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DNA replication licensing factor MCM7

Acts as component of the MCM2-7 complex (MCM complex) which is the replicative helicase essential for 'once per cell cycle' DNA replication initiation and elongation in eukaryotic cells. The active ATPase sites in the MCM2-7 ring are formed through the interaction surfaces of two neighboring subunits such that a critical structure of a conserved arginine finger motif is provided in trans relative to the ATP-binding site of the Walker A box of the adjacent subunit. The six ATPase active sites, however, are likely to contribute differentially to the complex helicase activity.

AlphaFold DB , UniProt , Accession A0A087X983, Species POEFO (Poecilia formosa, Amazon molly), Gene MCM7, Length 724 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.3	Very low	72.8	Confident	208 Å²	208	106.1 Å²	106.1	100%	1.025	52%	0.523	S	S	*	.				0	134.6	0	-81.5	146.7	156.8	0	0	108.8
2	A	44.4	Very low	73.8	Confident	91 Å²	91	103.3 Å²	103.3	75%	0.752	51%	0.506	S	S	*	.			trans	-56.7	140.7	-173.9	0	0	0	0	0	111.1	K4	A2-K4 VanDerWaalsContact C-N 3.3Å; A2-K4 PolarHBondContact O-N 3Å
3	R	56.3	Low	74.6	Confident	256 Å²	256	95.4 Å²	95.4	97%	0.966	47%	0.467	S	S	*	.			trans	-63.2	95.6	167.8	-80.5	179.8	172.3	175.6	-3.1	107.1
4	K	67.8	Low	75.4	Confident	73 Å²	73	92.6 Å²	92.6	32%	0.317	45%	0.451	S	S	.	.			trans	-62.7	142.9	171.3	-68.1	-166.1	176.7	-158.8	0	108.9	A2 Y6 E61 S65	A2-K4 VanDerWaalsContact C-N 3.3Å; A2-K4 PolarHBondContact O-N 3Å; K4-Y6 WeakPolarHBondContact O-CD2 3.39Å; K4-Y6 PolarHBondContact O-N 2.8Å; K4-E61 IonicContact NZ-OE1 3.62Å; K4-E61 PolarHBondContact NZ-OE1 3.14Å; K4-S65 PolarHBondContact NZ-OG 2.98Å
5	D	83.6	Confident	76.1	Confident	104 Å²	104	95.9 Å²	95.9	56%	0.556	46%	0.456	S	S	*	.			trans	-83.9	109.4	177.4	-165.2	-11.7	0	0	0	109.4	E7 A8 E9	D5-E7 VanDerWaalsContact C-N 3.26Å; D5-E7 PolarHBondContact O-N 3.28Å; D5-E7 PolarHBondContact OD1-N 3.35Å; D5-A8 HydrophobicContact CB-CB 4.37Å; D5-A8 PolarHBondContact O-N 2.84Å; D5-E9 WeakPolarHBondContact O-CG 3.49Å; D5-E9 PolarHBondContact O-N 3.26Å
6	Y	81.2	Confident	76.7	Confident	69 Å²	69	90.7 Å²	90.7	27%	0.271	43%	0.431	S	S	.	.	H	α-helix	trans	-74.3	-17.9	-173.3	-66	-78.9	0	0	0	113.1	K4 K10 R72 L76	K4-Y6 WeakPolarHBondContact O-CD2 3.39Å; K4-Y6 PolarHBondContact O-N 2.8Å; Y6-K10 WeakPolarHBondContact O-CB 3.42Å; Y6-K10 PolarHBondContact O-N 3.33Å; Y6-R72 HydrophobicContact CE1-CG 4.38Å; Y6-R72 VanDerWaalsContact CE2-NH1 3.29Å; Y6-R72 PolarHBondContact OH-NH1 3.16Å; Y6-L76 HydrophobicContact CD1-CD1 3.86Å
7	E	82.6	Confident	77.1	Confident	152 Å²	152	85.5 Å²	85.5	71%	0.71	41%	0.407	S	S	*	.	H	α-helix	trans	-72.2	-44.2	174.7	-69.5	-177.5	175.4	0	0	110.6	D5 E9 K10 E11	D5-E7 VanDerWaalsContact C-N 3.26Å; D5-E7 PolarHBondContact O-N 3.28Å; D5-E7 PolarHBondContact OD1-N 3.35Å; E7-E9 VanDerWaalsContact C-N 3.34Å; E7-E9 PolarHBondContact O-N 3.36Å; E7-K10 WeakPolarHBondContact O-CB 3.45Å; E7-K10 PolarHBondContact O-N 3Å; E7-E11 PolarHBondContact O-N 3.45Å; E7-E11 VanDerWaalsContact O-N 3.08Å
8	A	84.4	Confident	77.4	Confident	46 Å²	46	84.7 Å²	84.7	38%	0.38	40%	0.403	S	S	.	.	H	α-helix	trans	-61.9	-41.5	173.8	0	0	0	0	0	111.9	D5 K10 E11 K12	D5-A8 HydrophobicContact CB-CB 4.37Å; D5-A8 PolarHBondContact O-N 2.84Å; A8-K10 VanDerWaalsContact C-N 3.33Å; A8-K10 PolarHBondContact O-N 3.28Å; A8-E11 PolarHBondContact O-N 3Å; A8-K12 WeakPolarHBondContact O-CG 3.35Å; A8-K12 PolarHBondContact O-N 3.45Å
9	E	83.9	Confident	77.7	Confident	12 Å²	12	86.3 Å²	86.3	6%	0.056	41%	0.41	C	S	.	.	H	α-helix	trans	-63.9	-36.7	175.3	-67.4	-60	142	0	0	112.2	D5 E7 E11 K12 C13 L62 Y73	D5-E9 WeakPolarHBondContact O-CG 3.49Å; D5-E9 PolarHBondContact O-N 3.26Å; E7-E9 VanDerWaalsContact C-N 3.34Å; E7-E9 PolarHBondContact O-N 3.36Å; E9-E11 VanDerWaalsContact C-N 3.34Å; E9-E11 PolarHBondContact O-N 3.24Å; E9-K12 PolarHBondContact O-N 2.96Å; E9-K12 IonicContact OE1-NZ 2.67Å; E9-K12 PolarHBondContact OE1-NZ 2.92Å; E9-K12 IonicContact OE2-NZ 2.62Å; E9-C13 PolarHBondContact O-N 2.82Å; E9-C13 PolarHBondContact O-SG 3.37Å; E9-L62 WeakPolarHBondContact OE2-CD1 3.41Å; E9-Y73 HydrophobicContact CB-CE1 4.41Å
10	K	84.8	Confident	77.9	Confident	40 Å²	40	82.3 Å²	82.3	17%	0.174	39%	0.39	C	S	.	.	H	α-helix	trans	-63.7	-39.5	174.4	-174.5	-179.6	174.6	-175.9	0	111.8	Y6 E7 A8 C13 K14 A80 E83	Y6-K10 WeakPolarHBondContact O-CB 3.42Å; Y6-K10 PolarHBondContact O-N 3.33Å; E7-K10 WeakPolarHBondContact O-CB 3.45Å; E7-K10 PolarHBondContact O-N 3Å; A8-K10 VanDerWaalsContact C-N 3.33Å; A8-K10 PolarHBondContact O-N 3.28Å; K10-C13 PolarHBondContact O-N 3.37Å; K10-K14 PolarHBondContact O-N 3.22Å; K10-K14 VanDerWaalsContact O-N 3.1Å; K10-A80 HydrophobicContact CG-CB 4.44Å; K10-E83 WeakPolarHBondContact CE-OE2 3.42Å; K10-E83 VanDerWaalsContact NZ-CD 3.28Å; K10-E83 IonicContact NZ-OE1 3.5Å; K10-E83 PolarHBondContact NZ-OE1 2.94Å; K10-E83 IonicContact NZ-OE2 3.94Å; K10-E83 PolarHBondContact NZ-OE2 3.06Å
11	E	86.6	Confident	78	Confident	116 Å²	116	82.7 Å²	82.7	54%	0.542	39%	0.389	S	S	.	.	H	α-helix	trans	-65.3	-40.6	174.3	-69.9	-167.7	171.1	0	0	112.4	E7 A8 E9 C13 K14 R15	E7-E11 PolarHBondContact O-N 3.45Å; E7-E11 VanDerWaalsContact O-N 3.08Å; A8-E11 PolarHBondContact O-N 3Å; E9-E11 VanDerWaalsContact C-N 3.34Å; E9-E11 PolarHBondContact O-N 3.24Å; E11-C13 VanDerWaalsContact C-N 3.34Å; E11-C13 PolarHBondContact O-N 2.93Å; E11-K14 WeakPolarHBondContact O-CB 3.44Å; E11-K14 PolarHBondContact O-N 3.13Å; E11-R15 PolarHBondContact O-N 2.9Å
12	K	85.1	Confident	79.4	Confident	73 Å²	73	75.1 Å²	75.1	32%	0.317	36%	0.355	S	S	.	.	H	α-helix	trans	-58.7	-45.7	173.1	-67.8	177.6	-174.6	174.4	0	111.7	A8 E9 K14 R15 F16	A8-K12 WeakPolarHBondContact O-CG 3.35Å; A8-K12 PolarHBondContact O-N 3.45Å; E9-K12 PolarHBondContact O-N 2.96Å; E9-K12 IonicContact OE1-NZ 2.67Å; E9-K12 PolarHBondContact OE1-NZ 2.92Å; E9-K12 IonicContact OE2-NZ 2.62Å; K12-K14 VanDerWaalsContact C-N 3.26Å; K12-K14 PolarHBondContact O-N 3.47Å; K12-R15 PolarHBondContact O-N 3.32Å; K12-F16 PolarHBondContact O-N 3.08Å
13	C	83.6	Confident	80.8	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-59.3	-37.8	176.8	-63	0	0	0	0	112.1	E9 K10 E11 L17 F77 A80	E9-C13 PolarHBondContact O-N 2.82Å; E9-C13 PolarHBondContact O-SG 3.37Å; K10-C13 PolarHBondContact O-N 3.37Å; E11-C13 VanDerWaalsContact C-N 3.34Å; E11-C13 PolarHBondContact O-N 2.93Å; C13-L17 WeakPolarHBondContact O-CG 3.43Å; C13-L17 PolarHBondContact O-N 2.67Å; C13-L17 VanDerWaalsContact O-N 3.17Å; C13-F77 HydrophobicContact CB-CD1 4.11Å; C13-F77 HydrophobicContact CB-CE1 3.86Å; C13-F77 HydrophobicContact CB-CE2 4.33Å; C13-F77 HydrophobicContact CB-CG 4.46Å; C13-F77 HydrophobicContact CB-CZ 3.98Å; C13-F77 WeakPolarHBondContact SG-CE2 3.05Å; C13-F77 VanDerWaalsContact SG-CZ 3.51Å; C13-A80 HydrophobicContact CB-CB 4.49Å
14	K	85.8	Confident	81.4	Confident	56 Å²	56	70 Å²	70	24%	0.243	33%	0.329	C	S	.	.	H	α-helix	trans	-66.3	-45.5	175.4	-74	-178.3	178.2	-175.4	0	112.4	K10 E11 K12 F16 L17 Q18 A80 E83 L84	K10-K14 PolarHBondContact O-N 3.22Å; K10-K14 VanDerWaalsContact O-N 3.1Å; E11-K14 WeakPolarHBondContact O-CB 3.44Å; E11-K14 PolarHBondContact O-N 3.13Å; K12-K14 VanDerWaalsContact C-N 3.26Å; K12-K14 PolarHBondContact O-N 3.47Å; K14-F16 VanDerWaalsContact C-N 3.33Å; K14-F16 PolarHBondContact O-N 3.28Å; K14-L17 PolarHBondContact O-N 3.24Å; K14-Q18 WeakPolarHBondContact O-CG 3.37Å; K14-Q18 PolarHBondContact O-N 3.08Å; K14-A80 HydrophobicContact CG-CB 3.83Å; K14-E83 WeakPolarHBondContact CE-OE2 3.17Å; K14-E83 IonicContact NZ-OE2 3.37Å; K14-E83 PolarHBondContact NZ-OE2 3.04Å; K14-L84 HydrophobicContact CG-CD1 4.38Å
15	R	86.1	Confident	81.2	Confident	142 Å²	142	74.6 Å²	74.6	54%	0.536	36%	0.357	S	S	.	.	H	α-helix	trans	-59.3	-47.2	178	-69.9	-175.7	-166.7	175.8	5.5	110.7	E11 K12 L17 Q18 E19	E11-R15 PolarHBondContact O-N 2.9Å; K12-R15 PolarHBondContact O-N 3.32Å; R15-L17 VanDerWaalsContact C-N 3.34Å; R15-L17 PolarHBondContact O-N 3.27Å; R15-Q18 PolarHBondContact O-N 3.17Å; R15-Q18 VanDerWaalsContact O-N 3.08Å; R15-E19 WeakPolarHBondContact O-CB 3.4Å; R15-E19 WeakPolarHBondContact O-CG 3.36Å; R15-E19 PolarHBondContact O-N 3.33Å
16	F	85.7	Confident	80.4	Confident	13 Å²	13	76.4 Å²	76.4	6%	0.057	37%	0.367	C	S	.	.	H	α-helix	trans	-53.1	-49.1	175.1	172.4	-101	0	0	0	112.6	K12 K14 Q18 F20 Y33 I50 D54 V55 E58 F77	K12-F16 PolarHBondContact O-N 3.08Å; K14-F16 VanDerWaalsContact C-N 3.33Å; K14-F16 PolarHBondContact O-N 3.28Å; F16-Q18 VanDerWaalsContact C-N 3.25Å; F16-Q18 PolarHBondContact O-N 3.11Å; F16-F20 HydrophobicContact CE2-CB 4.29Å; F16-F20 AromaticContact CE2-CD2 3.88Å; F16-F20 HydrophobicContact CE2-CD2 3.88Å; F16-F20 HydrophobicContact CE2-CG 4.21Å; F16-F20 HydrophobicContact CZ-CD2 4.46Å; F16-F20 HydrophobicContact CZ-CG 4.48Å; F16-F20 VanDerWaalsContact O-CB 3.3Å; F16-F20 WeakPolarHBondContact O-CB 3.45Å; F16-F20 PolarHBondContact O-N 3.17Å; F16-Y33 HydrophobicContact CE1-CD2 4.21Å; F16-Y33 AromaticContact CE1-CE2 3.84Å; F16-Y33 HydrophobicContact CE1-CE2 3.84Å; F16-Y33 HydrophobicContact CZ-CD2 4.25Å; F16-Y33 AromaticContact CZ-CE2 3.6Å; F16-Y33 HydrophobicContact CZ-CE2 3.6Å; F16-I50 HydrophobicContact CE1-CG2 4.3Å; F16-D54 HydrophobicContact CE2-CB 4.43Å; F16-D54 HydrophobicContact CZ-CB 4.01Å; F16-V55 HydrophobicContact CD1-CG2 4.33Å; F16-V55 HydrophobicContact CE1-CG2 3.63Å; F16-V55 HydrophobicContact CE2-CB 4.27Å; F16-V55 HydrophobicContact CE2-CG2 3.94Å; F16-V55 HydrophobicContact CZ-CB 4.2Å; F16-V55 HydrophobicContact CZ-CG2 3.4Å; F16-V55 VanDerWaalsContact CZ-CG2 3.4Å; F16-E58 HydrophobicContact CD2-CB 4.26Å; F16-E58 HydrophobicContact CD2-CG 4.22Å; F16-E58 HydrophobicContact CE2-CG 4.4Å; F16-F77 HydrophobicContact CD1-CE1 4.31Å
17	L	83.8	Confident	79.7	Confident	2 Å²	2	76 Å²	76	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-65	-26.1	-179.3	-72.2	170.2	0	0	0	113.9	C13 K14 R15 Y33 I50 F77 V81 L84	C13-L17 WeakPolarHBondContact O-CG 3.43Å; C13-L17 PolarHBondContact O-N 2.67Å; C13-L17 VanDerWaalsContact O-N 3.17Å; K14-L17 PolarHBondContact O-N 3.24Å; R15-L17 VanDerWaalsContact C-N 3.34Å; R15-L17 PolarHBondContact O-N 3.27Å; L17-Y33 HydrophobicContact CD2-CD1 4.38Å; L17-Y33 HydrophobicContact CD2-CG 4.3Å; L17-I50 HydrophobicContact CD2-CD1 4.3Å; L17-F77 HydrophobicContact CD1-CD1 4.42Å; L17-V81 HydrophobicContact CD1-CG2 3.64Å; L17-L84 HydrophobicContact CB-CD1 4.11Å; L17-L84 HydrophobicContact CD1-CD1 4.09Å
18	Q	83	Confident	79.4	Confident	71 Å²	71	76.1 Å²	76.1	33%	0.332	38%	0.382	S	S	.	.	H	α-helix	trans	-92	-37.4	-179	-68.8	-176.9	-26	0	0	112.9	K14 R15 F16 L84	K14-Q18 WeakPolarHBondContact O-CG 3.37Å; K14-Q18 PolarHBondContact O-N 3.08Å; R15-Q18 PolarHBondContact O-N 3.17Å; R15-Q18 VanDerWaalsContact O-N 3.08Å; F16-Q18 VanDerWaalsContact C-N 3.25Å; F16-Q18 PolarHBondContact O-N 3.11Å; Q18-L84 HydrophobicContact CG-CD1 4.42Å; Q18-L84 HydrophobicContact CG-CD2 4.33Å
19	E	83.1	Confident	79.1	Confident	116 Å²	116	79.5 Å²	79.5	54%	0.542	39%	0.388	S	S	.	.	H	α-helix	trans	-92.9	-21.6	-168.1	-66.2	176.4	172.8	0	0	113.1	R15 Y21	R15-E19 WeakPolarHBondContact O-CB 3.4Å; R15-E19 WeakPolarHBondContact O-CG 3.36Å; R15-E19 PolarHBondContact O-N 3.33Å; E19-Y21 WeakPolarHBondContact O-CD1 3.34Å; E19-Y21 PolarHBondContact O-N 3.26Å
20	F	80.6	Confident	78.8	Confident	5 Å²	5	81.9 Å²	81.9	2%	0.022	40%	0.403	C	S	.	.			trans	-66.7	124.6	-174.8	-173.9	-97.3	0	0	0	113.3	F16 T22 F31 K32 Y33 D54 E58	F16-F20 HydrophobicContact CE2-CB 4.29Å; F16-F20 AromaticContact CE2-CD2 3.88Å; F16-F20 HydrophobicContact CE2-CD2 3.88Å; F16-F20 HydrophobicContact CE2-CG 4.21Å; F16-F20 HydrophobicContact CZ-CD2 4.46Å; F16-F20 HydrophobicContact CZ-CG 4.48Å; F16-F20 VanDerWaalsContact O-CB 3.3Å; F16-F20 WeakPolarHBondContact O-CB 3.45Å; F16-F20 PolarHBondContact O-N 3.17Å; F20-T22 HydrophobicContact CE1-CG2 3.66Å; F20-T22 HydrophobicContact CZ-CG2 4.06Å; F20-F31 WeakPolarHBondContact O-CD1 3.33Å; F20-K32 HydrophobicContact CD1-CB 4.38Å; F20-K32 HydrophobicContact CE1-CB 4.37Å; F20-K32 HydrophobicContact CE1-CD 4.13Å; F20-Y33 HydrophobicContact CB-CD2 4.01Å; F20-Y33 HydrophobicContact CB-CE2 4.45Å; F20-Y33 AromaticContact CD1-CD2 3.52Å; F20-Y33 HydrophobicContact CD1-CD2 3.52Å; F20-Y33 AromaticContact CD1-CE2 3.5Å; F20-Y33 HydrophobicContact CD1-CE2 3.5Å; F20-Y33 VanDerWaalsContact CD1-CE2 3.5Å; F20-Y33 HydrophobicContact CE1-CD2 4.33Å; F20-Y33 AromaticContact CE1-CE2 3.91Å; F20-Y33 HydrophobicContact CE1-CE2 3.91Å; F20-Y33 AromaticContact CG-CD2 4Å; F20-Y33 HydrophobicContact CG-CD2 4Å; F20-Y33 HydrophobicContact CG-CE2 4.02Å; F20-D54 HydrophobicContact CD2-CB 4.32Å; F20-D54 HydrophobicContact CE1-CB 3.86Å; F20-D54 HydrophobicContact CE2-CB 3.63Å; F20-D54 HydrophobicContact CZ-CB 3.36Å; F20-E58 HydrophobicContact CD2-CG 4.16Å
21	Y	79.5	Confident	78.6	Confident	92 Å²	92	85 Å²	85	36%	0.361	42%	0.417	S	S	.	.			trans	-129.6	142.8	177.3	63.9	-83.5	0	0	0	111.2	E19 E23 K29 V30	E19-Y21 WeakPolarHBondContact O-CD1 3.34Å; E19-Y21 PolarHBondContact O-N 3.26Å; Y21-E23 HydrophobicContact CD2-CG 4.45Å; Y21-E23 HydrophobicContact CE2-CG 4.4Å; Y21-K29 HydrophobicContact CD2-CB 4.11Å; Y21-K29 HydrophobicContact CD2-CD 3.66Å; Y21-K29 HydrophobicContact CD2-CG 3.8Å; Y21-K29 HydrophobicContact CE2-CD 3.76Å; Y21-K29 HydrophobicContact CE2-CG 4.2Å; Y21-K29 HydrophobicContact CG-CB 4.45Å; Y21-K29 HydrophobicContact CG-CD 4.19Å; Y21-K29 PolarHBondContact OH-NZ 3.19Å; Y21-V30 WeakPolarHBondContact CA-O 3.3Å
22	T	75.3	Confident	78.4	Confident	49 Å²	49	82 Å²	82	30%	0.301	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	141.4	168.8	54.2	0	0	0	0	109.2	F20 V30 K32	F20-T22 HydrophobicContact CE1-CG2 3.66Å; F20-T22 HydrophobicContact CZ-CG2 4.06Å; T22-V30 PolarHBondContact N-O 3.3Å; T22-V30 PolarHBondContact O-N 3.1Å; T22-V30 PolarHBondContact OG1-O 2.96Å; T22-K32 HydrophobicContact CG2-CB 4.36Å; T22-K32 HydrophobicContact CG2-CD 4.24Å
23	E	74.9	Confident	78.3	Confident	140 Å²	140	78.5 Å²	78.5	65%	0.654	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	118	171.2	-62.2	-168.9	162.8	0	0	108.9	Y21	Y21-E23 HydrophobicContact CD2-CG 4.45Å; Y21-E23 HydrophobicContact CE2-CG 4.4Å
24	D	68.7	Low	78.2	Confident	98 Å²	98	79 Å²	79	52%	0.524	39%	0.392	S	S	.	.			trans	-73.7	160.4	173.1	-138.4	8.8	0	0	0	109.8	N26 G27 K28 V30	D24-N26 PolarHBondContact O-N 3.49Å; D24-G27 PolarHBondContact O-N 3.18Å; D24-K28 PolarHBondContact N-O 3.31Å; D24-V30 HydrophobicContact CB-CG2 4.49Å
25	D	63.6	Low	78.1	Confident	170 Å²	170	79.3 Å²	79.3	91%	0.909	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-15.4	179.2	-77.8	-24.4	0	0	0	114.2
26	N	66.6	Low	78.1	Confident	142 Å²	142	74.5 Å²	74.5	76%	0.759	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	11.2	176.3	-70	-45.3	0	0	0	114.6	D24 K28	D24-N26 PolarHBondContact O-N 3.49Å; N26-K28 VanDerWaalsContact C-N 3.28Å; N26-K28 PolarHBondContact O-N 3.01Å
27	G	66.6	Low	78	Confident	60 Å²	60	73.9 Å²	73.9	62%	0.619	39%	0.386	S	S	*	.	S	Bend	trans	69.4	16.8	175.7	0	0	0	0	0	115.3	D24	D24-G27 PolarHBondContact O-N 3.18Å
28	K	76.6	Confident	78.1	Confident	155 Å²	155	75 Å²	75	67%	0.674	39%	0.393	S	S	*	.			trans	-90.9	131.6	171.8	-73.7	-178.1	-178.3	174.3	0	109.5	D24 N26 V30	D24-K28 PolarHBondContact N-O 3.31Å; N26-K28 VanDerWaalsContact C-N 3.28Å; N26-K28 PolarHBondContact O-N 3.01Å; K28-V30 PolarHBondContact O-N 2.62Å
29	K	77.9	Confident	78.2	Confident	117 Å²	117	72.6 Å²	72.6	51%	0.509	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	116	172.1	-62.2	-169.5	175.3	-154.2	0	109.4	Y21	Y21-K29 HydrophobicContact CD2-CB 4.11Å; Y21-K29 HydrophobicContact CD2-CD 3.66Å; Y21-K29 HydrophobicContact CD2-CG 3.8Å; Y21-K29 HydrophobicContact CE2-CD 3.76Å; Y21-K29 HydrophobicContact CE2-CG 4.2Å; Y21-K29 HydrophobicContact CG-CB 4.45Å; Y21-K29 HydrophobicContact CG-CD 4.19Å; Y21-K29 PolarHBondContact OH-NZ 3.19Å
30	V	76.1	Confident	78.3	Confident	62 Å²	62	67.6 Å²	67.6	38%	0.376	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.6	176.2	-179.4	0	0	0	0	108.5	Y21 T22 D24 K28 K32	Y21-V30 WeakPolarHBondContact CA-O 3.3Å; T22-V30 PolarHBondContact N-O 3.3Å; T22-V30 PolarHBondContact O-N 3.1Å; T22-V30 PolarHBondContact OG1-O 2.96Å; D24-V30 HydrophobicContact CB-CG2 4.49Å; K28-V30 PolarHBondContact O-N 2.62Å; V30-K32 PolarHBondContact O-N 2.97Å; V30-K32 VanDerWaalsContact O-N 3.13Å
31	F	81.2	Confident	78.4	Confident	107 Å²	107	67.6 Å²	67.6	47%	0.469	36%	0.363	S	S	.	.			trans	-78	94.8	174.1	-63.6	-81	0	0	0	109.7	F20 Y33 G34 A35	F20-F31 WeakPolarHBondContact O-CD1 3.33Å; F31-Y33 PolarHBondContact O-N 3.47Å; F31-G34 PolarHBondContact O-N 3.39Å; F31-A35 PolarHBondContact O-N 3.25Å
32	K	82.7	Confident	78.5	Confident	51 Å²	51	64.6 Å²	64.6	22%	0.222	35%	0.352	C	S	.	.	H	α-helix	trans	-54	-53.4	-178.7	-177.6	-177.2	-179.7	-176.5	0	112	F20 T22 V30 Q36 E51 D54	F20-K32 HydrophobicContact CD1-CB 4.38Å; F20-K32 HydrophobicContact CE1-CB 4.37Å; F20-K32 HydrophobicContact CE1-CD 4.13Å; T22-K32 HydrophobicContact CG2-CB 4.36Å; T22-K32 HydrophobicContact CG2-CD 4.24Å; V30-K32 PolarHBondContact O-N 2.97Å; V30-K32 VanDerWaalsContact O-N 3.13Å; K32-Q36 WeakPolarHBondContact O-CG 3.46Å; K32-Q36 PolarHBondContact O-N 3.03Å; K32-E51 IonicContact NZ-OE2 3.65Å; K32-E51 PolarHBondContact NZ-OE2 3.2Å; K32-D54 IonicContact NZ-OD1 3Å; K32-D54 PolarHBondContact NZ-OD1 3.3Å; K32-D54 IonicContact NZ-OD2 3.07Å; K32-D54 PolarHBondContact NZ-OD2 3.1Å
33	Y	83.6	Confident	78.5	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-73.2	-31.7	179.8	-65.1	-67	0	0	0	112.7	F16 L17 F20 F31 Q36 L37 I50 E51 D54	F16-Y33 HydrophobicContact CE1-CD2 4.21Å; F16-Y33 AromaticContact CE1-CE2 3.84Å; F16-Y33 HydrophobicContact CE1-CE2 3.84Å; F16-Y33 HydrophobicContact CZ-CD2 4.25Å; F16-Y33 AromaticContact CZ-CE2 3.6Å; F16-Y33 HydrophobicContact CZ-CE2 3.6Å; L17-Y33 HydrophobicContact CD2-CD1 4.38Å; L17-Y33 HydrophobicContact CD2-CG 4.3Å; F20-Y33 HydrophobicContact CB-CD2 4.01Å; F20-Y33 HydrophobicContact CB-CE2 4.45Å; F20-Y33 AromaticContact CD1-CD2 3.52Å; F20-Y33 HydrophobicContact CD1-CD2 3.52Å; F20-Y33 AromaticContact CD1-CE2 3.5Å; F20-Y33 HydrophobicContact CD1-CE2 3.5Å; F20-Y33 VanDerWaalsContact CD1-CE2 3.5Å; F20-Y33 HydrophobicContact CE1-CD2 4.33Å; F20-Y33 AromaticContact CE1-CE2 3.91Å; F20-Y33 HydrophobicContact CE1-CE2 3.91Å; F20-Y33 AromaticContact CG-CD2 4Å; F20-Y33 HydrophobicContact CG-CD2 4Å; F20-Y33 HydrophobicContact CG-CE2 4.02Å; F31-Y33 PolarHBondContact O-N 3.47Å; Y33-Q36 PolarHBondContact O-N 3.46Å; Y33-L37 WeakPolarHBondContact O-CB 3.43Å; Y33-L37 WeakPolarHBondContact O-CG 3.01Å; Y33-L37 PolarHBondContact O-N 2.8Å; Y33-I50 HydrophobicContact CE1-CG1 4.33Å; Y33-E51 PolarHBondContact OH-N 3.04Å; Y33-E51 VanDerWaalsContact OH-N 3.14Å; Y33-D54 HydrophobicContact CE2-CB 4.1Å; Y33-D54 WeakPolarHBondContact CE2-OD2 3.49Å; Y33-D54 VanDerWaalsContact CZ-OD2 3.31Å; Y33-D54 PolarHBondContact OH-OD2 3.47Å
34	G	82	Confident	78.9	Confident	12 Å²	12	65.9 Å²	65.9	12%	0.124	35%	0.352	C	S	.	.	H	α-helix	trans	-59.5	-47.5	173.5	0	0	0	0	0	112.3	F31 Q36 L37 V38	F31-G34 PolarHBondContact O-N 3.39Å; G34-Q36 VanDerWaalsContact C-N 3.34Å; G34-Q36 PolarHBondContact O-N 3.09Å; G34-L37 PolarHBondContact O-N 3.49Å; G34-V38 WeakPolarHBondContact O-CG2 3.49Å; G34-V38 PolarHBondContact O-N 3.08Å
35	A	83.4	Confident	79.6	Confident	61 Å²	61	64 Å²	64	50%	0.504	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-40.7	176	0	0	0	0	0	112.2	F31 V38 A39	F31-A35 PolarHBondContact O-N 3.25Å; A35-V38 PolarHBondContact O-N 3.19Å; A35-A39 PolarHBondContact O-N 3.4Å
36	Q	84.5	Confident	80.6	Confident	41 Å²	41	59.3 Å²	59.3	19%	0.192	32%	0.317	C	S	.	.	H	α-helix	trans	-65.7	-40.5	175.5	-70.3	177.9	-6.1	0	0	112.1	K32 Y33 G34 V38 A39 L40 L48	K32-Q36 WeakPolarHBondContact O-CG 3.46Å; K32-Q36 PolarHBondContact O-N 3.03Å; Y33-Q36 PolarHBondContact O-N 3.46Å; G34-Q36 VanDerWaalsContact C-N 3.34Å; G34-Q36 PolarHBondContact O-N 3.09Å; Q36-V38 VanDerWaalsContact C-N 3.33Å; Q36-V38 PolarHBondContact O-N 3.46Å; Q36-A39 PolarHBondContact O-N 3.33Å; Q36-L40 WeakPolarHBondContact O-CB 3.33Å; Q36-L40 VanDerWaalsContact O-CG 3.27Å; Q36-L40 WeakPolarHBondContact O-CG 3.44Å; Q36-L40 PolarHBondContact O-N 2.9Å; Q36-L48 HydrophobicContact CB-CD1 3.86Å; Q36-L48 HydrophobicContact CG-CD1 4.48Å
37	L	85.4	Confident	81.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.6	-39	175.9	-73.1	173	0	0	0	111.7	Y33 G34 L40 A41 V81 Y88	Y33-L37 WeakPolarHBondContact O-CB 3.43Å; Y33-L37 WeakPolarHBondContact O-CG 3.01Å; Y33-L37 PolarHBondContact O-N 2.8Å; G34-L37 PolarHBondContact O-N 3.49Å; L37-L40 HydrophobicContact CD2-CD1 4.31Å; L37-L40 PolarHBondContact O-N 3.26Å; L37-A41 VanDerWaalsContact O-CB 3.27Å; L37-A41 WeakPolarHBondContact O-CB 3.34Å; L37-A41 PolarHBondContact O-N 3.4Å; L37-V81 HydrophobicContact CD2-CG1 3.74Å; L37-V81 HydrophobicContact CD2-CG2 4.33Å; L37-Y88 HydrophobicContact CB-CG 4.48Å; L37-Y88 HydrophobicContact CD1-CE2 4.32Å
38	V	85.8	Confident	82.5	Confident	27 Å²	27	50.6 Å²	50.6	16%	0.164	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-43.9	172.4	173.6	0	0	0	0	110.7	G34 A35 Q36 L40 A41 H42 Y88	G34-V38 WeakPolarHBondContact O-CG2 3.49Å; G34-V38 PolarHBondContact O-N 3.08Å; A35-V38 PolarHBondContact O-N 3.19Å; Q36-V38 VanDerWaalsContact C-N 3.33Å; Q36-V38 PolarHBondContact O-N 3.46Å; V38-L40 VanDerWaalsContact C-N 3.35Å; V38-L40 PolarHBondContact O-N 3.45Å; V38-A41 PolarHBondContact O-N 3.4Å; V38-H42 VanDerWaalsContact CG1-CE1 3.44Å; V38-H42 WeakPolarHBondContact CG1-CE1 3.46Å; V38-H42 WeakPolarHBondContact O-CB 3.47Å; V38-H42 PolarHBondContact O-N 3.4Å; V38-Y88 HydrophobicContact CG2-CD1 4.1Å
39	A	84.4	Confident	83	Confident	19 Å²	19	46.5 Å²	46.5	16%	0.157	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-37.5	176.2	0	0	0	0	0	112.9	A35 Q36 R43 E44 Q45	A35-A39 PolarHBondContact O-N 3.4Å; Q36-A39 PolarHBondContact O-N 3.33Å; A39-R43 PolarHBondContact O-N 3.49Å; A39-E44 PolarHBondContact O-N 2.85Å; A39-Q45 HydrophobicContact CB-CB 4.18Å; A39-Q45 PolarHBondContact O-N 3.49Å
40	L	84.8	Confident	83.4	Confident	12 Å²	12	40.9 Å²	40.9	6%	0.063	22%	0.216	C	C	.	.	H	α-helix	trans	-66.7	-42.4	172.3	-71	175.2	0	0	0	111.4	Q36 L37 V38 H42 R43 Q45 L48 L85 F134	Q36-L40 WeakPolarHBondContact O-CB 3.33Å; Q36-L40 VanDerWaalsContact O-CG 3.27Å; Q36-L40 WeakPolarHBondContact O-CG 3.44Å; Q36-L40 PolarHBondContact O-N 2.9Å; L37-L40 HydrophobicContact CD2-CD1 4.31Å; L37-L40 PolarHBondContact O-N 3.26Å; V38-L40 VanDerWaalsContact C-N 3.35Å; V38-L40 PolarHBondContact O-N 3.45Å; L40-H42 VanDerWaalsContact C-N 3.33Å; L40-H42 PolarHBondContact O-N 2.87Å; L40-R43 PolarHBondContact O-N 3.42Å; L40-Q45 HydrophobicContact CD2-CB 4.02Å; L40-Q45 HydrophobicContact CD2-CG 4.08Å; L40-Q45 WeakPolarHBondContact CD2-O 3.21Å; L40-L48 HydrophobicContact CD1-CB 4.1Å; L40-L48 HydrophobicContact CD1-CD1 4.08Å; L40-L48 HydrophobicContact CD1-CD2 4.09Å; L40-L48 HydrophobicContact CD1-CG 4.32Å; L40-L85 HydrophobicContact CB-CD2 4.03Å; L40-F134 HydrophobicContact CD2-CB 3.85Å
41	A	82.4	Confident	83.9	Confident	5 Å²	5	40.2 Å²	40.2	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-39.6	177.5	0	0	0	0	0	111.4	L37 V38 R43 L85 K89 V93	L37-A41 VanDerWaalsContact O-CB 3.27Å; L37-A41 WeakPolarHBondContact O-CB 3.34Å; L37-A41 PolarHBondContact O-N 3.4Å; V38-A41 PolarHBondContact O-N 3.4Å; A41-R43 PolarHBondContact O-N 2.97Å; A41-L85 HydrophobicContact CB-CD2 4.26Å; A41-K89 HydrophobicContact CB-CG 4.04Å; A41-V93 WeakPolarHBondContact O-CG2 3.48Å
42	H	81.9	Confident	84.1	Confident	29 Å²	29	35.2 Å²	35.2	13%	0.134	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-5.8	173.1	-66.6	161.6	0	0	0	114.2	V38 L40 E44	V38-H42 VanDerWaalsContact CG1-CE1 3.44Å; V38-H42 WeakPolarHBondContact CG1-CE1 3.46Å; V38-H42 WeakPolarHBondContact O-CB 3.47Å; V38-H42 PolarHBondContact O-N 3.4Å; L40-H42 VanDerWaalsContact C-N 3.33Å; L40-H42 PolarHBondContact O-N 2.87Å; H42-E44 VanDerWaalsContact C-N 3.27Å; H42-E44 HydrophobicContact CB-CG 4.31Å; H42-E44 PolarHBondContact O-N 3.12Å
43	R	75.9	Confident	84.1	Confident	67 Å²	67	34.9 Å²	34.9	25%	0.253	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	32.7	178.8	-48.7	178.1	178.4	168.8	-19.2	113.8	A39 L40 A41 V93 D100	A39-R43 PolarHBondContact O-N 3.49Å; L40-R43 PolarHBondContact O-N 3.42Å; A41-R43 PolarHBondContact O-N 2.97Å; R43-V93 HydrophobicContact CB-CG1 4.35Å; R43-V93 HydrophobicContact CG-CG1 4.1Å; R43-D100 IonicContact CZ-OD2 3.5Å; R43-D100 IonicContact NH1-OD2 3.48Å; R43-D100 PolarHBondContact NH1-OD2 2.89Å; R43-D100 VanDerWaalsContact NH2-CG 3.32Å; R43-D100 IonicContact NH2-OD1 2.89Å; R43-D100 PolarHBondContact NH2-OD1 2.65Å; R43-D100 IonicContact NH2-OD2 3.47Å; R43-D100 PolarHBondContact NH2-OD2 2.86Å
44	E	82.6	Confident	84.2	Confident	149 Å²	149	35.6 Å²	35.6	70%	0.696	19%	0.191	S	C	*	.	S	Bend	trans	-86	-31.2	170.7	-63.9	-177.6	165.7	0	0	110.6	A39 H42	A39-E44 PolarHBondContact O-N 2.85Å; H42-E44 VanDerWaalsContact C-N 3.27Å; H42-E44 HydrophobicContact CB-CG 4.31Å; H42-E44 PolarHBondContact O-N 3.12Å
45	Q	83.1	Confident	84.2	Confident	59 Å²	59	35 Å²	35	28%	0.276	19%	0.185	S	C	.	.			trans	-113.3	147.1	178.4	-171.1	170.1	-1.9	0	0	110.8	A39 L40 S47	A39-Q45 HydrophobicContact CB-CB 4.18Å; A39-Q45 PolarHBondContact O-N 3.49Å; L40-Q45 HydrophobicContact CD2-CB 4.02Å; L40-Q45 HydrophobicContact CD2-CG 4.08Å; L40-Q45 WeakPolarHBondContact CD2-O 3.21Å; Q45-S47 WeakPolarHBondContact CG-O 3.35Å; Q45-S47 PolarHBondContact NE2-O 3.43Å
46	V	84.4	Confident	84.1	Confident	71 Å²	71	34 Å²	34	43%	0.43	18%	0.176	S	C	.	.			trans	-117.9	-41.3	179.2	177.5	0	0	0	0	111	R133 F134 E135	V46-R133 WeakPolarHBondContact CG1-O 3.42Å; V46-F134 CarbonylContact O-C 3.59Å; V46-F134 WeakPolarHBondContact O-CA 3.46Å; V46-F134 WeakPolarHBondContact O-CB 3.13Å; V46-E135 PolarHBondContact O-N 3.22Å
47	S	85.9	Confident	84	Confident	18 Å²	18	39.3 Å²	39.3	13%	0.126	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128	178.4	47.6	0	0	0	0	111.2	Q45	Q45-S47 WeakPolarHBondContact CG-O 3.35Å; Q45-S47 PolarHBondContact NE2-O 3.43Å
48	L	88.1	Confident	83.6	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.6	170.6	-175.1	65.9	0	0	0	108.9	Q36 L40 I50 V81 E135 L136 Y137	Q36-L48 HydrophobicContact CB-CD1 3.86Å; Q36-L48 HydrophobicContact CG-CD1 4.48Å; L40-L48 HydrophobicContact CD1-CB 4.1Å; L40-L48 HydrophobicContact CD1-CD1 4.08Å; L40-L48 HydrophobicContact CD1-CD2 4.09Å; L40-L48 HydrophobicContact CD1-CG 4.32Å; L48-I50 HydrophobicContact CD2-CD1 4.44Å; L48-I50 HydrophobicContact CD2-CG1 4.31Å; L48-I50 HydrophobicContact CG-CG1 4.3Å; L48-V81 HydrophobicContact CD2-CG2 4.09Å; L48-E135 PolarHBondContact N-O 3.41Å; L48-L136 HydrophobicContact CD2-CD1 4.16Å; L48-L136 WeakPolarHBondContact O-CA 3.46Å; L48-Y137 PolarHBondContact O-N 2.82Å
49	F	86.6	Confident	83.4	Confident	68 Å²	68	45.9 Å²	45.9	30%	0.298	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	112.2	173	-64.2	-81.5	0	0	0	108.8	Y137	F49-Y137 WeakPolarHBondContact CA-O 3.47Å; F49-Y137 HydrophobicContact CD1-CD2 4.15Å; F49-Y137 HydrophobicContact CD1-CG 4.32Å; F49-Y137 AromaticContact CE1-CD2 3.63Å; F49-Y137 HydrophobicContact CE1-CD2 3.63Å; F49-Y137 AromaticContact CE1-CG 4Å; F49-Y137 HydrophobicContact CE1-CG 4Å; F49-Y137 AromaticContact CZ-CD2 3.93Å; F49-Y137 HydrophobicContact CZ-CD2 3.93Å
50	I	87.6	Confident	83.3	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	119.4	171.6	-60.3	-171.8	0	0	0	107.7	F16 L17 Y33 L48 V55 F77 L136 Y137 F138 K139	F16-I50 HydrophobicContact CE1-CG2 4.3Å; L17-I50 HydrophobicContact CD2-CD1 4.3Å; Y33-I50 HydrophobicContact CE1-CG1 4.33Å; L48-I50 HydrophobicContact CD2-CD1 4.44Å; L48-I50 HydrophobicContact CD2-CG1 4.31Å; L48-I50 HydrophobicContact CG-CG1 4.3Å; I50-V55 HydrophobicContact CG2-CG2 3.91Å; I50-F77 HydrophobicContact CD1-CD1 3.52Å; I50-F77 HydrophobicContact CD1-CE1 3.89Å; I50-F77 HydrophobicContact CD1-CG 4.21Å; I50-L136 HydrophobicContact CD1-CD1 3.74Å; I50-L136 HydrophobicContact CD1-CD2 4Å; I50-L136 HydrophobicContact CD1-CG 4.04Å; I50-L136 HydrophobicContact CG1-CD1 4.47Å; I50-L136 HydrophobicContact CG1-CD2 4.34Å; I50-L136 HydrophobicContact CG1-CG 4.32Å; I50-Y137 PolarHBondContact N-O 3.45Å; I50-F138 HydrophobicContact CB-CD1 3.96Å; I50-F138 HydrophobicContact CB-CE1 4.15Å; I50-F138 HydrophobicContact CD1-CE1 4.37Å; I50-F138 HydrophobicContact CG2-CD1 4.23Å; I50-F138 HydrophobicContact CG2-CE1 4.23Å; I50-K139 PolarHBondContact O-N 3.48Å
51	E	85.9	Confident	83.3	Confident	48 Å²	48	53.7 Å²	53.7	22%	0.224	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	120.9	175.9	-54.8	-162.9	134.7	0	0	108.6	K32 Y33 D53 D54 V55 K139	K32-E51 IonicContact NZ-OE2 3.65Å; K32-E51 PolarHBondContact NZ-OE2 3.2Å; Y33-E51 PolarHBondContact OH-N 3.04Å; Y33-E51 VanDerWaalsContact OH-N 3.14Å; E51-D53 PolarHBondContact O-N 2.8Å; E51-D54 WeakPolarHBondContact O-CB 3.33Å; E51-D54 PolarHBondContact O-N 3.4Å; E51-V55 PolarHBondContact O-N 2.86Å; E51-K139 HydrophobicContact CG-CB 4.4Å; E51-K139 HydrophobicContact CG-CD 4.06Å; E51-K139 WeakPolarHBondContact OE1-CD 3.27Å; E51-K139 IonicContact OE1-NZ 3.55Å; E51-K139 PolarHBondContact OE1-NZ 2.8Å
52	L	84.3	Confident	83.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-71.3	-12.6	179.7	-68.4	176.9	0	0	0	112.8	V55 A56 V63 V66 F138 K139 P141 L160	L52-V55 HydrophobicContact CD2-CG2 4.29Å; L52-A56 WeakPolarHBondContact O-CB 3.21Å; L52-A56 PolarHBondContact O-N 3.05Å; L52-V63 HydrophobicContact CB-CG1 4.47Å; L52-V66 HydrophobicContact CD1-CG1 4.44Å; L52-V66 HydrophobicContact CD2-CG1 3.97Å; L52-F138 HydrophobicContact CD1-CB 4.3Å; L52-F138 HydrophobicContact CD2-CD1 3.86Å; L52-F138 HydrophobicContact CD2-CE1 4.31Å; L52-F138 HydrophobicContact CD2-CG 4.46Å; L52-F138 HydrophobicContact CG-CB 4.45Å; L52-F138 HydrophobicContact CG-CD1 4.37Å; L52-K139 WeakPolarHBondContact CB-O 3.48Å; L52-K139 VanDerWaalsContact CG-O 3.32Å; L52-K139 WeakPolarHBondContact CG-O 3.33Å; L52-K139 PolarHBondContact N-O 2.97Å; L52-K139 VanDerWaalsContact N-O 3.15Å; L52-P141 HydrophobicContact CB-CB 4.05Å; L52-P141 HydrophobicContact CB-CG 4.31Å; L52-L160 HydrophobicContact CD1-CD2 3.42Å; L52-L160 VanDerWaalsContact CD1-CD2 3.42Å
53	D	84.2	Confident	83.4	Confident	44 Å²	44	53.1 Å²	53.1	24%	0.235	27%	0.27	C	S	.	.	H	α-helix	trans	-68	-45.8	170.1	-69.4	-32.9	0	0	0	111	E51 V55 A56 E57 P141 S142	E51-D53 PolarHBondContact O-N 2.8Å; D53-V55 VanDerWaalsContact C-N 3.25Å; D53-V55 PolarHBondContact O-N 3.42Å; D53-A56 WeakPolarHBondContact O-CA 3.41Å; D53-A56 WeakPolarHBondContact O-CB 3.27Å; D53-A56 PolarHBondContact O-N 2.82Å; D53-E57 PolarHBondContact O-N 3.29Å; D53-E57 VanDerWaalsContact O-N 3.13Å; D53-P141 WeakPolarHBondContact OD1-CA 3.27Å; D53-P141 VanDerWaalsContact OD1-CB 3.27Å; D53-P141 WeakPolarHBondContact OD1-CB 3.47Å; D53-S142 VanDerWaalsContact CG-N 3.29Å; D53-S142 PolarHBondContact OD1-N 3.48Å; D53-S142 VanDerWaalsContact OD2-CB 3.26Å; D53-S142 WeakPolarHBondContact OD2-CB 3.39Å; D53-S142 PolarHBondContact OD2-N 3.28Å; D53-S142 PolarHBondContact OD2-OG 3.25Å
54	D	84.3	Confident	83.8	Confident	15 Å²	15	56.9 Å²	56.9	8%	0.08	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-40.7	173.8	-63.1	-10.6	0	0	0	111.1	F16 F20 K32 Y33 E51 A56 E57	F16-D54 HydrophobicContact CE2-CB 4.43Å; F16-D54 HydrophobicContact CZ-CB 4.01Å; F20-D54 HydrophobicContact CD2-CB 4.32Å; F20-D54 HydrophobicContact CE1-CB 3.86Å; F20-D54 HydrophobicContact CE2-CB 3.63Å; F20-D54 HydrophobicContact CZ-CB 3.36Å; K32-D54 IonicContact NZ-OD1 3Å; K32-D54 PolarHBondContact NZ-OD1 3.3Å; K32-D54 IonicContact NZ-OD2 3.07Å; K32-D54 PolarHBondContact NZ-OD2 3.1Å; Y33-D54 HydrophobicContact CE2-CB 4.1Å; Y33-D54 WeakPolarHBondContact CE2-OD2 3.49Å; Y33-D54 VanDerWaalsContact CZ-OD2 3.31Å; Y33-D54 PolarHBondContact OH-OD2 3.47Å; E51-D54 WeakPolarHBondContact O-CB 3.33Å; E51-D54 PolarHBondContact O-N 3.4Å; D54-A56 VanDerWaalsContact C-N 3.3Å; D54-A56 PolarHBondContact O-N 3.39Å; D54-E57 PolarHBondContact O-N 2.99Å
55	V	82.6	Confident	83.9	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-32.2	176.4	-173.9	0	0	0	0	111.3	F16 I50 E51 L52 D53 E57 D59 L62 V63	F16-V55 HydrophobicContact CD1-CG2 4.33Å; F16-V55 HydrophobicContact CE1-CG2 3.63Å; F16-V55 HydrophobicContact CE2-CB 4.27Å; F16-V55 HydrophobicContact CE2-CG2 3.94Å; F16-V55 HydrophobicContact CZ-CB 4.2Å; F16-V55 HydrophobicContact CZ-CG2 3.4Å; F16-V55 VanDerWaalsContact CZ-CG2 3.4Å; I50-V55 HydrophobicContact CG2-CG2 3.91Å; E51-V55 PolarHBondContact O-N 2.86Å; L52-V55 HydrophobicContact CD2-CG2 4.29Å; D53-V55 VanDerWaalsContact C-N 3.25Å; D53-V55 PolarHBondContact O-N 3.42Å; V55-E57 VanDerWaalsContact C-N 3.34Å; V55-D59 CarbonylContact O-C 3.54Å; V55-D59 PolarHBondContact O-N 3.31Å; V55-L62 HydrophobicContact CG1-CB 4.26Å; V55-L62 HydrophobicContact CG1-CD2 3.85Å; V55-L62 HydrophobicContact CG1-CG 4.1Å; V55-V63 HydrophobicContact CB-CG2 3.78Å; V55-V63 HydrophobicContact CG1-CG2 3.62Å
56	A	81.9	Confident	84	Confident	38 Å²	38	47.3 Å²	47.3	31%	0.314	25%	0.247	S	C	.	.	H	α-helix	trans	-71.3	-29	179.7	0	0	0	0	0	112.8	L52 D53 D54 P60 V63	L52-A56 WeakPolarHBondContact O-CB 3.21Å; L52-A56 PolarHBondContact O-N 3.05Å; D53-A56 WeakPolarHBondContact O-CA 3.41Å; D53-A56 WeakPolarHBondContact O-CB 3.27Å; D53-A56 PolarHBondContact O-N 2.82Å; D54-A56 VanDerWaalsContact C-N 3.3Å; D54-A56 PolarHBondContact O-N 3.39Å; A56-P60 WeakPolarHBondContact O-CG 3.4Å; A56-V63 HydrophobicContact CB-CG2 3.95Å
