672	S666-D668 WeakPolarHBondContact OG-CB 3.38Å; S666-D668 PolarHBondContact OG-N 3.01Å; S666-I672 WeakPolarHBondContact O-CD1 3.33Å
667	H	80.8	Confident	88.3	Confident	22 Å²	22	41.4 Å²	41.4	10%	0.102	18%	0.182	C	C	.	.			trans	-96.5	-10.3	167.2	-63.9	-57.9	0	0	0	113.5	L360 D361 I362 I365 K533 E638 E669	L360-H667 PolarHBondContact O-CD2 3.21Å; D361-H667 IonicContact OD1-CE1 3.23Å; D361-H667 PolarHBondContact OD1-CE1 3.1Å; D361-H667 IonicContact OD1-NE2 2.81Å; D361-H667 PolarHBondContact OD1-NE2 3.5Å; I362-H667 HydrophobicContact CG1-CB 4.29Å; I365-H667 HydrophobicContact CD1-CB 4.25Å; K533-H667 PolarHBondContact NZ-CE1 3.11Å; K533-H667 PolarHBondContact NZ-NE2 3.16Å; E638-H667 IonicContact OE1-CD2 3.72Å; E638-H667 PolarHBondContact OE1-CD2 3.25Å; E638-H667 IonicContact OE1-CE1 2.92Å; E638-H667 IonicContact OE1-CG 3.69Å; E638-H667 IonicContact OE1-NE2 2.9Å; E638-H667 PolarHBondContact OE1-NE2 2.94Å; E638-H667 IonicContact OE2-CD2 3.16Å; E638-H667 PolarHBondContact OE2-N 2.94Å; H667-E669 PolarHBondContact O-N 3.42Å
668	D	82.3	Confident	88.2	Confident	22 Å²	22	34.9 Å²	34.9	12%	0.118	16%	0.155	C	C	.	.			trans	-73.4	106	177.5	-175.2	-35.8	0	0	0	111.6	T640 S666 R670 L671 I672	T640-D668 HydrophobicContact CG2-CB 3.93Å; S666-D668 WeakPolarHBondContact OG-CB 3.38Å; S666-D668 PolarHBondContact OG-N 3.01Å; D668-R670 VanDerWaalsContact C-N 3.28Å; D668-R670 PolarHBondContact O-N 3.16Å; D668-R670 WeakPolarHBondContact OD1-CA 3.35Å; D668-R670 WeakPolarHBondContact OD1-CB 3.23Å; D668-R670 PolarHBondContact OD1-N 3.09Å; D668-L671 HydrophobicContact CB-CB 4.04Å; D668-L671 PolarHBondContact O-N 2.93Å; D668-L671 PolarHBondContact OD1-N 3.02Å; D668-I672 WeakPolarHBondContact O-CD1 3.38Å; D668-I672 WeakPolarHBondContact O-CG1 3.39Å; D668-I672 PolarHBondContact O-N 3.35Å; D668-I672 VanDerWaalsContact O-N 3.1Å
669	E	82.1	Confident	88.2	Confident	28 Å²	28	34.8 Å²	34.8	13%	0.131	15%	0.154	C	C	.	.	H	α-helix	trans	-54.3	-40.4	178.1	170.7	173.4	-169.7	0	0	113	N387 H667 I672 R673 F694 R698	N387-E669 PolarHBondContact ND2-OE2 3.4Å; H667-E669 PolarHBondContact O-N 3.42Å; E669-I672 PolarHBondContact O-N 3.03Å; E669-R673 HydrophobicContact CG-CG 4.31Å; E669-R673 WeakPolarHBondContact O-CB 3.44Å; E669-R673 VanDerWaalsContact O-CG 3.24Å; E669-R673 WeakPolarHBondContact O-CG 3.3Å; E669-R673 PolarHBondContact O-N 2.98Å; E669-R673 IonicContact OE1-CZ 2.72Å; E669-R673 IonicContact OE1-NE 3.9Å; E669-R673 PolarHBondContact OE1-NE 3.28Å; E669-R673 IonicContact OE1-NH1 3.99Å; E669-R673 IonicContact OE1-NH2 3.71Å; E669-R673 PolarHBondContact OE1-NH2 2.83Å; E669-F694 HydrophobicContact CB-CD1 4.47Å; E669-F694 HydrophobicContact CB-CE1 3.8Å; E669-F694 HydrophobicContact CB-CE2 4.35Å; E669-F694 HydrophobicContact CB-CZ 3.72Å; E669-F694 HydrophobicContact CG-CD1 3.69Å; E669-F694 HydrophobicContact CG-CE1 3.35Å; E669-F694 HydrophobicContact CG-CG 4.42Å; E669-F694 HydrophobicContact CG-CZ 3.83Å; E669-F694 WeakPolarHBondContact OE1-CE1 3.22Å; E669-R698 IonicContact OE1-NH1 3.9Å
670	R	82.2	Confident	88.3	Confident	89 Å²	89	28.7 Å²	28.7	34%	0.336	13%	0.128	S	C	.	.	H	α-helix	trans	-70.5	-43.7	-176.4	178.5	-178.7	168.2	82.5	-0.3	110.6	E649 D668 I672 R673 L674	E649-R670 IonicContact OE1-CZ 3.63Å; E649-R670 IonicContact OE1-NE 2.76Å; E649-R670 IonicContact OE1-NH2 3.81Å; E649-R670 PolarHBondContact OE1-NH2 3.48Å; D668-R670 VanDerWaalsContact C-N 3.28Å; D668-R670 PolarHBondContact O-N 3.16Å; D668-R670 WeakPolarHBondContact OD1-CA 3.35Å; D668-R670 WeakPolarHBondContact OD1-CB 3.23Å; D668-R670 PolarHBondContact OD1-N 3.09Å; R670-I672 VanDerWaalsContact C-N 3.3Å; R670-I672 PolarHBondContact O-N 3.44Å; R670-R673 PolarHBondContact O-N 3.41Å; R670-L674 HydrophobicContact CG-CD1 3.84Å; R670-L674 HydrophobicContact CG-CG 4.38Å; R670-L674 WeakPolarHBondContact O-CB 3.49Å; R670-L674 VanDerWaalsContact O-CG 3.24Å; R670-L674 WeakPolarHBondContact O-CG 3.38Å; R670-L674 PolarHBondContact O-N 3.14Å
671	L	86.9	Confident	88.2	Confident	1 Å²	1	29 Å²	29	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-43.7	176	-178	64.6	0	0	0	110.7	P639 T640 I648 L651 A652 L664 D668 L674 V675	P639-L671 HydrophobicContact CG-CD2 4.26Å; T640-L671 HydrophobicContact CG2-CD2 3.5Å; T640-L671 VanDerWaalsContact CG2-CD2 3.5Å; I648-L671 HydrophobicContact CG2-CB 4.44Å; L651-L671 HydrophobicContact CD2-CD2 4.44Å; A652-L671 HydrophobicContact CB-CD1 3.72Å; L664-L671 HydrophobicContact CD1-CD2 4.06Å; L664-L671 HydrophobicContact CD2-CD2 3.78Å; L664-L671 HydrophobicContact CD2-CG 3.79Å; D668-L671 HydrophobicContact CB-CB 4.04Å; D668-L671 PolarHBondContact O-N 2.93Å; D668-L671 PolarHBondContact OD1-N 3.02Å; L671-L674 PolarHBondContact O-N 3.38Å; L671-V675 HydrophobicContact CD1-CG2 3.9Å; L671-V675 WeakPolarHBondContact O-CB 3.45Å; L671-V675 WeakPolarHBondContact O-CG2 3.45Å; L671-V675 PolarHBondContact O-N 3.25Å
672	I	88.6	Confident	88	Confident	5 Å²	5	29 Å²	29	3%	0.026	13%	0.13	C	C	.	.	H	α-helix	trans	-61	-51.5	177.9	-62.7	165.5	0	0	0	110.2	C524 V526 S666 D668 E669 R670 L674 V675 C676 L679 F694	C524-I672 HydrophobicContact CB-CG2 3.96Å; C524-I672 VanDerWaalsContact SG-CG1 3.59Å; V526-I672 HydrophobicContact CG1-CD1 4.38Å; S666-I672 WeakPolarHBondContact O-CD1 3.33Å; D668-I672 WeakPolarHBondContact O-CD1 3.38Å; D668-I672 WeakPolarHBondContact O-CG1 3.39Å; D668-I672 PolarHBondContact O-N 3.35Å; D668-I672 VanDerWaalsContact O-N 3.1Å; E669-I672 PolarHBondContact O-N 3.03Å; R670-I672 VanDerWaalsContact C-N 3.3Å; R670-I672 PolarHBondContact O-N 3.44Å; I672-L674 VanDerWaalsContact C-N 3.29Å; I672-L674 PolarHBondContact O-N 2.78Å; I672-V675 PolarHBondContact O-N 3.28Å; I672-C676 HydrophobicContact CG2-CB 4.15Å; I672-C676 WeakPolarHBondContact O-CA 3.24Å; I672-C676 VanDerWaalsContact O-CB 3.27Å; I672-C676 WeakPolarHBondContact O-CB 3.37Å; I672-C676 PolarHBondContact O-N 2.88Å; I672-L679 HydrophobicContact CG2-CD1 4.4Å; I672-F694 HydrophobicContact CD1-CD2 4.08Å; I672-F694 HydrophobicContact CD1-CE2 3.9Å; I672-F694 HydrophobicContact CG2-CD2 4.06Å
673	R	87.6	Confident	87.5	Confident	124 Å²	124	31.4 Å²	31.4	47%	0.468	14%	0.142	S	C	.	.	H	α-helix	trans	-62.4	-33.9	-179.7	-74.7	174.8	169.9	-153.1	-6	113.4	E669 R670 F694 D695	E669-R673 HydrophobicContact CG-CG 4.31Å; E669-R673 WeakPolarHBondContact O-CB 3.44Å; E669-R673 VanDerWaalsContact O-CG 3.24Å; E669-R673 WeakPolarHBondContact O-CG 3.3Å; E669-R673 PolarHBondContact O-N 2.98Å; E669-R673 IonicContact OE1-CZ 2.72Å; E669-R673 IonicContact OE1-NE 3.9Å; E669-R673 PolarHBondContact OE1-NE 3.28Å; E669-R673 IonicContact OE1-NH1 3.99Å; E669-R673 IonicContact OE1-NH2 3.71Å; E669-R673 PolarHBondContact OE1-NH2 2.83Å; R670-R673 PolarHBondContact O-N 3.41Å; R673-F694 HydrophobicContact CG-CB 4.34Å; R673-D695 IonicContact CZ-OD1 3.4Å; R673-D695 IonicContact NH2-OD1 3.78Å; R673-D695 PolarHBondContact NH2-OD1 3.5Å; R673-D695 IonicContact NH2-OD2 2.62Å
674	L	87.3	Confident	86.7	Confident	73 Å²	73	36.6 Å²	36.6	38%	0.382	18%	0.178	S	C	.	.	H	α-helix	trans	-77.3	-36.8	-179.3	-74.2	173.5	0	0	0	112.5	A652 N656 R670 L671 I672	A652-L674 HydrophobicContact CB-CB 4.19Å; A652-L674 HydrophobicContact CB-CD1 3.87Å; N656-L674 PolarHBondContact ND2-O 2.99Å; N656-L674 PolarHBondContact OD1-O 3.16Å; R670-L674 HydrophobicContact CG-CD1 3.84Å; R670-L674 HydrophobicContact CG-CG 4.38Å; R670-L674 WeakPolarHBondContact O-CB 3.49Å; R670-L674 VanDerWaalsContact O-CG 3.24Å; R670-L674 WeakPolarHBondContact O-CG 3.38Å; R670-L674 PolarHBondContact O-N 3.14Å; L671-L674 PolarHBondContact O-N 3.38Å; I672-L674 VanDerWaalsContact C-N 3.29Å; I672-L674 PolarHBondContact O-N 2.78Å
675	V	89.3	Confident	86.1	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.024	19%	0.187	C	C	.	.	H	α-helix	trans	-104.5	-41.4	-169.6	179.6	0	0	0	0	112.9	R522 A652 L655 N656 L671 I672	R522-V675 VanDerWaalsContact CB-O 3.25Å; R522-V675 WeakPolarHBondContact CB-O 3.42Å; R522-V675 WeakPolarHBondContact CG-O 3.24Å; A652-V675 HydrophobicContact CB-CG2 4.14Å; L655-V675 HydrophobicContact CB-CG1 3.87Å; L655-V675 HydrophobicContact CB-CG2 4.05Å; L655-V675 HydrophobicContact CD1-CG1 4.26Å; L655-V675 HydrophobicContact CD1-CG2 4.3Å; N656-V675 WeakPolarHBondContact OD1-CA 3.42Å; L671-V675 HydrophobicContact CD1-CG2 3.9Å; L671-V675 WeakPolarHBondContact O-CB 3.45Å; L671-V675 WeakPolarHBondContact O-CG2 3.45Å; L671-V675 PolarHBondContact O-N 3.25Å; I672-V675 PolarHBondContact O-N 3.28Å