57	E	81.6	Confident	84	Confident	154 Å²	154	45.5 Å²	45.5	72%	0.72	24%	0.237	S	C	*	.	H	α-helix	trans	-68	-39.4	177	-69.9	-173.3	166.9	0	0	112.3	D53 D54 V55	D53-E57 PolarHBondContact O-N 3.29Å; D53-E57 VanDerWaalsContact O-N 3.13Å; D54-E57 PolarHBondContact O-N 2.99Å; V55-E57 VanDerWaalsContact C-N 3.34Å
58	E	77.1	Confident	84	Confident	93 Å²	93	49 Å²	49	44%	0.435	25%	0.251	S	S	.	.	H	α-helix	trans	-84.2	-53.1	178.3	-70	-70	165.7	0	0	112	F16 F20	F16-E58 HydrophobicContact CD2-CB 4.26Å; F16-E58 HydrophobicContact CD2-CG 4.22Å; F16-E58 HydrophobicContact CE2-CG 4.4Å; F20-E58 HydrophobicContact CD2-CG 4.16Å
59	D	80.9	Confident	84	Confident	72 Å²	72	51.9 Å²	51.9	39%	0.385	27%	0.267	S	S	.	.			trans	-141	92.2	-171.8	-89	-36.3	0	0	0	113	V55 E61 L62 V63	V55-D59 CarbonylContact O-C 3.54Å; V55-D59 PolarHBondContact O-N 3.31Å; D59-E61 VanDerWaalsContact C-N 3.3Å; D59-E61 PolarHBondContact O-N 2.88Å; D59-L62 HydrophobicContact CB-CB 3.97Å; D59-L62 WeakPolarHBondContact O-CB 3.29Å; D59-L62 PolarHBondContact O-N 3.27Å; D59-V63 PolarHBondContact O-N 2.86Å
60	P	82.5	Confident	83.8	Confident	83 Å²	83	48.6 Å²	48.6	54%	0.539	25%	0.252	S	S	.	.	H	α-helix	trans	-59.7	-33.6	177.1	-24.7	32.5	0	0	0	114.5	A56 L62 V63 E64	A56-P60 WeakPolarHBondContact O-CG 3.4Å; P60-L62 VanDerWaalsContact C-N 3.3Å; P60-L62 PolarHBondContact O-N 3.3Å; P60-V63 PolarHBondContact O-N 3.27Å; P60-E64 PolarHBondContact O-N 3.09Å
61	E	84.9	Confident	83.8	Confident	112 Å²	112	52.7 Å²	52.7	52%	0.523	27%	0.27	S	S	.	.	H	α-helix	trans	-68	-31.8	-179.5	-162.5	-164.8	152.7	0	0	112.1	K4 D59 S65	K4-E61 IonicContact NZ-OE1 3.62Å; K4-E61 PolarHBondContact NZ-OE1 3.14Å; D59-E61 VanDerWaalsContact C-N 3.3Å; D59-E61 PolarHBondContact O-N 2.88Å; E61-S65 PolarHBondContact O-N 2.74Å; E61-S65 VanDerWaalsContact O-N 3.16Å; E61-S65 PolarHBondContact O-OG 2.61Å
62	L	82.9	Confident	83.9	Confident	6 Å²	6	56 Å²	56	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-40.7	176.6	-175.4	60.2	0	0	0	110	E9 V55 D59 P60 E64 S65 V66 Y73 F77	E9-L62 WeakPolarHBondContact OE2-CD1 3.41Å; V55-L62 HydrophobicContact CG1-CB 4.26Å; V55-L62 HydrophobicContact CG1-CD2 3.85Å; V55-L62 HydrophobicContact CG1-CG 4.1Å; D59-L62 HydrophobicContact CB-CB 3.97Å; D59-L62 WeakPolarHBondContact O-CB 3.29Å; D59-L62 PolarHBondContact O-N 3.27Å; P60-L62 VanDerWaalsContact C-N 3.3Å; P60-L62 PolarHBondContact O-N 3.3Å; L62-E64 PolarHBondContact O-N 3.46Å; L62-S65 WeakPolarHBondContact O-CB 3.49Å; L62-S65 PolarHBondContact O-N 2.86Å; L62-V66 HydrophobicContact CD1-CG2 4.37Å; L62-V66 HydrophobicContact CG-CG2 4.35Å; L62-V66 WeakPolarHBondContact O-CB 3.3Å; L62-V66 WeakPolarHBondContact O-CG2 3.45Å; L62-V66 PolarHBondContact O-N 3.24Å; L62-Y73 HydrophobicContact CD1-CD1 4.34Å; L62-Y73 HydrophobicContact CD1-CE1 3.82Å; L62-F77 HydrophobicContact CD2-CZ 4.36Å
63	V	83.9	Confident	84	Confident	15 Å²	15	56.2 Å²	56.2	9%	0.091	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-44.3	177.6	179.9	0	0	0	0	112.1	L52 V55 A56 D59 P60 S65 V66 C67	L52-V63 HydrophobicContact CB-CG1 4.47Å; V55-V63 HydrophobicContact CB-CG2 3.78Å; V55-V63 HydrophobicContact CG1-CG2 3.62Å; A56-V63 HydrophobicContact CB-CG2 3.95Å; D59-V63 PolarHBondContact O-N 2.86Å; P60-V63 PolarHBondContact O-N 3.27Å; V63-S65 VanDerWaalsContact C-N 3.28Å; V63-S65 PolarHBondContact O-N 3.41Å; V63-V66 PolarHBondContact O-N 3.31Å; V63-C67 WeakPolarHBondContact O-CB 3.46Å; V63-C67 PolarHBondContact O-N 3.28Å; V63-C67 PolarHBondContact O-SG 3.48Å
64	E	84.4	Confident	84.2	Confident	146 Å²	146	55 Å²	55	68%	0.682	28%	0.276	S	S	*	.	H	α-helix	trans	-60.3	-42.1	175.7	-70.3	-172.6	168.9	0	0	111.2	P60 L62 C67 E68	P60-E64 PolarHBondContact O-N 3.09Å; L62-E64 PolarHBondContact O-N 3.46Å; E64-C67 PolarHBondContact O-N 3.5Å; E64-E68 PolarHBondContact O-N 3.45Å
65	S	85.5	Confident	84.3	Confident	7 Å²	7	56.4 Å²	56.4	5%	0.049	29%	0.289	C	S	.	.	H	α-helix	trans	-67.6	-39.7	179.7	-54.8	0	0	0	0	112.4	K4 E61 L62 V63 C67 E68 N69 Y73	K4-S65 PolarHBondContact NZ-OG 2.98Å; E61-S65 PolarHBondContact O-N 2.74Å; E61-S65 VanDerWaalsContact O-N 3.16Å; E61-S65 PolarHBondContact O-OG 2.61Å; L62-S65 WeakPolarHBondContact O-CB 3.49Å; L62-S65 PolarHBondContact O-N 2.86Å; V63-S65 VanDerWaalsContact C-N 3.28Å; V63-S65 PolarHBondContact O-N 3.41Å; S65-C67 VanDerWaalsContact C-N 3.35Å; S65-E68 PolarHBondContact O-N 3.13Å; S65-N69 PolarHBondContact O-N 2.97Å; S65-Y73 VanDerWaalsContact C-CE2 3.44Å; S65-Y73 VanDerWaalsContact CB-OH 3.27Å; S65-Y73 WeakPolarHBondContact CB-OH 3.5Å; S65-Y73 WeakPolarHBondContact O-CD2 3.47Å; S65-Y73 WeakPolarHBondContact O-CE2 3.39Å
66	V	84.9	Confident	84.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-40.5	173.6	174.4	0	0	0	0	110.2	L52 L62 V63 E68 N69 A70 Y73 F77 F138	L52-V66 HydrophobicContact CD1-CG1 4.44Å; L52-V66 HydrophobicContact CD2-CG1 3.97Å; L62-V66 HydrophobicContact CD1-CG2 4.37Å; L62-V66 HydrophobicContact CG-CG2 4.35Å; L62-V66 WeakPolarHBondContact O-CB 3.3Å; L62-V66 WeakPolarHBondContact O-CG2 3.45Å; L62-V66 PolarHBondContact O-N 3.24Å; V63-V66 PolarHBondContact O-N 3.31Å; V66-E68 VanDerWaalsContact C-N 3.33Å; V66-E68 PolarHBondContact O-N 3.49Å; V66-N69 CarbonylContact O-C 3.37Å; V66-A70 WeakPolarHBondContact O-CA 3.47Å; V66-A70 VanDerWaalsContact O-CB 3.3Å; V66-A70 WeakPolarHBondContact O-CB 3.34Å; V66-A70 PolarHBondContact O-N 2.83Å; V66-Y73 HydrophobicContact CB-CD2 4.44Å; V66-Y73 HydrophobicContact CB-CG 4.36Å; V66-Y73 HydrophobicContact CG2-CD1 3.8Å; V66-Y73 HydrophobicContact CG2-CD2 4.11Å; V66-Y73 HydrophobicContact CG2-CE1 4.39Å; V66-Y73 HydrophobicContact CG2-CG 3.66Å; V66-F77 HydrophobicContact CG2-CE2 4.28Å; V66-F138 HydrophobicContact CG1-CD2 4.15Å; V66-F138 HydrophobicContact CG1-CE1 4.32Å; V66-F138 HydrophobicContact CG1-CE2 3.89Å; V66-F138 HydrophobicContact CG1-CG 4.46Å; V66-F138 HydrophobicContact CG1-CZ 4Å
67	C	84.8	Confident	84.8	Confident	34 Å²	34	55.6 Å²	55.6	23%	0.23	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-34.3	176.7	-72	0	0	0	0	112.7	V63 E64 S65 H159 L160	V63-C67 WeakPolarHBondContact O-CB 3.46Å; V63-C67 PolarHBondContact O-N 3.28Å; V63-C67 PolarHBondContact O-SG 3.48Å; E64-C67 PolarHBondContact O-N 3.5Å; S65-C67 VanDerWaalsContact C-N 3.35Å; C67-H159 CarbonylContact O-C 3.55Å; C67-H159 WeakPolarHBondContact O-CA 3.46Å; C67-H159 WeakPolarHBondContact O-CB 3.43Å; C67-H159 PolarHBondContact O-CD2 3.15Å; C67-L160 PolarHBondContact O-N 2.67Å
68	E	85.7	Confident	85	Confident	90 Å²	90	48.8 Å²	48.8	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-77.4	-39.8	179.2	-166.6	-179.9	-168.8	0	0	112.8	E64 S65 V66 G158	E64-E68 PolarHBondContact O-N 3.45Å; S65-E68 PolarHBondContact O-N 3.13Å; V66-E68 VanDerWaalsContact C-N 3.33Å; V66-E68 PolarHBondContact O-N 3.49Å; E68-G158 CarbonylContact O-C 3.52Å
69	N	86.6	Confident	85.5	Confident	62 Å²	62	46.6 Å²	46.6	33%	0.332	24%	0.241	S	C	.	.	S	Bend	trans	-134.6	60.2	-177.8	-167	-8.5	0	0	0	113.2	S65 V66 K71 R72 Y73	S65-N69 PolarHBondContact O-N 2.97Å; V66-N69 CarbonylContact O-C 3.37Å; N69-K71 PolarHBondContact O-N 3.19Å; N69-K71 VanDerWaalsContact O-N 3.15Å; N69-R72 PolarHBondContact O-N 3.46Å; N69-R72 PolarHBondContact OD1-N 3.43Å; N69-Y73 VanDerWaalsContact O-CD2 3.28Å; N69-Y73 WeakPolarHBondContact O-CD2 3.5Å; N69-Y73 PolarHBondContact O-N 2.82Å
70	A	84.3	Confident	85.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-35.6	-174.2	0	0	0	0	0	113.1	V66 R72 Y73 T74 L160 I276	V66-A70 WeakPolarHBondContact O-CA 3.47Å; V66-A70 VanDerWaalsContact O-CB 3.3Å; V66-A70 WeakPolarHBondContact O-CB 3.34Å; V66-A70 PolarHBondContact O-N 2.83Å; A70-R72 VanDerWaalsContact C-N 3.35Å; A70-R72 PolarHBondContact O-N 3.2Å; A70-Y73 PolarHBondContact O-N 3.25Å; A70-T74 WeakPolarHBondContact O-CG2 3.5Å; A70-T74 PolarHBondContact O-N 3.01Å; A70-L160 HydrophobicContact CB-CB 4.1Å; A70-L160 HydrophobicContact CB-CD1 4.31Å; A70-I276 HydrophobicContact CB-CD1 3.55Å; A70-I276 HydrophobicContact CB-CG1 3.7Å
71	K	86.1	Confident	85.9	Confident	86 Å²	86	39.2 Å²	39.2	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-64.4	-40.4	-176	-168.4	63.7	176.4	-176.7	0	112	N69 T74 A75 I276 E299	N69-K71 PolarHBondContact O-N 3.19Å; N69-K71 VanDerWaalsContact O-N 3.15Å; K71-T74 PolarHBondContact O-OG1 2.99Å; K71-A75 PolarHBondContact O-N 2.91Å; K71-I276 HydrophobicContact CB-CD1 4.15Å; K71-I276 HydrophobicContact CD-CD1 4.21Å; K71-E299 IonicContact NZ-OE1 3.87Å; K71-E299 PolarHBondContact NZ-OE1 3.21Å; K71-E299 IonicContact NZ-OE2 3.24Å; K71-E299 PolarHBondContact NZ-OE2 3.26Å
72	R	87.6	Confident	85.9	Confident	116 Å²	116	37 Å²	37	44%	0.438	19%	0.187	S	C	.	.	H	α-helix	trans	-72.8	-40.3	178.3	-165.9	167.1	-175.8	168.3	2.1	111.6	Y6 N69 A70 T74 A75 L76	Y6-R72 HydrophobicContact CE1-CG 4.38Å; Y6-R72 VanDerWaalsContact CE2-NH1 3.29Å; Y6-R72 PolarHBondContact OH-NH1 3.16Å; N69-R72 PolarHBondContact O-N 3.46Å; N69-R72 PolarHBondContact OD1-N 3.43Å; A70-R72 VanDerWaalsContact C-N 3.35Å; A70-R72 PolarHBondContact O-N 3.2Å; R72-T74 PolarHBondContact O-N 2.86Å; R72-A75 WeakPolarHBondContact O-CB 3.5Å; R72-A75 PolarHBondContact O-N 3.17Å; R72-A75 VanDerWaalsContact O-N 3.16Å; R72-L76 HydrophobicContact CG-CD1 4.5Å; R72-L76 WeakPolarHBondContact O-CG 3.27Å; R72-L76 PolarHBondContact O-N 2.97Å
73	Y	87.7	Confident	86	Confident	7 Å²	7	41 Å²	41	3%	0.027	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-36.5	175.9	-77.4	-80.1	0	0	0	112.4	E9 L62 S65 V66 N69 A70 A75 L76 F77	E9-Y73 HydrophobicContact CB-CE1 4.41Å; L62-Y73 HydrophobicContact CD1-CD1 4.34Å; L62-Y73 HydrophobicContact CD1-CE1 3.82Å; S65-Y73 VanDerWaalsContact C-CE2 3.44Å; S65-Y73 VanDerWaalsContact CB-OH 3.27Å; S65-Y73 WeakPolarHBondContact CB-OH 3.5Å; S65-Y73 WeakPolarHBondContact O-CD2 3.47Å; S65-Y73 WeakPolarHBondContact O-CE2 3.39Å; V66-Y73 HydrophobicContact CB-CD2 4.44Å; V66-Y73 HydrophobicContact CB-CG 4.36Å; V66-Y73 HydrophobicContact CG2-CD1 3.8Å; V66-Y73 HydrophobicContact CG2-CD2 4.11Å; V66-Y73 HydrophobicContact CG2-CE1 4.39Å; V66-Y73 HydrophobicContact CG2-CG 3.66Å; N69-Y73 VanDerWaalsContact O-CD2 3.28Å; N69-Y73 WeakPolarHBondContact O-CD2 3.5Å; N69-Y73 PolarHBondContact O-N 2.82Å; A70-Y73 PolarHBondContact O-N 3.25Å; Y73-A75 PolarHBondContact O-N 3.3Å; Y73-L76 HydrophobicContact CD1-CD1 4.28Å; Y73-L76 HydrophobicContact CE1-CD1 4.45Å; Y73-L76 PolarHBondContact O-N 2.85Å; Y73-F77 HydrophobicContact CD1-CE2 4.46Å; Y73-F77 WeakPolarHBondContact O-CB 3.35Å; Y73-F77 WeakPolarHBondContact O-CD2 3.47Å; Y73-F77 PolarHBondContact O-N 3.26Å
74	T	88	Confident	85.9	Confident	19 Å²	19	40.5 Å²	40.5	12%	0.117	20%	0.202	C	C	.	.	H	α-helix	trans	-57.2	-40.1	172.3	56.6	0	0	0	0	112.3	A70 K71 R72 A78 F138 H301	A70-T74 WeakPolarHBondContact O-CG2 3.5Å; A70-T74 PolarHBondContact O-N 3.01Å; K71-T74 PolarHBondContact O-OG1 2.99Å; R72-T74 PolarHBondContact O-N 2.86Å; T74-A78 VanDerWaalsContact O-CB 3.25Å; T74-A78 WeakPolarHBondContact O-CB 3.21Å; T74-A78 PolarHBondContact O-N 2.81Å; T74-F138 HydrophobicContact CG2-CD2 3.67Å; T74-F138 HydrophobicContact CG2-CE2 3.36Å; T74-F138 HydrophobicContact CG2-CZ 4.39Å; T74-H301 VanDerWaalsContact CG2-CE1 3.41Å; T74-H301 WeakPolarHBondContact CG2-CE1 3.29Å
75	A	86.6	Confident	85.7	Confident	44 Å²	44	34.8 Å²	34.8	36%	0.364	18%	0.175	S	C	.	.	H	α-helix	trans	-69	-42.9	177.5	0	0	0	0	0	111.7	K71 R72 Y73 A78 D79	K71-A75 PolarHBondContact O-N 2.91Å; R72-A75 WeakPolarHBondContact O-CB 3.5Å; R72-A75 PolarHBondContact O-N 3.17Å; R72-A75 VanDerWaalsContact O-N 3.16Å; Y73-A75 PolarHBondContact O-N 3.3Å; A75-A78 PolarHBondContact O-N 3.4Å; A75-D79 PolarHBondContact O-N 2.57Å
76	L	88.3	Confident	85.2	Confident	20 Å²	20	38.6 Å²	38.6	11%	0.105	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-44.1	178.5	-69	172.2	0	0	0	112.6	Y6 R72 Y73 A78 D79 A80	Y6-L76 HydrophobicContact CD1-CD1 3.86Å; R72-L76 HydrophobicContact CG-CD1 4.5Å; R72-L76 WeakPolarHBondContact O-CG 3.27Å; R72-L76 PolarHBondContact O-N 2.97Å; Y73-L76 HydrophobicContact CD1-CD1 4.28Å; Y73-L76 HydrophobicContact CE1-CD1 4.45Å; Y73-L76 PolarHBondContact O-N 2.85Å; L76-A78 VanDerWaalsContact C-N 3.32Å; L76-D79 WeakPolarHBondContact O-CB 3.39Å; L76-D79 PolarHBondContact O-N 2.74Å; L76-A80 WeakPolarHBondContact O-CB 3.12Å; L76-A80 PolarHBondContact O-N 3.24Å
77	F	86.9	Confident	84.8	Confident	1 Å²	1	45 Å²	45	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-39.8	174.2	-88.6	-87.4	0	0	0	111.1	C13 F16 L17 I50 L62 V66 Y73 D79 A80 V81 L136 F138	C13-F77 HydrophobicContact CB-CD1 4.11Å; C13-F77 HydrophobicContact CB-CE1 3.86Å; C13-F77 HydrophobicContact CB-CE2 4.33Å; C13-F77 HydrophobicContact CB-CG 4.46Å; C13-F77 HydrophobicContact CB-CZ 3.98Å; C13-F77 WeakPolarHBondContact SG-CE2 3.05Å; C13-F77 VanDerWaalsContact SG-CZ 3.51Å; F16-F77 HydrophobicContact CD1-CE1 4.31Å; L17-F77 HydrophobicContact CD1-CD1 4.42Å; I50-F77 HydrophobicContact CD1-CD1 3.52Å; I50-F77 HydrophobicContact CD1-CE1 3.89Å; I50-F77 HydrophobicContact CD1-CG 4.21Å; L62-F77 HydrophobicContact CD2-CZ 4.36Å; V66-F77 HydrophobicContact CG2-CE2 4.28Å; Y73-F77 HydrophobicContact CD1-CE2 4.46Å; Y73-F77 WeakPolarHBondContact O-CB 3.35Å; Y73-F77 WeakPolarHBondContact O-CD2 3.47Å; Y73-F77 PolarHBondContact O-N 3.26Å; F77-D79 VanDerWaalsContact C-N 3.33Å; F77-D79 PolarHBondContact O-N 3.03Å; F77-A80 PolarHBondContact O-N 3.21Å; F77-V81 WeakPolarHBondContact O-CB 3.33Å; F77-V81 VanDerWaalsContact O-CG2 3.29Å; F77-V81 WeakPolarHBondContact O-CG2 3.42Å; F77-V81 PolarHBondContact O-N 3.35Å; F77-L136 HydrophobicContact CB-CD1 3.62Å; F77-L136 HydrophobicContact CB-CD2 4.25Å; F77-F138 HydrophobicContact CD2-CE1 4.13Å; F77-F138 AromaticContact CD2-CZ 3.69Å; F77-F138 HydrophobicContact CD2-CZ 3.69Å; F77-F138 HydrophobicContact CE2-CE1 4.22Å; F77-F138 HydrophobicContact CE2-CZ 4.06Å; F77-F138 HydrophobicContact CG-CE1 4.47Å; F77-F138 HydrophobicContact CG-CZ 4.24Å
78	A	86.4	Confident	84.2	Confident	11 Å²	11	46.1 Å²	46.1	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-36.7	174.2	0	0	0	0	0	112.6	T74 A75 L76 H82 F134	T74-A78 VanDerWaalsContact O-CB 3.25Å; T74-A78 WeakPolarHBondContact O-CB 3.21Å; T74-A78 PolarHBondContact O-N 2.81Å; A75-A78 PolarHBondContact O-N 3.4Å; L76-A78 VanDerWaalsContact C-N 3.32Å; A78-H82 VanDerWaalsContact O-CB 3.3Å; A78-H82 WeakPolarHBondContact O-CB 3.49Å; A78-H82 PolarHBondContact O-N 2.75Å; A78-F134 HydrophobicContact CB-CE2 4.44Å; A78-F134 WeakPolarHBondContact O-CZ 3.38Å
79	D	86.7	Confident	83.6	Confident	48 Å²	48	48 Å²	48	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-65.3	-45.7	172.9	-66.1	-8	0	0	0	111.1	A75 L76 F77 H82 E83 R132	A75-D79 PolarHBondContact O-N 2.57Å; L76-D79 WeakPolarHBondContact O-CB 3.39Å; L76-D79 PolarHBondContact O-N 2.74Å; F77-D79 VanDerWaalsContact C-N 3.33Å; F77-D79 PolarHBondContact O-N 3.03Å; D79-H82 PolarHBondContact O-N 2.79Å; D79-E83 PolarHBondContact O-N 3.42Å; D79-E83 VanDerWaalsContact O-N 3.09Å; D79-R132 IonicContact OD1-CZ 2.8Å; D79-R132 VanDerWaalsContact OD1-CZ 3.25Å; D79-R132 IonicContact OD1-NH1 2.74Å; D79-R132 PolarHBondContact OD1-NH1 3Å; D79-R132 IonicContact OD1-NH2 3.01Å; D79-R132 PolarHBondContact OD1-NH2 3.37Å
80	A	86.4	Confident	82.7	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-48.6	179.5	0	0	0	0	0	111.6	K10 C13 K14 L76 F77 H82 E83 L84	K10-A80 HydrophobicContact CG-CB 4.44Å; C13-A80 HydrophobicContact CB-CB 4.49Å; K14-A80 HydrophobicContact CG-CB 3.83Å; L76-A80 WeakPolarHBondContact O-CB 3.12Å; L76-A80 PolarHBondContact O-N 3.24Å; F77-A80 PolarHBondContact O-N 3.21Å; A80-H82 VanDerWaalsContact C-N 3.32Å; A80-H82 PolarHBondContact O-N 2.6Å; A80-E83 PolarHBondContact O-N 2.65Å; A80-L84 WeakPolarHBondContact O-CG 2.99Å; A80-L84 PolarHBondContact O-N 3.2Å; A80-L84 VanDerWaalsContact O-N 3.11Å
81	V	86.2	Confident	82.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.5	-43.1	175.6	173.2	0	0	0	0	110.5	L17 L37 L48 F77 E83 L84 L85 F134 L136	L17-V81 HydrophobicContact CD1-CG2 3.64Å; L37-V81 HydrophobicContact CD2-CG1 3.74Å; L37-V81 HydrophobicContact CD2-CG2 4.33Å; L48-V81 HydrophobicContact CD2-CG2 4.09Å; F77-V81 WeakPolarHBondContact O-CB 3.33Å; F77-V81 VanDerWaalsContact O-CG2 3.29Å; F77-V81 WeakPolarHBondContact O-CG2 3.42Å; F77-V81 PolarHBondContact O-N 3.35Å; V81-E83 VanDerWaalsContact C-N 3.28Å; V81-E83 PolarHBondContact O-N 3.08Å; V81-L84 PolarHBondContact O-N 3.44Å; V81-L84 VanDerWaalsContact O-N 3.08Å; V81-L85 HydrophobicContact CG1-CD2 4.46Å; V81-L85 HydrophobicContact CG1-CG 4.18Å; V81-L85 WeakPolarHBondContact O-CG 3.18Å; V81-L85 PolarHBondContact O-N 2.85Å; V81-F134 HydrophobicContact CB-CE1 4.5Å; V81-F134 HydrophobicContact CB-CE2 3.74Å; V81-F134 HydrophobicContact CB-CZ 3.6Å; V81-F134 HydrophobicContact CG1-CD1 4.43Å; V81-F134 HydrophobicContact CG1-CD2 4.12Å; V81-F134 HydrophobicContact CG1-CE1 3.86Å; V81-F134 HydrophobicContact CG1-CE2 3.5Å; V81-F134 VanDerWaalsContact CG1-CE2 3.5Å; V81-F134 HydrophobicContact CG1-CZ 3.36Å; V81-F134 HydrophobicContact CG2-CE2 4.43Å; V81-L136 HydrophobicContact CG2-CD1 4.23Å
82	H	84.1	Confident	80.9	Confident	66 Å²	66	65.2 Å²	65.2	31%	0.306	31%	0.314	S	S	.	.	H	α-helix	trans	-60.7	-36.7	179.8	-173.7	61.7	0	0	0	113.2	A78 D79 A80 F134	A78-H82 VanDerWaalsContact O-CB 3.3Å; A78-H82 WeakPolarHBondContact O-CB 3.49Å; A78-H82 PolarHBondContact O-N 2.75Å; D79-H82 PolarHBondContact O-N 2.79Å; A80-H82 VanDerWaalsContact C-N 3.32Å; A80-H82 PolarHBondContact O-N 2.6Å; H82-F134 HydrophobicContact CB-CZ 4.48Å
83	E	84.5	Confident	79.7	Confident	90 Å²	90	61.6 Å²	61.6	42%	0.421	30%	0.304	S	S	.	.	H	α-helix	trans	-72.9	-29.3	175.3	-73.9	174.1	-174.2	0	0	113.1	K10 K14 D79 A80 V81 P86	K10-E83 WeakPolarHBondContact CE-OE2 3.42Å; K10-E83 VanDerWaalsContact NZ-CD 3.28Å; K10-E83 IonicContact NZ-OE1 3.5Å; K10-E83 PolarHBondContact NZ-OE1 2.94Å; K10-E83 IonicContact NZ-OE2 3.94Å; K10-E83 PolarHBondContact NZ-OE2 3.06Å; K14-E83 WeakPolarHBondContact CE-OE2 3.17Å; K14-E83 IonicContact NZ-OE2 3.37Å; K14-E83 PolarHBondContact NZ-OE2 3.04Å; D79-E83 PolarHBondContact O-N 3.42Å; D79-E83 VanDerWaalsContact O-N 3.09Å; A80-E83 PolarHBondContact O-N 2.65Å; V81-E83 VanDerWaalsContact C-N 3.28Å; V81-E83 PolarHBondContact O-N 3.08Å; E83-P86 WeakPolarHBondContact O-CD 3.34Å
84	L	82.4	Confident	78.5	Confident	4 Å²	4	67 Å²	67	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-81	-31.6	178.4	-69.3	175.2	0	0	0	113.2	K14 L17 Q18 A80 V81 P86 E87 Y88	K14-L84 HydrophobicContact CG-CD1 4.38Å; L17-L84 HydrophobicContact CB-CD1 4.11Å; L17-L84 HydrophobicContact CD1-CD1 4.09Å; Q18-L84 HydrophobicContact CG-CD1 4.42Å; Q18-L84 HydrophobicContact CG-CD2 4.33Å; A80-L84 WeakPolarHBondContact O-CG 2.99Å; A80-L84 PolarHBondContact O-N 3.2Å; A80-L84 VanDerWaalsContact O-N 3.11Å; V81-L84 PolarHBondContact O-N 3.44Å; V81-L84 VanDerWaalsContact O-N 3.08Å; L84-P86 VanDerWaalsContact C-N 3.31Å; L84-P86 VanDerWaalsContact O-N 3.11Å; L84-E87 WeakPolarHBondContact O-CB 3.32Å; L84-E87 PolarHBondContact O-N 2.68Å; L84-Y88 HydrophobicContact CB-CE2 4.41Å; L84-Y88 WeakPolarHBondContact O-CD2 3.42Å
85	L	79.3	Confident	77.2	Confident	25 Å²	25	67.4 Å²	67.4	13%	0.131	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-38.1	-176.3	-79.5	175.5	0	0	0	115.6	L40 A41 V81 E87 F134	L40-L85 HydrophobicContact CB-CD2 4.03Å; A41-L85 HydrophobicContact CB-CD2 4.26Å; V81-L85 HydrophobicContact CG1-CD2 4.46Å; V81-L85 HydrophobicContact CG1-CG 4.18Å; V81-L85 WeakPolarHBondContact O-CG 3.18Å; V81-L85 PolarHBondContact O-N 2.85Å; L85-E87 VanDerWaalsContact C-N 3.32Å; L85-E87 PolarHBondContact O-N 2.79Å; L85-F134 HydrophobicContact CD1-CD1 3.77Å; L85-F134 HydrophobicContact CD1-CE1 3.55Å
86	P	76.3	Confident	76.2	Confident	87 Å²	87	73.4 Å²	73.4	57%	0.565	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-30.6	177.1	-22.6	35.1	0	0	0	114.3	E83 L84 Y88	E83-P86 WeakPolarHBondContact O-CD 3.34Å; L84-P86 VanDerWaalsContact C-N 3.31Å; L84-P86 VanDerWaalsContact O-N 3.11Å; P86-Y88 VanDerWaalsContact C-N 3.34Å
87	E	75.7	Confident	75.1	Confident	134 Å²	134	76.1 Å²	76.1	63%	0.626	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-27	-176.9	-62	-179.5	166.7	0	0	112.4	L84 L85	L84-E87 WeakPolarHBondContact O-CB 3.32Å; L84-E87 PolarHBondContact O-N 2.68Å; L85-E87 VanDerWaalsContact C-N 3.32Å; L85-E87 PolarHBondContact O-N 2.79Å
88	Y	72.1	Confident	74.2	Confident	59 Å²	59	80.8 Å²	80.8	23%	0.231	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	10.8	-175.2	-70	-84.8	0	0	0	114.1	L37 V38 L84 P86 E90	L37-Y88 HydrophobicContact CB-CG 4.48Å; L37-Y88 HydrophobicContact CD1-CE2 4.32Å; V38-Y88 HydrophobicContact CG2-CD1 4.1Å; L84-Y88 HydrophobicContact CB-CE2 4.41Å; L84-Y88 WeakPolarHBondContact O-CD2 3.42Å; P86-Y88 VanDerWaalsContact C-N 3.34Å; Y88-E90 PolarHBondContact O-N 3.14Å
89	K	72.9	Confident	73.5	Confident	128 Å²	128	82 Å²	82	56%	0.557	41%	0.413	S	S	*	.			trans	-79.2	101.7	175.1	-77.7	-178.3	178.7	-175.3	0	110.7	A41	A41-K89 HydrophobicContact CB-CG 4.04Å
90	E	68.9	Low	72.7	Confident	147 Å²	147	80 Å²	80	69%	0.687	40%	0.402	S	S	*	.			trans	-86.3	-24.6	176.5	-60	-177.4	166.6	0	0	113.1	Y88	Y88-E90 PolarHBondContact O-N 3.14Å
91	R	70.6	Confident	72.1	Confident	191 Å²	191	83.5 Å²	83.5	72%	0.721	42%	0.424	S	S	*	.	S	Bend	trans	-135	146	-178.6	-62.1	-178	-177.5	176.2	2.1	112.1	V93	R91-V93 PolarHBondContact O-N 2.85Å
92	D	61.9	Low	71.5	Confident	172 Å²	172	86.4 Å²	86.4	92%	0.92	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-67.9	116.9	169	-75.6	-31.9	0	0	0	109.7
93	V	62.6	Low	71.1	Confident	40 Å²	40	83.9 Å²	83.9	24%	0.242	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-84.8	122.5	-175.4	-170.7	0	0	0	0	109.3	A41 R43 R91 A95	A41-V93 WeakPolarHBondContact O-CG2 3.48Å; R43-V93 HydrophobicContact CB-CG1 4.35Å; R43-V93 HydrophobicContact CG-CG1 4.1Å; R91-V93 PolarHBondContact O-N 2.85Å; V93-A95 PolarHBondContact O-N 3.11Å
94	V	61.9	Low	70.5	Confident	121 Å²	121	83.4 Å²	83.4	73%	0.733	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-64.9	128.6	170.6	-177.6	0	0	0	0	108.9	K96	V94-K96 PolarHBondContact O-N 3.26Å
95	A	60.7	Low	70.2	Confident	28 Å²	28	88.3 Å²	88.3	23%	0.231	44%	0.444	C	S	.	.			trans	-59.7	106.9	176.7	0	0	0	0	0	110.6	V93 V101	V93-A95 PolarHBondContact O-N 3.11Å; A95-V101 HydrophobicContact CB-CG2 3.65Å
96	K	64.4	Low	69.8	Low	169 Å²	169	88.7 Å²	88.7	74%	0.735	44%	0.444	S	S	*	.			trans	-86.3	-23.4	178.3	-70	-178.5	-179	171.7	0	113.1	V94	V94-K96 PolarHBondContact O-N 3.26Å
97	D	65.4	Low	69.7	Low	78 Å²	78	87.4 Å²	87.4	42%	0.417	43%	0.432	S	S	.	.	S	Bend	trans	-114.2	139.8	-167.7	-169.2	5.3	0	0	0	112.7	L99 D100 V101	D97-L99 VanDerWaalsContact C-N 3.32Å; D97-L99 PolarHBondContact O-N 2.96Å; D97-D100 HydrophobicContact CB-CB 4.45Å; D97-D100 VanDerWaalsContact O-CB 3.31Å; D97-D100 WeakPolarHBondContact O-CB 3.34Å; D97-D100 PolarHBondContact O-N 3.11Å; D97-V101 PolarHBondContact O-N 3.01Å
98	S	68.7	Low	69.6	Low	98 Å²	98	84.5 Å²	84.5	69%	0.685	42%	0.42	S	S	*	.	H	α-helix	trans	-55.5	-40.5	179	59	0	0	0	0	113.5	D100 Y102	S98-D100 VanDerWaalsContact C-N 3.28Å; S98-D100 PolarHBondContact O-N 2.84Å; S98-Y102 VanDerWaalsContact O-CB 3.26Å; S98-Y102 WeakPolarHBondContact O-CB 3.23Å; S98-Y102 PolarHBondContact O-N 3.28Å; S98-Y102 VanDerWaalsContact O-N 3.1Å
99	L	72.4	Confident	69.5	Low	37 Å²	37	86.4 Å²	86.4	19%	0.194	43%	0.432	C	S	.	.	H	α-helix	trans	-66.8	-33	176.9	-166.8	108.7	0	0	0	111.2	D97 Y102 I103	D97-L99 VanDerWaalsContact C-N 3.32Å; D97-L99 PolarHBondContact O-N 2.96Å; L99-Y102 PolarHBondContact O-N 2.86Å; L99-I103 HydrophobicContact CD2-CD1 3.62Å; L99-I103 HydrophobicContact CG-CD1 4.02Å; L99-I103 WeakPolarHBondContact O-CB 3.26Å; L99-I103 VanDerWaalsContact O-CG1 3.23Å; L99-I103 WeakPolarHBondContact O-CG1 3.32Å; L99-I103 PolarHBondContact O-N 3.28Å
100	D	69.5	Low	69.2	Low	5 Å²	5	82.9 Å²	82.9	3%	0.027	42%	0.418	C	S	.	.	H	α-helix	trans	-73	-49.2	178.9	-156.9	39	0	0	0	113.4	R43 D97 S98 Y102 I103 E104 R133	R43-D100 IonicContact CZ-OD2 3.5Å; R43-D100 IonicContact NH1-OD2 3.48Å; R43-D100 PolarHBondContact NH1-OD2 2.89Å; R43-D100 VanDerWaalsContact NH2-CG 3.32Å; R43-D100 IonicContact NH2-OD1 2.89Å; R43-D100 PolarHBondContact NH2-OD1 2.65Å; R43-D100 IonicContact NH2-OD2 3.47Å; R43-D100 PolarHBondContact NH2-OD2 2.86Å; D97-D100 HydrophobicContact CB-CB 4.45Å; D97-D100 VanDerWaalsContact O-CB 3.31Å; D97-D100 WeakPolarHBondContact O-CB 3.34Å; D97-D100 PolarHBondContact O-N 3.11Å; S98-D100 VanDerWaalsContact C-N 3.28Å; S98-D100 PolarHBondContact O-N 2.84Å; D100-Y102 PolarHBondContact O-N 3.47Å; D100-Y102 VanDerWaalsContact O-N 3.16Å; D100-I103 PolarHBondContact O-N 3.31Å; D100-I103 VanDerWaalsContact O-N 3.08Å; D100-E104 WeakPolarHBondContact O-CB 3.47Å; D100-E104 PolarHBondContact O-N 2.55Å; D100-R133 IonicContact OD1-CZ 3.36Å; D100-R133 IonicContact OD1-NE 3.53Å; D100-R133 PolarHBondContact OD1-NE 2.75Å; D100-R133 IonicContact OD1-NH1 3.73Å; D100-R133 IonicContact OD1-NH2 3.79Å; D100-R133 PolarHBondContact OD1-NH2 3.41Å; D100-R133 IonicContact OD2-CZ 3.83Å; D100-R133 IonicContact OD2-NH1 3.58Å
101	V	72.8	Confident	69.1	Low	75 Å²	75	82.4 Å²	82.4	46%	0.455	42%	0.416	S	S	.	.	H	α-helix	trans	-54.9	-37.6	174.6	177.4	0	0	0	0	109.1	A95 D97 H105	A95-V101 HydrophobicContact CB-CG2 3.65Å; D97-V101 PolarHBondContact O-N 3.01Å; V101-H105 WeakPolarHBondContact O-CB 3.25Å; V101-H105 PolarHBondContact O-N 3.47Å
102	Y	75.1	Confident	68.8	Low	61 Å²	61	82.9 Å²	82.9	24%	0.239	42%	0.417	C	S	.	.	H	α-helix	trans	-68.9	-45.5	177.7	-159	-107.5	0	0	0	113.1	S98 L99 D100 R106 Q223 R225	S98-Y102 VanDerWaalsContact O-CB 3.26Å; S98-Y102 WeakPolarHBondContact O-CB 3.23Å; S98-Y102 PolarHBondContact O-N 3.28Å; S98-Y102 VanDerWaalsContact O-N 3.1Å; L99-Y102 PolarHBondContact O-N 2.86Å; D100-Y102 PolarHBondContact O-N 3.47Å; D100-Y102 VanDerWaalsContact O-N 3.16Å; Y102-R106 WeakPolarHBondContact O-CB 3.48Å; Y102-R106 VanDerWaalsContact O-CG 3.31Å; Y102-R106 WeakPolarHBondContact O-CG 3.35Å; Y102-R106 PolarHBondContact O-N 3.18Å; Y102-R106 PolarHBondContact OH-NH2 3.16Å; Y102-Q223 PolarHBondContact OH-NE2 3.28Å; Y102-R225 HydrophobicContact CD1-CB 4.49Å; Y102-R225 HydrophobicContact CE1-CB 4.07Å
103	I	75.4	Confident	68.6	Low	12 Å²	12	78.1 Å²	78.1	6%	0.062	41%	0.408	C	S	.	.	H	α-helix	trans	-66.7	-45.4	176.7	-69.8	166.7	0	0	0	111.1	L99 D100 R106 L107 M131	L99-I103 HydrophobicContact CD2-CD1 3.62Å; L99-I103 HydrophobicContact CG-CD1 4.02Å; L99-I103 WeakPolarHBondContact O-CB 3.26Å; L99-I103 VanDerWaalsContact O-CG1 3.23Å; L99-I103 WeakPolarHBondContact O-CG1 3.32Å; L99-I103 PolarHBondContact O-N 3.28Å; D100-I103 PolarHBondContact O-N 3.31Å; D100-I103 VanDerWaalsContact O-N 3.08Å; I103-R106 CarbonylContact O-C 3.38Å; I103-R106 WeakPolarHBondContact O-CB 3.49Å; I103-R106 PolarHBondContact O-N 3.02Å; I103-L107 WeakPolarHBondContact O-CB 3.32Å; I103-L107 PolarHBondContact O-N 3.15Å; I103-M131 HydrophobicContact CG2-CE 4.08Å; I103-M131 HydrophobicContact CG2-SD 3.7Å
104	E	72.4	Confident	68.4	Low	81 Å²	81	81.9 Å²	81.9	38%	0.379	42%	0.418	S	S	.	.	H	α-helix	trans	-63.1	-46.1	177.5	-76	-172.7	162.4	0	0	111.3	D100 R106 L107 I108	D100-E104 WeakPolarHBondContact O-CB 3.47Å; D100-E104 PolarHBondContact O-N 2.55Å; E104-R106 PolarHBondContact O-N 2.89Å; E104-L107 PolarHBondContact O-N 2.85Å; E104-I108 WeakPolarHBondContact O-CB 3.34Å; E104-I108 WeakPolarHBondContact O-CD1 3.27Å; E104-I108 WeakPolarHBondContact O-CG1 3.15Å; E104-I108 PolarHBondContact O-N 3Å
105	H	74.8	Confident	67.9	Low	107 Å²	107	82.5 Å²	82.5	50%	0.495	42%	0.418	S	S	.	.	H	α-helix	trans	-59.1	-37.6	175.2	-174.3	-87	0	0	0	111.3	V101 M109	V101-H105 WeakPolarHBondContact O-CB 3.25Å; V101-H105 PolarHBondContact O-N 3.47Å; H105-M109 WeakPolarHBondContact O-CB 3.35Å; H105-M109 WeakPolarHBondContact O-CG 3.14Å; H105-M109 PolarHBondContact O-N 3.17Å
106	R	72.1	Confident	67.5	Low	33 Å²	33	87.8 Å²	87.8	13%	0.125	45%	0.449	C	S	.	.	H	α-helix	trans	-68.3	-44.7	173.6	-79.9	179.9	170.4	-168.5	-8.7	113	Y102 I103 E104 I108 M109 E110 E190	Y102-R106 WeakPolarHBondContact O-CB 3.48Å; Y102-R106 VanDerWaalsContact O-CG 3.31Å; Y102-R106 WeakPolarHBondContact O-CG 3.35Å; Y102-R106 PolarHBondContact O-N 3.18Å; Y102-R106 PolarHBondContact OH-NH2 3.16Å; I103-R106 CarbonylContact O-C 3.38Å; I103-R106 WeakPolarHBondContact O-CB 3.49Å; I103-R106 PolarHBondContact O-N 3.02Å; E104-R106 PolarHBondContact O-N 2.89Å; R106-I108 VanDerWaalsContact C-N 3.28Å; R106-I108 PolarHBondContact O-N 2.77Å; R106-M109 PolarHBondContact O-N 3.4Å; R106-E110 WeakPolarHBondContact O-CB 3.44Å; R106-E110 PolarHBondContact O-N 3.34Å; R106-E190 IonicContact CZ-OE1 2.57Å; R106-E190 IonicContact CZ-OE2 3.24Å; R106-E190 IonicContact NE-OE1 3.95Å; R106-E190 PolarHBondContact NE-OE1 3.31Å; R106-E190 IonicContact NE-OE2 3.91Å; R106-E190 VanDerWaalsContact NH1-CD 3.3Å; R106-E190 IonicContact NH1-OE1 2.74Å; R106-E190 PolarHBondContact NH1-OE1 3.31Å; R106-E190 IonicContact NH1-OE2 2.85Å; R106-E190 PolarHBondContact NH1-OE2 3.18Å; R106-E190 IonicContact NH2-OE1 3.37Å; R106-E190 PolarHBondContact NH2-OE1 3.37Å; R106-E190 IonicContact NH2-OE2 3.21Å
107	L	73.4	Confident	66.8	Low	59 Å²	59	84 Å²	84	31%	0.309	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-41	178.4	-140	96.8	0	0	0	110.7	I103 E104 Q111 Y126	I103-L107 WeakPolarHBondContact O-CB 3.32Å; I103-L107 PolarHBondContact O-N 3.15Å; E104-L107 PolarHBondContact O-N 2.85Å; L107-Q111 WeakPolarHBondContact O-CB 3.31Å; L107-Q111 VanDerWaalsContact O-CG 3.27Å; L107-Q111 WeakPolarHBondContact O-CG 3.26Å; L107-Q111 PolarHBondContact O-N 2.59Å; L107-Y126 HydrophobicContact CD1-CD2 4.43Å; L107-Y126 HydrophobicContact CD1-CE2 4.06Å
108	I	74.1	Confident	66.1	Low	74 Å²	74	86.5 Å²	86.5	38%	0.379	46%	0.463	S	S	.	.	H	α-helix	trans	-68.6	-42.9	177.2	-66.7	164.5	0	0	0	111.1	E104 R106 Q111 R112	E104-I108 WeakPolarHBondContact O-CB 3.34Å; E104-I108 WeakPolarHBondContact O-CD1 3.27Å; E104-I108 WeakPolarHBondContact O-CG1 3.15Å; E104-I108 PolarHBondContact O-N 3Å; R106-I108 VanDerWaalsContact C-N 3.28Å; R106-I108 PolarHBondContact O-N 2.77Å; I108-Q111 PolarHBondContact O-N 2.84Å; I108-R112 WeakPolarHBondContact O-CB 3.26Å; I108-R112 WeakPolarHBondContact O-CG 3.23Å; I108-R112 PolarHBondContact O-N 3.27Å
109	M	69.3	Low	65.2	Low	98 Å²	98	88.1 Å²	88.1	48%	0.483	47%	0.469	S	S	.	.	H	α-helix	trans	-64.3	-40.3	175.9	-74.3	-71.3	157.9	0	0	111.7	H105 R106 R112 G113	H105-M109 WeakPolarHBondContact O-CB 3.35Å; H105-M109 WeakPolarHBondContact O-CG 3.14Å; H105-M109 PolarHBondContact O-N 3.17Å; R106-M109 PolarHBondContact O-N 3.4Å; M109-R112 PolarHBondContact O-N 3.4Å; M109-G113 PolarHBondContact O-N 3.23Å; M109-G113 VanDerWaalsContact O-N 3.12Å
110	E	67.1	Low	64.3	Low	54 Å²	54	90.7 Å²	90.7	25%	0.252	48%	0.476	S	S	.	.	H	α-helix	trans	-67.8	-38.9	175.9	-165.4	-173.8	162.9	0	0	111.7	R106 G113 R114 R120 Y126	R106-E110 WeakPolarHBondContact O-CB 3.44Å; R106-E110 PolarHBondContact O-N 3.34Å; E110-G113 PolarHBondContact O-N 2.97Å; E110-R114 IonicContact OE1-CZ 2.8Å; E110-R114 IonicContact OE1-NH1 3.86Å; E110-R114 PolarHBondContact OE1-NH1 3.05Å; E110-R114 IonicContact OE1-NH2 3.86Å; E110-R114 PolarHBondContact OE1-NH2 3.48Å; E110-R120 IonicContact OE1-NH2 3.3Å; E110-Y126 WeakPolarHBondContact OE2-CE2 3.28Å; E110-Y126 VanDerWaalsContact OE2-CZ 3.28Å; E110-Y126 PolarHBondContact OE2-OH 3.06Å
111	Q	65.9	Low	63.5	Low	138 Å²	138	93.3 Å²	93.3	65%	0.645	49%	0.49	S	S	*	.	H	α-helix	trans	-66.9	-35.7	175.1	-80.6	178.8	-2	0	0	112.8	L107 I108	L107-Q111 WeakPolarHBondContact O-CB 3.31Å; L107-Q111 VanDerWaalsContact O-CG 3.27Å; L107-Q111 WeakPolarHBondContact O-CG 3.26Å; L107-Q111 PolarHBondContact O-N 2.59Å; I108-Q111 PolarHBondContact O-N 2.84Å
112	R	65.9	Low	62.6	Low	201 Å²	201	94.7 Å²	94.7	76%	0.758	50%	0.501	S	S	*	.	H	α-helix	trans	-76.2	-25.1	178.6	-74.9	178.8	-179.1	-177.2	1.9	113.6	I108 M109	I108-R112 WeakPolarHBondContact O-CB 3.26Å; I108-R112 WeakPolarHBondContact O-CG 3.23Å; I108-R112 PolarHBondContact O-N 3.27Å; M109-R112 PolarHBondContact O-N 3.4Å
113	G	56.7	Low	61.6	Low	71 Å²	71	102.6 Å²	102.6	73%	0.732	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	4.3	-178.3	0	0	0	0	0	115.5	M109 E110	M109-G113 PolarHBondContact O-N 3.23Å; M109-G113 VanDerWaalsContact O-N 3.12Å; E110-G113 PolarHBondContact O-N 2.97Å
114	R	58	Low	60.8	Low	120 Å²	120	104.3 Å²	104.3	45%	0.453	54%	0.54	S	S	.	.			trans	-113	135.2	-168.7	-113.5	-172.1	-176.9	126.7	12.1	114.4	E110	E110-R114 IonicContact OE1-CZ 2.8Å; E110-R114 IonicContact OE1-NH1 3.86Å; E110-R114 PolarHBondContact OE1-NH1 3.05Å; E110-R114 IonicContact OE1-NH2 3.86Å; E110-R114 PolarHBondContact OE1-NH2 3.48Å
115	D	51.6	Low	60.6	Low	134 Å²	134	105.8 Å²	105.8	72%	0.717	55%	0.547	S	S	*	.			trans	-80.3	140.6	156.3	-84.8	-43.5	0	0	0	110.1	A117	D115-A117 PolarHBondContact O-N 3.1Å
116	P	52.6	Low	60.3	Low	138 Å²	138	102.4 Å²	102.4	90%	0.896	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	1	-174.9	25.1	-33	0	0	0	115.5
117	A	49.2	Very low	60.3	Low	90 Å²	90	101.9 Å²	101.9	74%	0.744	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-9.8	-174.7	0	0	0	0	0	114.7	D115 T119	D115-A117 PolarHBondContact O-N 3.1Å; A117-T119 PolarHBondContact O-N 3.45Å
118	D	51.8	Low	60.2	Low	130 Å²	130	101.8 Å²	101.8	70%	0.695	53%	0.534	S	S	*	.			trans	-90.1	101.6	-174.2	-130.7	0.9	0	0	0	111.2	R120	D118-R120 PolarHBondContact O-N 3.16Å
119	T	48.2	Very low	60.1	Low	133 Å²	133	101.5 Å²	101.5	82%	0.816	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-65.4	122.7	176.1	40	0	0	0	0	110.4	A117 D121	A117-T119 PolarHBondContact O-N 3.45Å; T119-D121 PolarHBondContact O-N 3.01Å
120	R	54.8	Low	60.4	Low	90 Å²	90	97.1 Å²	97.1	34%	0.34	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-51.4	135	177.3	-125.4	-177.9	-179.9	166.4	5.4	111.6	E110 D118 P122 Y126	E110-R120 IonicContact OE1-NH2 3.3Å; D118-R120 PolarHBondContact O-N 3.16Å; R120-P122 WeakPolarHBondContact O-CD 3.31Å; R120-Y126 VanDerWaalsContact NH2-CD2 3.33Å
121	D	52.4	Low	60.7	Low	60 Å²	60	97.8 Å²	97.8	32%	0.321	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-64.5	124.4	154	-102.5	-29.9	0	0	0	108.4	T119 R123 N124 Q209	T119-D121 PolarHBondContact O-N 3.01Å; D121-R123 PolarHBondContact O-N 3.35Å; D121-N124 PolarHBondContact O-N 2.9Å; D121-N124 VanDerWaalsContact O-N 3.1Å; D121-Q209 PolarHBondContact OD1-NE2 2.79Å; D121-Q209 VanDerWaalsContact OD2-CG 3.26Å; D121-Q209 WeakPolarHBondContact OD2-CG 3.49Å; D121-Q209 PolarHBondContact OD2-NE2 3.15Å
122	P	53.4	Low	61	Low	105 Å²	105	92.7 Å²	92.7	68%	0.682	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-62.4	-13.7	-179	22.7	-32.3	0	0	0	113.4	R120	R120-P122 WeakPolarHBondContact O-CD 3.31Å
123	R	53.9	Low	61.4	Low	226 Å²	226	86.7 Å²	86.7	85%	0.853	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-80	-21.1	177	-77	178.3	173.3	169.2	-1.6	114.7	D121	D121-R123 PolarHBondContact O-N 3.35Å
124	N	59.6	Low	62.8	Low	49 Å²	49	84.1 Å²	84.1	26%	0.262	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-100.3	14.9	178	-78.2	-0.1	0	0	0	112.3	D121	D121-N124 PolarHBondContact O-N 2.9Å; D121-N124 VanDerWaalsContact O-N 3.1Å
125	Q	67.6	Low	64	Low	112 Å²	112	80.5 Å²	80.5	52%	0.523	42%	0.422	S	S	.	.	S	Bend	trans	-73.7	133.7	172.7	-170.8	148	13	0	0	109.5	P127	Q125-P127 WeakPolarHBondContact O-CD 3.23Å; Q125-P127 VanDerWaalsContact O-N 3.12Å
126	Y	69.5	Low	65.7	Low	35 Å²	35	75 Å²	75	14%	0.137	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-53.9	120.5	174.5	-66.5	-82	0	0	0	109.2	L107 E110 R120 L130 Y192	L107-Y126 HydrophobicContact CD1-CD2 4.43Å; L107-Y126 HydrophobicContact CD1-CE2 4.06Å; E110-Y126 WeakPolarHBondContact OE2-CE2 3.28Å; E110-Y126 VanDerWaalsContact OE2-CZ 3.28Å; E110-Y126 PolarHBondContact OE2-OH 3.06Å; R120-Y126 VanDerWaalsContact NH2-CD2 3.33Å; Y126-L130 HydrophobicContact CD1-CD2 3.88Å; Y126-Y192 HydrophobicContact CD1-CE1 4.1Å; Y126-Y192 AromaticContact CD1-CE2 3.94Å; Y126-Y192 HydrophobicContact CD1-CE2 3.94Å; Y126-Y192 AromaticContact CD1-CZ 3.61Å; Y126-Y192 HydrophobicContact CE1-CE1 4.27Å; Y126-Y192 HydrophobicContact CE1-CE2 4.07Å; Y126-Y192 AromaticContact CE1-CZ 3.54Å; Y126-Y192 WeakPolarHBondContact CE1-OH 3.29Å
127	P	71.1	Confident	67.5	Low	22 Å²	22	69 Å²	69	14%	0.143	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-62.7	138.2	175.8	21.5	-28.3	0	0	0	108.4	Q125 E129 L130 V179 Y192	Q125-P127 WeakPolarHBondContact O-CD 3.23Å; Q125-P127 VanDerWaalsContact O-N 3.12Å; P127-E129 PolarHBondContact O-N 2.9Å; P127-E129 VanDerWaalsContact O-N 3.11Å; P127-L130 HydrophobicContact CG-CB 4.2Å; P127-L130 WeakPolarHBondContact O-CB 3.5Å; P127-L130 PolarHBondContact O-N 3.18Å; P127-V179 HydrophobicContact CG-CG1 4.29Å; P127-Y192 HydrophobicContact CG-CG 4.24Å
128	P	71.3	Confident	69.4	Low	58 Å²	58	64.8 Å²	64.8	38%	0.377	32%	0.317	S	S	.	.	H	α-helix	trans	-60.3	-26.4	-179.2	25.6	-34.8	0	0	0	111.5	L130 M131 R132	P128-L130 PolarHBondContact O-N 3.17Å; P128-M131 CarbonylContact O-C 3.57Å; P128-M131 PolarHBondContact O-N 2.74Å; P128-M131 VanDerWaalsContact O-N 3.11Å; P128-R132 WeakPolarHBondContact O-CB 3.48Å; P128-R132 VanDerWaalsContact O-CG 3.23Å; P128-R132 WeakPolarHBondContact O-CG 3.46Å; P128-R132 PolarHBondContact O-N 2.96Å
129	E	71.7	Confident	70.9	Confident	67 Å²	67	62.7 Å²	62.7	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-58.3	-30.3	173.7	-63.1	-178.9	170.4	0	0	114	P127 V179 P194 K228	P127-E129 PolarHBondContact O-N 2.9Å; P127-E129 VanDerWaalsContact O-N 3.11Å; E129-V179 HydrophobicContact CB-CG2 4.11Å; E129-P194 VanDerWaalsContact OE2-CB 3.32Å; E129-P194 WeakPolarHBondContact OE2-CB 3.24Å; E129-K228 WeakPolarHBondContact O-CD 3.37Å; E129-K228 PolarHBondContact O-NZ 3.21Å
130	L	76.3	Confident	72.3	Confident	6 Å²	6	57 Å²	57	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-73.2	-38.9	176	-170.8	76.7	0	0	0	111.2	Y126 P127 P128 V179 T181 Y192 K228	Y126-L130 HydrophobicContact CD1-CD2 3.88Å; P127-L130 HydrophobicContact CG-CB 4.2Å; P127-L130 WeakPolarHBondContact O-CB 3.5Å; P127-L130 PolarHBondContact O-N 3.18Å; P128-L130 PolarHBondContact O-N 3.17Å; L130-V179 HydrophobicContact CD1-CB 3.97Å; L130-V179 HydrophobicContact CD1-CG1 3.89Å; L130-T181 HydrophobicContact CD1-CG2 4.45Å; L130-Y192 HydrophobicContact CD2-CD1 3.81Å; L130-Y192 HydrophobicContact CD2-CE1 3.54Å; L130-K228 HydrophobicContact CD1-CB 4.25Å
131	M	72.8	Confident	73.4	Confident	68 Å²	68	53.3 Å²	53.3	34%	0.335	26%	0.256	S	S	.	.	H	α-helix	trans	-82	-20.2	-179.9	-60.7	-59.8	-72.6	0	0	112.9	I103 P128 R133	I103-M131 HydrophobicContact CG2-CE 4.08Å; I103-M131 HydrophobicContact CG2-SD 3.7Å; P128-M131 CarbonylContact O-C 3.57Å; P128-M131 PolarHBondContact O-N 2.74Å; P128-M131 VanDerWaalsContact O-N 3.11Å; M131-R133 PolarHBondContact O-N 2.84Å; M131-R133 VanDerWaalsContact O-N 3.14Å
132	R	73.1	Confident	74.4	Confident	31 Å²	31	55.5 Å²	55.5	12%	0.117	28%	0.276	C	S	.	.			trans	-67.6	107.4	177.3	-81.7	173.1	-154.9	-176.9	10.5	110.7	D79 P128 F134 K228	D79-R132 IonicContact OD1-CZ 2.8Å; D79-R132 VanDerWaalsContact OD1-CZ 3.25Å; D79-R132 IonicContact OD1-NH1 2.74Å; D79-R132 PolarHBondContact OD1-NH1 3Å; D79-R132 IonicContact OD1-NH2 3.01Å; D79-R132 PolarHBondContact OD1-NH2 3.37Å; P128-R132 WeakPolarHBondContact O-CB 3.48Å; P128-R132 VanDerWaalsContact O-CG 3.23Å; P128-R132 WeakPolarHBondContact O-CG 3.46Å; P128-R132 PolarHBondContact O-N 2.96Å; R132-F134 HydrophobicContact CG-CE1 4.36Å; R132-K228 WeakPolarHBondContact O-CE 2.94Å; R132-K228 PolarHBondContact O-NZ 3.37Å
133	R	74.3	Confident	75	Confident	76 Å²	76	56.3 Å²	56.3	29%	0.287	28%	0.28	S	S	.	.			trans	-96.1	-15.7	175.3	-70.4	163.1	175.2	-85	-27.8	113.4	V46 D100 M131	V46-R133 WeakPolarHBondContact CG1-O 3.42Å; D100-R133 IonicContact OD1-CZ 3.36Å; D100-R133 IonicContact OD1-NE 3.53Å; D100-R133 PolarHBondContact OD1-NE 2.75Å; D100-R133 IonicContact OD1-NH1 3.73Å; D100-R133 IonicContact OD1-NH2 3.79Å; D100-R133 PolarHBondContact OD1-NH2 3.41Å; D100-R133 IonicContact OD2-CZ 3.83Å; D100-R133 IonicContact OD2-NH1 3.58Å; M131-R133 PolarHBondContact O-N 2.84Å; M131-R133 VanDerWaalsContact O-N 3.14Å
134	F	84.6	Confident	75.9	Confident	16 Å²	16	47.7 Å²	47.7	7%	0.07	25%	0.254	C	S	.	.			trans	-97	152.4	176.8	69.2	-85.2	0	0	0	110	L40 V46 A78 V81 H82 L85 R132	L40-F134 HydrophobicContact CD2-CB 3.85Å; V46-F134 CarbonylContact O-C 3.59Å; V46-F134 WeakPolarHBondContact O-CA 3.46Å; V46-F134 WeakPolarHBondContact O-CB 3.13Å; A78-F134 HydrophobicContact CB-CE2 4.44Å; A78-F134 WeakPolarHBondContact O-CZ 3.38Å; V81-F134 HydrophobicContact CB-CE1 4.5Å; V81-F134 HydrophobicContact CB-CE2 3.74Å; V81-F134 HydrophobicContact CB-CZ 3.6Å; V81-F134 HydrophobicContact CG1-CD1 4.43Å; V81-F134 HydrophobicContact CG1-CD2 4.12Å; V81-F134 HydrophobicContact CG1-CE1 3.86Å; V81-F134 HydrophobicContact CG1-CE2 3.5Å; V81-F134 VanDerWaalsContact CG1-CE2 3.5Å; V81-F134 HydrophobicContact CG1-CZ 3.36Å; V81-F134 HydrophobicContact CG2-CE2 4.43Å; H82-F134 HydrophobicContact CB-CZ 4.48Å; L85-F134 HydrophobicContact CD1-CD1 3.77Å; L85-F134 HydrophobicContact CD1-CE1 3.55Å; R132-F134 HydrophobicContact CG-CE1 4.36Å
135	E	84.7	Confident	76.7	Confident	44 Å²	44	54.1 Å²	54.1	21%	0.206	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.8	172.2	-65	175.1	157.7	0	0	107.7	V46 L48 Y137 V230 G259 E260	V46-E135 PolarHBondContact O-N 3.22Å; L48-E135 PolarHBondContact N-O 3.41Å; E135-Y137 HydrophobicContact CB-CE2 4.03Å; E135-Y137 PolarHBondContact OE2-OH 3.14Å; E135-V230 WeakPolarHBondContact OE1-CG1 3.31Å; E135-G259 WeakPolarHBondContact OE1-CA 3.37Å; E135-G259 WeakPolarHBondContact OE2-CA 3.3Å; E135-E260 PolarHBondContact OE2-N 2.64Å
136	L	87.8	Confident	77.3	Confident	19 Å²	19	50.7 Å²	50.7	10%	0.099	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.5	-177.7	-169	153.3	0	0	0	108.9	L48 I50 F77 V81 F138	L48-L136 HydrophobicContact CD2-CD1 4.16Å; L48-L136 WeakPolarHBondContact O-CA 3.46Å; I50-L136 HydrophobicContact CD1-CD1 3.74Å; I50-L136 HydrophobicContact CD1-CD2 4Å; I50-L136 HydrophobicContact CD1-CG 4.04Å; I50-L136 HydrophobicContact CG1-CD1 4.47Å; I50-L136 HydrophobicContact CG1-CD2 4.34Å; I50-L136 HydrophobicContact CG1-CG 4.32Å; F77-L136 HydrophobicContact CB-CD1 3.62Å; F77-L136 HydrophobicContact CB-CD2 4.25Å; V81-L136 HydrophobicContact CG2-CD1 4.23Å; L136-F138 HydrophobicContact CD2-CD1 4.4Å; L136-F138 HydrophobicContact CD2-CE1 4.01Å; L136-F138 HydrophobicContact CD2-CE2 4.42Å; L136-F138 HydrophobicContact CD2-CZ 4.01Å
137	Y	89.8	Confident	78	Confident	13 Å²	13	53.5 Å²	53.5	5%	0.051	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.5	-179.9	-60.9	-61.5	0	0	0	109.9	L48 F49 I50 E135 R258 G259 E260 N261 H301	L48-Y137 PolarHBondContact O-N 2.82Å; F49-Y137 WeakPolarHBondContact CA-O 3.47Å; F49-Y137 HydrophobicContact CD1-CD2 4.15Å; F49-Y137 HydrophobicContact CD1-CG 4.32Å; F49-Y137 AromaticContact CE1-CD2 3.63Å; F49-Y137 HydrophobicContact CE1-CD2 3.63Å; F49-Y137 AromaticContact CE1-CG 4Å; F49-Y137 HydrophobicContact CE1-CG 4Å; F49-Y137 AromaticContact CZ-CD2 3.93Å; F49-Y137 HydrophobicContact CZ-CD2 3.93Å; I50-Y137 PolarHBondContact N-O 3.45Å; E135-Y137 HydrophobicContact CB-CE2 4.03Å; E135-Y137 PolarHBondContact OE2-OH 3.14Å; Y137-R258 PolarHBondContact OH-O 3.41Å; Y137-G259 WeakPolarHBondContact OH-CA 3.5Å; Y137-E260 PolarHBondContact OH-N 3.27Å; Y137-N261 WeakPolarHBondContact CE1-ND2 3.39Å; Y137-H301 VanDerWaalsContact CB-O 3.27Å; Y137-H301 WeakPolarHBondContact CB-O 3.47Å; Y137-H301 HydrophobicContact CD1-CB 4.3Å; Y137-H301 WeakPolarHBondContact CD1-O 3.49Å; Y137-H301 VanDerWaalsContact CG-O 3.29Å
138	F	88.4	Confident	78.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129.3	170.3	-67.9	-59	0	0	0	109.5	I50 L52 V66 T74 F77 L136 L160 H301	I50-F138 HydrophobicContact CB-CD1 3.96Å; I50-F138 HydrophobicContact CB-CE1 4.15Å; I50-F138 HydrophobicContact CD1-CE1 4.37Å; I50-F138 HydrophobicContact CG2-CD1 4.23Å; I50-F138 HydrophobicContact CG2-CE1 4.23Å; L52-F138 HydrophobicContact CD1-CB 4.3Å; L52-F138 HydrophobicContact CD2-CD1 3.86Å; L52-F138 HydrophobicContact CD2-CE1 4.31Å; L52-F138 HydrophobicContact CD2-CG 4.46Å; L52-F138 HydrophobicContact CG-CB 4.45Å; L52-F138 HydrophobicContact CG-CD1 4.37Å; V66-F138 HydrophobicContact CG1-CD2 4.15Å; V66-F138 HydrophobicContact CG1-CE1 4.32Å; V66-F138 HydrophobicContact CG1-CE2 3.89Å; V66-F138 HydrophobicContact CG1-CG 4.46Å; V66-F138 HydrophobicContact CG1-CZ 4Å; T74-F138 HydrophobicContact CG2-CD2 3.67Å; T74-F138 HydrophobicContact CG2-CE2 3.36Å; T74-F138 HydrophobicContact CG2-CZ 4.39Å; F77-F138 HydrophobicContact CD2-CE1 4.13Å; F77-F138 AromaticContact CD2-CZ 3.69Å; F77-F138 HydrophobicContact CD2-CZ 3.69Å; F77-F138 HydrophobicContact CE2-CE1 4.22Å; F77-F138 HydrophobicContact CE2-CZ 4.06Å; F77-F138 HydrophobicContact CG-CE1 4.47Å; F77-F138 HydrophobicContact CG-CZ 4.24Å; L136-F138 HydrophobicContact CD2-CD1 4.4Å; L136-F138 HydrophobicContact CD2-CE1 4.01Å; L136-F138 HydrophobicContact CD2-CE2 4.42Å; L136-F138 HydrophobicContact CD2-CZ 4.01Å; F138-L160 HydrophobicContact CB-CD2 4.06Å; F138-H301 AromaticContact CD2-ND1 3.94Å; F138-H301 WeakPolarHBondContact O-CB 3.38Å
139	K	84.1	Confident	79.3	Confident	86 Å²	86	51.5 Å²	51.5	37%	0.374	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.7	163.1	-173.4	176.8	170.8	-171.1	0	107.2	I50 E51 L52	I50-K139 PolarHBondContact O-N 3.48Å; E51-K139 HydrophobicContact CG-CB 4.4Å; E51-K139 HydrophobicContact CG-CD 4.06Å; E51-K139 WeakPolarHBondContact OE1-CD 3.27Å; E51-K139 IonicContact OE1-NZ 3.55Å; E51-K139 PolarHBondContact OE1-NZ 2.8Å; L52-K139 WeakPolarHBondContact CB-O 3.48Å; L52-K139 VanDerWaalsContact CG-O 3.32Å; L52-K139 WeakPolarHBondContact CG-O 3.33Å; L52-K139 PolarHBondContact N-O 2.97Å; L52-K139 VanDerWaalsContact N-O 3.15Å
140	A	77.3	Confident	80	Confident	15 Å²	15	50.6 Å²	50.6	12%	0.124	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-59.3	149.2	-179	0	0	0	0	0	110.7	S144 A162 T274	A140-S144 WeakPolarHBondContact CB-OG 3.41Å; A140-A162 HydrophobicContact CB-CB 4.49Å; A140-T274 HydrophobicContact CB-CG2 3.46Å; A140-T274 VanDerWaalsContact CB-CG2 3.46Å
141	P	77.1	Confident	80.6	Confident	11 Å²	11	54.5 Å²	54.5	7%	0.071	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-68.8	148.5	-180	29.6	-33.5	0	0	0	110.2	L52 D53 T143 S144	L52-P141 HydrophobicContact CB-CB 4.05Å; L52-P141 HydrophobicContact CB-CG 4.31Å; D53-P141 WeakPolarHBondContact OD1-CA 3.27Å; D53-P141 VanDerWaalsContact OD1-CB 3.27Å; D53-P141 WeakPolarHBondContact OD1-CB 3.47Å; P141-T143 PolarHBondContact O-N 3.41Å; P141-T143 VanDerWaalsContact O-N 3.16Å; P141-S144 WeakPolarHBondContact O-CB 3.32Å; P141-S144 PolarHBondContact O-N 2.93Å; P141-S144 PolarHBondContact O-OG 3.49Å
142	S	74	Confident	81.2	Confident	107 Å²	107	52.3 Å²	52.3	75%	0.748	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.4	178.1	-65	0	0	0	0	112.6	D53 S144	D53-S142 VanDerWaalsContact CG-N 3.29Å; D53-S142 PolarHBondContact OD1-N 3.48Å; D53-S142 VanDerWaalsContact OD2-CB 3.26Å; D53-S142 WeakPolarHBondContact OD2-CB 3.39Å; D53-S142 PolarHBondContact OD2-N 3.28Å; D53-S142 PolarHBondContact OD2-OG 3.25Å; S142-S144 VanDerWaalsContact C-N 3.27Å; S142-S144 PolarHBondContact O-N 3.1Å
143	T	66.8	Low	81.8	Confident	122 Å²	122	59 Å²	59	75%	0.748	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.2	172.3	54.7	0	0	0	0	113.2	P141 K145	P141-T143 PolarHBondContact O-N 3.41Å; P141-T143 VanDerWaalsContact O-N 3.16Å; T143-K145 PolarHBondContact O-N 3.16Å; T143-K145 VanDerWaalsContact O-N 3.15Å
144	S	71.3	Confident	82.3	Confident	44 Å²	44	58.9 Å²	58.9	31%	0.308	31%	0.31	S	S	.	.	S	Bend	trans	-77.5	104.4	-178.4	70.6	0	0	0	0	110.8	A140 P141 S142	A140-S144 WeakPolarHBondContact CB-OG 3.41Å; P141-S144 WeakPolarHBondContact O-CB 3.32Å; P141-S144 PolarHBondContact O-N 2.93Å; P141-S144 PolarHBondContact O-OG 3.49Å; S142-S144 VanDerWaalsContact C-N 3.27Å; S142-S144 PolarHBondContact O-N 3.1Å
145	K	77	Confident	82.4	Confident	184 Å²	184	64.3 Å²	64.3	80%	0.8	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-65.9	130.5	173.4	-69.3	-174.2	180	-178	0	109.5	T143 K147	T143-K145 PolarHBondContact O-N 3.16Å; T143-K145 VanDerWaalsContact O-N 3.15Å; K145-K147 PolarHBondContact O-N 3.21Å
146	P	79.8	Confident	82.3	Confident	41 Å²	41	62.8 Å²	62.8	27%	0.266	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-63.7	127.2	176.3	20	-26.1	0	0	0	110.1	A162 R164	P146-A162 CarbonylContact C-O 3.54Å; P146-A162 WeakPolarHBondContact CA-O 3.43Å; P146-A162 HydrophobicContact CB-CB 4.25Å; P146-R164 HydrophobicContact CB-CB 4.5Å; P146-R164 HydrophobicContact CB-CG 3.68Å; P146-R164 HydrophobicContact CG-CG 4.09Å
147	K	84.6	Confident	82.4	Confident	94 Å²	94	65.5 Å²	65.5	41%	0.409	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	153.8	178.6	-65.5	-178.7	179.5	175.9	0	110.2	K145 A162 V163 R164	K145-K147 PolarHBondContact O-N 3.21Å; K147-A162 PolarHBondContact N-O 3.45Å; K147-V163 WeakPolarHBondContact O-CA 3.44Å; K147-R164 PolarHBondContact O-N 3.15Å
148	V	85	Confident	82.2	Confident	25 Å²	25	65.7 Å²	65.7	15%	0.152	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	148	169.1	-168.7	0	0	0	0	108.5	R150 D151 E239 Q243	V148-R150 HydrophobicContact CG1-CB 4.26Å; V148-R150 PolarHBondContact O-N 2.96Å; V148-D151 PolarHBondContact O-N 3.48Å; V148-E239 HydrophobicContact CG1-CG 4.13Å; V148-Q243 HydrophobicContact CG1-CB 4.39Å
149	V	85.9	Confident	82.2	Confident	12 Å²	12	68.5 Å²	68.5	7%	0.073	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-47.8	-35.9	174.1	174.3	0	0	0	0	111.4	D151 I152 V163 I237 E239 R251 M253	V149-D151 PolarHBondContact O-N 3.36Å; V149-I152 PolarHBondContact O-N 3.4Å; V149-V163 HydrophobicContact CB-CG1 4.42Å; V149-V163 HydrophobicContact CG2-CG1 3.59Å; V149-I237 HydrophobicContact CG2-CD1 4.41Å; V149-E239 HydrophobicContact CB-CG 3.55Å; V149-E239 HydrophobicContact CG1-CG 4.16Å; V149-E239 HydrophobicContact CG2-CG 3.97Å; V149-R251 HydrophobicContact CG1-CB 4.37Å; V149-M253 HydrophobicContact CB-CE 3.92Å; V149-M253 HydrophobicContact CG1-CB 4.22Å; V149-M253 HydrophobicContact CG1-CE 3.43Å; V149-M253 VanDerWaalsContact CG1-CE 3.43Å; V149-M253 HydrophobicContact CG1-CG 3.99Å; V149-M253 HydrophobicContact CG1-SD 4.35Å; V149-M253 HydrophobicContact CG2-CE 4.02Å; V149-M253 HydrophobicContact CG2-CG 4.24Å; V149-M253 HydrophobicContact CG2-SD 4.25Å
150	R	86.4	Confident	82.4	Confident	48 Å²	48	65.4 Å²	65.4	18%	0.181	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-64.2	-35.9	178.8	-166.3	165.5	-66.7	-112.5	-4.3	114.7	V148 I152 E239 N248 I249	V148-R150 HydrophobicContact CG1-CB 4.26Å; V148-R150 PolarHBondContact O-N 2.96Å; R150-I152 PolarHBondContact O-N 3.46Å; R150-E239 VanDerWaalsContact CA-OE1 3.3Å; R150-E239 WeakPolarHBondContact CA-OE1 3.36Å; R150-E239 WeakPolarHBondContact CB-OE1 3.38Å; R150-E239 IonicContact CZ-OE2 3.35Å; R150-E239 PolarHBondContact N-OE1 2.89Å; R150-E239 IonicContact NE-OE1 3.02Å; R150-E239 IonicContact NE-OE2 2.99Å; R150-E239 PolarHBondContact NE-OE2 3.41Å; R150-E239 IonicContact NH2-OE2 3.77Å; R150-E239 PolarHBondContact NH2-OE2 2.78Å; R150-N248 PolarHBondContact NH1-ND2 2.62Å; R150-I249 PolarHBondContact NH2-O 2.88Å
151	D	87.4	Confident	83	Confident	88 Å²	88	65 Å²	65	47%	0.471	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-80.4	-7.4	-172.7	-68	-24.7	0	0	0	112.2	V148 V149 R153	V148-D151 PolarHBondContact O-N 3.48Å; V149-D151 PolarHBondContact O-N 3.36Å; D151-R153 PolarHBondContact O-N 2.86Å
152	I	86	Confident	83.6	Confident	22 Å²	22	65.1 Å²	65.1	11%	0.113	35%	0.352	C	S	.	.			trans	-75.8	108.4	176.2	-60.6	162.6	0	0	0	108.2	V149 R150 V163 M253 F277	V149-I152 PolarHBondContact O-N 3.4Å; R150-I152 PolarHBondContact O-N 3.46Å; I152-V163 HydrophobicContact CD1-CB 4.47Å; I152-V163 HydrophobicContact CD1-CG1 4.12Å; I152-V163 HydrophobicContact CD1-CG2 3.48Å; I152-V163 VanDerWaalsContact CD1-CG2 3.48Å; I152-M253 HydrophobicContact CD1-CE 3.31Å; I152-F277 HydrophobicContact CG2-CD1 3.86Å; I152-F277 HydrophobicContact CG2-CD2 4.07Å; I152-F277 HydrophobicContact CG2-CE1 3.84Å; I152-F277 HydrophobicContact CG2-CE2 4.05Å; I152-F277 HydrophobicContact CG2-CG 3.96Å; I152-F277 HydrophobicContact CG2-CZ 3.91Å
153	R	85.7	Confident	84.3	Confident	173 Å²	173	60 Å²	60	65%	0.653	32%	0.317	S	S	*	.			trans	-107.2	175.1	178.5	-62.9	-176.8	-175.8	-165.9	2.1	110.5	D151 D155 S156	D151-R153 PolarHBondContact O-N 2.86Å; R153-D155 PolarHBondContact O-N 2.94Å; R153-D155 VanDerWaalsContact O-N 3.13Å; R153-S156 PolarHBondContact O-N 3.39Å
154	A	84.3	Confident	85.3	Confident	73 Å²	73	58.2 Å²	58.2	60%	0.603	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-55.1	-29.3	176.3	0	0	0	0	0	113.1	S156 I157	A154-S156 PolarHBondContact O-N 2.83Å; A154-I157 HydrophobicContact CB-CD1 4.47Å; A154-I157 WeakPolarHBondContact O-CD1 3.27Å; A154-I157 VanDerWaalsContact O-CG1 3.27Å; A154-I157 WeakPolarHBondContact O-CG1 3.44Å; A154-I157 PolarHBondContact O-N 3.38Å
155	D	86.3	Confident	86.1	Confident	129 Å²	129	56.3 Å²	56.3	69%	0.69	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-64.2	-22.5	179	-48.1	-34	0	0	0	112.8	R153 H159	R153-D155 PolarHBondContact O-N 2.94Å; R153-D155 VanDerWaalsContact O-N 3.13Å; D155-H159 PolarHBondContact O-CE1 2.88Å; D155-H159 VanDerWaalsContact O-CE1 3.28Å; D155-H159 PolarHBondContact O-ND1 3.16Å
156	S	84.4	Confident	86.5	Confident	13 Å²	13	49.2 Å²	49.2	9%	0.091	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-92.4	9.6	-178.9	-55.7	0	0	0	0	113.6	R153 A154 G158 H159	R153-S156 PolarHBondContact O-N 3.39Å; A154-S156 PolarHBondContact O-N 2.83Å; S156-G158 PolarHBondContact O-N 2.86Å; S156-H159 PolarHBondContact O-N 2.68Å
157	I	88.3	Confident	86.9	Confident	75 Å²	75	47.3 Å²	47.3	39%	0.385	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	132.8	174.5	-66.9	169.9	0	0	0	109.3	A154 H159 F277	A154-I157 HydrophobicContact CB-CD1 4.47Å; A154-I157 WeakPolarHBondContact O-CD1 3.27Å; A154-I157 VanDerWaalsContact O-CG1 3.27Å; A154-I157 WeakPolarHBondContact O-CG1 3.44Å; A154-I157 PolarHBondContact O-N 3.38Å; I157-H159 PolarHBondContact O-N 3.46Å; I157-H159 PolarHBondContact O-ND1 3.44Å; I157-H159 VanDerWaalsContact O-ND1 3.08Å; I157-F277 HydrophobicContact CG1-CD1 3.99Å; I157-F277 HydrophobicContact CG1-CE1 4.07Å
158	G	86.7	Confident	86.8	Confident	17 Å²	17	44.9 Å²	44.9	18%	0.175	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	-8.3	-178.7	0	0	0	0	0	114.9	E68 S156 F277	E68-G158 CarbonylContact O-C 3.52Å; S156-G158 PolarHBondContact O-N 2.86Å; G158-F277 PolarHBondContact N-O 3.21Å
159	H	87.6	Confident	86.6	Confident	60 Å²	60	47.8 Å²	47.8	28%	0.278	24%	0.243	S	C	.	.	S	Bend	trans	-84.6	151.6	-179.7	-68.1	69.3	0	0	0	112.1	C67 D155 S156 I157 V161 F277	C67-H159 CarbonylContact O-C 3.55Å; C67-H159 WeakPolarHBondContact O-CA 3.46Å; C67-H159 WeakPolarHBondContact O-CB 3.43Å; C67-H159 PolarHBondContact O-CD2 3.15Å; D155-H159 PolarHBondContact O-CE1 2.88Å; D155-H159 VanDerWaalsContact O-CE1 3.28Å; D155-H159 PolarHBondContact O-ND1 3.16Å; S156-H159 PolarHBondContact O-N 2.68Å; I157-H159 PolarHBondContact O-N 3.46Å; I157-H159 PolarHBondContact O-ND1 3.44Å; I157-H159 VanDerWaalsContact O-ND1 3.08Å; H159-V161 HydrophobicContact CB-CG1 4.42Å; H159-V161 PolarHBondContact O-N 2.97Å; H159-F277 PolarHBondContact O-N 3.24Å
160	L	88.8	Confident	86.5	Confident	21 Å²	21	48.9 Å²	48.9	11%	0.11	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.1	167.5	-165.4	73.3	0	0	0	109	L52 C67 A70 F138 I276	L52-L160 HydrophobicContact CD1-CD2 3.42Å; L52-L160 VanDerWaalsContact CD1-CD2 3.42Å; C67-L160 PolarHBondContact O-N 2.67Å; A70-L160 HydrophobicContact CB-CB 4.1Å; A70-L160 HydrophobicContact CB-CD1 4.31Å; F138-L160 HydrophobicContact CB-CD2 4.06Å; L160-I276 HydrophobicContact CD1-CG1 4.05Å
161	V	89.5	Confident	86.4	Confident	6 Å²	6	48 Å²	48	4%	0.036	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137.8	-179.9	-65.2	0	0	0	0	110.6	H159 V163 T274 G275 F277 L298	H159-V161 HydrophobicContact CB-CG1 4.42Å; H159-V161 PolarHBondContact O-N 2.97Å; V161-V163 HydrophobicContact CB-CG2 4.45Å; V161-V163 HydrophobicContact CG2-CG2 3.95Å; V161-T274 WeakPolarHBondContact O-CA 3.48Å; V161-G275 PolarHBondContact N-O 3.43Å; V161-G275 PolarHBondContact O-N 3.23Å; V161-F277 HydrophobicContact CG2-CB 4.17Å; V161-L298 HydrophobicContact CG2-CD1 3.67Å
162	A	89.1	Confident	86.3	Confident	13 Å²	13	51.7 Å²	51.7	11%	0.107	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.7	167	0	0	0	0	0	108.4	A140 P146 K147 T274	A140-A162 HydrophobicContact CB-CB 4.49Å; P146-A162 CarbonylContact C-O 3.54Å; P146-A162 WeakPolarHBondContact CA-O 3.43Å; P146-A162 HydrophobicContact CB-CB 4.25Å; K147-A162 PolarHBondContact N-O 3.45Å; A162-T274 HydrophobicContact CB-CG2 3.95Å
163	V	89.3	Confident	86.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.6	-178	-170.9	0	0	0	0	109.4	K147 V149 I152 V161 I237 M253 A272 I273 L298	K147-V163 WeakPolarHBondContact O-CA 3.44Å; V149-V163 HydrophobicContact CB-CG1 4.42Å; V149-V163 HydrophobicContact CG2-CG1 3.59Å; I152-V163 HydrophobicContact CD1-CB 4.47Å; I152-V163 HydrophobicContact CD1-CG1 4.12Å; I152-V163 HydrophobicContact CD1-CG2 3.48Å; I152-V163 VanDerWaalsContact CD1-CG2 3.48Å; V161-V163 HydrophobicContact CB-CG2 4.45Å; V161-V163 HydrophobicContact CG2-CG2 3.95Å; V163-I237 HydrophobicContact CG1-CD1 4.06Å; V163-M253 HydrophobicContact CG1-CE 4.27Å; V163-M253 HydrophobicContact CG1-SD 4.12Å; V163-A272 CarbonylContact O-C 3.6Å; V163-A272 WeakPolarHBondContact O-CA 3.47Å; V163-I273 PolarHBondContact N-O 3.15Å; V163-I273 PolarHBondContact O-N 3.13Å; V163-L298 HydrophobicContact CB-CD2 4.43Å; V163-L298 HydrophobicContact CG2-CD2 4.05Å
164	R	88.1	Confident	86.5	Confident	84 Å²	84	47.4 Å²	47.4	32%	0.317	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	135	171.1	-82.7	173	179	173.8	5.7	110.4	P146 K147 V271 A272 M306	P146-R164 HydrophobicContact CB-CB 4.5Å; P146-R164 HydrophobicContact CB-CG 3.68Å; P146-R164 HydrophobicContact CG-CG 4.09Å; K147-R164 PolarHBondContact O-N 3.15Å; R164-V271 WeakPolarHBondContact CA-O 3.46Å; R164-A272 HydrophobicContact CG-CB 3.93Å; R164-M306 HydrophobicContact CG-SD 4.15Å; R164-M306 PolarHBondContact NE-SD 3.47Å
165	G	87	Confident	86.8	Confident	5 Å²	5	48.7 Å²	48.7	5%	0.052	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	172.8	177.8	0	0	0	0	0	113	Q238 V271	G165-Q238 CarbonylContact C-O 3.56Å; G165-Q238 WeakPolarHBondContact CA-O 3.41Å; G165-V271 PolarHBondContact N-O 3.18Å; G165-V271 WeakPolarHBondContact O-CG2 3.47Å; G165-V271 PolarHBondContact O-N 2.93Å; G165-V271 VanDerWaalsContact O-O 3.08Å
166	I	86.7	Confident	86.9	Confident	35 Å²	35	44.6 Å²	44.6	18%	0.179	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.4	174.6	-58	172.7	0	0	0	107.9	T168 I237 Q238 D269	I166-T168 PolarHBondContact O-N 2.93Å; I166-I237 CarbonylContact O-C 3.59Å; I166-I237 VanDerWaalsContact O-CA 3.29Å; I166-I237 WeakPolarHBondContact O-CA 3.35Å; I166-Q238 PolarHBondContact N-O 3.28Å; I166-Q238 PolarHBondContact O-N 3.44Å; I166-D269 WeakPolarHBondContact CA-O 3.27Å
167	V	87.1	Confident	87	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	116.9	172.8	-175.7	0	0	0	0	108.6	A170 I237 A265 Q266 P267 G268 D269 V271	V167-A170 HydrophobicContact CG1-CB 4.47Å; V167-I237 HydrophobicContact CG2-CG2 4.15Å; V167-A265 HydrophobicContact CG2-CB 3.93Å; V167-Q266 WeakPolarHBondContact CB-O 3.48Å; V167-P267 CarbonylContact O-C 3.46Å; V167-P267 WeakPolarHBondContact O-CA 3.46Å; V167-G268 PolarHBondContact O-N 2.79Å; V167-D269 PolarHBondContact N-O 3.22Å; V167-V271 HydrophobicContact CG2-CB 4.33Å; V167-V271 HydrophobicContact CG2-CG1 3.87Å; V167-V271 HydrophobicContact CG2-CG2 3.45Å; V167-V271 VanDerWaalsContact CG2-CG2 3.45Å
168	T	82.5	Confident	87	Confident	43 Å²	43	43 Å²	43	26%	0.264	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-40.2	176.3	54.1	0	0	0	0	111.4	I166 R236 Q238	I166-T168 PolarHBondContact O-N 2.93Å; T168-R236 PolarHBondContact N-O 2.91Å; T168-R236 WeakPolarHBondContact OG1-CB 3.47Å; T168-R236 PolarHBondContact OG1-O 3.41Å; T168-Q238 HydrophobicContact CG2-CB 3.49Å; T168-Q238 VanDerWaalsContact CG2-CB 3.49Å; T168-Q238 HydrophobicContact CG2-CG 4.4Å; T168-Q238 VanDerWaalsContact CG2-OE1 3.28Å
169	R	81.5	Confident	87	Confident	86 Å²	86	42.2 Å²	42.2	33%	0.325	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.9	-175.7	-58	-176.2	179.3	179.2	-4.7	109.7	L235 R236 E430	R169-L235 CarbonylContact O-C 3.59Å; R169-L235 WeakPolarHBondContact O-CA 3.39Å; R169-R236 HydrophobicContact CB-CB 4.17Å; R169-R236 PolarHBondContact N-O 3.48Å; R169-R236 PolarHBondContact O-N 2.86Å; R169-E430 VanDerWaalsContact CD-OE1 3.25Å; R169-E430 WeakPolarHBondContact CD-OE1 3.37Å; R169-E430 VanDerWaalsContact CG-OE1 3.32Å; R169-E430 WeakPolarHBondContact CG-OE1 3.38Å; R169-E430 IonicContact CZ-OE1 3.68Å; R169-E430 VanDerWaalsContact CZ-OE1 3.23Å; R169-E430 IonicContact NE-OE1 3.75Å; R169-E430 PolarHBondContact NE-OE1 3.47Å; R169-E430 IonicContact NH2-OE1 3.46Å; R169-E430 PolarHBondContact NH2-OE1 3.29Å
170	A	84.1	Confident	87.1	Confident	35 Å²	35	39.3 Å²	39.3	29%	0.289	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.6	170	0	0	0	0	0	108.2	V167 L235 P267	V167-A170 HydrophobicContact CG1-CB 4.47Å; A170-L235 HydrophobicContact CB-CD2 3.41Å; A170-L235 VanDerWaalsContact CB-CD2 3.41Å; A170-P267 HydrophobicContact CB-CG 4.04Å
171	T	84.8	Confident	87	Confident	30 Å²	30	38.4 Å²	38.4	18%	0.184	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-79.4	161.8	173.2	54.8	0	0	0	0	110.7	Q233 E234	T171-Q233 VanDerWaalsContact O-CG 3.29Å; T171-Q233 WeakPolarHBondContact O-CG 3.12Å; T171-Q233 PolarHBondContact O-NE2 3.35Å; T171-E234 HydrophobicContact CG2-CB 4.24Å; T171-E234 PolarHBondContact N-O 3.31Å; T171-E234 WeakPolarHBondContact OG1-CA 3.5Å; T171-E234 PolarHBondContact OG1-N 3.47Å; T171-E234 PolarHBondContact OG1-O 3.09Å
172	E	84.1	Confident	87	Confident	166 Å²	166	38.2 Å²	38.2	78%	0.776	20%	0.202	S	C	*	.	P	Polyproline II helix	trans	-69.3	157.5	169.5	-64.2	-169.9	174	0	0	111.6	K174	E172-K174 PolarHBondContact O-N 2.93Å
173	V	88.5	Confident	86.8	Confident	38 Å²	38	39 Å²	39	23%	0.23	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-70.6	123.7	-178.4	-178.9	0	0	0	0	110.4	K231 R263	V173-K231 HydrophobicContact CG1-CB 3.76Å; V173-K231 HydrophobicContact CG1-CG 4.12Å; V173-R263 HydrophobicContact CG2-CG 3.48Å; V173-R263 VanDerWaalsContact CG2-CG 3.48Å
174	K	88.4	Confident	86.6	Confident	66 Å²	66	39.3 Å²	39.3	29%	0.287	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144.8	178.3	-63.9	170	-172.3	171.7	0	109.8	E172 M176 F232 D421	E172-K174 PolarHBondContact O-N 2.93Å; K174-M176 PolarHBondContact O-N 3.21Å; K174-F232 PolarHBondContact N-O 3.09Å; K174-F232 WeakPolarHBondContact O-CA 3.3Å; K174-F232 WeakPolarHBondContact O-CB 3.07Å; K174-F232 PolarHBondContact O-N 3.01Å; K174-D421 IonicContact NZ-OD2 3.31Å
175	P	89.7	Confident	86.3	Confident	101 Å²	101	40.5 Å²	40.5	66%	0.656	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	116.8	171.8	29.9	-31.6	0	0	0	110.2	F229	P175-F229 HydrophobicContact CB-CB 4.21Å; P175-F229 HydrophobicContact CB-CD1 4.24Å; P175-F229 HydrophobicContact CB-CG 4.43Å
176	M	87.8	Confident	86	Confident	43 Å²	43	45.7 Å²	45.7	21%	0.212	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.5	170.7	-178.4	174.7	-177.2	0	0	109.5	K174 F229 V230 F232	K174-M176 PolarHBondContact O-N 3.21Å; M176-F229 CarbonylContact O-C 3.55Å; M176-F229 WeakPolarHBondContact O-CA 3.48Å; M176-V230 PolarHBondContact N-O 3.44Å; M176-V230 PolarHBondContact O-N 2.83Å; M176-F232 HydrophobicContact CB-CB 3.58Å; M176-F232 HydrophobicContact CB-CG 4.2Å; M176-F232 HydrophobicContact SD-CB 4.49Å; M176-F232 HydrophobicContact SD-CD2 3.84Å; M176-F232 HydrophobicContact SD-CE2 4.38Å; M176-F232 HydrophobicContact SD-CG 4.27Å
177	M	87.9	Confident	85.5	Confident	27 Å²	27	45.5 Å²	45.5	13%	0.133	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.8	178.2	-168.5	161.2	56.1	0	0	110.2	A180 I195 F200 L222 F229	M177-A180 HydrophobicContact CE-CB 3.93Å; M177-A180 HydrophobicContact SD-CB 3.9Å; M177-I195 HydrophobicContact CB-CD1 4.42Å; M177-I195 HydrophobicContact CE-CD1 3.5Å; M177-I195 VanDerWaalsContact CE-CD1 3.5Å; M177-I195 HydrophobicContact CG-CD1 4.09Å; M177-I195 HydrophobicContact SD-CD1 4.42Å; M177-F200 HydrophobicContact CE-CE1 3.67Å; M177-F200 HydrophobicContact CE-CE2 4.04Å; M177-F200 HydrophobicContact CE-CZ 3.19Å; M177-L222 HydrophobicContact CE-CD2 4.31Å; M177-L222 HydrophobicContact SD-CD1 4.42Å; M177-L222 HydrophobicContact SD-CD2 4.45Å; M177-F229 HydrophobicContact CB-CD1 3.95Å; M177-F229 HydrophobicContact CB-CE1 3.83Å; M177-F229 HydrophobicContact CG-CD1 4.29Å; M177-F229 HydrophobicContact CG-CE1 3.97Å; M177-F229 HydrophobicContact SD-CE1 4.02Å; M177-F229 HydrophobicContact SD-CZ 4.26Å
178	A	86.9	Confident	85	Confident	27 Å²	27	48 Å²	48	22%	0.223	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-43.7	176.9	0	0	0	0	0	111.7	I195 K228 V230	A178-I195 PolarHBondContact O-N 2.98Å; A178-K228 PolarHBondContact N-O 3.45Å; A178-V230 HydrophobicContact CB-CG2 3.97Å
179	V	88.3	Confident	84.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.5	176.8	-176.1	0	0	0	0	108.9	P127 E129 L130 Y192 S227 K228	P127-V179 HydrophobicContact CG-CG1 4.29Å; E129-V179 HydrophobicContact CB-CG2 4.11Å; L130-V179 HydrophobicContact CD1-CB 3.97Å; L130-V179 HydrophobicContact CD1-CG1 3.89Å; V179-Y192 HydrophobicContact CG1-CD1 4.36Å; V179-S227 CarbonylContact O-C 3.49Å; V179-S227 VanDerWaalsContact O-CA 3.23Å; V179-S227 WeakPolarHBondContact O-CA 3.37Å; V179-S227 WeakPolarHBondContact O-CB 3.39Å; V179-K228 HydrophobicContact CB-CB 4.33Å; V179-K228 PolarHBondContact N-O 3.02Å; V179-K228 PolarHBondContact O-N 3.23Å
180	A	88.9	Confident	84.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.9	171.8	0	0	0	0	0	110	M177 Y182 Y192 Q193 I195 L222	M177-A180 HydrophobicContact CE-CB 3.93Å; M177-A180 HydrophobicContact SD-CB 3.9Å; A180-Y182 HydrophobicContact CB-CE2 3.76Å; A180-Y192 WeakPolarHBondContact O-CA 3.25Å; A180-Q193 HydrophobicContact CB-CB 4.45Å; A180-Q193 PolarHBondContact N-O 3.29Å; A180-Q193 PolarHBondContact O-N 3.11Å; A180-I195 HydrophobicContact CB-CD1 3.8Å; A180-L222 HydrophobicContact CB-CD1 3.66Å
181	T	87.3	Confident	84.4	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.7	173.1	58.6	0	0	0	0	110	L130 Y192 Q223 G226 S227	L130-T181 HydrophobicContact CD1-CG2 4.45Å; T181-Y192 HydrophobicContact CG2-CD1 3.51Å; T181-Y192 HydrophobicContact CG2-CE1 3.44Å; T181-Y192 VanDerWaalsContact CG2-CE1 3.44Å; T181-Q223 PolarHBondContact O-N 2.99Å; T181-Q223 PolarHBondContact OG1-O 2.9Å; T181-G226 WeakPolarHBondContact CG2-O 3.49Å; T181-G226 VanDerWaalsContact OG1-CA 3.32Å; T181-G226 WeakPolarHBondContact OG1-CA 3.27Å; T181-S227 PolarHBondContact OG1-N 3.38Å; T181-S227 VanDerWaalsContact OG1-N 3.11Å