676	C	88.7	Confident	85.8	Confident	22 Å²	22	43.4 Å²	43.4	15%	0.149	21%	0.213	C	C	.	.			trans	-92.1	137.8	-165.5	-56.6	0	0	0	0	111.5	C524 I672	C524-C676 HydrophobicContact CB-CB 3.74Å; C524-C676 VanDerWaalsContact CB-SG 3.58Å; I672-C676 HydrophobicContact CG2-CB 4.15Å; I672-C676 WeakPolarHBondContact O-CA 3.24Å; I672-C676 VanDerWaalsContact O-CB 3.27Å; I672-C676 WeakPolarHBondContact O-CB 3.37Å; I672-C676 PolarHBondContact O-N 2.88Å
677	K	87.4	Confident	85.8	Confident	163 Å²	163	44.4 Å²	44.4	71%	0.709	22%	0.219	S	C	*	.	S	Bend	trans	-106.5	-24	175.8	-64.4	179.7	-179.4	176.2	0	111.8	R522	R522-K677 HydrophobicContact CB-CB 4.33Å; R522-K677 HydrophobicContact CB-CG 4.19Å; R522-K677 PolarHBondContact O-N 3.41Å
678	E	89.1	Confident	86.1	Confident	36 Å²	36	48.6 Å²	48.6	17%	0.168	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139.1	-177	-50.2	-171.3	160.9	0	0	108.8	R522 I523 C524 R689	R522-E678 PolarHBondContact O-N 3.03Å; R522-E678 VanDerWaalsContact O-N 3.07Å; I523-E678 WeakPolarHBondContact CA-O 3.4Å; I523-E678 HydrophobicContact CG1-CB 4.31Å; C524-E678 PolarHBondContact N-O 3.12Å; E678-R689 VanDerWaalsContact CD-NH2 3.25Å; E678-R689 IonicContact OE1-CZ 2.86Å; E678-R689 IonicContact OE1-NH1 3.83Å; E678-R689 PolarHBondContact OE1-NH1 3.21Å; E678-R689 IonicContact OE1-NH2 3.75Å; E678-R689 PolarHBondContact OE1-NH2 3.42Å; E678-R689 IonicContact OE2-CZ 2.6Å; E678-R689 IonicContact OE2-NH1 3.57Å; E678-R689 PolarHBondContact OE2-NH1 2.97Å
679	L	90.7	Very high	86.4	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.1	179	-170.3	72.8	0	0	0	109.1	C524 V526 I672 V681 R689 V690 Y697	C524-L679 HydrophobicContact CB-CD1 3.68Å; C524-L679 CarbonylContact O-C 3.55Å; C524-L679 WeakPolarHBondContact O-CA 3.35Å; V526-L679 HydrophobicContact CB-CD1 4.26Å; V526-L679 HydrophobicContact CG1-CD1 3.6Å; V526-L679 HydrophobicContact CG2-CD1 3.66Å; V526-L679 HydrophobicContact CG2-CD2 3.99Å; V526-L679 HydrophobicContact CG2-CG 3.76Å; I672-L679 HydrophobicContact CG2-CD1 4.4Å; L679-V681 HydrophobicContact CD2-CG2 4.45Å; L679-R689 CarbonylContact O-C 3.59Å; L679-R689 WeakPolarHBondContact O-CA 3.48Å; L679-V690 HydrophobicContact CB-CB 4.33Å; L679-V690 HydrophobicContact CD2-CB 4.38Å; L679-V690 PolarHBondContact O-N 3.01Å; L679-Y697 VanDerWaalsContact CD2-CB 3.42Å; L679-Y697 HydrophobicContact CD2-CD1 4.11Å; L679-Y697 HydrophobicContact CD2-CD2 4.35Å; L679-Y697 HydrophobicContact CD2-CG 3.71Å
680	W	90.9	Very high	86.6	Confident	8 Å²	8	52.6 Å²	52.6	3%	0.03	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	114.8	175.6	-68.9	1.8	0	0	0	108.7	L515 S516 I523 C524 I525 V526 V687 W688	L515-W680 HydrophobicContact CB-CH2 3.78Å; L515-W680 HydrophobicContact CB-CZ2 4.44Å; L515-W680 HydrophobicContact CB-CZ3 3.93Å; L515-W680 HydrophobicContact CD1-CE3 4Å; L515-W680 HydrophobicContact CD1-CH2 4.48Å; L515-W680 HydrophobicContact CD1-CZ3 3.78Å; L515-W680 HydrophobicContact CD2-CD2 3.92Å; L515-W680 HydrophobicContact CD2-CE3 3.8Å; L515-W680 HydrophobicContact CD2-CH2 4.07Å; L515-W680 HydrophobicContact CD2-CZ2 4.18Å; L515-W680 HydrophobicContact CD2-CZ3 3.89Å; L515-W680 HydrophobicContact CG-CE3 4.38Å; L515-W680 HydrophobicContact CG-CH2 4.32Å; L515-W680 HydrophobicContact CG-CZ3 4.07Å; S516-W680 WeakPolarHBondContact O-CZ2 3.41Å; I523-W680 HydrophobicContact CD1-CH2 3.7Å; I523-W680 HydrophobicContact CD1-CZ2 3.48Å; I523-W680 VanDerWaalsContact CD1-CZ2 3.48Å; I523-W680 HydrophobicContact CD1-CZ3 4.45Å; I523-W680 HydrophobicContact CG1-CZ2 4.03Å; I523-W680 HydrophobicContact CG2-CB 4.41Å; I523-W680 HydrophobicContact CG2-CD2 3.39Å; I523-W680 HydrophobicContact CG2-CE3 3.69Å; I523-W680 HydrophobicContact CG2-CG 3.73Å; I523-W680 HydrophobicContact CG2-CH2 4.32Å; I523-W680 HydrophobicContact CG2-CZ2 4.07Å; I523-W680 HydrophobicContact CG2-CZ3 4.14Å; C524-W680 PolarHBondContact O-N 3.36Å; I525-W680 CarbonylContact C-O 3.56Å; I525-W680 WeakPolarHBondContact CA-O 3.31Å; I525-W680 HydrophobicContact CD1-CE3 4.3Å; I525-W680 HydrophobicContact CG1-CB 4.33Å; I525-W680 HydrophobicContact CG1-CE3 4.15Å; V526-W680 PolarHBondContact N-O 2.97Å; W680-V687 HydrophobicContact CB-CG1 3.95Å; W680-V687 HydrophobicContact CG-CG1 4.47Å; W680-W688 WeakPolarHBondContact CA-O 3.49Å
681	V	89.6	Confident	86.3	Confident	7 Å²	7	54.3 Å²	54.3	4%	0.042	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.5	179	-178.7	0	0	0	0	108.5	V526 L679 D683 V687 W688 V690 Y697	V526-V681 HydrophobicContact CG2-CB 4.45Å; V526-V681 HydrophobicContact CG2-CG2 3.82Å; V526-V681 WeakPolarHBondContact O-CA 3.32Å; L679-V681 HydrophobicContact CD2-CG2 4.45Å; V681-D683 HydrophobicContact CG1-CB 4.44Å; V681-V687 VanDerWaalsContact O-CA 3.32Å; V681-V687 WeakPolarHBondContact O-CA 3.05Å; V681-W688 HydrophobicContact CB-CD2 4.33Å; V681-W688 HydrophobicContact CB-CZ2 4.08Å; V681-W688 HydrophobicContact CG1-CH2 4.15Å; V681-W688 HydrophobicContact CG1-CZ2 3.67Å; V681-W688 PolarHBondContact N-O 3.48Å; V681-W688 PolarHBondContact O-N 2.83Å; V681-W688 VanDerWaalsContact O-N 3.14Å; V681-V690 HydrophobicContact CB-CG2 4.49Å; V681-V690 HydrophobicContact CG2-CG2 3.49Å; V681-V690 VanDerWaalsContact CG2-CG2 3.49Å; V681-Y697 HydrophobicContact CB-CE2 4.38Å; V681-Y697 HydrophobicContact CG1-CD2 4.43Å; V681-Y697 HydrophobicContact CG1-CE2 3.76Å; V681-Y697 HydrophobicContact CG2-CD2 3.55Å; V681-Y697 HydrophobicContact CG2-CE2 3.64Å; V681-Y697 HydrophobicContact CG2-CG 4.45Å
682	C	87.4	Confident	85.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	109.3	175.5	-176.8	0	0	0	0	109.1	I525 V526 G527 A531 I536 V687	I525-C682 HydrophobicContact CG2-CB 4.46Å; V526-C682 PolarHBondContact O-N 3.07Å; G527-C682 WeakPolarHBondContact CA-O 3.44Å; A531-C682 PolarHBondContact O-SG 2.89Å; I536-C682 HydrophobicContact CD1-CB 4.27Å; C682-V687 HydrophobicContact CB-CG2 4.16Å
683	D	83.6	Confident	85.2	Confident	50 Å²	50	57.1 Å²	57.1	27%	0.267	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	144.6	179.7	172.4	29.6	0	0	0	110.6	V681 G685 K686 W688	V681-D683 HydrophobicContact CG1-CB 4.44Å; D683-G685 PolarHBondContact O-N 3.14Å; D683-K686 PolarHBondContact N-O 3.06Å; D683-K686 VanDerWaalsContact N-O 3.07Å; D683-K686 PolarHBondContact O-N 2.86Å; D683-W688 HydrophobicContact CB-CH2 3.58Å; D683-W688 HydrophobicContact CB-CZ3 3.94Å
684	S	77.3	Confident	85	Confident	110 Å²	110	51.9 Å²	51.9	77%	0.769	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	35	173.1	-62.6	0	0	0	0	114.3	K686	S684-K686 VanDerWaalsContact C-N 3.33Å; S684-K686 PolarHBondContact O-N 2.96Å
685	G	78.3	Confident	84.7	Confident	17 Å²	17	52 Å²	52	18%	0.175	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	15.1	178	0	0	0	0	0	115.9	L509 F510 S511 D683	L509-G685 WeakPolarHBondContact O-CA 3.35Å; F510-G685 WeakPolarHBondContact CA-O 3.41Å; S511-G685 PolarHBondContact N-O 3.41Å; D683-G685 PolarHBondContact O-N 3.14Å
686	K	84.7	Confident	84.5	Confident	128 Å²	128	56 Å²	56	56%	0.557	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	157.9	172.2	-64.8	-175.6	-178.5	-179.5	0	110.4	D683 S684 W688	D683-K686 PolarHBondContact N-O 3.06Å; D683-K686 VanDerWaalsContact N-O 3.07Å; D683-K686 PolarHBondContact O-N 2.86Å; S684-K686 VanDerWaalsContact C-N 3.33Å; S684-K686 PolarHBondContact O-N 2.96Å; K686-W688 HydrophobicContact CB-CE3 4.34Å; K686-W688 HydrophobicContact CB-CZ3 4.44Å
687	V	88.3	Confident	84.3	Confident	21 Å²	21	55.8 Å²	55.8	13%	0.127	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.5	171.6	-177.5	0	0	0	0	107.9	F510 L513 L515 I536 W680 V681 C682	F510-V687 HydrophobicContact CE1-CG2 4.41Å; L513-V687 HydrophobicContact CD2-CB 3.66Å; L513-V687 HydrophobicContact CD2-CG2 3.44Å; L513-V687 VanDerWaalsContact CD2-CG2 3.44Å; L515-V687 HydrophobicContact CD1-CB 4.49Å; L515-V687 HydrophobicContact CD1-CG1 4.27Å; L515-V687 HydrophobicContact CD2-CB 4.33Å; L515-V687 HydrophobicContact CD2-CG1 3.82Å; I536-V687 HydrophobicContact CD1-CG2 3.53Å; W680-V687 HydrophobicContact CB-CG1 3.95Å; W680-V687 HydrophobicContact CG-CG1 4.47Å; V681-V687 VanDerWaalsContact O-CA 3.32Å; V681-V687 WeakPolarHBondContact O-CA 3.05Å; C682-V687 HydrophobicContact CB-CG2 4.16Å