182	Y	88	Confident	84.4	Confident	3 Å²	3	43.6 Å²	43.6	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140.1	174.2	-54.8	-91	0	0	0	110.6	A180 E190 T191 Q193 P202 L203 L220 Y221 L222	A180-Y182 HydrophobicContact CB-CE2 3.76Å; Y182-E190 CarbonylContact O-C 3.57Å; Y182-E190 VanDerWaalsContact O-CA 3.29Å; Y182-E190 WeakPolarHBondContact O-CA 3.47Å; Y182-T191 WeakPolarHBondContact CB-OG1 3.09Å; Y182-T191 PolarHBondContact N-O 2.91Å; Y182-T191 PolarHBondContact O-N 3.19Å; Y182-Q193 HydrophobicContact CE2-CB 3.92Å; Y182-Q193 PolarHBondContact OH-OE1 2.86Å; Y182-P202 HydrophobicContact CE1-CB 4.06Å; Y182-P202 WeakPolarHBondContact OH-CA 3.19Å; Y182-P202 WeakPolarHBondContact OH-CB 3.32Å; Y182-L203 HydrophobicContact CD2-CB 4.49Å; Y182-L203 HydrophobicContact CE2-CB 4.4Å; Y182-L220 HydrophobicContact CD1-CB 4.38Å; Y182-L220 HydrophobicContact CG-CB 4.46Å; Y182-Y221 CarbonylContact C-O 3.55Å; Y182-Y221 VanDerWaalsContact CA-O 3.25Å; Y182-Y221 WeakPolarHBondContact CA-O 3.35Å; Y182-L222 HydrophobicContact CD1-CB 3.94Å; Y182-L222 HydrophobicContact CD1-CD1 4.1Å; Y182-L222 HydrophobicContact CE1-CB 3.77Å; Y182-L222 HydrophobicContact CE1-CD1 3.71Å; Y182-L222 HydrophobicContact CE1-CG 4.3Å; Y182-L222 HydrophobicContact CE2-CD1 4.44Å
183	T	86.7	Confident	84.5	Confident	30 Å²	30	37.5 Å²	37.5	18%	0.184	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.8	174.6	54.1	0	0	0	0	109.1	E190 Y221 Q223	T183-E190 HydrophobicContact CG2-CG 4.21Å; T183-Y221 PolarHBondContact N-O 3.34Å; T183-Y221 PolarHBondContact O-N 3.35Å; T183-Q223 HydrophobicContact CG2-CB 4.44Å
184	C	84.4	Confident	84.4	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.034	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.3	173.4	-170.8	0	0	0	0	111.3	Q186 C187 G188 A189 C206 L220	C184-Q186 VanDerWaalsContact C-N 3.27Å; C184-Q186 PolarHBondContact O-N 3.5Å; C184-C187 WeakPolarHBondContact CB-SG 3.21Å; C184-G188 VanDerWaalsContact O-CA 3.23Å; C184-G188 WeakPolarHBondContact O-CA 3.23Å; C184-G188 PolarHBondContact O-N 2.99Å; C184-A189 PolarHBondContact N-O 2.73Å; C184-A189 VanDerWaalsContact N-O 3.09Å; C184-C206 HydrophobicContact CB-CB 4.3Å; C184-L220 HydrophobicContact CB-CD2 3.85Å
185	D	82.7	Confident	84.2	Confident	110 Å²	110	36.4 Å²	36.4	59%	0.588	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-27	-179.5	-73.7	-1.1	0	0	0	114.1	R219 Y221	D185-R219 PolarHBondContact N-O 2.89Å; D185-Y221 VanDerWaalsContact OD1-CD2 3.24Å; D185-Y221 WeakPolarHBondContact OD1-CD2 3.43Å; D185-Y221 WeakPolarHBondContact OD2-CE2 3.39Å
186	Q	80.6	Confident	83.6	Confident	114 Å²	114	39 Å²	39	53%	0.533	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-48.4	-172.7	-72.1	-179.9	-9.2	0	0	113.2	C184 S216	C184-Q186 VanDerWaalsContact C-N 3.27Å; C184-Q186 PolarHBondContact O-N 3.5Å; Q186-S216 PolarHBondContact NE2-O 2.89Å; Q186-S216 PolarHBondContact OE1-O 2.91Å; Q186-S216 PolarHBondContact OE1-OG 2.84Å; Q186-S216 VanDerWaalsContact OE1-OG 3.09Å
187	C	74.9	Confident	83.3	Confident	30 Å²	30	39.7 Å²	39.7	20%	0.203	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-9.6	179.2	61.6	0	0	0	0	113.1	C184 A189 S208	C184-C187 WeakPolarHBondContact CB-SG 3.21Å; C187-A189 HydrophobicContact CB-CB 4.46Å; C187-A189 PolarHBondContact O-N 3.44Å; C187-A189 WeakPolarHBondContact SG-CB 3.08Å; C187-S208 PolarHBondContact SG-OG 2.93Å; C187-S208 VanDerWaalsContact SG-OG 3.41Å
188	G	76.5	Confident	82.7	Confident	52 Å²	52	43 Å²	43	54%	0.536	25%	0.251	S	S	.	.			trans	64.4	2	-175.2	0	0	0	0	0	114.1	C184	C184-G188 VanDerWaalsContact O-CA 3.23Å; C184-G188 WeakPolarHBondContact O-CA 3.23Å; C184-G188 PolarHBondContact O-N 2.99Å
189	A	76.3	Confident	82.4	Confident	19 Å²	19	44.1 Å²	44.1	16%	0.157	26%	0.258	C	S	.	.			trans	-68.6	137.7	-177.9	0	0	0	0	0	110.9	C184 C187	C184-A189 PolarHBondContact N-O 2.73Å; C184-A189 VanDerWaalsContact N-O 3.09Å; C187-A189 HydrophobicContact CB-CB 4.46Å; C187-A189 PolarHBondContact O-N 3.44Å; C187-A189 WeakPolarHBondContact SG-CB 3.08Å
190	E	77.8	Confident	82.2	Confident	43 Å²	43	48 Å²	48	20%	0.201	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.3	176.2	-50.4	-162.9	155.6	0	0	109.6	R106 Y182 T183 Y192	R106-E190 IonicContact CZ-OE1 2.57Å; R106-E190 IonicContact CZ-OE2 3.24Å; R106-E190 IonicContact NE-OE1 3.95Å; R106-E190 PolarHBondContact NE-OE1 3.31Å; R106-E190 IonicContact NE-OE2 3.91Å; R106-E190 VanDerWaalsContact NH1-CD 3.3Å; R106-E190 IonicContact NH1-OE1 2.74Å; R106-E190 PolarHBondContact NH1-OE1 3.31Å; R106-E190 IonicContact NH1-OE2 2.85Å; R106-E190 PolarHBondContact NH1-OE2 3.18Å; R106-E190 IonicContact NH2-OE1 3.37Å; R106-E190 PolarHBondContact NH2-OE1 3.37Å; R106-E190 IonicContact NH2-OE2 3.21Å; Y182-E190 CarbonylContact O-C 3.57Å; Y182-E190 VanDerWaalsContact O-CA 3.29Å; Y182-E190 WeakPolarHBondContact O-CA 3.47Å; T183-E190 HydrophobicContact CG2-CG 4.21Å; E190-Y192 HydrophobicContact CB-CE2 4.24Å; E190-Y192 PolarHBondContact OE2-OH 2.9Å
191	T	82.8	Confident	82	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.2	179.1	61.5	0	0	0	0	109.6	Y182 P207	Y182-T191 WeakPolarHBondContact CB-OG1 3.09Å; Y182-T191 PolarHBondContact N-O 2.91Å; Y182-T191 PolarHBondContact O-N 3.19Å; T191-P207 HydrophobicContact CG2-CG 3.69Å
192	Y	84.3	Confident	81.9	Confident	35 Å²	35	58.3 Å²	58.3	14%	0.137	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127	-174.7	-56.5	-86	0	0	0	109.7	Y126 P127 L130 V179 A180 T181 E190	Y126-Y192 HydrophobicContact CD1-CE1 4.1Å; Y126-Y192 AromaticContact CD1-CE2 3.94Å; Y126-Y192 HydrophobicContact CD1-CE2 3.94Å; Y126-Y192 AromaticContact CD1-CZ 3.61Å; Y126-Y192 HydrophobicContact CE1-CE1 4.27Å; Y126-Y192 HydrophobicContact CE1-CE2 4.07Å; Y126-Y192 AromaticContact CE1-CZ 3.54Å; Y126-Y192 WeakPolarHBondContact CE1-OH 3.29Å; P127-Y192 HydrophobicContact CG-CG 4.24Å; L130-Y192 HydrophobicContact CD2-CD1 3.81Å; L130-Y192 HydrophobicContact CD2-CE1 3.54Å; V179-Y192 HydrophobicContact CG1-CD1 4.36Å; A180-Y192 WeakPolarHBondContact O-CA 3.25Å; T181-Y192 HydrophobicContact CG2-CD1 3.51Å; T181-Y192 HydrophobicContact CG2-CE1 3.44Å; T181-Y192 VanDerWaalsContact CG2-CE1 3.44Å; E190-Y192 HydrophobicContact CB-CE2 4.24Å; E190-Y192 PolarHBondContact OE2-OH 2.9Å
193	Q	85.1	Confident	81.7	Confident	38 Å²	38	61.5 Å²	61.5	18%	0.178	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	109.7	173.5	-174.5	179.5	0	0	0	108.9	A180 Y182 M201 L203	A180-Q193 HydrophobicContact CB-CB 4.45Å; A180-Q193 PolarHBondContact N-O 3.29Å; A180-Q193 PolarHBondContact O-N 3.11Å; Y182-Q193 HydrophobicContact CE2-CB 3.92Å; Y182-Q193 PolarHBondContact OH-OE1 2.86Å; Q193-M201 PolarHBondContact NE2-O 3.24Å; Q193-L203 HydrophobicContact CB-CD1 4.23Å; Q193-L203 HydrophobicContact CG-CD1 4.47Å
194	P	86.3	Confident	81.4	Confident	65 Å²	65	65.9 Å²	65.9	42%	0.422	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	137.9	170.2	30.2	-33	0	0	0	109.8	E129	E129-P194 VanDerWaalsContact OE2-CB 3.32Å; E129-P194 WeakPolarHBondContact OE2-CB 3.24Å
195	I	85.9	Confident	81	Confident	16 Å²	16	73.5 Å²	73.5	8%	0.082	41%	0.406	C	S	.	.			trans	-118.2	112.9	-176	-61.6	161.5	0	0	0	108.3	M177 A178 A180 S197 F200	M177-I195 HydrophobicContact CB-CD1 4.42Å; M177-I195 HydrophobicContact CE-CD1 3.5Å; M177-I195 VanDerWaalsContact CE-CD1 3.5Å; M177-I195 HydrophobicContact CG-CD1 4.09Å; M177-I195 HydrophobicContact SD-CD1 4.42Å; A178-I195 PolarHBondContact O-N 2.98Å; A180-I195 HydrophobicContact CB-CD1 3.8Å; I195-S197 VanDerWaalsContact CG2-O 3.28Å; I195-S197 WeakPolarHBondContact CG2-O 3.24Å; I195-F200 HydrophobicContact CD1-CD1 3.76Å; I195-F200 HydrophobicContact CD1-CD2 3.79Å; I195-F200 HydrophobicContact CD1-CE1 3.7Å; I195-F200 HydrophobicContact CD1-CE2 3.73Å; I195-F200 HydrophobicContact CD1-CG 3.83Å; I195-F200 HydrophobicContact CD1-CZ 3.71Å; I195-F200 HydrophobicContact CG1-CB 4.37Å; I195-F200 HydrophobicContact CG1-CD1 4.18Å; I195-F200 HydrophobicContact CG1-CD2 4.08Å; I195-F200 HydrophobicContact CG1-CE2 4.5Å; I195-F200 HydrophobicContact CG1-CG 3.93Å; I195-F200 HydrophobicContact CG2-CB 4.11Å; I195-F200 HydrophobicContact CG2-CD1 3.82Å; I195-F200 HydrophobicContact CG2-CG 4.06Å
196	Q	77.2	Confident	80.6	Confident	156 Å²	156	68.9 Å²	68.9	73%	0.729	38%	0.381	S	S	*	.			trans	-104.7	-26.2	175.6	-64.4	-169	-7.8	0	0	112.6
197	S	79.8	Confident	80.3	Confident	57 Å²	57	66.8 Å²	66.8	40%	0.399	38%	0.378	S	S	.	.	S	Bend	trans	-90.7	150.8	-179.4	50.7	0	0	0	0	112.1	I195 S199	I195-S197 VanDerWaalsContact CG2-O 3.28Å; I195-S197 WeakPolarHBondContact CG2-O 3.24Å; S197-S199 WeakPolarHBondContact CB-O 3.35Å; S197-S199 PolarHBondContact O-N 3.38Å; S197-S199 PolarHBondContact OG-O 3.21Å
198	P	75.9	Confident	80.2	Confident	96 Å²	96	65.7 Å²	65.7	62%	0.623	37%	0.37	S	S	*	.	S	Bend	trans	-65.3	-28.3	177	26.1	-34.1	0	0	0	112.6
199	S	81.4	Confident	80	Confident	51 Å²	51	68.8 Å²	68.8	36%	0.357	37%	0.371	S	S	.	.	S	Bend	trans	-107.5	134.1	172.1	44.6	0	0	0	0	109.5	S197 T283	S197-S199 WeakPolarHBondContact CB-O 3.35Å; S197-S199 PolarHBondContact O-N 3.38Å; S197-S199 PolarHBondContact OG-O 3.21Å; S199-T283 PolarHBondContact OG-OG1 3.39Å
200	F	84.1	Confident	79.8	Confident	82 Å²	82	73.8 Å²	73.8	36%	0.36	39%	0.391	S	S	.	.			trans	-142.7	153.7	170.4	74.9	-79.1	0	0	0	109.9	M177 I195	M177-F200 HydrophobicContact CE-CE1 3.67Å; M177-F200 HydrophobicContact CE-CE2 4.04Å; M177-F200 HydrophobicContact CE-CZ 3.19Å; I195-F200 HydrophobicContact CD1-CD1 3.76Å; I195-F200 HydrophobicContact CD1-CD2 3.79Å; I195-F200 HydrophobicContact CD1-CE1 3.7Å; I195-F200 HydrophobicContact CD1-CE2 3.73Å; I195-F200 HydrophobicContact CD1-CG 3.83Å; I195-F200 HydrophobicContact CD1-CZ 3.71Å; I195-F200 HydrophobicContact CG1-CB 4.37Å; I195-F200 HydrophobicContact CG1-CD1 4.18Å; I195-F200 HydrophobicContact CG1-CD2 4.08Å; I195-F200 HydrophobicContact CG1-CE2 4.5Å; I195-F200 HydrophobicContact CG1-CG 3.93Å; I195-F200 HydrophobicContact CG2-CB 4.11Å; I195-F200 HydrophobicContact CG2-CD1 3.82Å; I195-F200 HydrophobicContact CG2-CG 4.06Å
201	M	84.9	Confident	79.5	Confident	151 Å²	151	72 Å²	72	74%	0.744	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-98.3	127.5	173.2	-174.1	173.5	66.3	0	0	108.5	Q193	Q193-M201 PolarHBondContact NE2-O 3.24Å
202	P	84.8	Confident	79.2	Confident	67 Å²	67	76.1 Å²	76.1	44%	0.435	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-68.2	144.4	177.5	28.5	-34.3	0	0	0	110.9	Y182 I204	Y182-P202 HydrophobicContact CE1-CB 4.06Å; Y182-P202 WeakPolarHBondContact OH-CA 3.19Å; Y182-P202 WeakPolarHBondContact OH-CB 3.32Å; P202-I204 PolarHBondContact O-N 3.26Å
203	L	82.4	Confident	78.8	Confident	70 Å²	70	79.6 Å²	79.6	37%	0.366	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-73.2	122.1	172	-66.7	169.9	0	0	0	109.6	Y182 Q193 L220	Y182-L203 HydrophobicContact CD2-CB 4.49Å; Y182-L203 HydrophobicContact CE2-CB 4.4Å; Q193-L203 HydrophobicContact CB-CD1 4.23Å; Q193-L203 HydrophobicContact CG-CD1 4.47Å; L203-L220 HydrophobicContact CB-CD1 3.77Å; L203-L220 WeakPolarHBondContact O-CB 3.42Å
204	I	81.4	Confident	78.3	Confident	121 Å²	121	83.6 Å²	83.6	62%	0.621	46%	0.456	S	S	*	.			trans	-100.6	-30.1	-178.2	-28.6	173	0	0	0	111.2	P202 L220	P202-I204 PolarHBondContact O-N 3.26Å; I204-L220 PolarHBondContact O-N 3.41Å
205	M	76.4	Confident	77.6	Confident	166 Å²	166	89.5 Å²	89.5	82%	0.818	48%	0.475	S	S	*	.	B	Isolated β-bridge	trans	-103.7	132.3	-178.3	-70.3	-174.1	148.1	0	0	110.3	P207 L220	M205-P207 WeakPolarHBondContact O-CD 3.44Å; M205-L220 VanDerWaalsContact O-CD1 3.24Å; M205-L220 WeakPolarHBondContact O-CD1 3.19Å
206	C	73.6	Confident	76.9	Confident	12 Å²	12	91 Å²	91	8%	0.081	49%	0.487	C	S	.	.			trans	-70.1	122.1	177.4	-167.4	0	0	0	0	111.4	C184 S208 C211 L220	C184-C206 HydrophobicContact CB-CB 4.3Å; C206-S208 VanDerWaalsContact C-N 3.27Å; C206-S208 PolarHBondContact O-N 2.73Å; C206-S208 PolarHBondContact SG-OG 2.85Å; C206-C211 HydrophobicContact CB-CB 4.17Å; C206-L220 HydrophobicContact CB-CD2 3.98Å; C206-L220 HydrophobicContact CB-CG 4.17Å
207	P	73.9	Confident	76.4	Confident	71 Å²	71	86.5 Å²	86.5	46%	0.461	48%	0.483	S	S	.	.			trans	-78.2	-3.2	174.4	33.3	-37.2	0	0	0	114.1	T191 M205	T191-P207 HydrophobicContact CG2-CG 3.69Å; M205-P207 WeakPolarHBondContact O-CD 3.44Å
208	S	72.7	Confident	76.3	Confident	6 Å²	6	84 Å²	84	4%	0.042	47%	0.465	C	S	.	.			trans	-62.3	137.6	-176.9	68	0	0	0	0	111.5	C187 C206 E210 C211 V212	C187-S208 PolarHBondContact SG-OG 2.93Å; C187-S208 VanDerWaalsContact SG-OG 3.41Å; C206-S208 VanDerWaalsContact C-N 3.27Å; C206-S208 PolarHBondContact O-N 2.73Å; C206-S208 PolarHBondContact SG-OG 2.85Å; S208-E210 PolarHBondContact O-N 3.25Å; S208-C211 PolarHBondContact O-N 3.08Å; S208-C211 WeakPolarHBondContact OG-CB 3.11Å; S208-C211 PolarHBondContact OG-N 2.67Å; S208-V212 WeakPolarHBondContact O-CG2 3.35Å; S208-V212 PolarHBondContact O-N 2.72Å; S208-V212 VanDerWaalsContact O-N 3.1Å
209	Q	73.1	Confident	76.6	Confident	118 Å²	118	87.8 Å²	87.8	55%	0.551	47%	0.467	S	S	*	.	H	α-helix	trans	-57.3	-34.1	179.2	-67.9	-169.1	22	0	0	112.8	D121 V212 T213	D121-Q209 PolarHBondContact OD1-NE2 2.79Å; D121-Q209 VanDerWaalsContact OD2-CG 3.26Å; D121-Q209 WeakPolarHBondContact OD2-CG 3.49Å; D121-Q209 PolarHBondContact OD2-NE2 3.15Å; Q209-V212 PolarHBondContact O-N 3.31Å; Q209-T213 WeakPolarHBondContact O-CB 3.45Å; Q209-T213 PolarHBondContact O-N 3.1Å; Q209-T213 PolarHBondContact O-OG1 3.28Å
210	E	72.3	Confident	76.8	Confident	123 Å²	123	86.1 Å²	86.1	58%	0.575	45%	0.454	S	S	*	.	H	α-helix	trans	-62	-49.9	177	-64.1	-178.1	174.5	0	0	112.7	S208 V212 T213 N214	S208-E210 PolarHBondContact O-N 3.25Å; E210-V212 PolarHBondContact O-N 2.82Å; E210-T213 PolarHBondContact O-N 3.37Å; E210-N214 VanDerWaalsContact O-CB 3.24Å; E210-N214 WeakPolarHBondContact O-CB 3.45Å; E210-N214 PolarHBondContact O-N 3.44Å; E210-N214 PolarHBondContact O-ND2 2.95Å
211	C	71.9	Confident	76.9	Confident	7 Å²	7	87.8 Å²	87.8	5%	0.047	46%	0.459	C	S	.	.	H	α-helix	trans	-68.9	-32.4	178	-95.4	0	0	0	0	113.3	C206 S208 K215 S216	C206-C211 HydrophobicContact CB-CB 4.17Å; S208-C211 PolarHBondContact O-N 3.08Å; S208-C211 WeakPolarHBondContact OG-CB 3.11Å; S208-C211 PolarHBondContact OG-N 2.67Å; C211-K215 PolarHBondContact O-N 3.25Å; C211-K215 VanDerWaalsContact O-N 3.16Å; C211-S216 PolarHBondContact O-N 3.2Å
212	V	75.4	Confident	77.1	Confident	91 Å²	91	84.4 Å²	84.4	55%	0.552	44%	0.443	S	S	*	.	H	α-helix	trans	-71	-43.3	177.1	175.5	0	0	0	0	110.4	S208 Q209 E210 K215	S208-V212 WeakPolarHBondContact O-CG2 3.35Å; S208-V212 PolarHBondContact O-N 2.72Å; S208-V212 VanDerWaalsContact O-N 3.1Å; Q209-V212 PolarHBondContact O-N 3.31Å; E210-V212 PolarHBondContact O-N 2.82Å; V212-K215 PolarHBondContact O-N 2.74Å
213	T	77.1	Confident	77.1	Confident	108 Å²	108	83.6 Å²	83.6	66%	0.663	43%	0.434	S	S	*	.	H	α-helix	trans	-70.4	-42.2	-179.4	-54.5	0	0	0	0	111.5	Q209 E210 K215	Q209-T213 WeakPolarHBondContact O-CB 3.45Å; Q209-T213 PolarHBondContact O-N 3.1Å; Q209-T213 PolarHBondContact O-OG1 3.28Å; E210-T213 PolarHBondContact O-N 3.37Å; T213-K215 VanDerWaalsContact C-N 3.25Å; T213-K215 PolarHBondContact O-N 3.04Å
214	N	74.2	Confident	77.3	Confident	121 Å²	121	84.5 Å²	84.5	65%	0.647	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-6	178.1	-70.1	-26.2	0	0	0	113.8	E210 S216	E210-N214 VanDerWaalsContact O-CB 3.24Å; E210-N214 WeakPolarHBondContact O-CB 3.45Å; E210-N214 PolarHBondContact O-N 3.44Å; E210-N214 PolarHBondContact O-ND2 2.95Å; N214-S216 PolarHBondContact O-N 2.73Å
215	K	70.8	Confident	77.4	Confident	189 Å²	189	87.4 Å²	87.4	82%	0.822	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	23.9	-174.1	-67.7	-178	178.5	176.2	0	114.1	C211 V212 T213 G217	C211-K215 PolarHBondContact O-N 3.25Å; C211-K215 VanDerWaalsContact O-N 3.16Å; V212-K215 PolarHBondContact O-N 2.74Å; T213-K215 VanDerWaalsContact C-N 3.25Å; T213-K215 PolarHBondContact O-N 3.04Å; K215-G217 PolarHBondContact O-N 2.92Å
216	S	71.1	Confident	77.6	Confident	49 Å²	49	79.7 Å²	79.7	34%	0.343	41%	0.409	S	S	.	.			trans	-76.7	-15.5	-172.8	54.4	0	0	0	0	112.3	Q186 C211 N214 G218	Q186-S216 PolarHBondContact NE2-O 2.89Å; Q186-S216 PolarHBondContact OE1-O 2.91Å; Q186-S216 PolarHBondContact OE1-OG 2.84Å; Q186-S216 VanDerWaalsContact OE1-OG 3.09Å; C211-S216 PolarHBondContact O-N 3.2Å; N214-S216 PolarHBondContact O-N 2.73Å; S216-G218 VanDerWaalsContact C-N 3.32Å; S216-G218 PolarHBondContact O-N 2.93Å
217	G	67.7	Low	78.2	Confident	61 Å²	61	79.2 Å²	79.2	63%	0.629	41%	0.405	S	S	*	.			trans	61.6	39.1	165.4	0	0	0	0	0	113	K215 R219	K215-G217 PolarHBondContact O-N 2.92Å; G217-R219 PolarHBondContact O-N 2.84Å
218	G	76.3	Confident	78.7	Confident	3 Å²	3	77.7 Å²	77.7	3%	0.031	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-58.2	134.4	-178.3	0	0	0	0	0	112.4	S216	S216-G218 VanDerWaalsContact C-N 3.32Å; S216-G218 PolarHBondContact O-N 2.93Å
219	R	82.3	Confident	79.5	Confident	177 Å²	177	81.8 Å²	81.8	67%	0.668	41%	0.409	S	S	*	.	B	Isolated β-bridge	trans	-77.1	140.7	174.9	-67.5	-176.8	177.8	-173.4	-1	109.7	D185 G217 Y221	D185-R219 PolarHBondContact N-O 2.89Å; G217-R219 PolarHBondContact O-N 2.84Å; R219-Y221 HydrophobicContact CB-CE2 4.12Å
220	L	85.6	Confident	80.2	Confident	16 Å²	16	77.5 Å²	77.5	8%	0.084	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128.2	173.9	-73	177.8	0	0	0	109.9	Y182 C184 L203 I204 M205 C206	Y182-L220 HydrophobicContact CD1-CB 4.38Å; Y182-L220 HydrophobicContact CG-CB 4.46Å; C184-L220 HydrophobicContact CB-CD2 3.85Å; L203-L220 HydrophobicContact CB-CD1 3.77Å; L203-L220 WeakPolarHBondContact O-CB 3.42Å; I204-L220 PolarHBondContact O-N 3.41Å; M205-L220 VanDerWaalsContact O-CD1 3.24Å; M205-L220 WeakPolarHBondContact O-CD1 3.19Å; C206-L220 HydrophobicContact CB-CD2 3.98Å; C206-L220 HydrophobicContact CB-CG 4.17Å
221	Y	87.3	Confident	81.1	Confident	117 Å²	117	76.1 Å²	76.1	46%	0.459	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.9	171.6	-72.6	-87.1	0	0	0	110	Y182 T183 D185 R219 Q223	Y182-Y221 CarbonylContact C-O 3.55Å; Y182-Y221 VanDerWaalsContact CA-O 3.25Å; Y182-Y221 WeakPolarHBondContact CA-O 3.35Å; T183-Y221 PolarHBondContact N-O 3.34Å; T183-Y221 PolarHBondContact O-N 3.35Å; D185-Y221 VanDerWaalsContact OD1-CD2 3.24Å; D185-Y221 WeakPolarHBondContact OD1-CD2 3.43Å; D185-Y221 WeakPolarHBondContact OD2-CE2 3.39Å; R219-Y221 HydrophobicContact CB-CE2 4.12Å; Y221-Q223 PolarHBondContact O-N 3Å
222	L	88.3	Confident	82	Confident	80 Å²	80	77.4 Å²	77.4	42%	0.419	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.5	174	-179.9	69.6	0	0	0	109.1	M177 A180 Y182	M177-L222 HydrophobicContact CE-CD2 4.31Å; M177-L222 HydrophobicContact SD-CD1 4.42Å; M177-L222 HydrophobicContact SD-CD2 4.45Å; A180-L222 HydrophobicContact CB-CD1 3.66Å; Y182-L222 HydrophobicContact CD1-CB 3.94Å; Y182-L222 HydrophobicContact CD1-CD1 4.1Å; Y182-L222 HydrophobicContact CE1-CB 3.77Å; Y182-L222 HydrophobicContact CE1-CD1 3.71Å; Y182-L222 HydrophobicContact CE1-CG 4.3Å; Y182-L222 HydrophobicContact CE2-CD1 4.44Å
223	Q	86.3	Confident	82.6	Confident	49 Å²	49	73.6 Å²	73.6	23%	0.229	36%	0.363	C	S	.	.			trans	-106.5	116.3	176.3	-166.4	177	24.6	0	0	110.9	Y102 T181 T183 Y221 R225 G226 S227	Y102-Q223 PolarHBondContact OH-NE2 3.28Å; T181-Q223 PolarHBondContact O-N 2.99Å; T181-Q223 PolarHBondContact OG1-O 2.9Å; T183-Q223 HydrophobicContact CG2-CB 4.44Å; Y221-Q223 PolarHBondContact O-N 3Å; Q223-R225 VanDerWaalsContact C-N 3.29Å; Q223-R225 HydrophobicContact CG-CB 4.4Å; Q223-R225 PolarHBondContact O-N 3.41Å; Q223-G226 PolarHBondContact O-N 3.28Å; Q223-S227 PolarHBondContact O-N 3.08Å; Q223-S227 PolarHBondContact O-OG 3.29Å
224	T	86.3	Confident	83.1	Confident	90 Å²	90	69.1 Å²	69.1	55%	0.552	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.8	-179	52.2	0	0	0	0	113.7	S227 F229	T224-S227 VanDerWaalsContact C-OG 3.29Å; T224-S227 VanDerWaalsContact CA-OG 3.23Å; T224-S227 WeakPolarHBondContact CA-OG 3.45Å; T224-S227 PolarHBondContact O-OG 3.26Å; T224-F229 HydrophobicContact CG2-CZ 4.48Å
225	R	83.5	Confident	83.9	Confident	182 Å²	182	63.3 Å²	63.3	69%	0.687	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-31.4	-179.4	-64.6	-173.7	-179.9	-176.8	-0.4	113.7	Y102 Q223	Y102-R225 HydrophobicContact CD1-CB 4.49Å; Y102-R225 HydrophobicContact CE1-CB 4.07Å; Q223-R225 VanDerWaalsContact C-N 3.29Å; Q223-R225 HydrophobicContact CG-CB 4.4Å; Q223-R225 PolarHBondContact O-N 3.41Å
226	G	79.5	Confident	84.7	Confident	4 Å²	4	57.8 Å²	57.8	4%	0.041	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-19.6	175.8	0	0	0	0	0	112.8	T181 Q223	T181-G226 WeakPolarHBondContact CG2-O 3.49Å; T181-G226 VanDerWaalsContact OG1-CA 3.32Å; T181-G226 WeakPolarHBondContact OG1-CA 3.27Å; Q223-G226 PolarHBondContact O-N 3.28Å
227	S	86.1	Confident	85.7	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.007	26%	0.262	C	S	.	.	S	Bend	trans	-78.1	145.9	-179	60.4	0	0	0	0	112.3	V179 T181 Q223 T224 F229	V179-S227 CarbonylContact O-C 3.49Å; V179-S227 VanDerWaalsContact O-CA 3.23Å; V179-S227 WeakPolarHBondContact O-CA 3.37Å; V179-S227 WeakPolarHBondContact O-CB 3.39Å; T181-S227 PolarHBondContact OG1-N 3.38Å; T181-S227 VanDerWaalsContact OG1-N 3.11Å; Q223-S227 PolarHBondContact O-N 3.08Å; Q223-S227 PolarHBondContact O-OG 3.29Å; T224-S227 VanDerWaalsContact C-OG 3.29Å; T224-S227 VanDerWaalsContact CA-OG 3.23Å; T224-S227 WeakPolarHBondContact CA-OG 3.45Å; T224-S227 PolarHBondContact O-OG 3.26Å; S227-F229 WeakPolarHBondContact OG-CE2 3.03Å; S227-F229 VanDerWaalsContact OG-CZ 3.31Å; S227-F229 WeakPolarHBondContact OG-CZ 3.24Å
228	K	85.8	Confident	86.7	Confident	39 Å²	39	55.7 Å²	55.7	17%	0.17	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.3	177.5	-172.4	-176.4	-177.2	-167.6	0	110.5	E129 L130 R132 A178 V179	E129-K228 WeakPolarHBondContact O-CD 3.37Å; E129-K228 PolarHBondContact O-NZ 3.21Å; L130-K228 HydrophobicContact CD1-CB 4.25Å; R132-K228 WeakPolarHBondContact O-CE 2.94Å; R132-K228 PolarHBondContact O-NZ 3.37Å; A178-K228 PolarHBondContact N-O 3.45Å; V179-K228 HydrophobicContact CB-CB 4.33Å; V179-K228 PolarHBondContact N-O 3.02Å; V179-K228 PolarHBondContact O-N 3.23Å
229	F	88.3	Confident	87.3	Confident	93 Å²	93	55.7 Å²	55.7	41%	0.408	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	142.5	171.6	-60.2	-81.2	0	0	0	110.3	P175 M176 M177 T224 S227	P175-F229 HydrophobicContact CB-CB 4.21Å; P175-F229 HydrophobicContact CB-CD1 4.24Å; P175-F229 HydrophobicContact CB-CG 4.43Å; M176-F229 CarbonylContact O-C 3.55Å; M176-F229 WeakPolarHBondContact O-CA 3.48Å; M177-F229 HydrophobicContact CB-CD1 3.95Å; M177-F229 HydrophobicContact CB-CE1 3.83Å; M177-F229 HydrophobicContact CG-CD1 4.29Å; M177-F229 HydrophobicContact CG-CE1 3.97Å; M177-F229 HydrophobicContact SD-CE1 4.02Å; M177-F229 HydrophobicContact SD-CZ 4.26Å; T224-F229 HydrophobicContact CG2-CZ 4.48Å; S227-F229 WeakPolarHBondContact OG-CE2 3.03Å; S227-F229 VanDerWaalsContact OG-CZ 3.31Å; S227-F229 WeakPolarHBondContact OG-CZ 3.24Å
230	V	87.9	Confident	87.3	Confident	27 Å²	27	49.4 Å²	49.4	16%	0.164	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	141.9	176	179	0	0	0	0	107.8	E135 M176 A178 F232	E135-V230 WeakPolarHBondContact OE1-CG1 3.31Å; M176-V230 PolarHBondContact N-O 3.44Å; M176-V230 PolarHBondContact O-N 2.83Å; A178-V230 HydrophobicContact CB-CG2 3.97Å; V230-F232 PolarHBondContact O-N 3.42Å
231	K	90.8	Very high	86.8	Confident	95 Å²	95	52.8 Å²	52.8	41%	0.413	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	131.4	173.7	-61	174	-167.4	164.8	0	108.7	V173 R258 G259 E260 T262	V173-K231 HydrophobicContact CG1-CB 3.76Å; V173-K231 HydrophobicContact CG1-CG 4.12Å; K231-R258 CarbonylContact O-C 3.43Å; K231-R258 WeakPolarHBondContact O-CA 3.46Å; K231-G259 PolarHBondContact O-N 2.87Å; K231-E260 IonicContact NZ-OE1 2.72Å; K231-E260 IonicContact NZ-OE2 2.62Å; K231-E260 PolarHBondContact NZ-OE2 2.78Å; K231-T262 HydrophobicContact CB-CG2 3.92Å; K231-T262 WeakPolarHBondContact CD-OG1 3.32Å
232	F	90.8	Very high	86.3	Confident	34 Å²	34	53.9 Å²	53.9	15%	0.149	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	135.2	178.4	173.6	-95.6	0	0	0	109.7	K174 M176 V230 E234 Y256 R258	K174-F232 PolarHBondContact N-O 3.09Å; K174-F232 WeakPolarHBondContact O-CA 3.3Å; K174-F232 WeakPolarHBondContact O-CB 3.07Å; K174-F232 PolarHBondContact O-N 3.01Å; M176-F232 HydrophobicContact CB-CB 3.58Å; M176-F232 HydrophobicContact CB-CG 4.2Å; M176-F232 HydrophobicContact SD-CB 4.49Å; M176-F232 HydrophobicContact SD-CD2 3.84Å; M176-F232 HydrophobicContact SD-CE2 4.38Å; M176-F232 HydrophobicContact SD-CG 4.27Å; V230-F232 PolarHBondContact O-N 3.42Å; F232-E234 HydrophobicContact CE1-CB 4.47Å; F232-Y256 AromaticContact CE2-CD1 3.97Å; F232-Y256 HydrophobicContact CE2-CD1 3.97Å; F232-Y256 HydrophobicContact CE2-CD2 4.03Å; F232-Y256 AromaticContact CE2-CG 3.68Å; F232-Y256 HydrophobicContact CE2-CG 3.68Å; F232-Y256 AromaticContact CZ-CD1 3.7Å; F232-Y256 HydrophobicContact CZ-CD1 3.7Å; F232-Y256 HydrophobicContact CZ-CD2 4.31Å; F232-Y256 AromaticContact CZ-CE1 3.96Å; F232-Y256 HydrophobicContact CZ-CE1 3.96Å; F232-Y256 AromaticContact CZ-CG 3.91Å; F232-Y256 HydrophobicContact CZ-CG 3.91Å; F232-R258 HydrophobicContact CD2-CG 4.21Å
233	Q	88.5	Confident	85.7	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.047	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	134.3	176.3	-171.2	179.7	20.4	0	0	109.4	T171 L235 A257 T262	T171-Q233 VanDerWaalsContact O-CG 3.29Å; T171-Q233 WeakPolarHBondContact O-CG 3.12Å; T171-Q233 PolarHBondContact O-NE2 3.35Å; Q233-L235 HydrophobicContact CG-CD2 4.15Å; Q233-A257 HydrophobicContact CB-CB 4.35Å; Q233-A257 PolarHBondContact N-O 2.92Å; Q233-A257 PolarHBondContact O-N 3.35Å; Q233-T262 HydrophobicContact CB-CG2 3.73Å
234	E	88.7	Confident	85.6	Confident	14 Å²	14	53.2 Å²	53.2	7%	0.065	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.5	169.8	-176.3	-178	163.5	0	0	109.4	T171 F232 R236 Y256 L423	T171-E234 HydrophobicContact CG2-CB 4.24Å; T171-E234 PolarHBondContact N-O 3.31Å; T171-E234 WeakPolarHBondContact OG1-CA 3.5Å; T171-E234 PolarHBondContact OG1-N 3.47Å; T171-E234 PolarHBondContact OG1-O 3.09Å; F232-E234 HydrophobicContact CE1-CB 4.47Å; E234-R236 IonicContact OE1-NE 2.9Å; E234-Y256 HydrophobicContact CB-CD1 4.37Å; E234-Y256 HydrophobicContact CB-CE1 4.44Å; E234-Y256 HydrophobicContact CG-CD1 4.14Å; E234-Y256 HydrophobicContact CG-CE1 3.96Å; E234-L423 WeakPolarHBondContact OE2-CD1 3.23Å
235	L	89.3	Confident	85.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.3	173	-56.6	174.6	0	0	0	108.7	R169 A170 Q233 V255 A257 A265 I303	R169-L235 CarbonylContact O-C 3.59Å; R169-L235 WeakPolarHBondContact O-CA 3.39Å; A170-L235 HydrophobicContact CB-CD2 3.41Å; A170-L235 VanDerWaalsContact CB-CD2 3.41Å; Q233-L235 HydrophobicContact CG-CD2 4.15Å; L235-V255 HydrophobicContact CB-CB 4.24Å; L235-V255 PolarHBondContact N-O 3.3Å; L235-V255 PolarHBondContact O-N 3.27Å; L235-A257 HydrophobicContact CD1-CB 4.37Å; L235-A265 HydrophobicContact CD1-CB 4.36Å; L235-I303 HydrophobicContact CD1-CD1 3.97Å
236	R	89.5	Confident	85.5	Confident	73 Å²	73	50.8 Å²	50.8	28%	0.275	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.6	168.5	-67.7	-166	178.3	-166.1	-2.1	109.6	T168 R169 E234 T254	T168-R236 PolarHBondContact N-O 2.91Å; T168-R236 WeakPolarHBondContact OG1-CB 3.47Å; T168-R236 PolarHBondContact OG1-O 3.41Å; R169-R236 HydrophobicContact CB-CB 4.17Å; R169-R236 PolarHBondContact N-O 3.48Å; R169-R236 PolarHBondContact O-N 2.86Å; E234-R236 IonicContact OE1-NE 2.9Å; R236-T254 HydrophobicContact CG-CG2 4.25Å
237	I	90.5	Very high	85.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	148.4	176.4	65.7	169.1	0	0	0	110.7	V149 V163 I166 V167 S252 M253 V255 V271 I273	V149-I237 HydrophobicContact CG2-CD1 4.41Å; V163-I237 HydrophobicContact CG1-CD1 4.06Å; I166-I237 CarbonylContact O-C 3.59Å; I166-I237 VanDerWaalsContact O-CA 3.29Å; I166-I237 WeakPolarHBondContact O-CA 3.35Å; V167-I237 HydrophobicContact CG2-CG2 4.15Å; I237-S252 CarbonylContact O-C 3.44Å; I237-S252 WeakPolarHBondContact O-CA 3.04Å; I237-M253 HydrophobicContact CD1-CG 3.61Å; I237-M253 HydrophobicContact CD1-SD 3.51Å; I237-M253 VanDerWaalsContact CD1-SD 3.51Å; I237-M253 HydrophobicContact CG1-CG 3.24Å; I237-M253 HydrophobicContact CG1-SD 3.89Å; I237-M253 PolarHBondContact N-O 3.21Å; I237-M253 PolarHBondContact O-N 3.15Å; I237-V255 HydrophobicContact CD1-CG2 3.85Å; I237-V255 HydrophobicContact CG1-CG2 3.78Å; I237-V255 HydrophobicContact CG2-CG2 4.08Å; I237-V271 HydrophobicContact CG2-CG2 4.24Å; I237-I273 HydrophobicContact CD1-CD1 4.36Å; I237-I273 HydrophobicContact CG2-CD1 3.73Å
238	Q	89.1	Confident	85.8	Confident	66 Å²	66	58.4 Å²	58.4	31%	0.308	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	149.9	178.2	-173.5	172.7	24.6	0	0	110.3	G165 I166 T168 P250	G165-Q238 CarbonylContact C-O 3.56Å; G165-Q238 WeakPolarHBondContact CA-O 3.41Å; I166-Q238 PolarHBondContact N-O 3.28Å; I166-Q238 PolarHBondContact O-N 3.44Å; T168-Q238 HydrophobicContact CG2-CB 3.49Å; T168-Q238 VanDerWaalsContact CG2-CB 3.49Å; T168-Q238 HydrophobicContact CG2-CG 4.4Å; T168-Q238 VanDerWaalsContact CG2-OE1 3.28Å; Q238-P250 HydrophobicContact CG-CB 3.91Å; Q238-P250 HydrophobicContact CG-CG 4.49Å
239	E	88.8	Confident	85.9	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.009	35%	0.351	C	S	.	.			trans	-55.4	143.4	171.6	-73.3	172.8	-176.8	0	0	111.9	V148 V149 R150 S241 V244 P250 R251	V148-E239 HydrophobicContact CG1-CG 4.13Å; V149-E239 HydrophobicContact CB-CG 3.55Å; V149-E239 HydrophobicContact CG1-CG 4.16Å; V149-E239 HydrophobicContact CG2-CG 3.97Å; R150-E239 VanDerWaalsContact CA-OE1 3.3Å; R150-E239 WeakPolarHBondContact CA-OE1 3.36Å; R150-E239 WeakPolarHBondContact CB-OE1 3.38Å; R150-E239 IonicContact CZ-OE2 3.35Å; R150-E239 PolarHBondContact N-OE1 2.89Å; R150-E239 IonicContact NE-OE1 3.02Å; R150-E239 IonicContact NE-OE2 2.99Å; R150-E239 PolarHBondContact NE-OE2 3.41Å; R150-E239 IonicContact NH2-OE2 3.77Å; R150-E239 PolarHBondContact NH2-OE2 2.78Å; E239-S241 PolarHBondContact O-N 2.79Å; E239-V244 HydrophobicContact CB-CG2 4.26Å; E239-P250 HydrophobicContact CB-CB 4.32Å; E239-R251 PolarHBondContact N-O 3.37Å; E239-R251 VanDerWaalsContact N-O 3.13Å; E239-R251 PolarHBondContact OE2-N 3.42Å
240	H	82.1	Confident	85.8	Confident	46 Å²	46	61.1 Å²	61.1	21%	0.213	35%	0.345	C	S	.	.			trans	-64	133.8	169.7	-163.3	-90.9	0	0	0	110.2	D242 Q243 V244 H270	H240-D242 VanDerWaalsContact C-N 3.27Å; H240-D242 IonicContact CE1-OD1 3.2Å; H240-D242 IonicContact CE1-OD2 3.41Å; H240-D242 PolarHBondContact CE1-OD2 3.17Å; H240-D242 WeakPolarHBondContact ND1-CB 3.29Å; H240-D242 PolarHBondContact ND1-N 3.38Å; H240-D242 IonicContact ND1-OD1 3.6Å; H240-D242 IonicContact ND1-OD2 2.79Å; H240-D242 PolarHBondContact ND1-OD2 3.42Å; H240-D242 PolarHBondContact O-N 2.92Å; H240-Q243 HydrophobicContact CB-CG 4.41Å; H240-Q243 PolarHBondContact O-N 3.24Å; H240-Q243 VanDerWaalsContact O-N 3.13Å; H240-V244 WeakPolarHBondContact O-CG2 3.49Å; H240-H270 AromaticContact CD2-CE1 3.47Å; H240-H270 PolarHBondContact CD2-CE1 2.96Å; H240-H270 VanDerWaalsContact CD2-CE1 3.47Å; H240-H270 AromaticContact CD2-ND1 3.39Å; H240-H270 PolarHBondContact CD2-ND1 2.79Å; H240-H270 AromaticContact NE2-CE1 3.21Å; H240-H270 PolarHBondContact NE2-CE1 2.88Å; H240-H270 AromaticContact NE2-ND1 3.53Å
241	S	76.1	Confident	85.9	Confident	86 Å²	86	66.8 Å²	66.8	60%	0.601	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-58.6	-36.5	-176.4	-57.8	0	0	0	0	113.2	E239 Q243 V244	E239-S241 PolarHBondContact O-N 2.79Å; S241-Q243 PolarHBondContact O-N 3.22Å; S241-V244 PolarHBondContact O-N 3Å
242	D	76.9	Confident	85.8	Confident	141 Å²	141	66 Å²	66	75%	0.754	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-63.6	-25.3	-179.5	-58.4	-5	0	0	0	113.8	H240	H240-D242 VanDerWaalsContact C-N 3.27Å; H240-D242 IonicContact CE1-OD1 3.2Å; H240-D242 IonicContact CE1-OD2 3.41Å; H240-D242 PolarHBondContact CE1-OD2 3.17Å; H240-D242 WeakPolarHBondContact ND1-CB 3.29Å; H240-D242 PolarHBondContact ND1-N 3.38Å; H240-D242 IonicContact ND1-OD1 3.6Å; H240-D242 IonicContact ND1-OD2 2.79Å; H240-D242 PolarHBondContact ND1-OD2 3.42Å; H240-D242 PolarHBondContact O-N 2.92Å
243	Q	75.6	Confident	85.7	Confident	86 Å²	86	65.4 Å²	65.4	40%	0.402	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-93.4	-2.6	-176.6	-63.7	171.3	0.2	0	0	112.1	V148 H240 S241 P245	V148-Q243 HydrophobicContact CG1-CB 4.39Å; H240-Q243 HydrophobicContact CB-CG 4.41Å; H240-Q243 PolarHBondContact O-N 3.24Å; H240-Q243 VanDerWaalsContact O-N 3.13Å; S241-Q243 PolarHBondContact O-N 3.22Å; Q243-P245 WeakPolarHBondContact O-CD 3.43Å
244	V	83.5	Confident	85.7	Confident	28 Å²	28	66.5 Å²	66.5	17%	0.17	38%	0.375	C	S	.	.	S	Bend	trans	-82.4	123.1	-178.8	-176.5	0	0	0	0	109.5	E239 H240 S241 N248 P250	E239-V244 HydrophobicContact CB-CG2 4.26Å; H240-V244 WeakPolarHBondContact O-CG2 3.49Å; S241-V244 PolarHBondContact O-N 3Å; V244-N248 HydrophobicContact CG1-CB 4.2Å; V244-N248 WeakPolarHBondContact CG1-O 3.28Å; V244-P250 HydrophobicContact CG2-CB 4.06Å
245	P	83.6	Confident	85.9	Confident	63 Å²	63	65.9 Å²	65.9	41%	0.409	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-60.2	140.9	173.4	-22.1	32.7	0	0	0	111.4	Q243 G247 N248	Q243-P245 WeakPolarHBondContact O-CD 3.43Å; P245-G247 PolarHBondContact O-N 3.06Å; P245-N248 PolarHBondContact O-N 2.81Å; P245-N248 VanDerWaalsContact O-N 3.08Å
246	V	85.1	Confident	86	Confident	158 Å²	158	67.7 Å²	67.7	96%	0.958	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	125.2	-179.1	-172.7	0	0	0	0	110.5
247	G	84.8	Confident	86.1	Confident	79 Å²	79	64.2 Å²	64.2	81%	0.814	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	-6.3	178.3	0	0	0	0	0	115.9	P245	P245-G247 PolarHBondContact O-N 3.06Å
248	N	87.1	Confident	86	Confident	86 Å²	86	66.8 Å²	66.8	46%	0.46	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-96.3	148.5	173.2	-76.4	-37	0	0	0	112.3	R150 V244 P245	R150-N248 PolarHBondContact NH1-ND2 2.62Å; V244-N248 HydrophobicContact CG1-CB 4.2Å; V244-N248 WeakPolarHBondContact CG1-O 3.28Å; P245-N248 PolarHBondContact O-N 2.81Å; P245-N248 VanDerWaalsContact O-N 3.08Å
249	I	86.9	Confident	85.9	Confident	147 Å²	147	63.8 Å²	63.8	75%	0.754	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-80.8	139	171.9	-57.3	173.7	0	0	0	108.6	R150 R251	R150-I249 PolarHBondContact NH2-O 2.88Å; I249-R251 PolarHBondContact O-N 3.22Å