688	W	86.9	Confident	84	Confident	110 Å²	110	51.5 Å²	51.5	42%	0.417	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	157	175	64.9	92.1	0	0	0	110.9	W680 V681 D683 K686	W680-W688 WeakPolarHBondContact CA-O 3.49Å; V681-W688 HydrophobicContact CB-CD2 4.33Å; V681-W688 HydrophobicContact CB-CZ2 4.08Å; V681-W688 HydrophobicContact CG1-CH2 4.15Å; V681-W688 HydrophobicContact CG1-CZ2 3.67Å; V681-W688 PolarHBondContact N-O 3.48Å; V681-W688 PolarHBondContact O-N 2.83Å; V681-W688 VanDerWaalsContact O-N 3.14Å; D683-W688 HydrophobicContact CB-CH2 3.58Å; D683-W688 HydrophobicContact CB-CZ3 3.94Å; K686-W688 HydrophobicContact CB-CE3 4.34Å; K686-W688 HydrophobicContact CB-CZ3 4.44Å
689	R	87.8	Confident	83.8	Confident	124 Å²	124	53.6 Å²	53.6	47%	0.468	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	138.5	178.7	179.3	-179.8	167.1	139.4	9.2	110.2	E678 L679 D691	E678-R689 VanDerWaalsContact CD-NH2 3.25Å; E678-R689 IonicContact OE1-CZ 2.86Å; E678-R689 IonicContact OE1-NH1 3.83Å; E678-R689 PolarHBondContact OE1-NH1 3.21Å; E678-R689 IonicContact OE1-NH2 3.75Å; E678-R689 PolarHBondContact OE1-NH2 3.42Å; E678-R689 IonicContact OE2-CZ 2.6Å; E678-R689 IonicContact OE2-NH1 3.57Å; E678-R689 PolarHBondContact OE2-NH1 2.97Å; L679-R689 CarbonylContact O-C 3.59Å; L679-R689 WeakPolarHBondContact O-CA 3.48Å; R689-D691 IonicContact CZ-OD1 2.72Å; R689-D691 IonicContact NE-OD1 3.98Å; R689-D691 PolarHBondContact NE-OD1 2.62Å; R689-D691 IonicContact NH2-OD1 3.56Å
690	V	86	Confident	83.5	Confident	9 Å²	9	56.6 Å²	56.6	6%	0.055	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.6	171.5	178	0	0	0	0	108.2	L679 V681 E696	L679-V690 HydrophobicContact CB-CB 4.33Å; L679-V690 HydrophobicContact CD2-CB 4.38Å; L679-V690 PolarHBondContact O-N 3.01Å; V681-V690 HydrophobicContact CB-CG2 4.49Å; V681-V690 HydrophobicContact CG2-CG2 3.49Å; V681-V690 VanDerWaalsContact CG2-CG2 3.49Å; V690-E696 HydrophobicContact CG1-CB 4.16Å; V690-E696 HydrophobicContact CG1-CG 4.21Å; V690-E696 WeakPolarHBondContact CG1-OE2 3.41Å
691	D	76.8	Confident	83	Confident	126 Å²	126	56.6 Å²	56.6	67%	0.674	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-27.4	-174.2	-69.6	-36.6	0	0	0	113	R689 G693	R689-D691 IonicContact CZ-OD1 2.72Å; R689-D691 IonicContact NE-OD1 3.98Å; R689-D691 PolarHBondContact NE-OD1 2.62Å; R689-D691 IonicContact NH2-OD1 3.56Å; D691-G693 PolarHBondContact O-N 3.01Å
692	G	71.4	Confident	82.5	Confident	43 Å²	43	59.6 Å²	59.6	44%	0.443	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	11.4	174.7	0	0	0	0	0	114.7	E696	G692-E696 WeakPolarHBondContact CA-OE2 3.32Å; G692-E696 PolarHBondContact N-OE2 3.17Å
693	G	81.2	Confident	82.3	Confident	21 Å²	21	65 Å²	65	22%	0.216	34%	0.336	C	S	.	.	H	α-helix	trans	67.1	-148.2	174.9	0	0	0	0	0	113.6	D691 Y697	D691-G693 PolarHBondContact O-N 3.01Å; G693-Y697 PolarHBondContact O-N 3.42Å
694	F	81.6	Confident	82.1	Confident	15 Å²	15	66 Å²	66	7%	0.066	34%	0.339	C	S	.	.	H	α-helix	trans	-73	-32	-173.7	-170.3	-91.4	0	0	0	113.5	I362 E669 I672 R673 Y697 R698	I362-F694 HydrophobicContact CD1-CE2 3.82Å; I362-F694 HydrophobicContact CD1-CZ 4.37Å; I362-F694 HydrophobicContact CG2-CZ 4.15Å; E669-F694 HydrophobicContact CB-CD1 4.47Å; E669-F694 HydrophobicContact CB-CE1 3.8Å; E669-F694 HydrophobicContact CB-CE2 4.35Å; E669-F694 HydrophobicContact CB-CZ 3.72Å; E669-F694 HydrophobicContact CG-CD1 3.69Å; E669-F694 HydrophobicContact CG-CE1 3.35Å; E669-F694 HydrophobicContact CG-CG 4.42Å; E669-F694 HydrophobicContact CG-CZ 3.83Å; E669-F694 WeakPolarHBondContact OE1-CE1 3.22Å; I672-F694 HydrophobicContact CD1-CD2 4.08Å; I672-F694 HydrophobicContact CD1-CE2 3.9Å; I672-F694 HydrophobicContact CG2-CD2 4.06Å; R673-F694 HydrophobicContact CG-CB 4.34Å; F694-Y697 PolarHBondContact O-N 3.27Å; F694-R698 HydrophobicContact CE1-CB 4.43Å; F694-R698 PolarHBondContact O-N 3.38Å
695	D	82.1	Confident	81.9	Confident	74 Å²	74	61 Å²	61	40%	0.396	30%	0.304	S	S	.	.	H	α-helix	trans	-66.8	-46.8	-177.1	-71.1	-33	0	0	0	111.6	R673 Y697 R698 D699	R673-D695 IonicContact CZ-OD1 3.4Å; R673-D695 IonicContact NH2-OD1 3.78Å; R673-D695 PolarHBondContact NH2-OD1 3.5Å; R673-D695 IonicContact NH2-OD2 2.62Å; D695-Y697 VanDerWaalsContact C-N 3.28Å; D695-Y697 PolarHBondContact O-N 3.38Å; D695-R698 PolarHBondContact O-N 2.95Å; D695-R698 VanDerWaalsContact O-N 3.17Å; D695-D699 PolarHBondContact O-N 2.94Å
696	E	84.5	Confident	81.7	Confident	89 Å²	89	66.7 Å²	66.7	42%	0.416	32%	0.323	S	S	.	.	H	α-helix	trans	-60.1	-40.9	174.7	-173.9	177.6	-162	0	0	111.1	V690 G692 R698 D699 I700	V690-E696 HydrophobicContact CG1-CB 4.16Å; V690-E696 HydrophobicContact CG1-CG 4.21Å; V690-E696 WeakPolarHBondContact CG1-OE2 3.41Å; G692-E696 WeakPolarHBondContact CA-OE2 3.32Å; G692-E696 PolarHBondContact N-OE2 3.17Å; E696-R698 PolarHBondContact O-N 2.92Å; E696-D699 PolarHBondContact O-N 3.48Å; E696-I700 HydrophobicContact CG-CD1 4.12Å; E696-I700 WeakPolarHBondContact O-CD1 3.34Å; E696-I700 VanDerWaalsContact O-CG1 3.22Å; E696-I700 WeakPolarHBondContact O-CG1 3.33Å; E696-I700 PolarHBondContact O-N 3.25Å
697	Y	83.8	Confident	81.2	Confident	18 Å²	18	68.5 Å²	68.5	7%	0.071	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-42.1	175.6	179.3	-114.6	0	0	0	112.8	I362 V526 L679 V681 G693 F694 D695 D699 I700 L701	I362-Y697 HydrophobicContact CD1-CE1 3.96Å; I362-Y697 HydrophobicContact CG2-CE1 4.46Å; V526-Y697 HydrophobicContact CB-CE1 4.06Å; V526-Y697 HydrophobicContact CG2-CD1 4.13Å; V526-Y697 HydrophobicContact CG2-CD2 4.36Å; V526-Y697 HydrophobicContact CG2-CE1 3.74Å; V526-Y697 HydrophobicContact CG2-CE2 4.01Å; V526-Y697 HydrophobicContact CG2-CG 4.42Å; L679-Y697 VanDerWaalsContact CD2-CB 3.42Å; L679-Y697 HydrophobicContact CD2-CD1 4.11Å; L679-Y697 HydrophobicContact CD2-CD2 4.35Å; L679-Y697 HydrophobicContact CD2-CG 3.71Å; V681-Y697 HydrophobicContact CB-CE2 4.38Å; V681-Y697 HydrophobicContact CG1-CD2 4.43Å; V681-Y697 HydrophobicContact CG1-CE2 3.76Å; V681-Y697 HydrophobicContact CG2-CD2 3.55Å; V681-Y697 HydrophobicContact CG2-CE2 3.64Å; V681-Y697 HydrophobicContact CG2-CG 4.45Å; G693-Y697 PolarHBondContact O-N 3.42Å; F694-Y697 PolarHBondContact O-N 3.27Å; D695-Y697 VanDerWaalsContact C-N 3.28Å; D695-Y697 PolarHBondContact O-N 3.38Å; Y697-D699 VanDerWaalsContact C-N 3.34Å; Y697-D699 PolarHBondContact O-N 3.32Å; Y697-I700 PolarHBondContact O-N 3.48Å; Y697-L701 HydrophobicContact CD1-CD1 4.06Å; Y697-L701 HydrophobicContact CE1-CD1 3.53Å; Y697-L701 HydrophobicContact CE1-CG 4.25Å; Y697-L701 HydrophobicContact CE2-CD1 4.38Å; Y697-L701 HydrophobicContact CE2-CD2 4.38Å; Y697-L701 HydrophobicContact CE2-CG 4.24Å; Y697-L701 WeakPolarHBondContact O-CG 3.4Å; Y697-L701 PolarHBondContact O-N 3.34Å
698	R	82.4	Confident	80.3	Confident	73 Å²	73	71.9 Å²	71.9	28%	0.275	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-41.1	176.3	-171	-176.5	68.2	-177.3	0.5	111.4	L366 E669 F694 D695 E696 L701 Q702	L366-R698 HydrophobicContact CD1-CG 4.18Å; E669-R698 IonicContact OE1-NH1 3.9Å; F694-R698 HydrophobicContact CE1-CB 4.43Å; F694-R698 PolarHBondContact O-N 3.38Å; D695-R698 PolarHBondContact O-N 2.95Å; D695-R698 VanDerWaalsContact O-N 3.17Å; E696-R698 PolarHBondContact O-N 2.92Å; R698-L701 PolarHBondContact O-N 3.02Å; R698-Q702 WeakPolarHBondContact O-CG 3.41Å; R698-Q702 PolarHBondContact O-N 3.41Å
699	D	84.3	Confident	79	Confident	80 Å²	80	69.6 Å²	69.6	43%	0.428	36%	0.356	S	S	.	.	H	α-helix	trans	-66	-41.4	178.4	-67.8	-13.1	0	0	0	111.1	D695 E696 Y697 L701 Q702 E703	D695-D699 PolarHBondContact O-N 2.94Å; E696-D699 PolarHBondContact O-N 3.48Å; Y697-D699 VanDerWaalsContact C-N 3.34Å; Y697-D699 PolarHBondContact O-N 3.32Å; D699-L701 VanDerWaalsContact C-N 3.32Å; D699-L701 PolarHBondContact O-N 3.02Å; D699-Q702 PolarHBondContact O-N 3.01Å; D699-E703 PolarHBondContact O-N 3.13Å