250	P	86.7	Confident	85.7	Confident	43 Å²	43	67.9 Å²	67.9	28%	0.279	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-59.9	131.4	172.7	23	-34.5	0	0	0	111.2	Q238 E239 V244	Q238-P250 HydrophobicContact CG-CB 3.91Å; Q238-P250 HydrophobicContact CG-CG 4.49Å; E239-P250 HydrophobicContact CB-CB 4.32Å; V244-P250 HydrophobicContact CG2-CB 4.06Å
251	R	89	Confident	85.9	Confident	145 Å²	145	65.8 Å²	65.8	55%	0.547	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-82	152.5	175.8	-63	-179.7	174.3	177.6	-1	110.5	V149 E239 I249	V149-R251 HydrophobicContact CG1-CB 4.37Å; E239-R251 PolarHBondContact N-O 3.37Å; E239-R251 VanDerWaalsContact N-O 3.13Å; E239-R251 PolarHBondContact OE2-N 3.42Å; I249-R251 PolarHBondContact O-N 3.22Å
252	S	88.6	Confident	86.4	Confident	78 Å²	78	62.3 Å²	62.3	55%	0.545	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.4	172.5	57.7	0	0	0	0	110.1	I237	I237-S252 CarbonylContact O-C 3.44Å; I237-S252 WeakPolarHBondContact O-CA 3.04Å
253	M	88.8	Confident	86.9	Confident	23 Å²	23	64.8 Å²	64.8	11%	0.113	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151.6	172.6	62.6	162.1	53.7	0	0	110.8	V149 I152 V163 I237 L298	V149-M253 HydrophobicContact CB-CE 3.92Å; V149-M253 HydrophobicContact CG1-CB 4.22Å; V149-M253 HydrophobicContact CG1-CE 3.43Å; V149-M253 VanDerWaalsContact CG1-CE 3.43Å; V149-M253 HydrophobicContact CG1-CG 3.99Å; V149-M253 HydrophobicContact CG1-SD 4.35Å; V149-M253 HydrophobicContact CG2-CE 4.02Å; V149-M253 HydrophobicContact CG2-CG 4.24Å; V149-M253 HydrophobicContact CG2-SD 4.25Å; I152-M253 HydrophobicContact CD1-CE 3.31Å; V163-M253 HydrophobicContact CG1-CE 4.27Å; V163-M253 HydrophobicContact CG1-SD 4.12Å; I237-M253 HydrophobicContact CD1-CG 3.61Å; I237-M253 HydrophobicContact CD1-SD 3.51Å; I237-M253 VanDerWaalsContact CD1-SD 3.51Å; I237-M253 HydrophobicContact CG1-CG 3.24Å; I237-M253 HydrophobicContact CG1-SD 3.89Å; I237-M253 PolarHBondContact N-O 3.21Å; I237-M253 PolarHBondContact O-N 3.15Å; M253-L298 HydrophobicContact SD-CD2 4.34Å
254	T	90.3	Very high	87.3	Confident	33 Å²	33	64.6 Å²	64.6	20%	0.202	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	133.6	177.2	46.6	0	0	0	0	109.9	R236 T296 Y297 L298	R236-T254 HydrophobicContact CG-CG2 4.25Å; T254-T296 PolarHBondContact OG1-O 2.92Å; T254-Y297 WeakPolarHBondContact O-CA 3.48Å; T254-L298 PolarHBondContact O-N 3.37Å
255	V	91.8	Very high	87.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.9	179.7	-176.5	0	0	0	0	108.1	L235 I237 I273 L298 A300	L235-V255 HydrophobicContact CB-CB 4.24Å; L235-V255 PolarHBondContact N-O 3.3Å; L235-V255 PolarHBondContact O-N 3.27Å; I237-V255 HydrophobicContact CD1-CG2 3.85Å; I237-V255 HydrophobicContact CG1-CG2 3.78Å; I237-V255 HydrophobicContact CG2-CG2 4.08Å; V255-I273 HydrophobicContact CB-CD1 4.44Å; V255-I273 HydrophobicContact CG1-CD1 4.04Å; V255-I273 HydrophobicContact CG1-CG2 4.05Å; V255-I273 HydrophobicContact CG2-CD1 4.07Å; V255-L298 CarbonylContact C-O 3.6Å; V255-L298 WeakPolarHBondContact CA-O 3.44Å; V255-L298 HydrophobicContact CG1-CB 4.41Å; V255-L298 HydrophobicContact CG1-CD2 4.5Å; V255-L298 HydrophobicContact CG2-CB 4.15Å; V255-L298 HydrophobicContact CG2-CD2 4.21Å; V255-A300 HydrophobicContact CG1-CB 3.69Å
256	Y	92.1	Very high	87.1	Confident	38 Å²	38	66 Å²	66	15%	0.149	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	113.1	173.1	-68.2	-13.4	0	0	0	109.2	F232 E234 L280 Y297 L298 A300	F232-Y256 AromaticContact CE2-CD1 3.97Å; F232-Y256 HydrophobicContact CE2-CD1 3.97Å; F232-Y256 HydrophobicContact CE2-CD2 4.03Å; F232-Y256 AromaticContact CE2-CG 3.68Å; F232-Y256 HydrophobicContact CE2-CG 3.68Å; F232-Y256 AromaticContact CZ-CD1 3.7Å; F232-Y256 HydrophobicContact CZ-CD1 3.7Å; F232-Y256 HydrophobicContact CZ-CD2 4.31Å; F232-Y256 AromaticContact CZ-CE1 3.96Å; F232-Y256 HydrophobicContact CZ-CE1 3.96Å; F232-Y256 AromaticContact CZ-CG 3.91Å; F232-Y256 HydrophobicContact CZ-CG 3.91Å; E234-Y256 HydrophobicContact CB-CD1 4.37Å; E234-Y256 HydrophobicContact CB-CE1 4.44Å; E234-Y256 HydrophobicContact CG-CD1 4.14Å; E234-Y256 HydrophobicContact CG-CE1 3.96Å; Y256-L280 HydrophobicContact CE2-CD1 3.84Å; Y256-Y297 AromaticContact CD2-CD2 3.19Å; Y256-Y297 HydrophobicContact CD2-CD2 3.19Å; Y256-Y297 AromaticContact CD2-CE2 3.46Å; Y256-Y297 HydrophobicContact CD2-CE2 3.46Å; Y256-Y297 VanDerWaalsContact CD2-CE2 3.46Å; Y256-Y297 AromaticContact CD2-CG 3.87Å; Y256-Y297 HydrophobicContact CD2-CG 3.87Å; Y256-Y297 HydrophobicContact CE2-CD1 4.35Å; Y256-Y297 AromaticContact CE2-CD2 3.62Å; Y256-Y297 HydrophobicContact CE2-CD2 3.62Å; Y256-Y297 AromaticContact CE2-CE2 3.98Å; Y256-Y297 HydrophobicContact CE2-CE2 3.98Å; Y256-Y297 AromaticContact CE2-CG 3.81Å; Y256-Y297 HydrophobicContact CE2-CG 3.81Å; Y256-Y297 AromaticContact CG-CD2 3.82Å; Y256-Y297 HydrophobicContact CG-CD2 3.82Å; Y256-Y297 HydrophobicContact CG-CE2 4.35Å; Y256-L298 PolarHBondContact N-O 3.38Å; Y256-A300 PolarHBondContact O-N 3.17Å
257	A	90.2	Very high	86.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	119.6	169.6	0	0	0	0	0	108.5	Q233 L235 I303	Q233-A257 HydrophobicContact CB-CB 4.35Å; Q233-A257 PolarHBondContact N-O 2.92Å; Q233-A257 PolarHBondContact O-N 3.35Å; L235-A257 HydrophobicContact CD1-CB 4.37Å; A257-I303 HydrophobicContact CB-CD1 4.24Å
258	R	89.1	Confident	86.5	Confident	55 Å²	55	59.2 Å²	59.2	21%	0.208	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	146.5	176.2	-70.5	176.2	173.2	165.9	-4.6	109.4	Y137 K231 F232 E299	Y137-R258 PolarHBondContact OH-O 3.41Å; K231-R258 CarbonylContact O-C 3.43Å; K231-R258 WeakPolarHBondContact O-CA 3.46Å; F232-R258 HydrophobicContact CD2-CG 4.21Å; R258-E299 IonicContact CZ-OE1 3.8Å; R258-E299 IonicContact NH1-OE1 3.58Å; R258-E299 PolarHBondContact NH1-OE1 3.48Å; R258-E299 IonicContact NH1-OE2 3.94Å
259	G	86.6	Confident	86.2	Confident	2 Å²	2	56.8 Å²	56.8	2%	0.021	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	75.9	-135.3	169.3	0	0	0	0	0	113.6	E135 Y137 K231 N261 T262	E135-G259 WeakPolarHBondContact OE1-CA 3.37Å; E135-G259 WeakPolarHBondContact OE2-CA 3.3Å; Y137-G259 WeakPolarHBondContact OH-CA 3.5Å; K231-G259 PolarHBondContact O-N 2.87Å; G259-N261 VanDerWaalsContact C-N 3.25Å; G259-N261 PolarHBondContact O-N 2.95Å; G259-T262 WeakPolarHBondContact O-CG2 3.46Å; G259-T262 PolarHBondContact O-N 3.35Å; G259-T262 PolarHBondContact O-OG1 3.06Å
260	E	85.8	Confident	86	Confident	88 Å²	88	51.5 Å²	51.5	41%	0.411	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-74.9	-14.2	-175.2	-156.7	57.1	-161.9	0	0	113.9	E135 Y137 K231 T262	E135-E260 PolarHBondContact OE2-N 2.64Å; Y137-E260 PolarHBondContact OH-N 3.27Å; K231-E260 IonicContact NZ-OE1 2.72Å; K231-E260 IonicContact NZ-OE2 2.62Å; K231-E260 PolarHBondContact NZ-OE2 2.78Å; E260-T262 PolarHBondContact O-N 3.44Å
261	N	85	Confident	85.9	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.016	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-71	0.8	174	-65.1	-17.2	0	0	0	114	Y137 G259 L264 A300 H301 I303	Y137-N261 WeakPolarHBondContact CE1-ND2 3.39Å; G259-N261 VanDerWaalsContact C-N 3.25Å; G259-N261 PolarHBondContact O-N 2.95Å; N261-L264 HydrophobicContact CB-CD1 4.32Å; N261-A300 PolarHBondContact ND2-O 3.16Å; N261-H301 VanDerWaalsContact ND2-C 3.26Å; N261-H301 PolarHBondContact ND2-O 3.4Å; N261-I303 HydrophobicContact CB-CD1 4.4Å
262	T	87.8	Confident	85.9	Confident	12 Å²	12	42.8 Å²	42.8	7%	0.074	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	145.3	177.9	55.9	0	0	0	0	111.3	K231 Q233 G259 E260 L264	K231-T262 HydrophobicContact CB-CG2 3.92Å; K231-T262 WeakPolarHBondContact CD-OG1 3.32Å; Q233-T262 HydrophobicContact CB-CG2 3.73Å; G259-T262 WeakPolarHBondContact O-CG2 3.46Å; G259-T262 PolarHBondContact O-N 3.35Å; G259-T262 PolarHBondContact O-OG1 3.06Å; E260-T262 PolarHBondContact O-N 3.44Å; T262-L264 PolarHBondContact O-N 3.2Å
263	R	86.4	Confident	86	Confident	193 Å²	193	39.1 Å²	39.1	73%	0.728	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	9.5	-178.2	-51.4	-179.9	175.4	-179.8	-3	116.2	V173	V173-R263 HydrophobicContact CG2-CG 3.48Å; V173-R263 VanDerWaalsContact CG2-CG 3.48Å
264	L	83.6	Confident	86	Confident	82 Å²	82	38.6 Å²	38.6	43%	0.429	19%	0.193	S	C	.	.			trans	-73.1	-35.4	177.1	-68.5	179.5	0	0	0	113.3	N261 T262 I303	N261-L264 HydrophobicContact CB-CD1 4.32Å; T262-L264 PolarHBondContact O-N 3.2Å; L264-I303 HydrophobicContact CD1-CB 4.42Å
265	A	82.7	Confident	86	Confident	4 Å²	4	37 Å²	37	3%	0.033	18%	0.183	C	C	.	.			trans	-109.8	138.3	-176.9	0	0	0	0	0	112.5	V167 L235 V271 I303 L305	V167-A265 HydrophobicContact CG2-CB 3.93Å; L235-A265 HydrophobicContact CD1-CB 4.36Å; A265-V271 HydrophobicContact CB-CG1 3.95Å; A265-I303 HydrophobicContact CB-CG2 4.21Å; A265-L305 HydrophobicContact CB-CD2 4.35Å
266	Q	81.4	Confident	86	Confident	117 Å²	117	37 Å²	37	55%	0.547	18%	0.183	S	C	.	.			trans	-104.2	155.3	172.5	-55.2	-172.6	-1.9	0	0	110.9	V167 G268 D269	V167-Q266 WeakPolarHBondContact CB-O 3.48Å; Q266-G268 PolarHBondContact O-N 2.82Å; Q266-D269 WeakPolarHBondContact CA-OD2 3.39Å; Q266-D269 VanDerWaalsContact CB-OD2 3.31Å; Q266-D269 WeakPolarHBondContact CB-OD2 3.44Å; Q266-D269 PolarHBondContact N-OD2 2.86Å; Q266-D269 WeakPolarHBondContact O-CB 3.27Å; Q266-D269 PolarHBondContact O-N 2.9Å
267	P	81.3	Confident	86	Confident	57 Å²	57	36.1 Å²	36.1	37%	0.37	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	132.7	170.9	-21.6	33.3	0	0	0	111.5	V167 A170	V167-P267 CarbonylContact O-C 3.46Å; V167-P267 WeakPolarHBondContact O-CA 3.46Å; A170-P267 HydrophobicContact CB-CG 4.04Å
268	G	74.6	Confident	85.9	Confident	37 Å²	37	37.4 Å²	37.4	38%	0.381	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.8	-14.5	-175.8	0	0	0	0	0	113.8	V167 Q266	V167-G268 PolarHBondContact O-N 2.79Å; Q266-G268 PolarHBondContact O-N 2.82Å
269	D	81.3	Confident	85.9	Confident	36 Å²	36	37 Å²	37	19%	0.193	19%	0.191	C	C	.	.			trans	-76.8	138.6	-179.9	-62.9	-20.2	0	0	0	111	I166 V167 Q266 V271 L305	I166-D269 WeakPolarHBondContact CA-O 3.27Å; V167-D269 PolarHBondContact N-O 3.22Å; Q266-D269 WeakPolarHBondContact CA-OD2 3.39Å; Q266-D269 VanDerWaalsContact CB-OD2 3.31Å; Q266-D269 WeakPolarHBondContact CB-OD2 3.44Å; Q266-D269 PolarHBondContact N-OD2 2.86Å; Q266-D269 WeakPolarHBondContact O-CB 3.27Å; Q266-D269 PolarHBondContact O-N 2.9Å; D269-V271 HydrophobicContact CB-CG1 4.38Å; D269-L305 HydrophobicContact CB-CD2 3.8Å
270	H	82.4	Confident	85.7	Confident	35 Å²	35	37.9 Å²	37.9	16%	0.162	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.3	168.3	-66.9	-107.2	0	0	0	107.3	H240 M306	H240-H270 AromaticContact CD2-CE1 3.47Å; H240-H270 PolarHBondContact CD2-CE1 2.96Å; H240-H270 VanDerWaalsContact CD2-CE1 3.47Å; H240-H270 AromaticContact CD2-ND1 3.39Å; H240-H270 PolarHBondContact CD2-ND1 2.79Å; H240-H270 AromaticContact NE2-CE1 3.21Å; H240-H270 PolarHBondContact NE2-CE1 2.88Å; H240-H270 AromaticContact NE2-ND1 3.53Å; H270-M306 WeakPolarHBondContact CB-O 3.46Å; H270-M306 CarbonylContact O-C 3.49Å; H270-M306 PolarHBondContact O-N 2.93Å
271	V	86.3	Confident	85.1	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	143.2	-175.1	-70.9	0	0	0	0	110.5	R164 G165 V167 I237 A265 D269 I273 I303 L305	R164-V271 WeakPolarHBondContact CA-O 3.46Å; G165-V271 PolarHBondContact N-O 3.18Å; G165-V271 WeakPolarHBondContact O-CG2 3.47Å; G165-V271 PolarHBondContact O-N 2.93Å; G165-V271 VanDerWaalsContact O-O 3.08Å; V167-V271 HydrophobicContact CG2-CB 4.33Å; V167-V271 HydrophobicContact CG2-CG1 3.87Å; V167-V271 HydrophobicContact CG2-CG2 3.45Å; V167-V271 VanDerWaalsContact CG2-CG2 3.45Å; I237-V271 HydrophobicContact CG2-CG2 4.24Å; A265-V271 HydrophobicContact CB-CG1 3.95Å; D269-V271 HydrophobicContact CB-CG1 4.38Å; V271-I273 HydrophobicContact CB-CG1 4.15Å; V271-I273 HydrophobicContact CG2-CD1 3.88Å; V271-I273 HydrophobicContact CG2-CG1 3.85Å; V271-I303 HydrophobicContact CB-CG2 4.43Å; V271-I303 HydrophobicContact CG1-CG2 4.16Å; V271-L305 HydrophobicContact CG1-CD2 3.57Å
272	A	88.3	Confident	84.2	Confident	4 Å²	4	48 Å²	48	3%	0.033	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.3	156.9	0	0	0	0	0	108.3	V163 R164 T304 M306	V163-A272 CarbonylContact O-C 3.6Å; V163-A272 WeakPolarHBondContact O-CA 3.47Å; R164-A272 HydrophobicContact CG-CB 3.93Å; A272-T304 WeakPolarHBondContact CB-OG1 3.47Å; A272-T304 PolarHBondContact N-O 2.98Å; A272-T304 PolarHBondContact O-N 2.95Å; A272-T304 PolarHBondContact O-OG1 2.83Å; A272-T304 VanDerWaalsContact O-OG1 3.06Å; A272-M306 HydrophobicContact CB-CE 3.49Å; A272-M306 VanDerWaalsContact CB-CE 3.49Å; A272-M306 HydrophobicContact CB-CG 4.08Å; A272-M306 HydrophobicContact CB-SD 3.52Å; A272-M306 VanDerWaalsContact CB-SD 3.52Å
273	I	89.8	Confident	83	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122	179.1	-57.2	-177.9	0	0	0	107.5	V163 I237 V255 V271 L298 A300 I303	V163-I273 PolarHBondContact N-O 3.15Å; V163-I273 PolarHBondContact O-N 3.13Å; I237-I273 HydrophobicContact CD1-CD1 4.36Å; I237-I273 HydrophobicContact CG2-CD1 3.73Å; V255-I273 HydrophobicContact CB-CD1 4.44Å; V255-I273 HydrophobicContact CG1-CD1 4.04Å; V255-I273 HydrophobicContact CG1-CG2 4.05Å; V255-I273 HydrophobicContact CG2-CD1 4.07Å; V271-I273 HydrophobicContact CB-CG1 4.15Å; V271-I273 HydrophobicContact CG2-CD1 3.88Å; V271-I273 HydrophobicContact CG2-CG1 3.85Å; I273-L298 HydrophobicContact CB-CD2 4.31Å; I273-L298 HydrophobicContact CG2-CD2 3.83Å; I273-A300 HydrophobicContact CG2-CB 3.67Å; I273-I303 HydrophobicContact CG1-CG1 4.32Å; I273-I303 HydrophobicContact CG1-CG2 4.34Å; I273-I303 HydrophobicContact CG2-CG1 4.36Å
274	T	90.1	Very high	81.6	Confident	13 Å²	13	46.5 Å²	46.5	8%	0.08	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.9	169.5	60.2	0	0	0	0	108.1	A140 V161 A162 H301 S302	A140-T274 HydrophobicContact CB-CG2 3.46Å; A140-T274 VanDerWaalsContact CB-CG2 3.46Å; V161-T274 WeakPolarHBondContact O-CA 3.48Å; A162-T274 HydrophobicContact CB-CG2 3.95Å; T274-H301 PolarHBondContact O-N 2.97Å; T274-S302 PolarHBondContact N-O 3.47Å; T274-S302 PolarHBondContact O-N 3.18Å; T274-S302 WeakPolarHBondContact OG1-CA 3.41Å; T274-S302 VanDerWaalsContact OG1-CB 3.27Å; T274-S302 WeakPolarHBondContact OG1-CB 3.4Å; T274-S302 PolarHBondContact OG1-N 3.02Å; T274-S302 PolarHBondContact OG1-O 3.46Å; T274-S302 VanDerWaalsContact OG1-O 3.04Å
275	G	90.5	Very high	80	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	171.4	-174	0	0	0	0	0	113.8	V161 E299	V161-G275 PolarHBondContact N-O 3.43Å; V161-G275 PolarHBondContact O-N 3.23Å; G275-E299 CarbonylContact C-O 3.58Å; G275-E299 WeakPolarHBondContact CA-O 3.37Å
276	I	91.3	Very high	78.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	125.9	179.5	-47.8	175.3	0	0	0	108.4	A70 K71 L160 L278 E299 H301	A70-I276 HydrophobicContact CB-CD1 3.55Å; A70-I276 HydrophobicContact CB-CG1 3.7Å; K71-I276 HydrophobicContact CB-CD1 4.15Å; K71-I276 HydrophobicContact CD-CD1 4.21Å; L160-I276 HydrophobicContact CD1-CG1 4.05Å; I276-L278 HydrophobicContact CB-CG 4.43Å; I276-L278 HydrophobicContact CG2-CD1 4.34Å; I276-L278 HydrophobicContact CG2-CD2 3.92Å; I276-L278 HydrophobicContact CG2-CG 3.9Å; I276-E299 PolarHBondContact N-O 2.91Å; I276-E299 PolarHBondContact O-N 2.82Å; I276-H301 VanDerWaalsContact CD1-CE1 3.47Å; I276-H301 WeakPolarHBondContact CD1-CE1 3.49Å; I276-H301 WeakPolarHBondContact CD1-NE2 3.26Å
277	F	90.9	Very high	77	Confident	18 Å²	18	60.5 Å²	60.5	8%	0.079	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.6	176.9	-173.2	-111.8	0	0	0	110.5	I152 I157 G158 H159 V161 T296 L298	I152-F277 HydrophobicContact CG2-CD1 3.86Å; I152-F277 HydrophobicContact CG2-CD2 4.07Å; I152-F277 HydrophobicContact CG2-CE1 3.84Å; I152-F277 HydrophobicContact CG2-CE2 4.05Å; I152-F277 HydrophobicContact CG2-CG 3.96Å; I152-F277 HydrophobicContact CG2-CZ 3.91Å; I157-F277 HydrophobicContact CG1-CD1 3.99Å; I157-F277 HydrophobicContact CG1-CE1 4.07Å; G158-F277 PolarHBondContact N-O 3.21Å; H159-F277 PolarHBondContact O-N 3.24Å; V161-F277 HydrophobicContact CG2-CB 4.17Å; F277-T296 HydrophobicContact CE1-CG2 3.94Å; F277-T296 HydrophobicContact CE2-CG2 4.27Å; F277-T296 HydrophobicContact CZ-CG2 3.52Å; F277-T296 WeakPolarHBondContact CZ-OG1 3.13Å; F277-L298 HydrophobicContact CB-CD1 4.22Å
278	L	89.5	Confident	75.7	Confident	28 Å²	28	62.2 Å²	62.2	15%	0.147	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.5	-173.6	-65.2	173.4	0	0	0	111.9	I276 Y297	I276-L278 HydrophobicContact CB-CG 4.43Å; I276-L278 HydrophobicContact CG2-CD1 4.34Å; I276-L278 HydrophobicContact CG2-CD2 3.92Å; I276-L278 HydrophobicContact CG2-CG 3.9Å; L278-Y297 HydrophobicContact CB-CD1 4.49Å; L278-Y297 HydrophobicContact CB-CE1 3.9Å; L278-Y297 PolarHBondContact N-O 2.76Å; L278-Y297 VanDerWaalsContact O-CD1 3.31Å; L278-Y297 WeakPolarHBondContact O-CD1 3.45Å; L278-Y297 PolarHBondContact O-N 3.25Å; L278-Y297 VanDerWaalsContact O-O 3.07Å
279	P	88.5	Confident	74.6	Confident	47 Å²	47	65.1 Å²	65.1	31%	0.305	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	140.7	167.6	30.9	-32.9	0	0	0	110.5	E295	P279-E295 CarbonylContact C-O 3.35Å; P279-E295 WeakPolarHBondContact CA-O 3.24Å
280	L	82.5	Confident	73.1	Confident	20 Å²	20	71.8 Å²	71.8	11%	0.105	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126.6	171.4	-165.2	119.7	0	0	0	109.8	Y256 R282 E295 Y297	Y256-L280 HydrophobicContact CE2-CD1 3.84Å; L280-R282 HydrophobicContact CD2-CG 3.49Å; L280-R282 VanDerWaalsContact CD2-CG 3.49Å; L280-E295 PolarHBondContact N-O 3.46Å; L280-Y297 HydrophobicContact CB-CD1 3.77Å; L280-Y297 HydrophobicContact CB-CE1 4Å; L280-Y297 HydrophobicContact CD1-CD1 3.87Å; L280-Y297 HydrophobicContact CD1-CE1 3.93Å; L280-Y297 HydrophobicContact CG-CD1 4.43Å; L280-Y297 HydrophobicContact CG-CE1 4.45Å
281	L	73.1	Confident	71.9	Confident	141 Å²	141	72.2 Å²	72.2	74%	0.738	40%	0.401	S	S	*	.			trans	-93.9	106.2	172.4	-62.8	170.8	0	0	0	108.7
282	R	65.6	Low	70.8	Confident	162 Å²	162	80.9 Å²	80.9	61%	0.611	45%	0.446	S	S	*	.			trans	-82.5	116.1	169.3	-72.8	-160.4	-176.6	171.4	8.8	110	L280 G284 E295	L280-R282 HydrophobicContact CD2-CG 3.49Å; L280-R282 VanDerWaalsContact CD2-CG 3.49Å; R282-G284 PolarHBondContact O-N 3.1Å; R282-E295 IonicContact CZ-OE1 2.55Å; R282-E295 IonicContact CZ-OE2 3.94Å; R282-E295 IonicContact NE-OE1 2.75Å; R282-E295 IonicContact NE-OE2 3.23Å; R282-E295 PolarHBondContact NE-OE2 3.32Å; R282-E295 VanDerWaalsContact NE-OE2 3.1Å; R282-E295 IonicContact NH1-OE1 2.73Å; R282-E295 IonicContact NH2-OE1 2.65Å; R282-E295 PolarHBondContact NH2-OE1 3.44Å; R282-E295 IonicContact NH2-OE2 2.92Å; R282-E295 PolarHBondContact NH2-OE2 2.93Å
283	T	62.7	Low	69.8	Low	108 Å²	108	88.6 Å²	88.6	66%	0.663	49%	0.486	S	S	*	.			trans	-89.2	92.7	169.7	62.4	0	0	0	0	108.5	S199	S199-T283 PolarHBondContact OG-OG1 3.39Å
284	G	56.8	Low	68.8	Low	65 Å²	65	91.5 Å²	91.5	67%	0.67	51%	0.506	S	S	*	.			trans	-142.2	164.7	-177.4	0	0	0	0	0	113.4	R282	R282-G284 PolarHBondContact O-N 3.1Å
285	Y	51.3	Low	68.3	Low	238 Å²	238	95.6 Å²	95.6	93%	0.933	53%	0.525	S	S	*	.	S	Bend	trans	-74.8	137.5	-170.6	-125.9	-94	0	0	0	113.6
286	S	48.1	Very low	68.1	Low	82 Å²	82	98.2 Å²	98.2	57%	0.573	54%	0.541	S	S	*	.	S	Bend	trans	94.6	129.1	165.4	-154.2	0	0	0	0	117.4	A288 V289	S286-A288 PolarHBondContact O-N 3.42Å; S286-V289 PolarHBondContact O-N 3.3Å
287	Q	52.6	Low	68.1	Low	177 Å²	177	99.8 Å²	99.8	83%	0.827	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-0.3	-169.8	-66.6	160.9	-35.8	0	0	116.6
288	A	53.4	Low	68.1	Low	93 Å²	93	99 Å²	99	77%	0.769	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-22.6	175.1	0	0	0	0	0	113.5	S286	S286-A288 PolarHBondContact O-N 3.42Å
289	V	51.9	Low	68.2	Low	99 Å²	99	98.3 Å²	98.3	60%	0.6	54%	0.54	S	S	*	.	S	Bend	trans	-97.4	-7.4	-178.7	-175.7	0	0	0	0	112.4	S286 G291	S286-V289 PolarHBondContact O-N 3.3Å; V289-G291 PolarHBondContact O-N 3.11Å
290	Q	49.3	Very low	68.3	Low	175 Å²	175	96.2 Å²	96.2	82%	0.818	53%	0.526	S	S	*	.			trans	-73.4	24.8	166.9	-84.9	-167.4	-23.8	0	0	113.3
291	G	56.7	Low	68.6	Low	45 Å²	45	95.6 Å²	95.6	46%	0.464	52%	0.523	S	S	.	.	S	Bend	trans	-67.8	150.6	159.2	0	0	0	0	0	109.2	V289 L293	V289-G291 PolarHBondContact O-N 3.11Å; G291-L293 PolarHBondContact O-N 3.26Å
292	L	65	Low	69.2	Low	183 Å²	183	89.5 Å²	89.5	96%	0.958	49%	0.492	S	S	*	.	S	Bend	trans	-62.2	7.1	166.8	-67.9	164.4	0	0	0	113	S294	L292-S294 PolarHBondContact O-N 3.08Å
293	L	66	Low	70.2	Confident	167 Å²	167	82.5 Å²	82.5	87%	0.874	47%	0.466	S	S	*	.			trans	-74.2	94.2	177.3	-138.7	87.7	0	0	0	108.4	G291	G291-L293 PolarHBondContact O-N 3.26Å
294	S	69.1	Low	71.3	Confident	60 Å²	60	79.9 Å²	79.9	42%	0.42	45%	0.451	S	S	.	.			trans	-86.3	128.7	173.5	38.4	0	0	0	0	109.5	L292	L292-S294 PolarHBondContact O-N 3.08Å
295	E	79.3	Confident	72.2	Confident	99 Å²	99	79 Å²	79	46%	0.463	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	145.4	160.6	-70.5	-178.5	174.7	0	0	107.8	P279 L280 R282	P279-E295 CarbonylContact C-O 3.35Å; P279-E295 WeakPolarHBondContact CA-O 3.24Å; L280-E295 PolarHBondContact N-O 3.46Å; R282-E295 IonicContact CZ-OE1 2.55Å; R282-E295 IonicContact CZ-OE2 3.94Å; R282-E295 IonicContact NE-OE1 2.75Å; R282-E295 IonicContact NE-OE2 3.23Å; R282-E295 PolarHBondContact NE-OE2 3.32Å; R282-E295 VanDerWaalsContact NE-OE2 3.1Å; R282-E295 IonicContact NH1-OE1 2.73Å; R282-E295 IonicContact NH2-OE1 2.65Å; R282-E295 PolarHBondContact NH2-OE1 3.44Å; R282-E295 IonicContact NH2-OE2 2.92Å; R282-E295 PolarHBondContact NH2-OE2 2.93Å
296	T	87.1	Confident	73.1	Confident	56 Å²	56	70 Å²	70	34%	0.344	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	149.4	179.9	52.8	0	0	0	0	109.9	T254 F277	T254-T296 PolarHBondContact OG1-O 2.92Å; F277-T296 HydrophobicContact CE1-CG2 3.94Å; F277-T296 HydrophobicContact CE2-CG2 4.27Å; F277-T296 HydrophobicContact CZ-CG2 3.52Å; F277-T296 WeakPolarHBondContact CZ-OG1 3.13Å
297	Y	90.9	Very high	73.5	Confident	32 Å²	32	69.6 Å²	69.6	13%	0.125	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.5	174.3	72.2	-77.6	0	0	0	109.7	T254 Y256 L278 L280 E299	T254-Y297 WeakPolarHBondContact O-CA 3.48Å; Y256-Y297 AromaticContact CD2-CD2 3.19Å; Y256-Y297 HydrophobicContact CD2-CD2 3.19Å; Y256-Y297 AromaticContact CD2-CE2 3.46Å; Y256-Y297 HydrophobicContact CD2-CE2 3.46Å; Y256-Y297 VanDerWaalsContact CD2-CE2 3.46Å; Y256-Y297 AromaticContact CD2-CG 3.87Å; Y256-Y297 HydrophobicContact CD2-CG 3.87Å; Y256-Y297 HydrophobicContact CE2-CD1 4.35Å; Y256-Y297 AromaticContact CE2-CD2 3.62Å; Y256-Y297 HydrophobicContact CE2-CD2 3.62Å; Y256-Y297 AromaticContact CE2-CE2 3.98Å; Y256-Y297 HydrophobicContact CE2-CE2 3.98Å; Y256-Y297 AromaticContact CE2-CG 3.81Å; Y256-Y297 HydrophobicContact CE2-CG 3.81Å; Y256-Y297 AromaticContact CG-CD2 3.82Å; Y256-Y297 HydrophobicContact CG-CD2 3.82Å; Y256-Y297 HydrophobicContact CG-CE2 4.35Å; L278-Y297 HydrophobicContact CB-CD1 4.49Å; L278-Y297 HydrophobicContact CB-CE1 3.9Å; L278-Y297 PolarHBondContact N-O 2.76Å; L278-Y297 VanDerWaalsContact O-CD1 3.31Å; L278-Y297 WeakPolarHBondContact O-CD1 3.45Å; L278-Y297 PolarHBondContact O-N 3.25Å; L278-Y297 VanDerWaalsContact O-O 3.07Å; L280-Y297 HydrophobicContact CB-CD1 3.77Å; L280-Y297 HydrophobicContact CB-CE1 4Å; L280-Y297 HydrophobicContact CD1-CD1 3.87Å; L280-Y297 HydrophobicContact CD1-CE1 3.93Å; L280-Y297 HydrophobicContact CG-CD1 4.43Å; L280-Y297 HydrophobicContact CG-CE1 4.45Å; Y297-E299 HydrophobicContact CE2-CB 4.24Å
298	L	91.1	Very high	73.8	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.5	174.3	-170.9	71.9	0	0	0	109.1	V161 V163 M253 T254 V255 Y256 I273 F277	V161-L298 HydrophobicContact CG2-CD1 3.67Å; V163-L298 HydrophobicContact CB-CD2 4.43Å; V163-L298 HydrophobicContact CG2-CD2 4.05Å; M253-L298 HydrophobicContact SD-CD2 4.34Å; T254-L298 PolarHBondContact O-N 3.37Å; V255-L298 CarbonylContact C-O 3.6Å; V255-L298 WeakPolarHBondContact CA-O 3.44Å; V255-L298 HydrophobicContact CG1-CB 4.41Å; V255-L298 HydrophobicContact CG1-CD2 4.5Å; V255-L298 HydrophobicContact CG2-CB 4.15Å; V255-L298 HydrophobicContact CG2-CD2 4.21Å; Y256-L298 PolarHBondContact N-O 3.38Å; I273-L298 HydrophobicContact CB-CD2 4.31Å; I273-L298 HydrophobicContact CG2-CD2 3.83Å; F277-L298 HydrophobicContact CB-CD1 4.22Å
299	E	91.3	Very high	73.4	Confident	15 Å²	15	64.3 Å²	64.3	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	110.6	170.5	-174.3	171.3	-162.9	0	0	108.9	K71 R258 G275 I276 Y297	K71-E299 IonicContact NZ-OE1 3.87Å; K71-E299 PolarHBondContact NZ-OE1 3.21Å; K71-E299 IonicContact NZ-OE2 3.24Å; K71-E299 PolarHBondContact NZ-OE2 3.26Å; R258-E299 IonicContact CZ-OE1 3.8Å; R258-E299 IonicContact NH1-OE1 3.58Å; R258-E299 PolarHBondContact NH1-OE1 3.48Å; R258-E299 IonicContact NH1-OE2 3.94Å; G275-E299 CarbonylContact C-O 3.58Å; G275-E299 WeakPolarHBondContact CA-O 3.37Å; I276-E299 PolarHBondContact N-O 2.91Å; I276-E299 PolarHBondContact O-N 2.82Å; Y297-E299 HydrophobicContact CE2-CB 4.24Å
300	A	90.8	Very high	73.2	Confident	2 Å²	2	66 Å²	66	2%	0.017	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.7	-173.9	0	0	0	0	0	112.2	V255 Y256 N261 I273 I303	V255-A300 HydrophobicContact CG1-CB 3.69Å; Y256-A300 PolarHBondContact O-N 3.17Å; N261-A300 PolarHBondContact ND2-O 3.16Å; I273-A300 HydrophobicContact CG2-CB 3.67Å; A300-I303 HydrophobicContact CB-CD1 4.33Å; A300-I303 HydrophobicContact CB-CG1 4.2Å
301	H	87.7	Confident	72.9	Confident	7 Å²	7	61.9 Å²	61.9	3%	0.032	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-40.2	174.1	-75.5	-166.5	0	0	0	112.5	T74 Y137 F138 N261 T274 I276	T74-H301 VanDerWaalsContact CG2-CE1 3.41Å; T74-H301 WeakPolarHBondContact CG2-CE1 3.29Å; Y137-H301 VanDerWaalsContact CB-O 3.27Å; Y137-H301 WeakPolarHBondContact CB-O 3.47Å; Y137-H301 HydrophobicContact CD1-CB 4.3Å; Y137-H301 WeakPolarHBondContact CD1-O 3.49Å; Y137-H301 VanDerWaalsContact CG-O 3.29Å; F138-H301 AromaticContact CD2-ND1 3.94Å; F138-H301 WeakPolarHBondContact O-CB 3.38Å; N261-H301 VanDerWaalsContact ND2-C 3.26Å; N261-H301 PolarHBondContact ND2-O 3.4Å; T274-H301 PolarHBondContact O-N 2.97Å; I276-H301 VanDerWaalsContact CD1-CE1 3.47Å; I276-H301 WeakPolarHBondContact CD1-CE1 3.49Å; I276-H301 WeakPolarHBondContact CD1-NE2 3.26Å
302	S	87	Confident	72.4	Confident	13 Å²	13	64.7 Å²	64.7	9%	0.091	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.6	172.2	171.1	0	0	0	0	110.1	T274	T274-S302 PolarHBondContact N-O 3.47Å; T274-S302 PolarHBondContact O-N 3.18Å; T274-S302 WeakPolarHBondContact OG1-CA 3.41Å; T274-S302 VanDerWaalsContact OG1-CB 3.27Å; T274-S302 WeakPolarHBondContact OG1-CB 3.4Å; T274-S302 PolarHBondContact OG1-N 3.02Å; T274-S302 PolarHBondContact OG1-O 3.46Å; T274-S302 VanDerWaalsContact OG1-O 3.04Å
303	I	86.9	Confident	71.5	Confident	15 Å²	15	63.4 Å²	63.4	8%	0.077	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	111.8	177.9	-58.1	173.5	0	0	0	106.3	L235 A257 N261 L264 A265 V271 I273 A300	L235-I303 HydrophobicContact CD1-CD1 3.97Å; A257-I303 HydrophobicContact CB-CD1 4.24Å; N261-I303 HydrophobicContact CB-CD1 4.4Å; L264-I303 HydrophobicContact CD1-CB 4.42Å; A265-I303 HydrophobicContact CB-CG2 4.21Å; V271-I303 HydrophobicContact CB-CG2 4.43Å; V271-I303 HydrophobicContact CG1-CG2 4.16Å; I273-I303 HydrophobicContact CG1-CG1 4.32Å; I273-I303 HydrophobicContact CG1-CG2 4.34Å; I273-I303 HydrophobicContact CG2-CG1 4.36Å; A300-I303 HydrophobicContact CB-CD1 4.33Å; A300-I303 HydrophobicContact CB-CG1 4.2Å
304	T	84.3	Confident	70.5	Confident	54 Å²	54	57.5 Å²	57.5	33%	0.331	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.5	173.2	52.1	0	0	0	0	108.4	A272 M306	A272-T304 WeakPolarHBondContact CB-OG1 3.47Å; A272-T304 PolarHBondContact N-O 2.98Å; A272-T304 PolarHBondContact O-N 2.95Å; A272-T304 PolarHBondContact O-OG1 2.83Å; A272-T304 VanDerWaalsContact O-OG1 3.06Å; T304-M306 PolarHBondContact O-N 3.34Å
305	L	77.1	Confident	69.2	Low	47 Å²	47	57.4 Å²	57.4	25%	0.246	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	125.5	173.5	-65.3	162.2	0	0	0	107.9	A265 D269 V271	A265-L305 HydrophobicContact CB-CD2 4.35Å; D269-L305 HydrophobicContact CB-CD2 3.8Å; V271-L305 HydrophobicContact CG1-CD2 3.57Å
306	M	69.6	Low	67.5	Low	47 Å²	47	59.9 Å²	59.9	23%	0.232	32%	0.324	C	S	.	.			trans	-116.8	82.3	175.9	-72.8	-170.7	170.9	0	0	107.6	R164 H270 A272 T304	R164-M306 HydrophobicContact CG-SD 4.15Å; R164-M306 PolarHBondContact NE-SD 3.47Å; H270-M306 WeakPolarHBondContact CB-O 3.46Å; H270-M306 CarbonylContact O-C 3.49Å; H270-M306 PolarHBondContact O-N 2.93Å; A272-M306 HydrophobicContact CB-CE 3.49Å; A272-M306 VanDerWaalsContact CB-CE 3.49Å; A272-M306 HydrophobicContact CB-CG 4.08Å; A272-M306 HydrophobicContact CB-SD 3.52Å; A272-M306 VanDerWaalsContact CB-SD 3.52Å; T304-M306 PolarHBondContact O-N 3.34Å
307	N	57.1	Low	65.4	Low	74 Å²	74	63.9 Å²	63.9	40%	0.396	34%	0.339	S	S	.	.			trans	-58.1	161.7	171.2	-73.9	-32.2	0	0	0	110.6	T309	N307-T309 CarbonylContact O-C 3.6Å; N307-T309 VanDerWaalsContact O-C 3.3Å; N307-T309 WeakPolarHBondContact O-CA 2.93Å; N307-T309 PolarHBondContact O-N 3.36Å; N307-T309 VanDerWaalsContact O-O 3.1Å
308	K	58.2	Low	63.6	Low	90 Å²	90	71 Å²	71	39%	0.391	37%	0.373	S	S	.	.	S	Bend	trans	-46.1	-6.9	-165.3	-68.6	-179.7	-178.8	175.5	0	117.6	D395 S401	K308-D395 IonicContact NZ-OD1 3.57Å; K308-D395 IonicContact NZ-OD2 2.7Å; K308-S401 PolarHBondContact NZ-O 3.41Å; K308-S401 VanDerWaalsContact NZ-O 3.12Å; K308-S401 PolarHBondContact NZ-OG 2.98Å
309	T	46	Very low	62	Low	69 Å²	69	72.1 Å²	72.1	42%	0.423	38%	0.379	S	S	.	.	S	Bend	trans	-140.3	144.3	160.4	59.5	0	0	0	0	110.9	N307 R560	N307-T309 CarbonylContact O-C 3.6Å; N307-T309 VanDerWaalsContact O-C 3.3Å; N307-T309 WeakPolarHBondContact O-CA 2.93Å; N307-T309 PolarHBondContact O-N 3.36Å; N307-T309 VanDerWaalsContact O-O 3.1Å; T309-R560 PolarHBondContact OG1-NH1 2.86Å
310	E	46.2	Very low	60.5	Low	134 Å²	134	75.1 Å²	75.1	63%	0.626	40%	0.398	S	S	*	.	S	Bend	trans	-38.9	135.2	-174.9	-59.5	175.2	156	0	0	116.3
311	D	42.9	Very low	59.2	Low	89 Å²	89	80.5 Å²	80.5	48%	0.476	43%	0.427	S	S	.	.			trans	74.3	107	162.2	-51.2	-35.1	0	0	0	119.2	E313 L314	D311-E313 HydrophobicContact CB-CB 4.4Å; D311-E313 PolarHBondContact O-N 3.01Å; D311-E313 VanDerWaalsContact O-N 3.08Å; D311-L314 PolarHBondContact O-N 2.85Å
312	D	47.3	Very low	58.2	Low	104 Å²	104	87.5 Å²	87.5	56%	0.556	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-61.5	-0.4	164.3	-129.9	9.7	0	0	0	112.8	L314 G315	D312-L314 PolarHBondContact O-N 2.82Å; D312-G315 PolarHBondContact O-N 2.84Å
313	E	46.3	Very low	57.3	Low	157 Å²	157	89.8 Å²	89.8	73%	0.734	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-67.2	-14	170.5	-68.7	-169.5	158	0	0	112.7	D311	D311-E313 HydrophobicContact CB-CB 4.4Å; D311-E313 PolarHBondContact O-N 3.01Å; D311-E313 VanDerWaalsContact O-N 3.08Å
314	L	44.2	Very low	56.4	Low	42 Å²	42	91.4 Å²	91.4	22%	0.22	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-97.1	6.2	-179.8	-77.8	146.8	0	0	0	115	D311 D312 E317 K557	D311-L314 PolarHBondContact O-N 2.85Å; D312-L314 PolarHBondContact O-N 2.82Å; L314-E317 HydrophobicContact CD2-CB 4.38Å; L314-K557 VanDerWaalsContact CD1-NZ 3.28Å
315	G	41.8	Very low	55.7	Low	58 Å²	58	97.1 Å²	97.1	60%	0.598	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-69.9	-23.2	164.5	0	0	0	0	0	113.1	D312	D312-G315 PolarHBondContact O-N 2.84Å
316	N	43.9	Very low	55.2	Low	152 Å²	152	98 Å²	98	81%	0.813	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-15.8	-170.3	-76.1	-13.6	0	0	0	115.8	E318	N316-E318 PolarHBondContact O-N 2.73Å
317	E	43.3	Very low	55	Low	140 Å²	140	96.2 Å²	96.2	65%	0.654	49%	0.494	S	S	*	.			trans	-80.6	102.5	169.5	-72.1	-176.6	159.4	0	0	109.1	L314 L319	L314-E317 HydrophobicContact CD2-CB 4.38Å; E317-L319 PolarHBondContact O-N 3.14Å
318	E	53	Low	55.4	Low	182 Å²	182	96.8 Å²	96.8	85%	0.85	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-49.3	132.9	160	-62.8	-175.7	151.4	0	0	108.1	N316 T320	N316-E318 PolarHBondContact O-N 2.73Å; E318-T320 PolarHBondContact O-N 2.96Å
319	L	57.3	Low	55.8	Low	23 Å²	23	97.9 Å²	97.9	12%	0.12	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-48.6	129.1	174.7	-79.5	125.2	0	0	0	108.1	E317 D321 E323 L558 R561 L565	E317-L319 PolarHBondContact O-N 3.14Å; L319-D321 PolarHBondContact O-N 3.44Å; L319-E323 HydrophobicContact CD2-CB 4.28Å; L319-E323 WeakPolarHBondContact CD2-OE2 3.31Å; L319-L558 HydrophobicContact CD2-CD1 4.23Å; L319-R561 HydrophobicContact CD1-CB 4.36Å; L319-L565 HydrophobicContact CD1-CB 4.27Å; L319-L565 HydrophobicContact CD1-CD1 3.53Å
320	T	60.4	Low	56.5	Low	79 Å²	79	103.7 Å²	103.7	49%	0.485	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-57.1	137.2	173.2	36.6	0	0	0	0	108.7	E318 E322 E323 L324	E318-T320 PolarHBondContact O-N 2.96Å; T320-E322 PolarHBondContact O-N 2.77Å; T320-E323 PolarHBondContact O-N 3.23Å; T320-E323 WeakPolarHBondContact OG1-CG 3.46Å; T320-L324 PolarHBondContact O-N 2.9Å
321	D	62.7	Low	57.5	Low	115 Å²	115	99.5 Å²	99.5	62%	0.615	52%	0.522	S	S	*	.	H	α-helix	trans	-53.9	-23	178.4	-78.9	-30.2	0	0	0	112.3	L319 R325	L319-D321 PolarHBondContact O-N 3.44Å; D321-R325 WeakPolarHBondContact O-CB 3.49Å; D321-R325 WeakPolarHBondContact O-CG 3.48Å; D321-R325 PolarHBondContact O-N 2.96Å
322	E	66.4	Low	59.3	Low	154 Å²	154	96.6 Å²	96.6	72%	0.72	51%	0.506	S	S	*	.	H	α-helix	trans	-68.6	-44.5	173.9	-59.8	-177.3	171.5	0	0	113	T320 L324 R325 S326	T320-E322 PolarHBondContact O-N 2.77Å; E322-L324 VanDerWaalsContact C-N 3.31Å; E322-R325 PolarHBondContact O-N 2.83Å; E322-S326 PolarHBondContact O-N 2.86Å; E322-S326 VanDerWaalsContact O-N 3.1Å
323	E	68.4	Low	61	Low	61 Å²	61	94 Å²	94	29%	0.285	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-41.5	174	-72.8	-177.5	168.9	0	0	110	L319 T320 R325 S326 I327 L558	L319-E323 HydrophobicContact CD2-CB 4.28Å; L319-E323 WeakPolarHBondContact CD2-OE2 3.31Å; T320-E323 PolarHBondContact O-N 3.23Å; T320-E323 WeakPolarHBondContact OG1-CG 3.46Å; E323-R325 VanDerWaalsContact C-N 3.35Å; E323-R325 PolarHBondContact O-N 2.95Å; E323-S326 PolarHBondContact O-N 3.05Å; E323-S326 PolarHBondContact O-OG 2.74Å; E323-I327 WeakPolarHBondContact O-CD1 3.4Å; E323-I327 WeakPolarHBondContact O-CG1 3.39Å; E323-I327 PolarHBondContact O-N 2.68Å; E323-I327 VanDerWaalsContact O-N 3.15Å; E323-L558 HydrophobicContact CB-CD1 4.44Å; E323-L558 HydrophobicContact CG-CD1 4.3Å; E323-L558 WeakPolarHBondContact OE2-CD1 3.17Å
324	L	67.6	Low	62.8	Low	48 Å²	48	92 Å²	92	25%	0.251	48%	0.479	S	S	.	.	H	α-helix	trans	-64.9	-39.2	179.1	-151.4	134	0	0	0	111.8	T320 E322 I327 T328 L565	T320-L324 PolarHBondContact O-N 2.9Å; E322-L324 VanDerWaalsContact C-N 3.31Å; L324-I327 PolarHBondContact O-N 2.63Å; L324-T328 HydrophobicContact CD2-CG2 3.96Å; L324-T328 VanDerWaalsContact O-CG2 3.29Å; L324-T328 WeakPolarHBondContact O-CG2 3.4Å; L324-T328 PolarHBondContact O-N 2.9Å; L324-T328 PolarHBondContact O-OG1 2.93Å; L324-L565 HydrophobicContact CD1-CD1 4.42Å
325	R	69.5	Low	64.7	Low	174 Å²	174	92.9 Å²	92.9	66%	0.657	48%	0.481	S	S	*	.	H	α-helix	trans	-62.7	-43.9	174.5	-77.5	170.5	-170	-176.2	6.6	112.9	D321 E322 E323 I327 T328	D321-R325 WeakPolarHBondContact O-CB 3.49Å; D321-R325 WeakPolarHBondContact O-CG 3.48Å; D321-R325 PolarHBondContact O-N 2.96Å; E322-R325 PolarHBondContact O-N 2.83Å; E323-R325 VanDerWaalsContact C-N 3.35Å; E323-R325 PolarHBondContact O-N 2.95Å; R325-I327 PolarHBondContact O-N 2.78Å; R325-T328 WeakPolarHBondContact CA-OG1 3.39Å; R325-T328 PolarHBondContact O-N 3.03Å; R325-T328 PolarHBondContact O-OG1 2.94Å
326	S	66.1	Low	66.7	Low	66 Å²	66	90.2 Å²	90.2	46%	0.462	45%	0.453	S	S	.	.	H	α-helix	trans	-60.5	-31.5	176.5	77	0	0	0	0	112.4	E322 E323	E322-S326 PolarHBondContact O-N 2.86Å; E322-S326 VanDerWaalsContact O-N 3.1Å; E323-S326 PolarHBondContact O-N 3.05Å; E323-S326 PolarHBondContact O-OG 2.74Å
327	I	67.1	Low	68.7	Low	10 Å²	10	83.2 Å²	83.2	5%	0.051	42%	0.416	C	S	.	.	H	α-helix	trans	-80.1	-38.6	179.2	-66.7	168.6	0	0	0	111.2	E323 L324 R325 E329 F332 L558 Y562	E323-I327 WeakPolarHBondContact O-CD1 3.4Å; E323-I327 WeakPolarHBondContact O-CG1 3.39Å; E323-I327 PolarHBondContact O-N 2.68Å; E323-I327 VanDerWaalsContact O-N 3.15Å; L324-I327 PolarHBondContact O-N 2.63Å; R325-I327 PolarHBondContact O-N 2.78Å; I327-E329 PolarHBondContact O-N 3.5Å; I327-F332 HydrophobicContact CB-CE2 4.43Å; I327-F332 HydrophobicContact CG2-CD2 3.51Å; I327-F332 HydrophobicContact CG2-CE2 3.03Å; I327-F332 HydrophobicContact CG2-CZ 3.68Å; I327-F332 WeakPolarHBondContact O-CD2 3.25Å; I327-L558 HydrophobicContact CD1-CD2 3.85Å; I327-L558 HydrophobicContact CD1-CG 4.25Å; I327-L558 HydrophobicContact CG1-CD2 4.24Å; I327-Y562 HydrophobicContact CD1-CD2 3.9Å; I327-Y562 HydrophobicContact CG2-CD2 3.92Å; I327-Y562 HydrophobicContact CG2-CE2 3.64Å
328	T	64.8	Low	70.6	Confident	86 Å²	86	77.4 Å²	77.4	53%	0.528	39%	0.394	S	S	.	.	S	Bend	trans	-75	1.6	-176.7	53.6	0	0	0	0	115.7	L324 R325	L324-T328 HydrophobicContact CD2-CG2 3.96Å; L324-T328 VanDerWaalsContact O-CG2 3.29Å; L324-T328 WeakPolarHBondContact O-CG2 3.4Å; L324-T328 PolarHBondContact O-N 2.9Å; L324-T328 PolarHBondContact O-OG1 2.93Å; R325-T328 WeakPolarHBondContact CA-OG1 3.39Å; R325-T328 PolarHBondContact O-N 3.03Å; R325-T328 PolarHBondContact O-OG1 2.94Å
329	E	66.9	Low	72.2	Confident	113 Å²	113	68.9 Å²	68.9	53%	0.528	35%	0.354	S	S	.	.	S	Bend	trans	-58.3	154.3	174.1	-69.9	-176.3	172.5	0	0	112.7	I327 G331 F332 K335	I327-E329 PolarHBondContact O-N 3.5Å; E329-G331 PolarHBondContact O-N 3.05Å; E329-F332 PolarHBondContact O-N 3.4Å; E329-K335 IonicContact OE2-NZ 2.79Å; E329-K335 PolarHBondContact OE2-NZ 3.48Å; E329-K335 VanDerWaalsContact OE2-NZ 3.15Å
330	E	60.5	Low	73.6	Confident	190 Å²	190	67.8 Å²	67.8	89%	0.888	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	136.9	-178.1	-62.6	-178	178	0	0	112.3
331	G	67.9	Low	74.8	Confident	46 Å²	46	64.2 Å²	64.2	47%	0.474	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	16.8	-177	0	0	0	0	0	115.5	E329 Y333 E334 K335	E329-G331 PolarHBondContact O-N 3.05Å; G331-Y333 PolarHBondContact O-N 3.15Å; G331-E334 PolarHBondContact O-N 2.87Å; G331-E334 VanDerWaalsContact O-N 3.13Å; G331-K335 PolarHBondContact O-N 2.69Å
332	F	79.1	Confident	75.7	Confident	29 Å²	29	59.7 Å²	59.7	13%	0.127	30%	0.304	C	S	.	.	H	α-helix	trans	-49.5	-45.6	-178	171.8	-114.8	0	0	0	115.5	I327 E329 E334 K335 L336 Y562	I327-F332 HydrophobicContact CB-CE2 4.43Å; I327-F332 HydrophobicContact CG2-CD2 3.51Å; I327-F332 HydrophobicContact CG2-CE2 3.03Å; I327-F332 HydrophobicContact CG2-CZ 3.68Å; I327-F332 WeakPolarHBondContact O-CD2 3.25Å; E329-F332 PolarHBondContact O-N 3.4Å; F332-E334 VanDerWaalsContact C-N 3.27Å; F332-E334 PolarHBondContact O-N 2.93Å; F332-K335 PolarHBondContact O-N 3.09Å; F332-L336 HydrophobicContact CD2-CD1 4.46Å; F332-L336 HydrophobicContact CD2-CG 4.08Å; F332-L336 HydrophobicContact CE1-CD1 3.6Å; F332-L336 HydrophobicContact CE1-CG 4.25Å; F332-L336 HydrophobicContact CE2-CD1 3.48Å; F332-L336 VanDerWaalsContact CE2-CD1 3.48Å; F332-L336 HydrophobicContact CE2-CD2 3.84Å; F332-L336 HydrophobicContact CE2-CG 3.29Å; F332-L336 HydrophobicContact CZ-CD1 3Å; F332-L336 HydrophobicContact CZ-CD2 4.14Å; F332-L336 HydrophobicContact CZ-CG 3.44Å; F332-L336 VanDerWaalsContact CZ-CG 3.44Å; F332-L336 PolarHBondContact O-N 2.67Å; F332-Y562 AromaticContact CE1-CE1 3.68Å; F332-Y562 HydrophobicContact CE1-CE1 3.68Å; F332-Y562 AromaticContact CE1-CZ 3.66Å; F332-Y562 VanDerWaalsContact CE1-OH 3.24Å; F332-Y562 WeakPolarHBondContact CE1-OH 3.39Å; F332-Y562 HydrophobicContact CE2-CE1 4.26Å; F332-Y562 AromaticContact CZ-CD1 3.88Å; F332-Y562 HydrophobicContact CZ-CD1 3.88Å; F332-Y562 AromaticContact CZ-CE1 3.17Å; F332-Y562 HydrophobicContact CZ-CE1 3.17Å; F332-Y562 HydrophobicContact CZ-CE2 4.11Å; F332-Y562 AromaticContact CZ-CZ 3.27Å; F332-Y562 WeakPolarHBondContact CZ-OH 3.4Å
333	Y	83.6	Confident	76.5	Confident	49 Å²	49	57.8 Å²	57.8	19%	0.192	30%	0.295	C	S	.	.	H	α-helix	trans	-59.8	-39.1	-178.8	178.8	-119.2	0	0	0	112.4	G331 A337 K352 L355 L616 L619 E632	G331-Y333 PolarHBondContact O-N 3.15Å; Y333-A337 WeakPolarHBondContact O-CB 3.46Å; Y333-A337 PolarHBondContact O-N 2.8Å; Y333-A337 VanDerWaalsContact O-N 3.08Å; Y333-K352 HydrophobicContact CD1-CD 4.46Å; Y333-K352 HydrophobicContact CE1-CB 4.4Å; Y333-K352 HydrophobicContact CE1-CD 3.61Å; Y333-K352 HydrophobicContact CE1-CG 3.76Å; Y333-K352 WeakPolarHBondContact OH-CB 3.39Å; Y333-L355 HydrophobicContact CD2-CD2 4.1Å; Y333-L355 HydrophobicContact CE2-CD2 4.11Å; Y333-L616 HydrophobicContact CD2-CD2 4.4Å; Y333-L616 HydrophobicContact CE2-CD2 3.77Å; Y333-L619 HydrophobicContact CD2-CD1 4.12Å; Y333-L619 HydrophobicContact CE2-CD1 4.01Å; Y333-E632 HydrophobicContact CE1-CG 4.32Å
334	E	83.9	Confident	77.4	Confident	114 Å²	114	56.3 Å²	56.3	53%	0.533	29%	0.289	S	S	.	.	H	α-helix	trans	-76.7	-39.4	178.7	-166.9	170.5	175.6	0	0	111.6	G331 F332 L336 A337 G338	G331-E334 PolarHBondContact O-N 2.87Å; G331-E334 VanDerWaalsContact O-N 3.13Å; F332-E334 VanDerWaalsContact C-N 3.27Å; F332-E334 PolarHBondContact O-N 2.93Å; E334-L336 PolarHBondContact O-N 3.38Å; E334-A337 PolarHBondContact O-N 2.8Å; E334-G338 PolarHBondContact O-N 3.28Å
335	K	83.5	Confident	78.2	Confident	62 Å²	62	58.8 Å²	58.8	27%	0.27	30%	0.295	S	S	.	.	H	α-helix	trans	-58.3	-44.8	173.3	-70.9	179.3	179.9	176	0	111.8	E329 G331 F332 S339 F551	E329-K335 IonicContact OE2-NZ 2.79Å; E329-K335 PolarHBondContact OE2-NZ 3.48Å; E329-K335 VanDerWaalsContact OE2-NZ 3.15Å; G331-K335 PolarHBondContact O-N 2.69Å; F332-K335 PolarHBondContact O-N 3.09Å; K335-S339 WeakPolarHBondContact O-CB 3.29Å; K335-S339 PolarHBondContact O-N 3.1Å; K335-S339 PolarHBondContact O-OG 3.06Å; K335-F551 HydrophobicContact CG-CB 4.46Å
336	L	84.8	Confident	78.8	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-46.6	175	-82.2	-171.7	0	0	0	112.4	F332 E334 G338 S339 I340 L355 I554 M559 Y562 L619	F332-L336 HydrophobicContact CD2-CD1 4.46Å; F332-L336 HydrophobicContact CD2-CG 4.08Å; F332-L336 HydrophobicContact CE1-CD1 3.6Å; F332-L336 HydrophobicContact CE1-CG 4.25Å; F332-L336 HydrophobicContact CE2-CD1 3.48Å; F332-L336 VanDerWaalsContact CE2-CD1 3.48Å; F332-L336 HydrophobicContact CE2-CD2 3.84Å; F332-L336 HydrophobicContact CE2-CG 3.29Å; F332-L336 HydrophobicContact CZ-CD1 3Å; F332-L336 HydrophobicContact CZ-CD2 4.14Å; F332-L336 HydrophobicContact CZ-CG 3.44Å; F332-L336 VanDerWaalsContact CZ-CG 3.44Å; F332-L336 PolarHBondContact O-N 2.67Å; E334-L336 PolarHBondContact O-N 3.38Å; L336-G338 VanDerWaalsContact C-N 3.29Å; L336-G338 PolarHBondContact O-N 3.15Å; L336-S339 PolarHBondContact O-N 3.34Å; L336-S339 VanDerWaalsContact O-N 3.11Å; L336-I340 PolarHBondContact O-N 2.95Å; L336-L355 HydrophobicContact CB-CD1 4.37Å; L336-L355 HydrophobicContact CB-CD2 3.71Å; L336-L355 HydrophobicContact CD1-CD1 4.05Å; L336-L355 HydrophobicContact CD1-CD2 3.91Å; L336-I554 HydrophobicContact CD2-CD1 3.72Å; L336-M559 HydrophobicContact CD2-CE 4.28Å; L336-M559 HydrophobicContact CD2-CG 4.33Å; L336-Y562 HydrophobicContact CD1-CD1 4.36Å; L336-Y562 HydrophobicContact CD1-CE1 4.29Å; L336-L619 HydrophobicContact CD1-CD2 4.11Å
337	A	86.4	Confident	79.7	Confident	4 Å²	4	52 Å²	52	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-40.5	-179.6	0	0	0	0	0	111.4	Y333 E334 S339 I340 K351 K352	Y333-A337 WeakPolarHBondContact O-CB 3.46Å; Y333-A337 PolarHBondContact O-N 2.8Å; Y333-A337 VanDerWaalsContact O-N 3.08Å; E334-A337 PolarHBondContact O-N 2.8Å; A337-S339 VanDerWaalsContact C-N 3.31Å; A337-S339 PolarHBondContact O-N 3.09Å; A337-I340 PolarHBondContact O-N 2.97Å; A337-K351 WeakPolarHBondContact O-CB 3.31Å; A337-K351 WeakPolarHBondContact O-CD 2.78Å; A337-K352 HydrophobicContact CB-CG 3.58Å
338	G	82.8	Confident	80.6	Confident	19 Å²	19	57.1 Å²	57.1	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-68.8	-26.4	175	0	0	0	0	0	113.8	E334 L336 I340 F551	E334-G338 PolarHBondContact O-N 3.28Å; L336-G338 VanDerWaalsContact C-N 3.29Å; L336-G338 PolarHBondContact O-N 3.15Å; G338-I340 VanDerWaalsContact C-N 3.33Å; G338-F551 VanDerWaalsContact C-CZ 3.43Å; G338-F551 VanDerWaalsContact CA-CZ 3.47Å
339	S	86	Confident	81.9	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.014	28%	0.278	C	S	.	.	H	α-helix	trans	-77.3	-16.6	175.5	-59.9	0	0	0	0	113.3	K335 L336 A337 A341 I554	K335-S339 WeakPolarHBondContact O-CB 3.29Å; K335-S339 PolarHBondContact O-N 3.1Å; K335-S339 PolarHBondContact O-OG 3.06Å; L336-S339 PolarHBondContact O-N 3.34Å; L336-S339 VanDerWaalsContact O-N 3.11Å; A337-S339 VanDerWaalsContact C-N 3.31Å; A337-S339 PolarHBondContact O-N 3.09Å; S339-A341 PolarHBondContact O-N 3.38Å; S339-I554 PolarHBondContact OG-N 2.98Å; S339-I554 VanDerWaalsContact OG-N 3.14Å
340	I	87.6	Confident	83	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	26%	0.255	C	S	.	.	S	Bend	trans	-75.3	123.5	173.7	-65.6	174.8	0	0	0	109.7	L336 A337 G338 K351 L355 L358 Y393 M559	L336-I340 PolarHBondContact O-N 2.95Å; A337-I340 PolarHBondContact O-N 2.97Å; G338-I340 VanDerWaalsContact C-N 3.33Å; I340-K351 VanDerWaalsContact O-CD 3.31Å; I340-K351 WeakPolarHBondContact O-CD 3.23Å; I340-K351 WeakPolarHBondContact O-CE 3.31Å; I340-K351 PolarHBondContact O-NZ 3.2Å; I340-L355 HydrophobicContact CD1-CB 3.68Å; I340-L355 HydrophobicContact CD1-CD1 3.94Å; I340-L355 HydrophobicContact CD1-CG 4.36Å; I340-L358 HydrophobicContact CD1-CD1 4.34Å; I340-Y393 HydrophobicContact CG2-CD1 4.17Å; I340-Y393 HydrophobicContact CG2-CE1 4.12Å; I340-M559 HydrophobicContact CD1-CE 3.72Å; I340-M559 HydrophobicContact CG1-CE 3.35Å; I340-M559 HydrophobicContact CG1-SD 4.27Å
341	A	84.4	Confident	84.5	Confident	3 Å²	3	41.1 Å²	41.1	3%	0.025	22%	0.215	C	C	.	.	S	Bend	trans	44.5	63.2	177.4	0	0	0	0	0	112	S339 E343 I344 K351 L390 Y393	S339-A341 PolarHBondContact O-N 3.38Å; A341-E343 PolarHBondContact O-N 2.8Å; A341-I344 HydrophobicContact CB-CD1 4.37Å; A341-I344 PolarHBondContact O-N 3.02Å; A341-I344 VanDerWaalsContact O-N 3.11Å; A341-K351 PolarHBondContact O-NZ 3.41Å; A341-L390 HydrophobicContact CB-CD2 3.97Å; A341-Y393 HydrophobicContact CB-CD1 3.85Å; A341-Y393 HydrophobicContact CB-CD2 4.19Å; A341-Y393 HydrophobicContact CB-CE1 4.24Å; A341-Y393 HydrophobicContact CB-CG 3.82Å
342	P	83.1	Confident	85.6	Confident	21 Å²	21	40 Å²	40	14%	0.136	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-12	-173	33.9	-37.9	0	0	0	112.9	I344 H536	P342-I344 PolarHBondContact O-N 3.27Å; P342-H536 PolarHBondContact O-CE1 3.43Å
343	E	83.4	Confident	86.2	Confident	113 Å²	113	38.7 Å²	38.7	53%	0.528	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.9	169.4	-62.4	171.2	-173.2	0	0	112.4	A341 H536	A341-E343 PolarHBondContact O-N 2.8Å; E343-H536 PolarHBondContact O-CE1 3.43Å; E343-H536 PolarHBondContact O-ND1 2.96Å
344	I	86.2	Confident	86.7	Confident	30 Å²	30	36.4 Å²	36.4	15%	0.154	18%	0.183	C	C	.	.	S	Bend	trans	-98.7	117.7	179.5	-58.7	172.1	0	0	0	108.5	A341 P342 K351 A386 Q389 L390	A341-I344 HydrophobicContact CB-CD1 4.37Å; A341-I344 PolarHBondContact O-N 3.02Å; A341-I344 VanDerWaalsContact O-N 3.11Å; P342-I344 PolarHBondContact O-N 3.27Å; I344-K351 PolarHBondContact O-NZ 2.76Å; I344-A386 HydrophobicContact CD1-CB 3.84Å; I344-A386 HydrophobicContact CG1-CB 4.31Å; I344-A386 HydrophobicContact CG2-CB 4.49Å; I344-Q389 HydrophobicContact CD1-CB 3.98Å; I344-L390 HydrophobicContact CD1-CD2 3.77Å; I344-L390 HydrophobicContact CD1-CG 3.92Å
345	Y	84.4	Confident	87.1	Confident	100 Å²	100	31 Å²	31	39%	0.392	16%	0.158	S	C	.	.			trans	-77.2	141.8	174.2	180	-104.6	0	0	0	111.5	R532 H536	Y345-R532 HydrophobicContact CE1-CB 3.84Å; Y345-H536 AromaticContact CD2-CD2 3.87Å; Y345-H536 HydrophobicContact CG-CB 4.29Å
346	G	82.8	Confident	87.5	Confident	28 Å²	28	28 Å²	28	29%	0.289	15%	0.145	S	C	.	.	S	Bend	trans	83.4	-160.6	178.1	0	0	0	0	0	114.7	E348 K351	G346-E348 VanDerWaalsContact C-N 3.34Å; G346-E348 PolarHBondContact O-N 3.13Å; G346-K351 WeakPolarHBondContact O-CE 3.48Å
347	H	84.1	Confident	87.9	Confident	69 Å²	69	28 Å²	28	32%	0.319	15%	0.145	S	C	.	.			trans	50.5	43.7	-179.5	-58.9	-50.5	0	0	0	115.1	D349 V350 K351 I521	H347-D349 VanDerWaalsContact C-N 3.34Å; H347-D349 PolarHBondContact O-N 3.32Å; H347-V350 HydrophobicContact CB-CB 4.08Å; H347-V350 HydrophobicContact CB-CG2 4.13Å; H347-V350 PolarHBondContact O-N 3.08Å; H347-V350 VanDerWaalsContact O-N 3.15Å; H347-K351 WeakPolarHBondContact O-CG 3.42Å; H347-K351 PolarHBondContact O-N 2.94Å; H347-I521 WeakPolarHBondContact CE1-CG2 3.29Å
348	E	87.2	Confident	88.1	Confident	118 Å²	118	28 Å²	28	55%	0.551	14%	0.144	S	C	*	.	H	α-helix	trans	-58.9	-42.4	-177.9	-64	-179.1	178.1	0	0	112.8	G346 V350 K351 K352	G346-E348 VanDerWaalsContact C-N 3.34Å; G346-E348 PolarHBondContact O-N 3.13Å; E348-V350 VanDerWaalsContact C-N 3.33Å; E348-V350 PolarHBondContact O-N 3.28Å; E348-K351 PolarHBondContact O-N 3.44Å; E348-K352 WeakPolarHBondContact O-CB 3.48Å; E348-K352 WeakPolarHBondContact O-CG 3.47Å; E348-K352 PolarHBondContact O-N 2.83Å
349	D	90.5	Very high	88.4	Confident	32 Å²	32	27.1 Å²	27.1	17%	0.171	14%	0.135	C	C	.	.	H	α-helix	trans	-67.1	-33.5	178.5	-66	-46.1	0	0	0	112.6	H347 K352 A353 W519 R635 L636 M639	H347-D349 VanDerWaalsContact C-N 3.34Å; H347-D349 PolarHBondContact O-N 3.32Å; D349-K352 WeakPolarHBondContact O-CB 3.33Å; D349-A353 PolarHBondContact O-N 3.25Å; D349-W519 HydrophobicContact CB-CH2 3.83Å; D349-W519 HydrophobicContact CB-CZ2 4.31Å; D349-W519 HydrophobicContact CB-CZ3 4.47Å; D349-R635 IonicContact OD1-CZ 2.95Å; D349-R635 IonicContact OD1-NH1 2.74Å; D349-R635 PolarHBondContact OD1-NH1 3.14Å; D349-R635 IonicContact OD1-NH2 3.67Å; D349-R635 PolarHBondContact OD1-NH2 3.42Å; D349-R635 IonicContact OD2-NH1 3.95Å; D349-L636 HydrophobicContact CB-CD2 4.39Å; D349-M639 WeakPolarHBondContact OD2-CE 3.44Å
350	V	91.1	Very high	88.4	Confident	8 Å²	8	27.4 Å²	27.4	5%	0.048	14%	0.139	C	C	.	.	H	α-helix	trans	-68.3	-44.8	174.3	-176.9	0	0	0	0	109.6	H347 E348 K352 A353 L354 L379 W519 I521	H347-V350 HydrophobicContact CB-CB 4.08Å; H347-V350 HydrophobicContact CB-CG2 4.13Å; H347-V350 PolarHBondContact O-N 3.08Å; H347-V350 VanDerWaalsContact O-N 3.15Å; E348-V350 VanDerWaalsContact C-N 3.33Å; E348-V350 PolarHBondContact O-N 3.28Å; V350-K352 VanDerWaalsContact C-N 3.32Å; V350-K352 PolarHBondContact O-N 3.03Å; V350-A353 WeakPolarHBondContact O-CB 3.48Å; V350-A353 PolarHBondContact O-N 3.47Å; V350-A353 VanDerWaalsContact O-N 3.14Å; V350-L354 HydrophobicContact CG1-CD1 3.98Å; V350-L354 HydrophobicContact CG1-CG 4.32Å; V350-L354 VanDerWaalsContact O-CG 3.24Å; V350-L354 WeakPolarHBondContact O-CG 3.38Å; V350-L354 PolarHBondContact O-N 3.11Å; V350-L379 HydrophobicContact CG1-CD2 3.71Å; V350-W519 HydrophobicContact CG2-CD2 4.19Å; V350-W519 HydrophobicContact CG2-CE3 4.36Å; V350-W519 HydrophobicContact CG2-CG 4.32Å; V350-I521 HydrophobicContact CG2-CD1 4.32Å
351	K	91.6	Very high	88.2	Confident	13 Å²	13	27.5 Å²	27.5	6%	0.057	14%	0.14	C	C	.	.	H	α-helix	trans	-61.2	-40.5	176.7	-67.3	178.4	-178.5	-162.1	0	112	A337 I340 A341 I344 G346 H347 E348 L354 L355	A337-K351 WeakPolarHBondContact O-CB 3.31Å; A337-K351 WeakPolarHBondContact O-CD 2.78Å; I340-K351 VanDerWaalsContact O-CD 3.31Å; I340-K351 WeakPolarHBondContact O-CD 3.23Å; I340-K351 WeakPolarHBondContact O-CE 3.31Å; I340-K351 PolarHBondContact O-NZ 3.2Å; A341-K351 PolarHBondContact O-NZ 3.41Å; I344-K351 PolarHBondContact O-NZ 2.76Å; G346-K351 WeakPolarHBondContact O-CE 3.48Å; H347-K351 WeakPolarHBondContact O-CG 3.42Å; H347-K351 PolarHBondContact O-N 2.94Å; E348-K351 PolarHBondContact O-N 3.44Å; K351-L354 PolarHBondContact O-N 3.49Å; K351-L355 PolarHBondContact O-N 2.81Å
352	K	91.4	Very high	88.3	Confident	24 Å²	24	28.2 Å²	28.2	10%	0.104	14%	0.143	C	C	.	.	H	α-helix	trans	-57.5	-45.7	171.4	-81.1	175.8	179.7	175	0	112.2	Y333 A337 E348 D349 V350 L355 L356 L636	Y333-K352 HydrophobicContact CD1-CD 4.46Å; Y333-K352 HydrophobicContact CE1-CB 4.4Å; Y333-K352 HydrophobicContact CE1-CD 3.61Å; Y333-K352 HydrophobicContact CE1-CG 3.76Å; Y333-K352 WeakPolarHBondContact OH-CB 3.39Å; A337-K352 HydrophobicContact CB-CG 3.58Å; E348-K352 WeakPolarHBondContact O-CB 3.48Å; E348-K352 WeakPolarHBondContact O-CG 3.47Å; E348-K352 PolarHBondContact O-N 2.83Å; D349-K352 WeakPolarHBondContact O-CB 3.33Å; V350-K352 VanDerWaalsContact C-N 3.32Å; V350-K352 PolarHBondContact O-N 3.03Å; K352-L355 WeakPolarHBondContact O-CB 3.08Å; K352-L355 PolarHBondContact O-N 3.42Å; K352-L356 WeakPolarHBondContact O-CG 3.43Å; K352-L356 PolarHBondContact O-N 2.94Å; K352-L636 HydrophobicContact CB-CD2 4.33Å
353	A	92.1	Very high	88.3	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-39.7	176.2	0	0	0	0	0	112.5	D349 V350 L355 L356 L357 I377 L517 W519	D349-A353 PolarHBondContact O-N 3.25Å; V350-A353 WeakPolarHBondContact O-CB 3.48Å; V350-A353 PolarHBondContact O-N 3.47Å; V350-A353 VanDerWaalsContact O-N 3.14Å; A353-L355 VanDerWaalsContact C-N 3.3Å; A353-L355 PolarHBondContact O-N 3.24Å; A353-L356 WeakPolarHBondContact O-CB 3.47Å; A353-L356 PolarHBondContact O-N 3.21Å; A353-L357 PolarHBondContact O-N 3.47Å; A353-I377 HydrophobicContact CB-CD1 4.05Å; A353-I377 VanDerWaalsContact O-CD1 3.27Å; A353-I377 WeakPolarHBondContact O-CD1 3.32Å; A353-L517 HydrophobicContact CB-CD1 3.85Å; A353-W519 HydrophobicContact CB-CZ2 4.35Å
354	L	92.8	Very high	88.1	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-65.7	-32.7	176.4	-67.6	171.3	0	0	0	112.3	V350 K351 L357 L358 L390 I394 L485	V350-L354 HydrophobicContact CG1-CD1 3.98Å; V350-L354 HydrophobicContact CG1-CG 4.32Å; V350-L354 VanDerWaalsContact O-CG 3.24Å; V350-L354 WeakPolarHBondContact O-CG 3.38Å; V350-L354 PolarHBondContact O-N 3.11Å; K351-L354 PolarHBondContact O-N 3.49Å; L354-L357 HydrophobicContact CD2-CD2 4.3Å; L354-L357 WeakPolarHBondContact O-CB 3.29Å; L354-L357 PolarHBondContact O-N 3.39Å; L354-L358 WeakPolarHBondContact O-CG 3.46Å; L354-L358 PolarHBondContact O-N 2.9Å; L354-L358 VanDerWaalsContact O-N 3.08Å; L354-L390 HydrophobicContact CD1-CB 4.45Å; L354-L390 HydrophobicContact CD1-CD1 4.47Å; L354-L390 HydrophobicContact CD1-CD2 4.32Å; L354-I394 HydrophobicContact CB-CD1 3.87Å; L354-I394 HydrophobicContact CD1-CD1 3.74Å; L354-I394 HydrophobicContact CD2-CD1 3.43Å; L354-I394 VanDerWaalsContact CD2-CD1 3.43Å; L354-I394 HydrophobicContact CG-CD1 3.8Å; L354-L485 HydrophobicContact CD2-CD1 3.68Å; L354-L485 HydrophobicContact CD2-CD2 4.04Å
355	L	91.9	Very high	87.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-43.3	171.3	-177.1	64.3	0	0	0	111.5	Y333 L336 I340 K351 K352 A353 L357 L358 V359 M559 L619	Y333-L355 HydrophobicContact CD2-CD2 4.1Å; Y333-L355 HydrophobicContact CE2-CD2 4.11Å; L336-L355 HydrophobicContact CB-CD1 4.37Å; L336-L355 HydrophobicContact CB-CD2 3.71Å; L336-L355 HydrophobicContact CD1-CD1 4.05Å; L336-L355 HydrophobicContact CD1-CD2 3.91Å; I340-L355 HydrophobicContact CD1-CB 3.68Å; I340-L355 HydrophobicContact CD1-CD1 3.94Å; I340-L355 HydrophobicContact CD1-CG 4.36Å; K351-L355 PolarHBondContact O-N 2.81Å; K352-L355 WeakPolarHBondContact O-CB 3.08Å; K352-L355 PolarHBondContact O-N 3.42Å; A353-L355 VanDerWaalsContact C-N 3.3Å; A353-L355 PolarHBondContact O-N 3.24Å; L355-L357 VanDerWaalsContact C-N 3.3Å; L355-L357 PolarHBondContact O-N 3.31Å; L355-L358 WeakPolarHBondContact O-CB 3.39Å; L355-L358 PolarHBondContact O-N 2.91Å; L355-L358 VanDerWaalsContact O-N 3.15Å; L355-V359 WeakPolarHBondContact O-CG2 3.22Å; L355-V359 PolarHBondContact O-N 3.15Å; L355-M559 HydrophobicContact CD1-CE 3.71Å; L355-L619 HydrophobicContact CD1-CD2 4.33Å; L355-L619 HydrophobicContact CD2-CD1 3.88Å; L355-L619 HydrophobicContact CD2-CD2 4.17Å; L355-L619 HydrophobicContact CG-CD1 4Å; L355-L619 HydrophobicContact CG-CD2 4.13Å
356	L	92.1	Very high	87.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-36.9	176.6	-64.8	174	0	0	0	112	K352 A353 L358 V359 G360 I375 L612 A615 L616 L619 L636	K352-L356 WeakPolarHBondContact O-CG 3.43Å; K352-L356 PolarHBondContact O-N 2.94Å; A353-L356 WeakPolarHBondContact O-CB 3.47Å; A353-L356 PolarHBondContact O-N 3.21Å; L356-L358 VanDerWaalsContact C-N 3.34Å; L356-L358 PolarHBondContact O-N 2.84Å; L356-V359 PolarHBondContact O-N 2.8Å; L356-G360 PolarHBondContact O-N 2.98Å; L356-I375 HydrophobicContact CB-CD1 4.25Å; L356-L612 HydrophobicContact CB-CD2 4.35Å; L356-L612 HydrophobicContact CD1-CD2 3.79Å; L356-A615 HydrophobicContact CB-CB 4.49Å; L356-A615 HydrophobicContact CD2-CB 3.97Å; L356-L616 HydrophobicContact CD1-CD2 4.35Å; L356-L616 HydrophobicContact CD1-CG 4.29Å; L356-L616 HydrophobicContact CD2-CB 4.47Å; L356-L616 HydrophobicContact CD2-CD2 3.65Å; L356-L616 HydrophobicContact CD2-CG 3.65Å; L356-L619 HydrophobicContact CD2-CD1 3.62Å; L356-L636 HydrophobicContact CD1-CD1 3.59Å
357	L	93	Very high	86.6	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-42.5	172.1	174.4	71.4	0	0	0	112.1	A353 L354 L355 V359 I375 I377 I441 L485	A353-L357 PolarHBondContact O-N 3.47Å; L354-L357 HydrophobicContact CD2-CD2 4.3Å; L354-L357 WeakPolarHBondContact O-CB 3.29Å; L354-L357 PolarHBondContact O-N 3.39Å; L355-L357 VanDerWaalsContact C-N 3.3Å; L355-L357 PolarHBondContact O-N 3.31Å; L357-V359 VanDerWaalsContact C-N 3.34Å; L357-V359 PolarHBondContact O-N 2.82Å; L357-I375 HydrophobicContact CD1-CB 4.47Å; L357-I375 WeakPolarHBondContact CD1-O 3.41Å; L357-I377 HydrophobicContact CB-CD1 3.79Å; L357-I377 HydrophobicContact CB-CG1 4.48Å; L357-I377 HydrophobicContact CD2-CD1 4.44Å; L357-I441 HydrophobicContact CD2-CD1 4.38Å; L357-I441 HydrophobicContact CD2-CG2 4.38Å; L357-I441 HydrophobicContact CG-CD1 4.16Å; L357-L485 HydrophobicContact CD2-CB 3.87Å; L357-L485 HydrophobicContact CD2-CD1 3.98Å; L357-L485 HydrophobicContact CD2-CD2 4.07Å; L357-L485 HydrophobicContact CD2-CG 4.18Å
358	L	90.6	Very high	86.3	Confident	3 Å²	3	40 Å²	40	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-37.8	-179.6	-78.1	161.7	0	0	0	112.7	I340 L354 L355 L356 I394 L397 A398 I441 I563 K567	I340-L358 HydrophobicContact CD1-CD1 4.34Å; L354-L358 WeakPolarHBondContact O-CG 3.46Å; L354-L358 PolarHBondContact O-N 2.9Å; L354-L358 VanDerWaalsContact O-N 3.08Å; L355-L358 WeakPolarHBondContact O-CB 3.39Å; L355-L358 PolarHBondContact O-N 2.91Å; L355-L358 VanDerWaalsContact O-N 3.15Å; L356-L358 VanDerWaalsContact C-N 3.34Å; L356-L358 PolarHBondContact O-N 2.84Å; L358-I394 HydrophobicContact CD2-CG2 4.29Å; L358-L397 HydrophobicContact CD1-CD2 3.55Å; L358-L397 HydrophobicContact CD1-CG 4.33Å; L358-A398 HydrophobicContact CD2-CB 4.04Å; L358-I441 HydrophobicContact CD2-CD1 3.62Å; L358-I441 HydrophobicContact CG-CD1 4.22Å; L358-I563 HydrophobicContact CB-CD1 4.16Å; L358-I563 HydrophobicContact CB-CG2 4.38Å; L358-I563 HydrophobicContact CD1-CD1 4.21Å; L358-K567 WeakPolarHBondContact O-CE 3.49Å; L358-K567 PolarHBondContact O-NZ 3.25Å
359	V	89.1	Confident	86	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-78.4	-44.4	179.7	178.1	0	0	0	0	110.9	L355 L356 L357 I563 C566 K567 R618 L619	L355-V359 WeakPolarHBondContact O-CG2 3.22Å; L355-V359 PolarHBondContact O-N 3.15Å; L356-V359 PolarHBondContact O-N 2.8Å; L357-V359 VanDerWaalsContact C-N 3.34Å; L357-V359 PolarHBondContact O-N 2.82Å; V359-I563 HydrophobicContact CG2-CG2 4.49Å; V359-C566 HydrophobicContact CG1-CB 4.04Å; V359-K567 VanDerWaalsContact O-CE 3.31Å; V359-K567 WeakPolarHBondContact O-CE 3.39Å; V359-K567 VanDerWaalsContact O-CG 3.29Å; V359-K567 WeakPolarHBondContact O-CG 3.42Å; V359-R618 HydrophobicContact CG1-CB 3.66Å; V359-L619 HydrophobicContact CB-CG 4.48Å; V359-L619 HydrophobicContact CG1-CG 4.45Å; V359-L619 HydrophobicContact CG2-CD1 4.34Å; V359-L619 HydrophobicContact CG2-CD2 3.38Å; V359-L619 HydrophobicContact CG2-CG 3.7Å
360	G	86.6	Confident	85.5	Confident	8 Å²	8	48.1 Å²	48.1	8%	0.082	26%	0.263	C	S	.	.			trans	73.2	157	-176.6	0	0	0	0	0	113.4	L356 R618	L356-G360 PolarHBondContact O-N 2.98Å; G360-R618 WeakPolarHBondContact O-CD 3.01Å; G360-R618 PolarHBondContact O-NH1 3.49Å
361	G	84.1	Confident	85.2	Confident	3 Å²	3	50.3 Å²	50.3	3%	0.031	27%	0.273	C	S	.	.			trans	-87.9	175.6	176.6	0	0	0	0	0	113.2	G373 R618	G361-G373 CarbonylContact C-O 3.57Å; G361-G373 WeakPolarHBondContact CA-O 3.49Å; G361-G373 PolarHBondContact N-O 2.87Å; G361-R618 PolarHBondContact O-NH1 3.22Å
362	V	86.1	Confident	85.1	Confident	17 Å²	17	50.7 Å²	50.7	10%	0.103	28%	0.275	C	S	.	.			trans	-77.6	131.4	-178.2	-179.4	0	0	0	0	110.9	Q364 G373 P571 T614	V362-Q364 HydrophobicContact CG1-CG 4.28Å; V362-G373 VanDerWaalsContact O-CA 3.3Å; V362-G373 WeakPolarHBondContact O-CA 3.22Å; V362-P571 HydrophobicContact CG2-CG 3.93Å; V362-T614 PolarHBondContact N-OG1 2.91Å
363	E	82.9	Confident	84.8	Confident	87 Å²	87	49.6 Å²	49.6	41%	0.407	27%	0.27	S	S	.	.			trans	-78.4	128.9	168.1	-64.5	-170.3	161.9	0	0	109.2
364	Q	78.6	Confident	84.7	Confident	92 Å²	92	50.5 Å²	50.5	43%	0.43	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-121.1	142.6	178.1	-64.1	-173.5	1.3	0	0	110.4	V362 P366 I371	V362-Q364 HydrophobicContact CG1-CG 4.28Å; Q364-P366 VanDerWaalsContact C-CD 3.43Å; Q364-I371 PolarHBondContact N-O 2.74Å; Q364-I371 PolarHBondContact O-N 3.07Å
365	A	77.3	Confident	84.7	Confident	70 Å²	70	50.4 Å²	50.4	58%	0.579	27%	0.274	S	S	*	.			trans	-126.8	62.1	176.1	0	0	0	0	0	112.3	K367 K370	A365-K367 PolarHBondContact O-N 3.39Å; A365-K370 HydrophobicContact CB-CG 4.43Å
366	P	72.8	Confident	84.7	Confident	68 Å²	68	50.6 Å²	50.6	44%	0.442	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-69.5	121.1	175.7	29.8	-32.5	0	0	0	109.8	Q364 G368 M369 I371	Q364-P366 VanDerWaalsContact C-CD 3.43Å; P366-G368 VanDerWaalsContact C-N 3.34Å; P366-G368 PolarHBondContact O-N 3.1Å; P366-M369 PolarHBondContact O-N 3.37Å; P366-I371 HydrophobicContact CG-CD1 4.05Å
367	K	72.8	Confident	84.8	Confident	217 Å²	217	50.6 Å²	50.6	94%	0.943	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	58.1	35.4	172.2	-54.8	-178.9	179.7	178.3	0	115.2	A365 M369	A365-K367 PolarHBondContact O-N 3.39Å; K367-M369 VanDerWaalsContact C-N 3.28Å; K367-M369 PolarHBondContact O-N 3.46Å
368	G	78.1	Confident	84.7	Confident	74 Å²	74	50.5 Å²	50.5	76%	0.763	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	82.5	-5.7	174.3	0	0	0	0	0	115.4	P366	P366-G368 VanDerWaalsContact C-N 3.34Å; P366-G368 PolarHBondContact O-N 3.1Å
369	M	81.4	Confident	84.7	Confident	142 Å²	142	50.4 Å²	50.4	70%	0.7	27%	0.274	S	S	*	.			trans	-88.2	114.4	167	-172.5	173.3	-175	0	0	108.9	P366 K367	P366-M369 PolarHBondContact O-N 3.37Å; K367-M369 VanDerWaalsContact C-N 3.28Å; K367-M369 PolarHBondContact O-N 3.46Å
370	K	80.1	Confident	84.7	Confident	180 Å²	180	50.6 Å²	50.6	78%	0.783	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-79.4	121.1	175.7	-64.9	-177.6	-178.5	-179.7	0	109.3	A365	A365-K370 HydrophobicContact CB-CG 4.43Å
371	I	85	Confident	84.7	Confident	53 Å²	53	50.2 Å²	50.2	27%	0.272	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-99.4	121.2	171.9	-58.3	175.7	0	0	0	107.3	Q364 P366 G373	Q364-I371 PolarHBondContact N-O 2.74Å; Q364-I371 PolarHBondContact O-N 3.07Å; P366-I371 HydrophobicContact CG-CD1 4.05Å; I371-G373 PolarHBondContact O-N 2.92Å
372	R	87.9	Confident	84.8	Confident	22 Å²	22	50.6 Å²	50.6	8%	0.083	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-58.9	137.5	176.6	70.9	176.7	-154.7	-164.2	3.3	110.9	N376 M462 Q465 R514 D516 R611	R372-N376 PolarHBondContact NH1-ND2 3.13Å; R372-N376 VanDerWaalsContact NH1-ND2 3.19Å; R372-N376 PolarHBondContact NH2-ND2 3.49Å; R372-M462 WeakPolarHBondContact CD-O 3.45Å; R372-M462 PolarHBondContact NH1-O 3.27Å; R372-Q465 VanDerWaalsContact CB-CD 3.5Å; R372-Q465 HydrophobicContact CB-CG 4.17Å; R372-R514 PolarHBondContact NH1-O 3.27Å; R372-R514 PolarHBondContact NH2-O 3.13Å; R372-D516 IonicContact NH2-OD1 3.49Å; R372-D516 PolarHBondContact NH2-OD1 2.81Å; R372-D516 IonicContact NH2-OD2 2.69Å; R372-D516 PolarHBondContact NH2-OD2 3.35Å; R372-R611 VanDerWaalsContact NE-NH1 3.12Å; R372-R611 PolarHBondContact O-NE 3.34Å; R372-R611 PolarHBondContact O-NH2 3.47Å
373	G	85.7	Confident	84.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.294	C	S	.	.			trans	-95.3	-14	170.9	0	0	0	0	0	113.6	G361 V362 I371	G361-G373 CarbonylContact C-O 3.57Å; G361-G373 WeakPolarHBondContact CA-O 3.49Å; G361-G373 PolarHBondContact N-O 2.87Å; V362-G373 VanDerWaalsContact O-CA 3.3Å; V362-G373 WeakPolarHBondContact O-CA 3.22Å; I371-G373 PolarHBondContact O-N 2.92Å
374	N	89.8	Confident	84.4	Confident	20 Å²	20	53.2 Å²	53.2	11%	0.107	31%	0.311	C	S	.	.			trans	-68.5	140	-178.3	-66.8	0.4	0	0	0	111.8	Q465 R481 C482 S483	N374-Q465 PolarHBondContact ND2-NE2 2.61Å; N374-Q465 VanDerWaalsContact ND2-NE2 3.11Å; N374-R481 VanDerWaalsContact ND2-C 3.3Å; N374-R481 PolarHBondContact ND2-O 3.4Å; N374-C482 VanDerWaalsContact ND2-C 3.27Å; N374-C482 PolarHBondContact ND2-O 3.24Å; N374-S483 WeakPolarHBondContact CB-OG 3.3Å
375	I	92.2	Very high	84.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	30%	0.295	C	S	.	.			trans	-97.8	134.6	176.6	-61.7	164.2	0	0	0	107.4	L356 L357 I377 S483 D516 R611 L612 A615	L356-I375 HydrophobicContact CB-CD1 4.25Å; L357-I375 HydrophobicContact CD1-CB 4.47Å; L357-I375 WeakPolarHBondContact CD1-O 3.41Å; I375-I377 HydrophobicContact CG2-CD1 4.38Å; I375-I377 HydrophobicContact CG2-CG1 3.98Å; I375-S483 WeakPolarHBondContact O-CB 3.25Å; I375-D516 HydrophobicContact CG2-CB 4.19Å; I375-R611 HydrophobicContact CG1-CB 4.33Å; I375-L612 HydrophobicContact CD1-CD2 4.01Å; I375-L612 HydrophobicContact CG2-CD2 4.4Å; I375-A615 HydrophobicContact CD1-CB 3.91Å
376	N	93.1	Very high	85.1	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	28%	0.281	C	S	.	.			trans	-113.6	130.2	172.8	-58.1	-58.1	0	0	0	110.3	R372 M462 I484 F515 D516 L517	R372-N376 PolarHBondContact NH1-ND2 3.13Å; R372-N376 VanDerWaalsContact NH1-ND2 3.19Å; R372-N376 PolarHBondContact NH2-ND2 3.49Å; N376-M462 HydrophobicContact CB-CE 3.57Å; N376-I484 WeakPolarHBondContact CA-O 3.25Å; N376-I484 PolarHBondContact OD1-N 2.84Å; N376-F515 HydrophobicContact CB-CD1 3.72Å; N376-F515 HydrophobicContact CB-CE1 4.2Å; N376-D516 PolarHBondContact N-OD2 3.26Å; N376-D516 VanDerWaalsContact N-OD2 3.07Å; N376-D516 PolarHBondContact O-N 3.15Å; N376-L517 PolarHBondContact O-N 2.99Å
377	I	92.8	Very high	85.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.6	-177.4	-57.1	-174.5	0	0	0	109.6	A353 L357 I375 L379 I484 L485 A486 L517	A353-I377 HydrophobicContact CB-CD1 4.05Å; A353-I377 VanDerWaalsContact O-CD1 3.27Å; A353-I377 WeakPolarHBondContact O-CD1 3.32Å; L357-I377 HydrophobicContact CB-CD1 3.79Å; L357-I377 HydrophobicContact CB-CG1 4.48Å; L357-I377 HydrophobicContact CD2-CD1 4.44Å; I375-I377 HydrophobicContact CG2-CD1 4.38Å; I375-I377 HydrophobicContact CG2-CG1 3.98Å; I377-L379 HydrophobicContact CG2-CD2 4.08Å; I377-I484 PolarHBondContact N-O 3.21Å; I377-I484 VanDerWaalsContact N-O 3.08Å; I377-L485 HydrophobicContact CB-CD1 3.95Å; I377-L485 HydrophobicContact CG2-CD1 4.13Å; I377-L485 WeakPolarHBondContact O-CA 3.5Å; I377-A486 PolarHBondContact O-N 2.89Å; I377-L517 WeakPolarHBondContact CA-O 3.5Å; I377-L517 HydrophobicContact CD1-CD1 4.4Å; I377-L517 HydrophobicContact CG1-CB 4.35Å