700	I	84.2	Confident	77.5	Confident	65 Å²	65	67.3 Å²	67.3	33%	0.333	35%	0.348	S	S	.	.	H	α-helix	trans	-57	-46.2	172.3	-69.2	163.6	0	0	0	110.6	E696 Y697 E703 Q704	E696-I700 HydrophobicContact CG-CD1 4.12Å; E696-I700 WeakPolarHBondContact O-CD1 3.34Å; E696-I700 VanDerWaalsContact O-CG1 3.22Å; E696-I700 WeakPolarHBondContact O-CG1 3.33Å; E696-I700 PolarHBondContact O-N 3.25Å; Y697-I700 PolarHBondContact O-N 3.48Å; I700-E703 PolarHBondContact O-N 2.9Å; I700-Q704 WeakPolarHBondContact O-CG 3.48Å; I700-Q704 PolarHBondContact O-N 3.22Å
701	L	81.5	Confident	75.7	Confident	8 Å²	8	72.8 Å²	72.8	4%	0.042	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-42.8	177.4	-71.6	178	0	0	0	112	I362 L366 Y697 R698 D699 E703 Q704 F705	I362-L701 HydrophobicContact CB-CD1 4.49Å; I362-L701 HydrophobicContact CG2-CD1 3.84Å; L366-L701 HydrophobicContact CD1-CD1 4.41Å; Y697-L701 HydrophobicContact CD1-CD1 4.06Å; Y697-L701 HydrophobicContact CE1-CD1 3.53Å; Y697-L701 HydrophobicContact CE1-CG 4.25Å; Y697-L701 HydrophobicContact CE2-CD1 4.38Å; Y697-L701 HydrophobicContact CE2-CD2 4.38Å; Y697-L701 HydrophobicContact CE2-CG 4.24Å; Y697-L701 WeakPolarHBondContact O-CG 3.4Å; Y697-L701 PolarHBondContact O-N 3.34Å; R698-L701 PolarHBondContact O-N 3.02Å; D699-L701 VanDerWaalsContact C-N 3.32Å; D699-L701 PolarHBondContact O-N 3.02Å; L701-E703 PolarHBondContact O-N 3.18Å; L701-Q704 WeakPolarHBondContact O-CB 3.35Å; L701-Q704 PolarHBondContact O-N 3.04Å; L701-F705 WeakPolarHBondContact O-CD2 3.32Å; L701-F705 PolarHBondContact O-N 2.72Å
702	Q	79.4	Confident	75.6	Confident	71 Å²	71	70.2 Å²	70.2	33%	0.332	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-39.1	177.8	-74.7	-175.8	1.7	0	0	112.4	R698 D699 F705 K706	R698-Q702 WeakPolarHBondContact O-CG 3.41Å; R698-Q702 PolarHBondContact O-N 3.41Å; D699-Q702 PolarHBondContact O-N 3.01Å; Q702-F705 PolarHBondContact O-N 3.32Å; Q702-K706 WeakPolarHBondContact O-CG 3.14Å; Q702-K706 PolarHBondContact O-N 3.49Å
703	E	82.7	Confident	75.8	Confident	112 Å²	112	71.6 Å²	71.6	52%	0.523	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-39.8	173.5	-76.2	-166.7	177.4	0	0	112.4	D699 I700 L701 F705 K706 K707	D699-E703 PolarHBondContact O-N 3.13Å; I700-E703 PolarHBondContact O-N 2.9Å; L701-E703 PolarHBondContact O-N 3.18Å; E703-F705 VanDerWaalsContact C-N 3.35Å; E703-K706 PolarHBondContact O-N 2.94Å; E703-K707 WeakPolarHBondContact O-CG 3.35Å; E703-K707 PolarHBondContact O-N 3.1Å; E703-K707 IonicContact OE2-NZ 3.68Å
704	Q	78.9	Confident	75.5	Confident	71 Å²	71	74.4 Å²	74.4	33%	0.332	37%	0.365	S	S	.	.	H	α-helix	trans	-60.5	-46.2	173.6	-74	175.7	-10.1	0	0	110.8	I700 L701 K706 K707 E708	I700-Q704 WeakPolarHBondContact O-CG 3.48Å; I700-Q704 PolarHBondContact O-N 3.22Å; L701-Q704 WeakPolarHBondContact O-CB 3.35Å; L701-Q704 PolarHBondContact O-N 3.04Å; Q704-K706 VanDerWaalsContact C-N 3.33Å; Q704-K706 PolarHBondContact O-N 3.13Å; Q704-K707 WeakPolarHBondContact O-CB 3.39Å; Q704-K707 PolarHBondContact O-N 3.01Å; Q704-K707 VanDerWaalsContact O-N 3.1Å; Q704-E708 WeakPolarHBondContact O-CG 3.34Å; Q704-E708 PolarHBondContact O-N 3.36Å
705	F	72.9	Confident	75.2	Confident	7 Å²	7	77.9 Å²	77.9	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-59	-41.4	176.6	-84.6	-61.3	0	0	0	113.6	R363 L366 W367 L701 Q702 E703 E708 G709 Y710 L711	R363-F705 HydrophobicContact CB-CE2 4.46Å; R363-F705 HydrophobicContact CB-CZ 4.24Å; R363-F705 HydrophobicContact CG-CE1 3.95Å; R363-F705 HydrophobicContact CG-CE2 3.63Å; R363-F705 HydrophobicContact CG-CZ 3.18Å; R363-F705 VanDerWaalsContact O-CZ 3.23Å; R363-F705 WeakPolarHBondContact O-CZ 3.45Å; L366-F705 HydrophobicContact CB-CE2 4.42Å; W367-F705 HydrophobicContact CB-CE1 4.21Å; W367-F705 HydrophobicContact CB-CZ 4.06Å; L701-F705 WeakPolarHBondContact O-CD2 3.32Å; L701-F705 PolarHBondContact O-N 2.72Å; Q702-F705 PolarHBondContact O-N 3.32Å; E703-F705 VanDerWaalsContact C-N 3.35Å; F705-E708 PolarHBondContact O-N 3.38Å; F705-G709 PolarHBondContact O-N 3.38Å; F705-G709 VanDerWaalsContact O-N 3.13Å; F705-Y710 AromaticContact CD1-CD2 3.98Å; F705-Y710 HydrophobicContact CD1-CD2 3.98Å; F705-Y710 HydrophobicContact CD1-CG 4.32Å; F705-Y710 HydrophobicContact CE1-CD2 4.45Å; F705-Y710 PolarHBondContact O-N 3.38Å; F705-Y710 VanDerWaalsContact O-N 3.13Å; F705-L711 HydrophobicContact CB-CD1 3.55Å; F705-L711 HydrophobicContact CB-CG 3.95Å; F705-L711 HydrophobicContact CG-CD1 4.37Å