378	C	91.1	Very high	86.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.8	169.4	-170	0	0	0	0	110.5	A486 F515 L517 W519	C378-A486 CarbonylContact C-O 3.5Å; C378-A486 VanDerWaalsContact CA-O 3.31Å; C378-A486 WeakPolarHBondContact CA-O 3.13Å; C378-A486 HydrophobicContact CB-CB 4.47Å; C378-F515 HydrophobicContact CB-CD1 4.03Å; C378-F515 HydrophobicContact CB-CD2 4.02Å; C378-F515 HydrophobicContact CB-CE1 4.1Å; C378-F515 HydrophobicContact CB-CE2 4.02Å; C378-F515 HydrophobicContact CB-CG 4.01Å; C378-F515 HydrophobicContact CB-CZ 4.1Å; C378-L517 PolarHBondContact N-O 3.43Å; C378-W519 PolarHBondContact O-N 3.15Å
379	L	91.7	Very high	87.2	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	108.7	172.8	-56.6	-177.5	0	0	0	109.1	V350 I377 K387 L390 L485 A486 A487 A488 W519	V350-L379 HydrophobicContact CG1-CD2 3.71Å; I377-L379 HydrophobicContact CG2-CD2 4.08Å; L379-K387 HydrophobicContact CB-CD 4.2Å; L379-K387 HydrophobicContact CB-CG 4.31Å; L379-L390 HydrophobicContact CD1-CD1 4.37Å; L379-L485 HydrophobicContact CD1-CD1 4.47Å; L379-L485 HydrophobicContact CG-CD1 4.34Å; L379-A486 PolarHBondContact N-O 3.36Å; L379-A487 CarbonylContact O-C 3.54Å; L379-A487 VanDerWaalsContact O-CA 3.31Å; L379-A487 WeakPolarHBondContact O-CA 3.42Å; L379-A488 PolarHBondContact O-N 2.93Å; L379-W519 HydrophobicContact CD2-CB 3.92Å; L379-W519 HydrophobicContact CD2-CG 4.33Å
380	M	88.3	Confident	87.6	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.025	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.7	173.9	-64.2	-173.7	163.5	0	0	109.2	A488 I505 L507 L512 L518 W519 L520 I521	M380-A488 WeakPolarHBondContact CA-O 3.45Å; M380-A488 HydrophobicContact CE-CB 4.4Å; M380-A488 HydrophobicContact CG-CB 4.29Å; M380-I505 HydrophobicContact CE-CD1 4.06Å; M380-I505 HydrophobicContact CE-CG1 4.29Å; M380-I505 HydrophobicContact CE-CG2 3.42Å; M380-I505 VanDerWaalsContact CE-CG2 3.42Å; M380-I505 HydrophobicContact SD-CD1 3.37Å; M380-I505 WeakPolarHBondContact SD-CD1 3.49Å; M380-I505 HydrophobicContact SD-CG1 3.83Å; M380-I505 HydrophobicContact SD-CG2 4.1Å; M380-L507 HydrophobicContact CE-CD1 3.75Å; M380-L512 HydrophobicContact CE-CD2 3.96Å; M380-L518 HydrophobicContact CE-CD1 4.02Å; M380-L518 HydrophobicContact SD-CD1 3.85Å; M380-L518 HydrophobicContact SD-CD2 3.88Å; M380-L518 HydrophobicContact SD-CG 3.97Å; M380-W519 WeakPolarHBondContact CA-O 3.36Å; M380-W519 WeakPolarHBondContact CB-O 3.44Å; M380-W519 PolarHBondContact N-O 3.36Å; M380-L520 CarbonylContact O-C 3.59Å; M380-L520 WeakPolarHBondContact O-CA 3.4Å; M380-I521 PolarHBondContact O-N 3.31Å
381	G	86.7	Confident	88.2	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.3	177	174.7	0	0	0	0	0	114.1	K387 A488 P490 I521	G381-K387 PolarHBondContact O-NZ 2.85Å; G381-A488 PolarHBondContact N-O 3.38Å; G381-P490 WeakPolarHBondContact O-CD 3.27Å; G381-I521 WeakPolarHBondContact CA-O 3.37Å
382	D	85.9	Confident	88.4	Confident	10 Å²	10	23.3 Å²	23.3	5%	0.053	15%	0.154	C	C	.	.			trans	-69.9	158.5	178.6	-59.7	-28.7	0	0	0	110.9	G384 V385 K387 R494 Y495 I521 D523	D382-G384 PolarHBondContact O-N 2.87Å; D382-V385 WeakPolarHBondContact O-CG2 3.33Å; D382-K387 WeakPolarHBondContact O-CE 3.33Å; D382-R494 VanDerWaalsContact OD1-CA 3.25Å; D382-R494 WeakPolarHBondContact OD1-CA 3.37Å; D382-Y495 PolarHBondContact OD1-N 2.99Å; D382-I521 PolarHBondContact N-O 3.34Å; D382-D523 HydrophobicContact CB-CB 4.41Å; D382-D523 PolarHBondContact OD2-N 3.12Å
383	P	83.1	Confident	88.6	Confident	85 Å²	85	23.2 Å²	23.2	55%	0.552	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	133.7	169.8	27.8	-34.5	0	0	0	109.4	G493	P383-G493 WeakPolarHBondContact CD-O 3.43Å
384	G	78.7	Confident	88.8	Confident	75 Å²	75	23.2 Å²	23.2	77%	0.773	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	120.1	-18.5	178.3	0	0	0	0	0	114.8	D382 A386	D382-G384 PolarHBondContact O-N 2.87Å; G384-A386 PolarHBondContact O-N 3.25Å
385	V	84	Confident	88.8	Confident	15 Å²	15	23.6 Å²	23.6	9%	0.091	16%	0.156	C	C	.	.	S	Bend	trans	-82.5	28.3	-176.9	-61.5	0	0	0	0	114.7	D382 K387 I521 D523	D382-V385 WeakPolarHBondContact O-CG2 3.33Å; V385-K387 HydrophobicContact CG2-CD 3.86Å; V385-K387 HydrophobicContact CG2-CG 3.67Å; V385-K387 PolarHBondContact O-N 2.98Å; V385-I521 HydrophobicContact CB-CG2 3.9Å; V385-I521 HydrophobicContact CG1-CG2 3.8Å; V385-I521 HydrophobicContact CG2-CB 4.29Å; V385-I521 HydrophobicContact CG2-CG2 4.08Å; V385-D523 HydrophobicContact CG1-CB 4.22Å
386	A	85.6	Confident	88.5	Confident	35 Å²	35	29.1 Å²	29.1	29%	0.289	18%	0.177	S	C	.	.			trans	50.6	23.4	177.6	0	0	0	0	0	116.8	I344 G384 S388 Q389 L390	I344-A386 HydrophobicContact CD1-CB 3.84Å; I344-A386 HydrophobicContact CG1-CB 4.31Å; I344-A386 HydrophobicContact CG2-CB 4.49Å; G384-A386 PolarHBondContact O-N 3.25Å; A386-S388 PolarHBondContact O-N 3.05Å; A386-Q389 HydrophobicContact CB-CB 4.33Å; A386-Q389 WeakPolarHBondContact O-CA 3.23Å; A386-Q389 WeakPolarHBondContact O-CB 3.3Å; A386-Q389 PolarHBondContact O-N 3.3Å; A386-L390 PolarHBondContact O-N 2.97Å; A386-L390 VanDerWaalsContact O-N 3.12Å
387	K	88.6	Confident	88.2	Confident	11 Å²	11	29 Å²	29	5%	0.048	18%	0.176	C	C	.	.	H	α-helix	trans	-53.2	-48.5	-179	-81.5	177.7	-78.5	157.2	0	114	L379 G381 D382 V385 Q389 L390 L391 A487 A488 N489 I521	L379-K387 HydrophobicContact CB-CD 4.2Å; L379-K387 HydrophobicContact CB-CG 4.31Å; G381-K387 PolarHBondContact O-NZ 2.85Å; D382-K387 WeakPolarHBondContact O-CE 3.33Å; V385-K387 HydrophobicContact CG2-CD 3.86Å; V385-K387 HydrophobicContact CG2-CG 3.67Å; V385-K387 PolarHBondContact O-N 2.98Å; K387-Q389 PolarHBondContact O-N 3.35Å; K387-L390 WeakPolarHBondContact O-CB 3.49Å; K387-L390 PolarHBondContact O-N 3.11Å; K387-L391 PolarHBondContact O-N 3.26Å; K387-L391 VanDerWaalsContact O-N 3.12Å; K387-A487 HydrophobicContact CB-CB 4.39Å; K387-A488 PolarHBondContact NZ-O 3.45Å; K387-N489 PolarHBondContact NZ-OD1 2.86Å; K387-I521 HydrophobicContact CG-CD1 4.4Å
388	S	88.9	Confident	87.7	Confident	51 Å²	51	29.4 Å²	29.4	36%	0.357	18%	0.18	S	C	.	.	H	α-helix	trans	-65	-28.7	179.1	-47.7	0	0	0	0	112.3	A386 S392 D445	A386-S388 PolarHBondContact O-N 3.05Å; S388-S392 WeakPolarHBondContact O-CB 3.47Å; S388-S392 PolarHBondContact O-N 3.17Å; S388-D445 VanDerWaalsContact CB-OD2 3.32Å; S388-D445 WeakPolarHBondContact CB-OD2 3.41Å; S388-D445 PolarHBondContact OG-OD2 3.13Å
389	Q	89.7	Confident	86.9	Confident	111 Å²	111	34 Å²	34	52%	0.519	20%	0.204	S	C	.	.	H	α-helix	trans	-70.9	-39.3	174.5	-64.6	-65.4	-6.1	0	0	111.7	I344 A386 K387 S392 Y393	I344-Q389 HydrophobicContact CD1-CB 3.98Å; A386-Q389 HydrophobicContact CB-CB 4.33Å; A386-Q389 WeakPolarHBondContact O-CA 3.23Å; A386-Q389 WeakPolarHBondContact O-CB 3.3Å; A386-Q389 PolarHBondContact O-N 3.3Å; K387-Q389 PolarHBondContact O-N 3.35Å; Q389-S392 PolarHBondContact O-N 3.37Å; Q389-Y393 WeakPolarHBondContact O-CB 3.16Å; Q389-Y393 PolarHBondContact O-N 3.3Å
390	L	91.4	Very high	86.4	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-60.8	-45	172.9	-69.8	170.9	0	0	0	111.6	A341 I344 L354 L379 A386 K387 Y393 I394	A341-L390 HydrophobicContact CB-CD2 3.97Å; I344-L390 HydrophobicContact CD1-CD2 3.77Å; I344-L390 HydrophobicContact CD1-CG 3.92Å; L354-L390 HydrophobicContact CD1-CB 4.45Å; L354-L390 HydrophobicContact CD1-CD1 4.47Å; L354-L390 HydrophobicContact CD1-CD2 4.32Å; L379-L390 HydrophobicContact CD1-CD1 4.37Å; A386-L390 PolarHBondContact O-N 2.97Å; A386-L390 VanDerWaalsContact O-N 3.12Å; K387-L390 WeakPolarHBondContact O-CB 3.49Å; K387-L390 PolarHBondContact O-N 3.11Å; L390-Y393 PolarHBondContact O-N 3.02Å; L390-I394 WeakPolarHBondContact O-CG1 3.38Å; L390-I394 PolarHBondContact O-N 3.3Å
391	L	92	Very high	86.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.8	-47.4	174.9	-80.8	154.4	0	0	0	112.1	K387 Y393 I394 D395 Y403 C443 D445 L485 A487	K387-L391 PolarHBondContact O-N 3.26Å; K387-L391 VanDerWaalsContact O-N 3.12Å; L391-Y393 VanDerWaalsContact C-N 3.34Å; L391-I394 PolarHBondContact O-N 3.48Å; L391-D395 PolarHBondContact O-N 3.41Å; L391-Y403 HydrophobicContact CB-CD2 4.49Å; L391-Y403 HydrophobicContact CB-CE2 4Å; L391-C443 HydrophobicContact CD2-CB 3.62Å; L391-D445 HydrophobicContact CD1-CB 4.13Å; L391-L485 HydrophobicContact CD2-CB 4.2Å; L391-L485 HydrophobicContact CD2-CD2 3.67Å; L391-L485 HydrophobicContact CD2-CG 3.58Å; L391-L485 HydrophobicContact CG-CD2 4.28Å; L391-L485 HydrophobicContact CG-CG 4.45Å; L391-A487 HydrophobicContact CD1-CB 3.39Å
392	S	89.8	Confident	86.4	Confident	42 Å²	42	42.1 Å²	42.1	29%	0.294	24%	0.238	S	C	.	.	H	α-helix	trans	-65	-37.5	178.6	179.1	0	0	0	0	112.2	S388 Q389 D395 R396	S388-S392 WeakPolarHBondContact O-CB 3.47Å; S388-S392 PolarHBondContact O-N 3.17Å; Q389-S392 PolarHBondContact O-N 3.37Å; S392-D395 PolarHBondContact O-N 3.29Å; S392-R396 WeakPolarHBondContact O-CG 3.19Å; S392-R396 PolarHBondContact O-N 3.44Å; S392-R396 VanDerWaalsContact O-N 3.13Å
393	Y	90.6	Very high	86.7	Confident	19 Å²	19	45.4 Å²	45.4	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-64.9	-43.2	175.5	-171	-90.9	0	0	0	111.7	I340 A341 Q389 L390 L391 R396 L397 M556	I340-Y393 HydrophobicContact CG2-CD1 4.17Å; I340-Y393 HydrophobicContact CG2-CE1 4.12Å; A341-Y393 HydrophobicContact CB-CD1 3.85Å; A341-Y393 HydrophobicContact CB-CD2 4.19Å; A341-Y393 HydrophobicContact CB-CE1 4.24Å; A341-Y393 HydrophobicContact CB-CG 3.82Å; Q389-Y393 WeakPolarHBondContact O-CB 3.16Å; Q389-Y393 PolarHBondContact O-N 3.3Å; L390-Y393 PolarHBondContact O-N 3.02Å; L391-Y393 VanDerWaalsContact C-N 3.34Å; Y393-R396 PolarHBondContact O-N 3.25Å; Y393-L397 HydrophobicContact CE1-CD2 4.2Å; Y393-L397 WeakPolarHBondContact O-CB 3.32Å; Y393-L397 PolarHBondContact O-N 2.98Å; Y393-M556 HydrophobicContact CE2-CE 4.15Å; Y393-M556 HydrophobicContact CE2-SD 4.31Å
394	I	91.3	Very high	86.9	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-66.2	-39	176.5	-71	169.1	0	0	0	111.7	L354 L358 L390 L391 R396 L397 A398 I441 L485	L354-I394 HydrophobicContact CB-CD1 3.87Å; L354-I394 HydrophobicContact CD1-CD1 3.74Å; L354-I394 HydrophobicContact CD2-CD1 3.43Å; L354-I394 VanDerWaalsContact CD2-CD1 3.43Å; L354-I394 HydrophobicContact CG-CD1 3.8Å; L358-I394 HydrophobicContact CD2-CG2 4.29Å; L390-I394 WeakPolarHBondContact O-CG1 3.38Å; L390-I394 PolarHBondContact O-N 3.3Å; L391-I394 PolarHBondContact O-N 3.48Å; I394-R396 PolarHBondContact O-N 3.05Å; I394-L397 PolarHBondContact O-N 3.34Å; I394-L397 VanDerWaalsContact O-N 3.15Å; I394-A398 WeakPolarHBondContact O-CB 3.33Å; I394-A398 PolarHBondContact O-N 3.45Å; I394-I441 HydrophobicContact CG2-CD1 3.96Å; I394-I441 HydrophobicContact CG2-CG2 4.4Å; I394-L485 HydrophobicContact CB-CD2 4.33Å; I394-L485 HydrophobicContact CD1-CD2 3.43Å; I394-L485 VanDerWaalsContact CD1-CD2 3.43Å; I394-L485 HydrophobicContact CG1-CD2 4.49Å; I394-L485 HydrophobicContact CG2-CD2 4.21Å
395	D	89.4	Confident	87.5	Confident	27 Å²	27	40.6 Å²	40.6	14%	0.144	20%	0.204	C	C	.	.	H	α-helix	trans	-58.5	-38.7	174.7	-174.2	72.1	0	0	0	111.3	K308 L391 S392 S401 Q402 Y403	K308-D395 IonicContact NZ-OD1 3.57Å; K308-D395 IonicContact NZ-OD2 2.7Å; L391-D395 PolarHBondContact O-N 3.41Å; S392-D395 PolarHBondContact O-N 3.29Å; D395-S401 PolarHBondContact O-OG 3.32Å; D395-S401 WeakPolarHBondContact OD1-CB 3.47Å; D395-S401 PolarHBondContact OD1-OG 3.5Å; D395-S401 VanDerWaalsContact OD1-OG 3.05Å; D395-Q402 PolarHBondContact OD1-N 2.7Å; D395-Y403 PolarHBondContact OD1-N 3.05Å
396	R	85.4	Confident	87.3	Confident	117 Å²	117	40 Å²	40	44%	0.442	20%	0.202	S	C	.	.	H	α-helix	trans	-73.2	-34.6	174.4	-69	-176.6	-70.2	170.4	-0.6	113.4	S392 Y393 I394 M556 R560	S392-R396 WeakPolarHBondContact O-CG 3.19Å; S392-R396 PolarHBondContact O-N 3.44Å; S392-R396 VanDerWaalsContact O-N 3.13Å; Y393-R396 PolarHBondContact O-N 3.25Å; I394-R396 PolarHBondContact O-N 3.05Å; R396-M556 HydrophobicContact CB-CE 4.21Å; R396-R560 PolarHBondContact O-NH2 3.39Å
397	L	86.6	Confident	87.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-76.7	-39.7	-176.5	-176.4	59.5	0	0	0	112.6	L358 Y393 I394 M556 M559 R560	L358-L397 HydrophobicContact CD1-CD2 3.55Å; L358-L397 HydrophobicContact CD1-CG 4.33Å; Y393-L397 HydrophobicContact CE1-CD2 4.2Å; Y393-L397 WeakPolarHBondContact O-CB 3.32Å; Y393-L397 PolarHBondContact O-N 2.98Å; I394-L397 PolarHBondContact O-N 3.34Å; I394-L397 VanDerWaalsContact O-N 3.15Å; L397-M556 HydrophobicContact CB-CE 4.26Å; L397-M556 HydrophobicContact CD1-CB 4.43Å; L397-M556 HydrophobicContact CD1-CE 4.28Å; L397-M559 HydrophobicContact CD1-CB 4.35Å; L397-M559 HydrophobicContact CD1-CG 4.28Å; L397-M559 HydrophobicContact CD1-SD 3.98Å; L397-M559 HydrophobicContact CD2-CE 3.95Å; L397-M559 HydrophobicContact CD2-SD 3.69Å; L397-M559 HydrophobicContact CG-SD 4.47Å; L397-R560 PolarHBondContact O-NE 3.23Å
398	A	83.3	Confident	86.7	Confident	9 Å²	9	49.5 Å²	49.5	7%	0.074	25%	0.249	C	C	.	.	S	Bend	trans	-68.6	143.1	-179.3	0	0	0	0	0	112.6	L358 I394 R400 I441	L358-A398 HydrophobicContact CD2-CB 4.04Å; I394-A398 WeakPolarHBondContact O-CB 3.33Å; I394-A398 PolarHBondContact O-N 3.45Å; A398-R400 VanDerWaalsContact C-N 3.35Å; A398-R400 PolarHBondContact O-N 3.34Å; A398-I441 HydrophobicContact CB-CD1 4.16Å
399	L	73.7	Confident	86.1	Confident	96 Å²	96	48.1 Å²	48.1	50%	0.503	24%	0.239	S	C	.	.	S	Bend	trans	-62.1	-41	178.1	-77.9	157.3	0	0	0	112.6	R560 A564	L399-R560 HydrophobicContact CD1-CG 4.4Å; L399-R560 VanDerWaalsContact CD2-CD 3.44Å; L399-R560 HydrophobicContact CD2-CG 3.89Å; L399-R560 HydrophobicContact CG-CG 3.73Å; L399-A564 HydrophobicContact CD1-CB 4.15Å
400	R	81.8	Confident	85.6	Confident	94 Å²	94	46.3 Å²	46.3	36%	0.355	24%	0.239	S	C	.	.	S	Bend	trans	-133.3	115.8	179.9	-171.9	170.6	176.4	-175.7	9.5	108.2	A398 L436 D438 G440 I441	A398-R400 VanDerWaalsContact C-N 3.35Å; A398-R400 PolarHBondContact O-N 3.34Å; R400-L436 PolarHBondContact NE-O 2.73Å; R400-L436 PolarHBondContact NH2-O 2.74Å; R400-D438 VanDerWaalsContact CD-O 3.23Å; R400-D438 WeakPolarHBondContact CD-O 3.49Å; R400-D438 VanDerWaalsContact CZ-O 3.27Å; R400-D438 PolarHBondContact NE-O 2.91Å; R400-D438 PolarHBondContact NH1-O 2.8Å; R400-G440 WeakPolarHBondContact O-CA 3.44Å; R400-I441 PolarHBondContact O-N 3.41Å; R400-I441 VanDerWaalsContact O-N 3.07Å
401	S	87.6	Confident	85	Confident	9 Å²	9	46.8 Å²	46.8	6%	0.063	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	141.9	-171.7	53.8	0	0	0	0	110.8	K308 D395 I441	K308-S401 PolarHBondContact NZ-O 3.41Å; K308-S401 VanDerWaalsContact NZ-O 3.12Å; K308-S401 PolarHBondContact NZ-OG 2.98Å; D395-S401 PolarHBondContact O-OG 3.32Å; D395-S401 WeakPolarHBondContact OD1-CB 3.47Å; D395-S401 PolarHBondContact OD1-OG 3.5Å; D395-S401 VanDerWaalsContact OD1-OG 3.05Å; S401-I441 VanDerWaalsContact CA-O 3.24Å; S401-I441 WeakPolarHBondContact CA-O 3.48Å
402	Q	87.8	Confident	84.5	Confident	73 Å²	73	49.9 Å²	49.9	34%	0.341	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120.2	175.3	-171.1	66.8	45.9	0	0	109	D395 T404 A433 A437 I441 C443	D395-Q402 PolarHBondContact OD1-N 2.7Å; Q402-T404 HydrophobicContact CG-CG2 4.11Å; Q402-A433 HydrophobicContact CG-CB 3.72Å; Q402-A437 HydrophobicContact CB-CB 4.13Å; Q402-I441 PolarHBondContact N-O 3.24Å; Q402-C443 PolarHBondContact O-N 3.24Å
403	Y	90.5	Very high	84.2	Confident	79 Å²	79	49.7 Å²	49.7	31%	0.31	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.6	170.6	-173.7	-96.8	0	0	0	110.6	L391 D395 T405 C443 D445	L391-Y403 HydrophobicContact CB-CD2 4.49Å; L391-Y403 HydrophobicContact CB-CE2 4Å; D395-Y403 PolarHBondContact OD1-N 3.05Å; Y403-T405 HydrophobicContact CE1-CG2 4.02Å; Y403-C443 HydrophobicContact CD2-CB 3.87Å; Y403-D445 HydrophobicContact CE2-CB 4.36Å; Y403-D445 WeakPolarHBondContact OH-CB 3.24Å; Y403-D445 PolarHBondContact OH-OD2 2.93Å
404	T	89.1	Confident	83.8	Confident	10 Å²	10	48.9 Å²	48.9	6%	0.061	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	151.9	176.7	55.6	0	0	0	0	110.8	Q402 S409 L414 A433 C443 I444 D445	Q402-T404 HydrophobicContact CG-CG2 4.11Å; T404-S409 WeakPolarHBondContact CB-OG 3.16Å; T404-L414 HydrophobicContact CG2-CD2 4.5Å; T404-A433 HydrophobicContact CG2-CB 3.46Å; T404-A433 VanDerWaalsContact CG2-CB 3.46Å; T404-C443 PolarHBondContact N-O 2.95Å; T404-C443 PolarHBondContact OG1-O 3.22Å; T404-I444 WeakPolarHBondContact O-CA 3.42Å; T404-D445 PolarHBondContact O-N 3.35Å
405	T	89.8	Confident	83.5	Confident	49 Å²	49	49.5 Å²	49.5	30%	0.301	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	144.3	171	66.5	0	0	0	0	109.6	Y403 R407 G408 S409 D445	Y403-T405 HydrophobicContact CE1-CG2 4.02Å; T405-R407 PolarHBondContact O-N 3.22Å; T405-G408 PolarHBondContact O-N 2.93Å; T405-G408 VanDerWaalsContact O-N 3.09Å; T405-G408 VanDerWaalsContact OG1-CA 3.31Å; T405-G408 WeakPolarHBondContact OG1-CA 3.39Å; T405-G408 PolarHBondContact OG1-N 3.21Å; T405-S409 PolarHBondContact O-N 2.94Å; T405-S409 PolarHBondContact O-OG 2.82Å; T405-D445 CarbonylContact C-O 3.56Å
406	G	81.5	Confident	83.3	Confident	4 Å²	4	48.2 Å²	48.2	4%	0.041	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.6	-176.4	0	0	0	0	0	114.4	D445 M450	G406-D445 PolarHBondContact N-O 3.23Å; G406-M450 WeakPolarHBondContact O-CG 3.22Å
407	R	83.4	Confident	83.2	Confident	183 Å²	183	43.9 Å²	43.9	69%	0.691	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-29.2	171.1	-74.2	-169.9	169.6	-176.2	2.9	114	T405 S409 K449	T405-R407 PolarHBondContact O-N 3.22Å; R407-S409 VanDerWaalsContact C-N 3.34Å; R407-K449 HydrophobicContact CG-CB 3.85Å; R407-K449 HydrophobicContact CG-CD 4.44Å
408	G	77.5	Confident	83	Confident	61 Å²	61	45.5 Å²	45.5	63%	0.629	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-18.3	-175.9	0	0	0	0	0	113.5	T405	T405-G408 PolarHBondContact O-N 2.93Å; T405-G408 VanDerWaalsContact O-N 3.09Å; T405-G408 VanDerWaalsContact OG1-CA 3.31Å; T405-G408 WeakPolarHBondContact OG1-CA 3.39Å; T405-G408 PolarHBondContact OG1-N 3.21Å
409	S	76.3	Confident	83	Confident	22 Å²	22	47.9 Å²	47.9	15%	0.154	27%	0.271	C	S	.	.			trans	-113.4	118.4	179.6	-52.9	0	0	0	0	110	T404 T405 R407	T404-S409 WeakPolarHBondContact CB-OG 3.16Å; T405-S409 PolarHBondContact O-N 2.94Å; T405-S409 PolarHBondContact O-OG 2.82Å; R407-S409 VanDerWaalsContact C-N 3.34Å
410	S	79.3	Confident	83.4	Confident	74 Å²	74	50.4 Å²	50.4	52%	0.517	28%	0.278	S	S	.	.			trans	-78.6	162.9	167.1	64	0	0	0	0	110.3	V412 G413 L414	S410-V412 PolarHBondContact O-N 2.98Å; S410-G413 CarbonylContact O-C 3.58Å; S410-G413 WeakPolarHBondContact O-CA 3.41Å; S410-G413 PolarHBondContact O-N 3.47Å; S410-L414 PolarHBondContact O-N 2.85Å
411	G	78.1	Confident	83.1	Confident	13 Å²	13	46.9 Å²	46.9	13%	0.134	27%	0.266	C	S	.	.	H	α-helix	trans	-53.7	-29.4	177.8	0	0	0	0	0	114.8	L414 T415 D454	G411-L414 PolarHBondContact O-N 2.73Å; G411-T415 WeakPolarHBondContact O-CB 3.29Å; G411-T415 WeakPolarHBondContact O-CG2 3.47Å; G411-T415 PolarHBondContact O-N 3.19Å; G411-T415 PolarHBondContact O-OG1 3.22Å; G411-D454 VanDerWaalsContact CA-CG 3.46Å; G411-D454 WeakPolarHBondContact CA-OD1 3.26Å; G411-D454 PolarHBondContact N-OD1 2.93Å; G411-D454 PolarHBondContact N-OD2 3.06Å
412	V	81.3	Confident	82.3	Confident	65 Å²	65	50.9 Å²	50.9	39%	0.394	29%	0.292	S	S	.	.	H	α-helix	trans	-70.2	-38.7	173.4	-177.2	0	0	0	0	111.5	S410 L414 A417	S410-V412 PolarHBondContact O-N 2.98Å; V412-L414 VanDerWaalsContact C-N 3.34Å; V412-A417 HydrophobicContact CG1-CB 3.62Å
413	G	83.1	Confident	81.3	Confident	37 Å²	37	52.7 Å²	52.7	38%	0.381	30%	0.303	S	S	.	.	H	α-helix	trans	-71.7	-24.9	174.9	0	0	0	0	0	113.6	S410 G432 A433	S410-G413 CarbonylContact O-C 3.58Å; S410-G413 WeakPolarHBondContact O-CA 3.41Å; S410-G413 PolarHBondContact O-N 3.47Å; G413-G432 CarbonylContact O-C 3.57Å; G413-G432 WeakPolarHBondContact O-CA 3.44Å; G413-A433 PolarHBondContact O-N 3.31Å
414	L	83.8	Confident	80.4	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-81.9	-40.8	172.6	-69	174.3	0	0	0	112.7	T404 S410 G411 V412 G432 A433 L434 M450 D454	T404-L414 HydrophobicContact CG2-CD2 4.5Å; S410-L414 PolarHBondContact O-N 2.85Å; G411-L414 PolarHBondContact O-N 2.73Å; V412-L414 VanDerWaalsContact C-N 3.34Å; L414-G432 CarbonylContact O-C 3.55Å; L414-A433 HydrophobicContact CD2-CB 4.28Å; L414-A433 PolarHBondContact O-N 3.21Å; L414-L434 HydrophobicContact CB-CD1 4.23Å; L414-L434 WeakPolarHBondContact O-CB 3.33Å; L414-L434 PolarHBondContact O-N 2.72Å; L414-L434 VanDerWaalsContact O-N 3.08Å; L414-M450 HydrophobicContact CD1-SD 4.45Å; L414-D454 HydrophobicContact CD1-CB 4.18Å
415	T	85.3	Confident	79.7	Confident	15 Å²	15	53.4 Å²	53.4	9%	0.092	33%	0.326	C	S	.	.	S	Bend	trans	-90.2	-96.4	-173.1	55.9	0	0	0	0	113.2	G411 G432 V435 A457 I467	G411-T415 WeakPolarHBondContact O-CB 3.29Å; G411-T415 WeakPolarHBondContact O-CG2 3.47Å; G411-T415 PolarHBondContact O-N 3.19Å; G411-T415 PolarHBondContact O-OG1 3.22Å; T415-G432 VanDerWaalsContact O-CA 3.24Å; T415-G432 WeakPolarHBondContact O-CA 3.35Å; T415-G432 PolarHBondContact O-N 3.26Å; T415-V435 WeakPolarHBondContact O-CG2 3.36Å; T415-A457 HydrophobicContact CG2-CB 3.41Å; T415-A457 VanDerWaalsContact CG2-CB 3.41Å; T415-I467 HydrophobicContact CG2-CG2 3.95Å
416	A	83.6	Confident	79.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	150.7	168.3	0	0	0	0	0	109.7	E430 I469 L478	A416-E430 CarbonylContact C-O 3.56Å; A416-E430 WeakPolarHBondContact CA-O 3.31Å; A416-E430 WeakPolarHBondContact CB-O 3.48Å; A416-I469 HydrophobicContact CB-CD1 3.17Å; A416-L478 HydrophobicContact CB-CD1 3.78Å
417	A	83.5	Confident	79.2	Confident	25 Å²	25	60.6 Å²	60.6	21%	0.207	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143	173.9	0	0	0	0	0	110.1	V412 L429 E430	V412-A417 HydrophobicContact CG1-CB 3.62Å; A417-L429 CarbonylContact O-C 3.51Å; A417-L429 WeakPolarHBondContact O-CA 3.5Å; A417-E430 PolarHBondContact N-O 2.95Å; A417-E430 PolarHBondContact O-N 3.04Å
418	V	83.9	Confident	79	Confident	35 Å²	35	54.6 Å²	54.6	21%	0.212	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.4	167.7	-178.4	0	0	0	0	107.5	M427 T428 L429 K471 A472 I474	V418-M427 HydrophobicContact CG1-CB 3.89Å; V418-M427 HydrophobicContact CG1-CE 3.98Å; V418-M427 HydrophobicContact CG1-CG 4.49Å; V418-M427 HydrophobicContact CG1-SD 4.26Å; V418-T428 CarbonylContact C-O 3.43Å; V418-T428 WeakPolarHBondContact CA-O 3.32Å; V418-L429 HydrophobicContact CG2-CD2 3.58Å; V418-K471 HydrophobicContact CG2-CB 4.12Å; V418-A472 HydrophobicContact CG1-CB 4.19Å; V418-I474 HydrophobicContact CG1-CD1 4.24Å
419	M	81.8	Confident	79.1	Confident	60 Å²	60	54.5 Å²	54.5	30%	0.296	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.5	177.1	-75.4	-161	-70.8	0	0	112.3	T428 E430	M419-T428 PolarHBondContact N-O 3.02Å; M419-T428 PolarHBondContact O-N 3.08Å; M419-T428 PolarHBondContact O-OG1 2.94Å; M419-E430 HydrophobicContact CE-CB 4.24Å; M419-E430 HydrophobicContact CE-CG 3.74Å; M419-E430 WeakPolarHBondContact CE-OE1 3.45Å; M419-E430 WeakPolarHBondContact CE-OE2 3.38Å
420	K	82.2	Confident	79.3	Confident	148 Å²	148	56.1 Å²	56.1	64%	0.643	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.1	173.5	-72.5	-178.6	179.5	-174.3	0	109.5	P422 E426 M427	K420-P422 WeakPolarHBondContact O-CD 3.49Å; K420-E426 WeakPolarHBondContact CA-O 3.24Å; K420-M427 HydrophobicContact CB-SD 4.44Å; K420-M427 HydrophobicContact CD-SD 3.96Å; K420-M427 WeakPolarHBondContact CE-SD 3.25Å; K420-M427 HydrophobicContact CG-CE 4.48Å; K420-M427 HydrophobicContact CG-SD 3.2Å; K420-M427 WeakPolarHBondContact CG-SD 3.4Å
421	D	76.6	Confident	79.3	Confident	21 Å²	21	54 Å²	54	11%	0.112	32%	0.319	C	S	.	.			trans	-67.3	122.9	168.1	174.6	11.3	0	0	0	108.7	K174 L423 T424 G425 E426 T428	K174-D421 IonicContact NZ-OD2 3.31Å; D421-L423 PolarHBondContact O-N 3.43Å; D421-L423 PolarHBondContact OD1-N 3.19Å; D421-T424 VanDerWaalsContact CB-OG1 3.29Å; D421-T424 WeakPolarHBondContact CB-OG1 3.43Å; D421-T424 VanDerWaalsContact CG-OG1 3.26Å; D421-T424 WeakPolarHBondContact OD2-CG2 3.44Å; D421-T424 PolarHBondContact OD2-OG1 3.15Å; D421-G425 VanDerWaalsContact O-CA 3.27Å; D421-G425 WeakPolarHBondContact O-CA 3.39Å; D421-G425 PolarHBondContact O-N 3.47Å; D421-E426 PolarHBondContact N-O 3.5Å; D421-T428 HydrophobicContact CB-CG2 4.22Å
422	P	70.1	Confident	79.7	Confident	92 Å²	92	53.7 Å²	53.7	60%	0.597	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.1	-176.5	23.7	-35	0	0	0	114.7	K420	K420-P422 WeakPolarHBondContact O-CD 3.49Å
423	L	66.4	Low	79.9	Confident	112 Å²	112	51 Å²	51	59%	0.586	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-46.3	-179	-91.4	149.8	0	0	0	112.9	E234 D421	E234-L423 WeakPolarHBondContact OE2-CD1 3.23Å; D421-L423 PolarHBondContact O-N 3.43Å; D421-L423 PolarHBondContact OD1-N 3.19Å
424	T	70.8	Confident	80.2	Confident	53 Å²	53	49.2 Å²	49.2	33%	0.325	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-24.6	-176.6	57.1	0	0	0	0	112.7	D421 E426	D421-T424 VanDerWaalsContact CB-OG1 3.29Å; D421-T424 WeakPolarHBondContact CB-OG1 3.43Å; D421-T424 VanDerWaalsContact CG-OG1 3.26Å; D421-T424 WeakPolarHBondContact OD2-CG2 3.44Å; D421-T424 PolarHBondContact OD2-OG1 3.15Å; T424-E426 PolarHBondContact O-N 3.42Å; T424-E426 WeakPolarHBondContact OG1-CB 3.1Å; T424-E426 PolarHBondContact OG1-N 2.88Å
425	G	75.1	Confident	80.3	Confident	51 Å²	51	50.3 Å²	50.3	53%	0.526	29%	0.289	S	S	.	.			trans	71.1	3.7	-168.1	0	0	0	0	0	113.6	D421	D421-G425 VanDerWaalsContact O-CA 3.27Å; D421-G425 WeakPolarHBondContact O-CA 3.39Å; D421-G425 PolarHBondContact O-N 3.47Å
426	E	80.1	Confident	80.3	Confident	127 Å²	127	52.3 Å²	52.3	59%	0.593	30%	0.299	S	S	*	.			trans	-72.7	145.3	177.9	-68.6	175.7	179.1	0	0	110.6	K420 D421 T424 T428	K420-E426 WeakPolarHBondContact CA-O 3.24Å; D421-E426 PolarHBondContact N-O 3.5Å; T424-E426 PolarHBondContact O-N 3.42Å; T424-E426 WeakPolarHBondContact OG1-CB 3.1Å; T424-E426 PolarHBondContact OG1-N 2.88Å; E426-T428 PolarHBondContact O-N 3.38Å
427	M	81.5	Confident	80.4	Confident	77 Å²	77	52.3 Å²	52.3	38%	0.379	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	107.6	176.2	-62.4	-68.8	-105	0	0	108.1	V418 K420 A472 I474	V418-M427 HydrophobicContact CG1-CB 3.89Å; V418-M427 HydrophobicContact CG1-CE 3.98Å; V418-M427 HydrophobicContact CG1-CG 4.49Å; V418-M427 HydrophobicContact CG1-SD 4.26Å; K420-M427 HydrophobicContact CB-SD 4.44Å; K420-M427 HydrophobicContact CD-SD 3.96Å; K420-M427 WeakPolarHBondContact CE-SD 3.25Å; K420-M427 HydrophobicContact CG-CE 4.48Å; K420-M427 HydrophobicContact CG-SD 3.2Å; K420-M427 WeakPolarHBondContact CG-SD 3.4Å; M427-A472 HydrophobicContact CE-CB 3.52Å; M427-I474 HydrophobicContact CB-CD1 4Å
428	T	79.4	Confident	80.6	Confident	57 Å²	57	52 Å²	52	35%	0.35	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	147.7	177.1	58.2	0	0	0	0	110.6	V418 M419 D421 E426	V418-T428 CarbonylContact C-O 3.43Å; V418-T428 WeakPolarHBondContact CA-O 3.32Å; M419-T428 PolarHBondContact N-O 3.02Å; M419-T428 PolarHBondContact O-N 3.08Å; M419-T428 PolarHBondContact O-OG1 2.94Å; D421-T428 HydrophobicContact CB-CG2 4.22Å; E426-T428 PolarHBondContact O-N 3.38Å
429	L	79.9	Confident	80.7	Confident	58 Å²	58	55 Å²	55	30%	0.304	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.3	174.8	-76.9	163.4	0	0	0	109.3	A417 V418 I469 I474 T476	A417-L429 CarbonylContact O-C 3.51Å; A417-L429 WeakPolarHBondContact O-CA 3.5Å; V418-L429 HydrophobicContact CG2-CD2 3.58Å; L429-I469 HydrophobicContact CD2-CG2 4.49Å; L429-I474 HydrophobicContact CD1-CG2 3.92Å; L429-I474 HydrophobicContact CG-CD1 4.35Å; L429-T476 WeakPolarHBondContact CD1-OG1 3.48Å
430	E	80.1	Confident	81	Confident	57 Å²	57	52.4 Å²	52.4	27%	0.266	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121.3	166.5	-77.6	-167.9	-169.8	0	0	109.9	R169 A416 A417 M419	R169-E430 VanDerWaalsContact CD-OE1 3.25Å; R169-E430 WeakPolarHBondContact CD-OE1 3.37Å; R169-E430 VanDerWaalsContact CG-OE1 3.32Å; R169-E430 WeakPolarHBondContact CG-OE1 3.38Å; R169-E430 IonicContact CZ-OE1 3.68Å; R169-E430 VanDerWaalsContact CZ-OE1 3.23Å; R169-E430 IonicContact NE-OE1 3.75Å; R169-E430 PolarHBondContact NE-OE1 3.47Å; R169-E430 IonicContact NH2-OE1 3.46Å; R169-E430 PolarHBondContact NH2-OE1 3.29Å; A416-E430 CarbonylContact C-O 3.56Å; A416-E430 WeakPolarHBondContact CA-O 3.31Å; A416-E430 WeakPolarHBondContact CB-O 3.48Å; A417-E430 PolarHBondContact N-O 2.95Å; A417-E430 PolarHBondContact O-N 3.04Å; M419-E430 HydrophobicContact CE-CB 4.24Å; M419-E430 HydrophobicContact CE-CG 3.74Å; M419-E430 WeakPolarHBondContact CE-OE1 3.45Å; M419-E430 WeakPolarHBondContact CE-OE2 3.38Å
431	G	79.6	Confident	81.5	Confident	28 Å²	28	45.5 Å²	45.5	29%	0.289	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	135.3	175.9	0	0	0	0	0	111.7
432	G	86.1	Confident	82.2	Confident	7 Å²	7	44.5 Å²	44.5	7%	0.072	26%	0.262	C	S	.	.			trans	-79.6	-176.3	168.4	0	0	0	0	0	111.8	G413 L414 T415 L434 V435 L436	G413-G432 CarbonylContact O-C 3.57Å; G413-G432 WeakPolarHBondContact O-CA 3.44Å; L414-G432 CarbonylContact O-C 3.55Å; T415-G432 VanDerWaalsContact O-CA 3.24Å; T415-G432 WeakPolarHBondContact O-CA 3.35Å; T415-G432 PolarHBondContact O-N 3.26Å; G432-L434 VanDerWaalsContact C-N 3.27Å; G432-L434 PolarHBondContact O-N 3.47Å; G432-L434 VanDerWaalsContact O-N 3.15Å; G432-V435 PolarHBondContact O-N 3.04Å; G432-L436 WeakPolarHBondContact O-CG 3.38Å; G432-L436 PolarHBondContact O-N 2.88Å
433	A	85.9	Confident	83.4	Confident	8 Å²	8	40.1 Å²	40.1	7%	0.066	23%	0.233	C	C	.	.	H	α-helix	trans	-52.5	-39.2	-174.6	0	0	0	0	0	114.2	Q402 T404 G413 L414 A437	Q402-A433 HydrophobicContact CG-CB 3.72Å; T404-A433 HydrophobicContact CG2-CB 3.46Å; T404-A433 VanDerWaalsContact CG2-CB 3.46Å; G413-A433 PolarHBondContact O-N 3.31Å; L414-A433 HydrophobicContact CD2-CB 4.28Å; L414-A433 PolarHBondContact O-N 3.21Å; A433-A437 VanDerWaalsContact O-CB 3.25Å; A433-A437 WeakPolarHBondContact O-CB 3.3Å; A433-A437 PolarHBondContact O-N 3.19Å
434	L	87.7	Confident	84.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-72.3	-34.8	-179.6	-66	168.9	0	0	0	112.4	L414 G432 A437 C442 V461 I467	L414-L434 HydrophobicContact CB-CD1 4.23Å; L414-L434 WeakPolarHBondContact O-CB 3.33Å; L414-L434 PolarHBondContact O-N 2.72Å; L414-L434 VanDerWaalsContact O-N 3.08Å; G432-L434 VanDerWaalsContact C-N 3.27Å; G432-L434 PolarHBondContact O-N 3.47Å; G432-L434 VanDerWaalsContact O-N 3.15Å; L434-A437 PolarHBondContact O-N 2.89Å; L434-C442 HydrophobicContact CD2-CB 3.91Å; L434-V461 HydrophobicContact CD1-CG2 3.91Å; L434-I467 HydrophobicContact CB-CD1 4Å; L434-I467 HydrophobicContact CD1-CD1 4.49Å
435	V	87.4	Confident	85.6	Confident	25 Å²	25	33.1 Å²	33.1	15%	0.152	19%	0.194	C	C	.	.	H	α-helix	trans	-73.3	-41.4	176.8	179.6	0	0	0	0	110.1	T415 G432 A437 D438 I467 L478	T415-V435 WeakPolarHBondContact O-CG2 3.36Å; G432-V435 PolarHBondContact O-N 3.04Å; V435-A437 PolarHBondContact O-N 3.42Å; V435-D438 PolarHBondContact O-N 3.34Å; V435-I467 HydrophobicContact CG2-CD1 3.77Å; V435-L478 HydrophobicContact CG1-CD1 4.48Å; V435-L478 HydrophobicContact CG2-CB 4.37Å; V435-L478 HydrophobicContact CG2-CD1 4.11Å
436	L	84.4	Confident	86.3	Confident	57 Å²	57	33.2 Å²	33.2	30%	0.298	18%	0.181	S	C	.	.	H	α-helix	trans	-65.5	-24.1	175.2	-66.1	175.5	0	0	0	112.4	R400 G432	R400-L436 PolarHBondContact NE-O 2.73Å; R400-L436 PolarHBondContact NH2-O 2.74Å; G432-L436 WeakPolarHBondContact O-CG 3.38Å; G432-L436 PolarHBondContact O-N 2.88Å
437	A	86.7	Confident	86.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	17.6	176.5	0	0	0	0	0	114.6	Q402 A433 L434 V435 L439 G440 C442 C482	Q402-A437 HydrophobicContact CB-CB 4.13Å; A433-A437 VanDerWaalsContact O-CB 3.25Å; A433-A437 WeakPolarHBondContact O-CB 3.3Å; A433-A437 PolarHBondContact O-N 3.19Å; L434-A437 PolarHBondContact O-N 2.89Å; V435-A437 PolarHBondContact O-N 3.42Å; A437-L439 PolarHBondContact O-N 3.26Å; A437-G440 CarbonylContact O-C 3.54Å; A437-G440 WeakPolarHBondContact O-CA 3.19Å; A437-G440 PolarHBondContact O-N 3.07Å; A437-C442 HydrophobicContact CB-CB 4.11Å; A437-C482 HydrophobicContact CB-CB 4.22Å; A437-C482 VanDerWaalsContact O-CB 3.26Å; A437-C482 WeakPolarHBondContact O-CB 3.46Å
438	D	87.7	Confident	87	Confident	20 Å²	20	25.4 Å²	25.4	11%	0.107	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	137.1	177.4	-173.6	40.5	0	0	0	111.9	R400 V435 G440 R481	R400-D438 VanDerWaalsContact CD-O 3.23Å; R400-D438 WeakPolarHBondContact CD-O 3.49Å; R400-D438 VanDerWaalsContact CZ-O 3.27Å; R400-D438 PolarHBondContact NE-O 2.91Å; R400-D438 PolarHBondContact NH1-O 2.8Å; V435-D438 PolarHBondContact O-N 3.34Å; D438-G440 PolarHBondContact O-N 3.2Å; D438-R481 VanDerWaalsContact OD1-CA 3.32Å; D438-R481 WeakPolarHBondContact OD1-CA 3.36Å; D438-R481 WeakPolarHBondContact OD1-CB 3.48Å; D438-R481 PolarHBondContact OD1-N 3.46Å; D438-R481 IonicContact OD1-NE 3.18Å; D438-R481 PolarHBondContact OD1-NE 3.46Å; D438-R481 IonicContact OD1-NH2 2.74Å; D438-R481 IonicContact OD2-CZ 3.87Å; D438-R481 IonicContact OD2-NE 2.78Å; D438-R481 IonicContact OD2-NH2 3.17Å; D438-R481 PolarHBondContact OD2-NH2 2.77Å
439	L	84.9	Confident	87.3	Confident	96 Å²	96	26.4 Å²	26.4	50%	0.503	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	6.7	-172.3	-61.1	173.4	0	0	0	115.6	A437 R481	A437-L439 PolarHBondContact O-N 3.26Å; L439-R481 WeakPolarHBondContact CA-O 3.4Å; L439-R481 HydrophobicContact CD2-CB 4.26Å; L439-R481 PolarHBondContact N-O 3.13Å
440	G	88.8	Confident	87.5	Confident	6 Å²	6	24 Å²	24	6%	0.062	13%	0.131	C	C	.	.	S	Bend	trans	-113.9	-156.4	-179.7	0	0	0	0	0	113	R400 A437 D438 S483	R400-G440 WeakPolarHBondContact O-CA 3.44Å; A437-G440 CarbonylContact O-C 3.54Å; A437-G440 WeakPolarHBondContact O-CA 3.19Å; A437-G440 PolarHBondContact O-N 3.07Å; D438-G440 PolarHBondContact O-N 3.2Å; G440-S483 PolarHBondContact O-N 3.45Å