706	K	75.1	Confident	74.7	Confident	136 Å²	136	78.1 Å²	78.1	59%	0.591	38%	0.382	S	S	*	.	H	α-helix	trans	-63.5	-41.1	174.4	-73.8	176.7	-177.1	172.5	0	111.8	Q702 E703 Q704 E708 G709 L711	Q702-K706 WeakPolarHBondContact O-CG 3.14Å; Q702-K706 PolarHBondContact O-N 3.49Å; E703-K706 PolarHBondContact O-N 2.94Å; Q704-K706 VanDerWaalsContact C-N 3.33Å; Q704-K706 PolarHBondContact O-N 3.13Å; K706-E708 VanDerWaalsContact C-N 3.31Å; K706-E708 PolarHBondContact O-N 3.03Å; K706-G709 PolarHBondContact O-N 2.91Å; K706-L711 HydrophobicContact CG-CB 4.15Å; K706-L711 HydrophobicContact CG-CD1 4.32Å
707	K	74	Confident	74.1	Confident	165 Å²	165	77.4 Å²	77.4	72%	0.717	38%	0.38	S	S	*	.	H	α-helix	trans	-66	-34.2	177.9	-75.7	169.2	-178.2	161.5	0	112.5	E703 Q704 G709	E703-K707 WeakPolarHBondContact O-CG 3.35Å; E703-K707 PolarHBondContact O-N 3.1Å; E703-K707 IonicContact OE2-NZ 3.68Å; Q704-K707 WeakPolarHBondContact O-CB 3.39Å; Q704-K707 PolarHBondContact O-N 3.01Å; Q704-K707 VanDerWaalsContact O-N 3.1Å; K707-G709 VanDerWaalsContact C-N 3.33Å
708	E	68	Low	73.4	Confident	92 Å²	92	81.6 Å²	81.6	43%	0.43	40%	0.402	S	S	.	.	H	α-helix	trans	-84.2	-6.9	179	-65.4	174.1	145	0	0	113.7	R363 Q704 F705 K706 Y710	R363-E708 IonicContact CZ-OE1 3.98Å; R363-E708 IonicContact CZ-OE2 3.03Å; R363-E708 IonicContact NH2-OE1 3.36Å; R363-E708 PolarHBondContact NH2-OE1 3.26Å; R363-E708 IonicContact NH2-OE2 3.91Å; R363-E708 PolarHBondContact NH2-OE2 3.02Å; Q704-E708 WeakPolarHBondContact O-CG 3.34Å; Q704-E708 PolarHBondContact O-N 3.36Å; F705-E708 PolarHBondContact O-N 3.38Å; K706-E708 VanDerWaalsContact C-N 3.31Å; K706-E708 PolarHBondContact O-N 3.03Å; E708-Y710 HydrophobicContact CB-CD2 3.43Å; E708-Y710 VanDerWaalsContact CB-CD2 3.43Å; E708-Y710 HydrophobicContact CB-CE2 3.42Å; E708-Y710 VanDerWaalsContact CB-CE2 3.42Å; E708-Y710 HydrophobicContact CG-CD2 4.45Å; E708-Y710 HydrophobicContact CG-CE2 4.21Å; E708-Y710 WeakPolarHBondContact OE2-CD2 3.47Å; E708-Y710 WeakPolarHBondContact OE2-CE2 3.37Å
709	G	60.3	Low	72.7	Confident	62 Å²	62	82.3 Å²	82.3	64%	0.639	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	22.1	175.9	0	0	0	0	0	114.6	F705 K706 K707	F705-G709 PolarHBondContact O-N 3.38Å; F705-G709 VanDerWaalsContact O-N 3.13Å; K706-G709 PolarHBondContact O-N 2.91Å; K707-G709 VanDerWaalsContact C-N 3.33Å
710	Y	56.5	Low	71.7	Confident	76 Å²	76	82.5 Å²	82.5	30%	0.298	41%	0.41	S	S	.	.			trans	-90.2	-12.4	176.5	-62.5	-63.7	0	0	0	113.6	A314 F705 E708	A314-Y710 HydrophobicContact CB-CE1 3.84Å; A314-Y710 WeakPolarHBondContact CB-OH 3.44Å; F705-Y710 AromaticContact CD1-CD2 3.98Å; F705-Y710 HydrophobicContact CD1-CD2 3.98Å; F705-Y710 HydrophobicContact CD1-CG 4.32Å; F705-Y710 HydrophobicContact CE1-CD2 4.45Å; F705-Y710 PolarHBondContact O-N 3.38Å; F705-Y710 VanDerWaalsContact O-N 3.13Å; E708-Y710 HydrophobicContact CB-CD2 3.43Å; E708-Y710 VanDerWaalsContact CB-CD2 3.43Å; E708-Y710 HydrophobicContact CB-CE2 3.42Å; E708-Y710 VanDerWaalsContact CB-CE2 3.42Å; E708-Y710 HydrophobicContact CG-CD2 4.45Å; E708-Y710 HydrophobicContact CG-CE2 4.21Å; E708-Y710 WeakPolarHBondContact OE2-CD2 3.47Å; E708-Y710 WeakPolarHBondContact OE2-CE2 3.37Å
711	L	47.3	Very low	70.6	Confident	125 Å²	125	84.1 Å²	84.1	65%	0.654	42%	0.417	S	S	*	.			trans	-117.3	0	177.2	-81.7	174.3	0	0	0	111.9	F705 K706	F705-L711 HydrophobicContact CB-CD1 3.55Å; F705-L711 HydrophobicContact CB-CG 3.95Å; F705-L711 HydrophobicContact CG-CD1 4.37Å; K706-L711 HydrophobicContact CG-CB 4.15Å; K706-L711 HydrophobicContact CG-CD1 4.32Å

Retrieved 711 of 711 residues in 855.3 ms (Link to these results)

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