441	I	91.9	Very high	87.8	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128.7	176.9	-57.5	175	0	0	0	109.1	L357 L358 I394 A398 R400 S401 Q402 S483 L485	L357-I441 HydrophobicContact CD2-CD1 4.38Å; L357-I441 HydrophobicContact CD2-CG2 4.38Å; L357-I441 HydrophobicContact CG-CD1 4.16Å; L358-I441 HydrophobicContact CD2-CD1 3.62Å; L358-I441 HydrophobicContact CG-CD1 4.22Å; I394-I441 HydrophobicContact CG2-CD1 3.96Å; I394-I441 HydrophobicContact CG2-CG2 4.4Å; A398-I441 HydrophobicContact CB-CD1 4.16Å; R400-I441 PolarHBondContact O-N 3.41Å; R400-I441 VanDerWaalsContact O-N 3.07Å; S401-I441 VanDerWaalsContact CA-O 3.24Å; S401-I441 WeakPolarHBondContact CA-O 3.48Å; Q402-I441 PolarHBondContact N-O 3.24Å; I441-S483 CarbonylContact C-O 3.58Å; I441-S483 WeakPolarHBondContact CA-O 3.35Å; I441-L485 HydrophobicContact CG2-CB 4.12Å
442	C	92.6	Very high	88	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.9	168.1	-172.2	0	0	0	0	108.9	L434 A437 S483 L485	L434-C442 HydrophobicContact CD2-CB 3.91Å; A437-C442 HydrophobicContact CB-CB 4.11Å; C442-S483 PolarHBondContact N-O 3.5Å; C442-L485 PolarHBondContact O-N 2.62Å
443	C	93.8	Very high	87.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.5	176.4	-69.8	0	0	0	0	108.6	L391 Q402 Y403 T404 L485	L391-C443 HydrophobicContact CD2-CB 3.62Å; Q402-C443 PolarHBondContact O-N 3.24Å; Y403-C443 HydrophobicContact CD2-CB 3.87Å; T404-C443 PolarHBondContact N-O 2.95Å; T404-C443 PolarHBondContact OG1-O 3.22Å; C443-L485 WeakPolarHBondContact CA-O 3.21Å
444	I	92.3	Very high	87.6	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	112.2	179.5	-51.2	176.4	0	0	0	108.9	T404 F447 M450 I458 I484 L485 A486 A487	T404-I444 WeakPolarHBondContact O-CA 3.42Å; I444-F447 HydrophobicContact CB-CD2 4.39Å; I444-F447 HydrophobicContact CD1-CD2 4.47Å; I444-F447 HydrophobicContact CD1-CE2 4.5Å; I444-F447 HydrophobicContact CG2-CD2 4.01Å; I444-M450 HydrophobicContact CG2-SD 3.99Å; I444-I458 HydrophobicContact CD1-CD1 4.1Å; I444-I484 HydrophobicContact CD1-CG2 3.98Å; I444-L485 PolarHBondContact N-O 3.3Å; I444-A486 CarbonylContact O-C 3.59Å; I444-A486 WeakPolarHBondContact O-CA 3.21Å; I444-A487 PolarHBondContact O-N 2.93Å
445	D	92.3	Very high	87.3	Confident	16 Å²	16	32.6 Å²	32.6	9%	0.086	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	155.8	171.2	-159.9	3.5	0	0	0	111.3	S388 L391 Y403 T404 T405 G406 F447	S388-D445 VanDerWaalsContact CB-OD2 3.32Å; S388-D445 WeakPolarHBondContact CB-OD2 3.41Å; S388-D445 PolarHBondContact OG-OD2 3.13Å; L391-D445 HydrophobicContact CD1-CB 4.13Å; Y403-D445 HydrophobicContact CE2-CB 4.36Å; Y403-D445 WeakPolarHBondContact OH-CB 3.24Å; Y403-D445 PolarHBondContact OH-OD2 2.93Å; T404-D445 PolarHBondContact O-N 3.35Å; T405-D445 CarbonylContact C-O 3.56Å; G406-D445 PolarHBondContact N-O 3.23Å; D445-F447 VanDerWaalsContact C-N 3.31Å; D445-F447 PolarHBondContact O-N 2.59Å
446	E	89.7	Confident	87.2	Confident	53 Å²	53	35.9 Å²	35.9	25%	0.248	21%	0.206	C	C	.	.	S	Bend	trans	51.7	46.2	-176.6	-52.5	-163.1	136.3	0	0	113.3	D448 K449 A487	E446-D448 PolarHBondContact O-N 3.44Å; E446-D448 VanDerWaalsContact O-N 3.17Å; E446-K449 HydrophobicContact CB-CB 4.44Å; E446-K449 HydrophobicContact CB-CD 4.22Å; E446-K449 HydrophobicContact CB-CG 4.42Å; E446-K449 VanDerWaalsContact CD-NZ 3.3Å; E446-K449 PolarHBondContact O-N 3.35Å; E446-K449 IonicContact OE1-NZ 3.93Å; E446-K449 PolarHBondContact OE1-NZ 3Å; E446-K449 WeakPolarHBondContact OE2-CD 3.24Å; E446-K449 IonicContact OE2-NZ 2.75Å; E446-K449 PolarHBondContact OE2-NZ 3.05Å; E446-A487 PolarHBondContact N-O 3.39Å
447	F	88.4	Confident	87.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-58	-29.7	-178.1	-172.5	-88.4	0	0	0	112.9	I444 D445 K449 M450 I458 A486 A487 A488 L507 L511 F515	I444-F447 HydrophobicContact CB-CD2 4.39Å; I444-F447 HydrophobicContact CD1-CD2 4.47Å; I444-F447 HydrophobicContact CD1-CE2 4.5Å; I444-F447 HydrophobicContact CG2-CD2 4.01Å; D445-F447 VanDerWaalsContact C-N 3.31Å; D445-F447 PolarHBondContact O-N 2.59Å; F447-K449 VanDerWaalsContact C-N 3.29Å; F447-K449 PolarHBondContact O-N 2.98Å; F447-M450 HydrophobicContact CB-CE 4.47Å; F447-M450 HydrophobicContact CD1-CE 4.11Å; F447-M450 HydrophobicContact CD2-CE 3.2Å; F447-M450 HydrophobicContact CD2-SD 4.36Å; F447-M450 HydrophobicContact CE1-CE 4.08Å; F447-M450 HydrophobicContact CE2-CE 3.2Å; F447-M450 HydrophobicContact CG-CE 3.68Å; F447-M450 HydrophobicContact CZ-CE 3.64Å; F447-M450 PolarHBondContact O-N 3.12Å; F447-I458 HydrophobicContact CE2-CD1 3.82Å; F447-I458 HydrophobicContact CE2-CG2 4.47Å; F447-I458 HydrophobicContact CZ-CD1 4.36Å; F447-A486 HydrophobicContact CB-CB 4.16Å; F447-A486 HydrophobicContact CD2-CB 3.68Å; F447-A486 HydrophobicContact CE2-CB 4.25Å; F447-A486 HydrophobicContact CG-CB 3.97Å; F447-A487 VanDerWaalsContact CB-O 3.28Å; F447-A487 WeakPolarHBondContact CB-O 3.16Å; F447-A487 PolarHBondContact N-O 3.39Å; F447-A488 HydrophobicContact CB-CB 4.31Å; F447-L507 HydrophobicContact CD1-CD1 4Å; F447-L507 HydrophobicContact CD1-CD2 4.04Å; F447-L507 HydrophobicContact CE1-CD1 4.08Å; F447-L507 HydrophobicContact CE1-CD2 3.93Å; F447-L511 HydrophobicContact CE1-CD1 4.09Å; F447-L511 HydrophobicContact CE1-CD2 3.57Å; F447-L511 HydrophobicContact CZ-CD1 3.91Å; F447-L511 HydrophobicContact CZ-CD2 3.69Å; F447-L511 HydrophobicContact CZ-CG 4.4Å; F447-F515 HydrophobicContact CE2-CZ 4.43Å; F447-F515 HydrophobicContact CZ-CZ 4.23Å
448	D	86.7	Confident	87.1	Confident	40 Å²	40	33.6 Å²	33.6	21%	0.214	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-64	-32	176.9	61.2	-59.8	0	0	0	112.8	E446 M450 R455	E446-D448 PolarHBondContact O-N 3.44Å; E446-D448 VanDerWaalsContact O-N 3.17Å; D448-M450 VanDerWaalsContact C-N 3.33Å; D448-M450 PolarHBondContact O-N 3.34Å; D448-R455 PolarHBondContact O-NH2 3.42Å
449	K	85.6	Confident	87.1	Confident	79 Å²	79	34.6 Å²	34.6	34%	0.343	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-87.5	1.9	-175.1	-59.2	-176.9	-168.8	166.1	0	114.1	R407 E446 F447	R407-K449 HydrophobicContact CG-CB 3.85Å; R407-K449 HydrophobicContact CG-CD 4.44Å; E446-K449 HydrophobicContact CB-CB 4.44Å; E446-K449 HydrophobicContact CB-CD 4.22Å; E446-K449 HydrophobicContact CB-CG 4.42Å; E446-K449 VanDerWaalsContact CD-NZ 3.3Å; E446-K449 PolarHBondContact O-N 3.35Å; E446-K449 IonicContact OE1-NZ 3.93Å; E446-K449 PolarHBondContact OE1-NZ 3Å; E446-K449 WeakPolarHBondContact OE2-CD 3.24Å; E446-K449 IonicContact OE2-NZ 2.75Å; E446-K449 PolarHBondContact OE2-NZ 3.05Å; F447-K449 VanDerWaalsContact C-N 3.29Å; F447-K449 PolarHBondContact O-N 2.98Å
450	M	85.8	Confident	87.3	Confident	6 Å²	6	32 Å²	32	3%	0.03	19%	0.185	C	C	.	.	S	Bend	trans	-69.3	144.3	176.1	-71.5	-166.6	-53.5	0	0	112.2	G406 L414 I444 F447 D448 R455 I458	G406-M450 WeakPolarHBondContact O-CG 3.22Å; L414-M450 HydrophobicContact CD1-SD 4.45Å; I444-M450 HydrophobicContact CG2-SD 3.99Å; F447-M450 HydrophobicContact CB-CE 4.47Å; F447-M450 HydrophobicContact CD1-CE 4.11Å; F447-M450 HydrophobicContact CD2-CE 3.2Å; F447-M450 HydrophobicContact CD2-SD 4.36Å; F447-M450 HydrophobicContact CE1-CE 4.08Å; F447-M450 HydrophobicContact CE2-CE 3.2Å; F447-M450 HydrophobicContact CG-CE 3.68Å; F447-M450 HydrophobicContact CZ-CE 3.64Å; F447-M450 PolarHBondContact O-N 3.12Å; D448-M450 VanDerWaalsContact C-N 3.33Å; D448-M450 PolarHBondContact O-N 3.34Å; M450-R455 PolarHBondContact O-NE 3.19Å; M450-R455 PolarHBondContact O-NH2 3.36Å; M450-I458 HydrophobicContact CE-CD1 3.43Å; M450-I458 VanDerWaalsContact CE-CD1 3.43Å; M450-I458 HydrophobicContact SD-CD1 3.93Å
451	A	85.7	Confident	87.2	Confident	54 Å²	54	31.9 Å²	31.9	45%	0.446	18%	0.183	S	C	.	.			trans	-65.5	147.6	174.7	0	0	0	0	0	111.5	A453 D454 R455	A451-A453 PolarHBondContact O-N 2.91Å; A451-D454 PolarHBondContact O-N 3.06Å; A451-R455 PolarHBondContact O-N 3.23Å
452	D	83.4	Confident	87.1	Confident	113 Å²	113	31.9 Å²	31.9	60%	0.604	18%	0.183	S	C	*	.	H	α-helix	trans	-63.4	-28.6	-177.6	-68.2	-40.5	0	0	0	113.3	D454 R455	D452-D454 VanDerWaalsContact C-N 3.32Å; D452-D454 PolarHBondContact O-N 2.81Å; D452-R455 WeakPolarHBondContact O-CB 3.45Å; D452-R455 PolarHBondContact O-N 2.85Å; D452-R455 IonicContact OD1-CZ 3.12Å; D452-R455 VanDerWaalsContact OD1-CZ 3.28Å; D452-R455 IonicContact OD1-NE 3.09Å; D452-R455 PolarHBondContact OD1-NE 3.37Å; D452-R455 IonicContact OD1-NH1 2.74Å; D452-R455 PolarHBondContact OD1-NH1 3.2Å
453	A	79.8	Confident	86.6	Confident	70 Å²	70	36.2 Å²	36.2	58%	0.579	20%	0.203	S	C	*	.	H	α-helix	trans	-61.6	-40.3	173.6	0	0	0	0	0	111.9	A451 R455 T456	A451-A453 PolarHBondContact O-N 2.91Å; A453-R455 VanDerWaalsContact C-N 3.32Å; A453-R455 PolarHBondContact O-N 2.75Å; A453-T456 PolarHBondContact O-N 3.18Å; A453-T456 PolarHBondContact O-OG1 2.92Å
454	D	83.4	Confident	86.1	Confident	22 Å²	22	42.1 Å²	42.1	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-74.8	-27.2	-176.3	-58.7	-16.5	0	0	0	111.3	G411 L414 A451 D452 T456 A457 I458	G411-D454 VanDerWaalsContact CA-CG 3.46Å; G411-D454 WeakPolarHBondContact CA-OD1 3.26Å; G411-D454 PolarHBondContact N-OD1 2.93Å; G411-D454 PolarHBondContact N-OD2 3.06Å; L414-D454 HydrophobicContact CD1-CB 4.18Å; A451-D454 PolarHBondContact O-N 3.06Å; D452-D454 VanDerWaalsContact C-N 3.32Å; D452-D454 PolarHBondContact O-N 2.81Å; D454-T456 PolarHBondContact O-N 3.11Å; D454-A457 PolarHBondContact O-N 3.44Å; D454-I458 PolarHBondContact O-N 3.5Å
455	R	82.8	Confident	85.9	Confident	23 Å²	23	43.1 Å²	43.1	9%	0.087	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-31.6	173.1	-61.7	176.5	-174.7	-176.5	-13.2	112.1	D448 M450 A451 D452 A453 I458 H459	D448-R455 PolarHBondContact O-NH2 3.42Å; M450-R455 PolarHBondContact O-NE 3.19Å; M450-R455 PolarHBondContact O-NH2 3.36Å; A451-R455 PolarHBondContact O-N 3.23Å; D452-R455 WeakPolarHBondContact O-CB 3.45Å; D452-R455 PolarHBondContact O-N 2.85Å; D452-R455 IonicContact OD1-CZ 3.12Å; D452-R455 VanDerWaalsContact OD1-CZ 3.28Å; D452-R455 IonicContact OD1-NE 3.09Å; D452-R455 PolarHBondContact OD1-NE 3.37Å; D452-R455 IonicContact OD1-NH1 2.74Å; D452-R455 PolarHBondContact OD1-NH1 3.2Å; A453-R455 VanDerWaalsContact C-N 3.32Å; A453-R455 PolarHBondContact O-N 2.75Å; R455-I458 PolarHBondContact O-N 3.23Å; R455-H459 PolarHBondContact O-CD2 3.05Å; R455-H459 PolarHBondContact O-N 3.44Å
456	T	83.8	Confident	85.7	Confident	93 Å²	93	43.8 Å²	43.8	57%	0.571	24%	0.24	S	C	*	.	H	α-helix	trans	-64.6	-39.4	177.2	68.8	0	0	0	0	112.5	A453 D454 I458 H459 E460	A453-T456 PolarHBondContact O-N 3.18Å; A453-T456 PolarHBondContact O-OG1 2.92Å; D454-T456 PolarHBondContact O-N 3.11Å; T456-I458 VanDerWaalsContact C-N 3.34Å; T456-I458 PolarHBondContact O-N 3.29Å; T456-H459 WeakPolarHBondContact O-CB 3.39Å; T456-H459 PolarHBondContact O-N 3.46Å; T456-E460 PolarHBondContact O-N 2.98Å
457	A	83.5	Confident	85.7	Confident	10 Å²	10	41.3 Å²	41.3	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-41.3	175.7	0	0	0	0	0	111.4	T415 D454 H459 E460 V461	T415-A457 HydrophobicContact CG2-CB 3.41Å; T415-A457 VanDerWaalsContact CG2-CB 3.41Å; D454-A457 PolarHBondContact O-N 3.44Å; A457-H459 VanDerWaalsContact C-N 3.33Å; A457-H459 PolarHBondContact O-N 3.27Å; A457-E460 WeakPolarHBondContact O-CB 3.4Å; A457-E460 PolarHBondContact O-N 3.23Å; A457-E460 VanDerWaalsContact O-N 3.16Å; A457-V461 WeakPolarHBondContact O-CG2 3.36Å; A457-V461 PolarHBondContact O-N 3.41Å
458	I	87.3	Confident	85.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-37.3	177.1	-63.9	176	0	0	0	111.2	I444 F447 M450 D454 R455 T456 E460 V461 M462 I484	I444-I458 HydrophobicContact CD1-CD1 4.1Å; F447-I458 HydrophobicContact CE2-CD1 3.82Å; F447-I458 HydrophobicContact CE2-CG2 4.47Å; F447-I458 HydrophobicContact CZ-CD1 4.36Å; M450-I458 HydrophobicContact CE-CD1 3.43Å; M450-I458 VanDerWaalsContact CE-CD1 3.43Å; M450-I458 HydrophobicContact SD-CD1 3.93Å; D454-I458 PolarHBondContact O-N 3.5Å; R455-I458 PolarHBondContact O-N 3.23Å; T456-I458 VanDerWaalsContact C-N 3.34Å; T456-I458 PolarHBondContact O-N 3.29Å; I458-E460 PolarHBondContact O-N 3.08Å; I458-V461 PolarHBondContact O-N 2.94Å; I458-M462 HydrophobicContact CG2-CG 4.1Å; I458-M462 HydrophobicContact CG2-SD 3.92Å; I458-M462 WeakPolarHBondContact O-CB 3.31Å; I458-M462 VanDerWaalsContact O-CG 3.29Å; I458-M462 WeakPolarHBondContact O-CG 3.28Å; I458-M462 PolarHBondContact O-N 3.02Å; I458-I484 HydrophobicContact CG2-CD1 3.9Å
459	H	87.5	Confident	85.4	Confident	41 Å²	41	43.5 Å²	43.5	19%	0.19	25%	0.246	C	C	.	.	H	α-helix	trans	-59.1	-37.1	173	-75.4	-54	0	0	0	112.8	R455 T456 A457 E463 L511 R514	R455-H459 PolarHBondContact O-CD2 3.05Å; R455-H459 PolarHBondContact O-N 3.44Å; T456-H459 WeakPolarHBondContact O-CB 3.39Å; T456-H459 PolarHBondContact O-N 3.46Å; A457-H459 VanDerWaalsContact C-N 3.33Å; A457-H459 PolarHBondContact O-N 3.27Å; H459-E463 PolarHBondContact O-N 3.42Å; H459-L511 VanDerWaalsContact CE1-CB 3.48Å; H459-L511 WeakPolarHBondContact CE1-CB 3.25Å; H459-R514 PolarHBondContact ND1-NE 3.14Å; H459-R514 VanDerWaalsContact O-CZ 3.27Å; H459-R514 PolarHBondContact O-NH1 2.94Å; H459-R514 PolarHBondContact O-NH2 2.98Å
460	E	87.8	Confident	85.3	Confident	42 Å²	42	43.6 Å²	43.6	20%	0.196	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-51.6	176.8	-160.6	-175	170.7	0	0	111.1	T456 A457 I458 M462 E463 Q464 T466 S468	T456-E460 PolarHBondContact O-N 2.98Å; A457-E460 WeakPolarHBondContact O-CB 3.4Å; A457-E460 PolarHBondContact O-N 3.23Å; A457-E460 VanDerWaalsContact O-N 3.16Å; I458-E460 PolarHBondContact O-N 3.08Å; E460-M462 VanDerWaalsContact C-N 3.32Å; E460-M462 PolarHBondContact O-N 3.33Å; E460-E463 PolarHBondContact O-N 2.99Å; E460-E463 VanDerWaalsContact O-N 3.1Å; E460-Q464 PolarHBondContact O-N 2.9Å; E460-T466 WeakPolarHBondContact CG-O 3.42Å; E460-S468 WeakPolarHBondContact OE1-CA 3.32Å; E460-S468 WeakPolarHBondContact OE1-CB 3.29Å; E460-S468 PolarHBondContact OE1-N 3.37Å; E460-S468 PolarHBondContact OE1-OG 2.8Å
461	V	88.4	Confident	85.2	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-43.8	179.6	178.3	0	0	0	0	111.7	L434 A457 I458 E463 Q465 I467 A480	L434-V461 HydrophobicContact CD1-CG2 3.91Å; A457-V461 WeakPolarHBondContact O-CG2 3.36Å; A457-V461 PolarHBondContact O-N 3.41Å; I458-V461 PolarHBondContact O-N 2.94Å; V461-E463 VanDerWaalsContact C-N 3.35Å; V461-E463 PolarHBondContact O-N 3.26Å; V461-Q465 WeakPolarHBondContact O-CA 3.41Å; V461-Q465 PolarHBondContact O-N 2.81Å; V461-I467 HydrophobicContact CG2-CD1 3.76Å; V461-I467 HydrophobicContact CG2-CG1 3.41Å; V461-I467 VanDerWaalsContact CG2-CG1 3.41Å; V461-A480 HydrophobicContact CG1-CB 4.28Å; V461-A480 HydrophobicContact CG2-CB 4.41Å
462	M	87.8	Confident	84.9	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.02	28%	0.284	C	S	.	.	H	α-helix	trans	-68.5	-30.1	179.6	-69.2	-174.5	95.9	0	0	113.1	R372 N376 I458 E460 I484 R514 F515	R372-M462 WeakPolarHBondContact CD-O 3.45Å; R372-M462 PolarHBondContact NH1-O 3.27Å; N376-M462 HydrophobicContact CB-CE 3.57Å; I458-M462 HydrophobicContact CG2-CG 4.1Å; I458-M462 HydrophobicContact CG2-SD 3.92Å; I458-M462 WeakPolarHBondContact O-CB 3.31Å; I458-M462 VanDerWaalsContact O-CG 3.29Å; I458-M462 WeakPolarHBondContact O-CG 3.28Å; I458-M462 PolarHBondContact O-N 3.02Å; E460-M462 VanDerWaalsContact C-N 3.32Å; E460-M462 PolarHBondContact O-N 3.33Å; M462-I484 HydrophobicContact CG-CD1 3.65Å; M462-I484 HydrophobicContact SD-CD1 4.33Å; M462-R514 HydrophobicContact CB-CB 4.32Å; M462-R514 HydrophobicContact CE-CB 3.82Å; M462-R514 WeakPolarHBondContact CE-O 2.98Å; M462-R514 HydrophobicContact SD-CB 3.87Å; M462-F515 HydrophobicContact CE-CD1 3.63Å; M462-F515 HydrophobicContact CE-CE1 3.66Å; M462-F515 HydrophobicContact CE-CG 4.08Å; M462-F515 HydrophobicContact CE-CZ 4.17Å
463	E	82.4	Confident	84.6	Confident	90 Å²	90	46.9 Å²	46.9	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-84.8	-52.6	179.7	-155.1	68.3	-178.8	0	0	112.1	H459 E460 V461 R514 R604	H459-E463 PolarHBondContact O-N 3.42Å; E460-E463 PolarHBondContact O-N 2.99Å; E460-E463 VanDerWaalsContact O-N 3.1Å; V461-E463 VanDerWaalsContact C-N 3.35Å; V461-E463 PolarHBondContact O-N 3.26Å; E463-R514 IonicContact OE2-CZ 3.12Å; E463-R514 IonicContact OE2-NH1 3.11Å; E463-R514 PolarHBondContact OE2-NH1 3.38Å; E463-R514 IonicContact OE2-NH2 2.7Å; E463-R604 IonicContact OE1-CZ 3.29Å; E463-R604 IonicContact OE1-NH2 3.92Å; E463-R604 PolarHBondContact OE1-NH2 3.16Å; E463-R604 IonicContact OE2-CZ 2.93Å; E463-R604 IonicContact OE2-NH2 3.38Å; E463-R604 PolarHBondContact OE2-NH2 3.28Å
464	Q	83.9	Confident	84.7	Confident	124 Å²	124	45.3 Å²	45.3	58%	0.579	28%	0.277	S	S	*	.	H	α-helix	trans	-106.2	-12.7	-165.2	-68.4	174.6	-0.2	0	0	112.6	E460 T466	E460-Q464 PolarHBondContact O-N 2.9Å; Q464-T466 WeakPolarHBondContact CB-OG1 3.34Å; Q464-T466 PolarHBondContact O-N 3.17Å
465	Q	88.6	Confident	84.8	Confident	22 Å²	22	52.3 Å²	52.3	10%	0.103	31%	0.311	C	S	.	.	S	Bend	trans	54	29.6	-170	-62.7	176.1	-55.7	0	0	112.5	R372 N374 V461 A480 R481	R372-Q465 VanDerWaalsContact CB-CD 3.5Å; R372-Q465 HydrophobicContact CB-CG 4.17Å; N374-Q465 PolarHBondContact ND2-NE2 2.61Å; N374-Q465 VanDerWaalsContact ND2-NE2 3.11Å; V461-Q465 WeakPolarHBondContact O-CA 3.41Å; V461-Q465 PolarHBondContact O-N 2.81Å; Q465-A480 CarbonylContact O-C 3.58Å; Q465-A480 PolarHBondContact O-N 3.41Å; Q465-R481 HydrophobicContact CB-CG 4.08Å
466	T	88.3	Confident	84.9	Confident	30 Å²	30	53.9 Å²	53.9	18%	0.184	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	152.5	177.1	56	0	0	0	0	109.8	E460 Q464 L478	E460-T466 WeakPolarHBondContact CG-O 3.42Å; Q464-T466 WeakPolarHBondContact CB-OG1 3.34Å; Q464-T466 PolarHBondContact O-N 3.17Å; T466-L478 CarbonylContact C-O 3.55Å; T466-L478 VanDerWaalsContact CA-O 3.26Å; T466-L478 WeakPolarHBondContact CA-O 3.49Å
467	I	88.7	Confident	84.9	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	115.4	173.6	-62.8	169.9	0	0	0	107.1	T415 L434 V435 V461 I469 S477 L478 A480	T415-I467 HydrophobicContact CG2-CG2 3.95Å; L434-I467 HydrophobicContact CB-CD1 4Å; L434-I467 HydrophobicContact CD1-CD1 4.49Å; V435-I467 HydrophobicContact CG2-CD1 3.77Å; V461-I467 HydrophobicContact CG2-CD1 3.76Å; V461-I467 HydrophobicContact CG2-CG1 3.41Å; V461-I467 VanDerWaalsContact CG2-CG1 3.41Å; I467-I469 HydrophobicContact CG2-CD1 4.17Å; I467-I469 HydrophobicContact CG2-CG1 3.88Å; I467-S477 CarbonylContact O-C 3.53Å; I467-S477 WeakPolarHBondContact O-CA 3.49Å; I467-L478 PolarHBondContact N-O 3.49Å; I467-L478 PolarHBondContact O-N 3.27Å; I467-A480 HydrophobicContact CD1-CB 3.76Å; I467-A480 HydrophobicContact CG1-CB 3.98Å
468	S	85.6	Confident	85.1	Confident	75 Å²	75	55.1 Å²	55.1	52%	0.524	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.7	174	59.3	0	0	0	0	110.1	E460	E460-S468 WeakPolarHBondContact OE1-CA 3.32Å; E460-S468 WeakPolarHBondContact OE1-CB 3.29Å; E460-S468 PolarHBondContact OE1-N 3.37Å; E460-S468 PolarHBondContact OE1-OG 2.8Å
469	I	84.6	Confident	85	Confident	10 Å²	10	59.9 Å²	59.9	5%	0.051	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	118.2	179.8	-54.5	-175.7	0	0	0	107.9	A416 L429 I467 K471 M475 T476 L478	A416-I469 HydrophobicContact CB-CD1 3.17Å; L429-I469 HydrophobicContact CD2-CG2 4.49Å; I467-I469 HydrophobicContact CG2-CD1 4.17Å; I467-I469 HydrophobicContact CG2-CG1 3.88Å; I469-K471 HydrophobicContact CG2-CB 4.09Å; I469-K471 HydrophobicContact CG2-CD 4.26Å; I469-K471 HydrophobicContact CG2-CG 4.1Å; I469-M475 WeakPolarHBondContact O-CA 2.98Å; I469-T476 PolarHBondContact N-O 2.92Å; I469-T476 PolarHBondContact O-N 3.48Å; I469-L478 HydrophobicContact CD1-CD1 3.8Å
470	A	83.3	Confident	85	Confident	81 Å²	81	57.9 Å²	57.9	67%	0.669	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	76.5	172.1	0	0	0	0	0	108.9	I474 M475	A470-I474 WeakPolarHBondContact CA-O 3.45Å; A470-M475 HydrophobicContact CB-CG 4.31Å
471	K	83	Confident	85	Confident	93 Å²	93	59.6 Å²	59.6	40%	0.404	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.6	-179.3	-69.9	-178.4	-176.8	170.1	0	110.7	V418 I469 G473 I474	V418-K471 HydrophobicContact CG2-CB 4.12Å; I469-K471 HydrophobicContact CG2-CB 4.09Å; I469-K471 HydrophobicContact CG2-CD 4.26Å; I469-K471 HydrophobicContact CG2-CG 4.1Å; K471-G473 PolarHBondContact O-N 3.13Å; K471-G473 VanDerWaalsContact O-N 3.13Å; K471-I474 PolarHBondContact N-O 3.39Å; K471-I474 PolarHBondContact O-N 2.81Å
472	A	79.5	Confident	85.1	Confident	66 Å²	66	59.7 Å²	59.7	55%	0.545	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	36.5	173.6	0	0	0	0	0	115.4	V418 M427 I474	V418-A472 HydrophobicContact CG1-CB 4.19Å; M427-A472 HydrophobicContact CE-CB 3.52Å; A472-I474 VanDerWaalsContact C-N 3.3Å; A472-I474 PolarHBondContact O-N 2.91Å
473	G	77.3	Confident	85.3	Confident	83 Å²	83	59.9 Å²	59.9	86%	0.856	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-2.2	178.9	0	0	0	0	0	115	K471	K471-G473 PolarHBondContact O-N 3.13Å; K471-G473 VanDerWaalsContact O-N 3.13Å
474	I	81.8	Confident	85.8	Confident	37 Å²	37	55.6 Å²	55.6	19%	0.19	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	114.7	174.6	-54.2	172.9	0	0	0	107.9	V418 M427 L429 A470 K471 A472 T476	V418-I474 HydrophobicContact CG1-CD1 4.24Å; M427-I474 HydrophobicContact CB-CD1 4Å; L429-I474 HydrophobicContact CD1-CG2 3.92Å; L429-I474 HydrophobicContact CG-CD1 4.35Å; A470-I474 WeakPolarHBondContact CA-O 3.45Å; K471-I474 PolarHBondContact N-O 3.39Å; K471-I474 PolarHBondContact O-N 2.81Å; A472-I474 VanDerWaalsContact C-N 3.3Å; A472-I474 PolarHBondContact O-N 2.91Å; I474-T476 HydrophobicContact CG2-CG2 3.5Å
475	M	84.7	Confident	86.3	Confident	169 Å²	169	49.7 Å²	49.7	83%	0.833	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	95.5	168	-65.9	-159.5	-57.7	0	0	108.1	I469 A470	I469-M475 WeakPolarHBondContact O-CA 2.98Å; A470-M475 HydrophobicContact CB-CG 4.31Å
476	T	85.1	Confident	86.5	Confident	57 Å²	57	48.7 Å²	48.7	35%	0.35	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	151.8	-179.3	54.5	0	0	0	0	110.2	L429 I469 I474	L429-T476 WeakPolarHBondContact CD1-OG1 3.48Å; I469-T476 PolarHBondContact N-O 2.92Å; I469-T476 PolarHBondContact O-N 3.48Å; I474-T476 HydrophobicContact CG2-CG2 3.5Å
477	S	84.9	Confident	86.6	Confident	85 Å²	85	47.3 Å²	47.3	59%	0.594	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.5	168.9	47.8	0	0	0	0	108.2	I467	I467-S477 CarbonylContact O-C 3.53Å; I467-S477 WeakPolarHBondContact O-CA 3.49Å
478	L	85.9	Confident	86.7	Confident	44 Å²	44	47.3 Å²	47.3	23%	0.23	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	138.5	174.2	-64.4	172.9	0	0	0	108.5	A416 V435 T466 I467 I469	A416-L478 HydrophobicContact CB-CD1 3.78Å; V435-L478 HydrophobicContact CG1-CD1 4.48Å; V435-L478 HydrophobicContact CG2-CB 4.37Å; V435-L478 HydrophobicContact CG2-CD1 4.11Å; T466-L478 CarbonylContact C-O 3.55Å; T466-L478 VanDerWaalsContact CA-O 3.26Å; T466-L478 WeakPolarHBondContact CA-O 3.49Å; I467-L478 PolarHBondContact N-O 3.49Å; I467-L478 PolarHBondContact O-N 3.27Å; I469-L478 HydrophobicContact CD1-CD1 3.8Å
479	N	86.9	Confident	86.8	Confident	99 Å²	99	45.8 Å²	45.8	53%	0.529	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	133.2	174.4	-64.3	-30	0	0	0	109.4
480	A	87.1	Confident	86.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	28%	0.281	C	S	.	.			trans	-137.7	70.6	178.3	0	0	0	0	0	109.3	V461 Q465 I467 C482	V461-A480 HydrophobicContact CG1-CB 4.28Å; V461-A480 HydrophobicContact CG2-CB 4.41Å; Q465-A480 CarbonylContact O-C 3.58Å; Q465-A480 PolarHBondContact O-N 3.41Å; I467-A480 HydrophobicContact CD1-CB 3.76Å; I467-A480 HydrophobicContact CG1-CB 3.98Å; A480-C482 PolarHBondContact O-N 3.24Å
481	R	88	Confident	86.7	Confident	78 Å²	78	44 Å²	44	29%	0.294	27%	0.267	S	S	.	.			trans	-81.6	51.3	176.8	-54.3	164.9	-69.2	178.8	-3	110.5	N374 D438 L439 Q465	N374-R481 VanDerWaalsContact ND2-C 3.3Å; N374-R481 PolarHBondContact ND2-O 3.4Å; D438-R481 VanDerWaalsContact OD1-CA 3.32Å; D438-R481 WeakPolarHBondContact OD1-CA 3.36Å; D438-R481 WeakPolarHBondContact OD1-CB 3.48Å; D438-R481 PolarHBondContact OD1-N 3.46Å; D438-R481 IonicContact OD1-NE 3.18Å; D438-R481 PolarHBondContact OD1-NE 3.46Å; D438-R481 IonicContact OD1-NH2 2.74Å; D438-R481 IonicContact OD2-CZ 3.87Å; D438-R481 IonicContact OD2-NE 2.78Å; D438-R481 IonicContact OD2-NH2 3.17Å; D438-R481 PolarHBondContact OD2-NH2 2.77Å; L439-R481 WeakPolarHBondContact CA-O 3.4Å; L439-R481 HydrophobicContact CD2-CB 4.26Å; L439-R481 PolarHBondContact N-O 3.13Å; Q465-R481 HydrophobicContact CB-CG 4.08Å
482	C	89.8	Confident	86.6	Confident	5 Å²	5	47 Å²	47	3%	0.034	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-86.5	155.2	175	63.3	0	0	0	0	110.7	N374 A437 A480	N374-C482 VanDerWaalsContact ND2-C 3.27Å; N374-C482 PolarHBondContact ND2-O 3.24Å; A437-C482 HydrophobicContact CB-CB 4.22Å; A437-C482 VanDerWaalsContact O-CB 3.26Å; A437-C482 WeakPolarHBondContact O-CB 3.46Å; A480-C482 PolarHBondContact O-N 3.24Å
483	S	91.8	Very high	86.6	Confident	7 Å²	7	45.2 Å²	45.2	5%	0.049	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.1	164.5	-57.1	0	0	0	0	108.5	N374 I375 G440 I441 C442	N374-S483 WeakPolarHBondContact CB-OG 3.3Å; I375-S483 WeakPolarHBondContact O-CB 3.25Å; G440-S483 PolarHBondContact O-N 3.45Å; I441-S483 CarbonylContact C-O 3.58Å; I441-S483 WeakPolarHBondContact CA-O 3.35Å; C442-S483 PolarHBondContact N-O 3.5Å
484	I	93.1	Very high	86.7	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.4	-176.8	-57.1	-179.2	0	0	0	109.5	N376 I377 I444 I458 M462 A486 F515	N376-I484 WeakPolarHBondContact CA-O 3.25Å; N376-I484 PolarHBondContact OD1-N 2.84Å; I377-I484 PolarHBondContact N-O 3.21Å; I377-I484 VanDerWaalsContact N-O 3.08Å; I444-I484 HydrophobicContact CD1-CG2 3.98Å; I458-I484 HydrophobicContact CG2-CD1 3.9Å; M462-I484 HydrophobicContact CG-CD1 3.65Å; M462-I484 HydrophobicContact SD-CD1 4.33Å; I484-A486 HydrophobicContact CG2-CB 4.45Å; I484-F515 HydrophobicContact CG2-CE1 4.43Å
485	L	94.4	Very high	86.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.2	165.7	-178.7	60	0	0	0	108.5	L354 L357 I377 L379 L391 I394 I441 C442 C443 I444	L354-L485 HydrophobicContact CD2-CD1 3.68Å; L354-L485 HydrophobicContact CD2-CD2 4.04Å; L357-L485 HydrophobicContact CD2-CB 3.87Å; L357-L485 HydrophobicContact CD2-CD1 3.98Å; L357-L485 HydrophobicContact CD2-CD2 4.07Å; L357-L485 HydrophobicContact CD2-CG 4.18Å; I377-L485 HydrophobicContact CB-CD1 3.95Å; I377-L485 HydrophobicContact CG2-CD1 4.13Å; I377-L485 WeakPolarHBondContact O-CA 3.5Å; L379-L485 HydrophobicContact CD1-CD1 4.47Å; L379-L485 HydrophobicContact CG-CD1 4.34Å; L391-L485 HydrophobicContact CD2-CB 4.2Å; L391-L485 HydrophobicContact CD2-CD2 3.67Å; L391-L485 HydrophobicContact CD2-CG 3.58Å; L391-L485 HydrophobicContact CG-CD2 4.28Å; L391-L485 HydrophobicContact CG-CG 4.45Å; I394-L485 HydrophobicContact CB-CD2 4.33Å; I394-L485 HydrophobicContact CD1-CD2 3.43Å; I394-L485 VanDerWaalsContact CD1-CD2 3.43Å; I394-L485 HydrophobicContact CG1-CD2 4.49Å; I394-L485 HydrophobicContact CG2-CD2 4.21Å; I441-L485 HydrophobicContact CG2-CB 4.12Å; C442-L485 PolarHBondContact O-N 2.62Å; C443-L485 WeakPolarHBondContact CA-O 3.21Å; I444-L485 PolarHBondContact N-O 3.3Å
486	A	92.1	Very high	86.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.9	-178.9	0	0	0	0	0	110.7	I377 C378 L379 I444 F447 I484 F515	I377-A486 PolarHBondContact O-N 2.89Å; C378-A486 CarbonylContact C-O 3.5Å; C378-A486 VanDerWaalsContact CA-O 3.31Å; C378-A486 WeakPolarHBondContact CA-O 3.13Å; C378-A486 HydrophobicContact CB-CB 4.47Å; L379-A486 PolarHBondContact N-O 3.36Å; I444-A486 CarbonylContact O-C 3.59Å; I444-A486 WeakPolarHBondContact O-CA 3.21Å; F447-A486 HydrophobicContact CB-CB 4.16Å; F447-A486 HydrophobicContact CD2-CB 3.68Å; F447-A486 HydrophobicContact CE2-CB 4.25Å; F447-A486 HydrophobicContact CG-CB 3.97Å; I484-A486 HydrophobicContact CG2-CB 4.45Å; A486-F515 HydrophobicContact CB-CE1 4.23Å; A486-F515 HydrophobicContact CB-CZ 3.98Å
487	A	91.9	Very high	86.2	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.1	160.9	0	0	0	0	0	110.4	L379 K387 L391 I444 E446 F447	L379-A487 CarbonylContact O-C 3.54Å; L379-A487 VanDerWaalsContact O-CA 3.31Å; L379-A487 WeakPolarHBondContact O-CA 3.42Å; K387-A487 HydrophobicContact CB-CB 4.39Å; L391-A487 HydrophobicContact CD1-CB 3.39Å; I444-A487 PolarHBondContact O-N 2.93Å; E446-A487 PolarHBondContact N-O 3.39Å; F447-A487 VanDerWaalsContact CB-O 3.28Å; F447-A487 WeakPolarHBondContact CB-O 3.16Å; F447-A487 PolarHBondContact N-O 3.39Å
488	A	89.4	Confident	85.9	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.017	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	152.9	176.9	0	0	0	0	0	110.8	L379 M380 G381 K387 F447	L379-A488 PolarHBondContact O-N 2.93Å; M380-A488 WeakPolarHBondContact CA-O 3.45Å; M380-A488 HydrophobicContact CE-CB 4.4Å; M380-A488 HydrophobicContact CG-CB 4.29Å; G381-A488 PolarHBondContact N-O 3.38Å; K387-A488 PolarHBondContact NZ-O 3.45Å; F447-A488 HydrophobicContact CB-CB 4.31Å
489	N	89	Confident	85.6	Confident	44 Å²	44	55.8 Å²	55.8	24%	0.235	27%	0.266	C	S	.	.			trans	-107.7	146.1	172.1	-61.9	-34.6	0	0	0	109.7	K387	K387-N489 PolarHBondContact NZ-OD1 2.86Å
490	P	85.3	Confident	85	Confident	9 Å²	9	53.6 Å²	53.6	6%	0.058	26%	0.258	C	S	.	.			trans	-57.1	149.4	168.3	-23.3	32.2	0	0	0	111.2	G381 Y492 G493	G381-P490 WeakPolarHBondContact O-CD 3.27Å; P490-Y492 PolarHBondContact O-N 2.9Å; P490-G493 PolarHBondContact O-N 3.11Å
491	A	79	Confident	84.3	Confident	45 Å²	45	54.8 Å²	54.8	37%	0.372	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.2	-172.4	0	0	0	0	0	114.7	N504	A491-N504 PolarHBondContact N-O 2.82Å
492	Y	81.7	Confident	83.5	Confident	155 Å²	155	56 Å²	56	61%	0.608	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	17.8	179.1	-58.8	-75.1	0	0	0	113.1	P490 R494 K499	P490-Y492 PolarHBondContact O-N 2.9Å; Y492-R494 PolarHBondContact O-N 2.97Å; Y492-K499 HydrophobicContact CE2-CD 4.48Å; Y492-K499 PolarHBondContact OH-NZ 2.95Å
493	G	79.7	Confident	82.9	Confident	29 Å²	29	61.7 Å²	61.7	30%	0.299	30%	0.299	S	S	.	.	S	Bend	trans	76.4	-36.7	-176.1	0	0	0	0	0	113.8	P383 P490	P383-G493 WeakPolarHBondContact CD-O 3.43Å; P490-G493 PolarHBondContact O-N 3.11Å
494	R	80.4	Confident	82.3	Confident	177 Å²	177	61.4 Å²	61.4	67%	0.668	30%	0.297	S	S	*	.	S	Bend	trans	-115.6	146.4	173.7	-71.9	-173.1	178.5	-170.3	-3.6	113	D382 Y492 N496	D382-R494 VanDerWaalsContact OD1-CA 3.25Å; D382-R494 WeakPolarHBondContact OD1-CA 3.37Å; Y492-R494 PolarHBondContact O-N 2.97Å; R494-N496 PolarHBondContact O-N 2.98Å
495	Y	81.5	Confident	81.4	Confident	29 Å²	29	61.9 Å²	61.9	11%	0.114	30%	0.3	C	S	.	.			trans	-69.3	124	173.8	-167.7	-97.9	0	0	0	111.6	D382 I501 N504 L520 L644	D382-Y495 PolarHBondContact OD1-N 2.99Å; Y495-I501 WeakPolarHBondContact OH-CG1 3.27Å; Y495-N504 HydrophobicContact CD2-CB 4.25Å; Y495-N504 HydrophobicContact CE2-CB 3.98Å; Y495-N504 VanDerWaalsContact CE2-ND2 3.33Å; Y495-N504 WeakPolarHBondContact CE2-ND2 3.43Å; Y495-L520 HydrophobicContact CD2-CD1 3.64Å; Y495-L520 HydrophobicContact CE2-CD1 3.62Å; Y495-L520 HydrophobicContact CG-CD1 4.39Å; Y495-L644 HydrophobicContact CE2-CD2 4.38Å; Y495-L644 WeakPolarHBondContact OH-CD2 3.47Å
496	N	81.7	Confident	80.6	Confident	64 Å²	64	69.1 Å²	69.1	34%	0.342	33%	0.333	S	S	.	.			trans	-99.4	113.9	176.8	-76.6	-47	0	0	0	110.2	R494 R498 K499 N504	R494-N496 PolarHBondContact O-N 2.98Å; N496-R498 PolarHBondContact O-N 2.83Å; N496-R498 VanDerWaalsContact O-N 3.14Å; N496-K499 PolarHBondContact O-N 2.79Å; N496-N504 PolarHBondContact O-ND2 2.79Å
497	P	76.5	Confident	79.9	Confident	108 Å²	108	69.7 Å²	69.7	70%	0.701	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-14	-176.2	27.7	-35.3	0	0	0	113.7
498	R	79.6	Confident	79.3	Confident	248 Å²	248	72.5 Å²	72.5	94%	0.936	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-15.4	178.5	-67.9	-173.5	176.2	175.8	-0.5	114	N496	N496-R498 PolarHBondContact O-N 2.83Å; N496-R498 VanDerWaalsContact O-N 3.14Å
499	K	78.3	Confident	78.8	Confident	71 Å²	71	74.6 Å²	74.6	31%	0.309	37%	0.372	S	S	.	.	S	Bend	trans	-103.2	149	-178.9	-72.9	-174.6	179.1	-176.1	0	109.3	Y492 N496 Q503 N504	Y492-K499 HydrophobicContact CE2-CD 4.48Å; Y492-K499 PolarHBondContact OH-NZ 2.95Å; N496-K499 PolarHBondContact O-N 2.79Å; K499-Q503 HydrophobicContact CB-CB 4.41Å; K499-N504 VanDerWaalsContact CB-OD1 3.28Å; K499-N504 WeakPolarHBondContact CB-OD1 3.27Å; K499-N504 PolarHBondContact O-ND2 2.81Å
500	S	74.8	Confident	78.4	Confident	52 Å²	52	75.3 Å²	75.3	36%	0.364	38%	0.384	S	S	.	.			trans	-65.5	156	173	64.7	0	0	0	0	110.8	E502 Q503 N504	S500-E502 PolarHBondContact O-N 2.74Å; S500-Q503 PolarHBondContact O-N 3.2Å; S500-N504 PolarHBondContact O-N 2.87Å; S500-N504 VanDerWaalsContact O-N 3.09Å
501	I	72.8	Confident	78.3	Confident	25 Å²	25	74.9 Å²	74.9	13%	0.128	38%	0.381	C	S	.	.	H	α-helix	trans	-53.4	-40.8	-179.9	-65.5	166.8	0	0	0	111.1	Y495 Q503 N504 I505 D597 T599 L644	Y495-I501 WeakPolarHBondContact OH-CG1 3.27Å; I501-Q503 PolarHBondContact O-N 2.84Å; I501-N504 PolarHBondContact O-N 2.91Å; I501-I505 HydrophobicContact CG2-CD1 3.49Å; I501-I505 VanDerWaalsContact CG2-CD1 3.49Å; I501-I505 WeakPolarHBondContact O-CB 3.47Å; I501-I505 WeakPolarHBondContact O-CG1 3.24Å; I501-I505 PolarHBondContact O-N 3.03Å; I501-D597 WeakPolarHBondContact CD1-O 3.5Å; I501-T599 HydrophobicContact CD1-CG2 3.92Å; I501-T599 HydrophobicContact CG2-CG2 4.4Å; I501-L644 HydrophobicContact CD1-CD1 3.69Å; I501-L644 HydrophobicContact CD1-CD2 4.17Å; I501-L644 HydrophobicContact CG1-CD2 4.21Å
502	E	71.9	Confident	78.5	Confident	105 Å²	105	74.4 Å²	74.4	49%	0.491	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-33.1	178.8	-58.7	-176.2	146.5	0	0	114	S500 I505 F600	S500-E502 PolarHBondContact O-N 2.74Å; E502-I505 CarbonylContact O-C 3.58Å; E502-F600 WeakPolarHBondContact OE1-CE2 3.33Å
503	Q	76.9	Confident	78.5	Confident	124 Å²	124	68.5 Å²	68.5	58%	0.579	35%	0.354	S	S	*	.	H	α-helix	trans	-81.4	-28.6	178.6	-68.8	179.8	0.1	0	0	111.5	K499 S500 I501	K499-Q503 HydrophobicContact CB-CB 4.41Å; S500-Q503 PolarHBondContact O-N 3.2Å; I501-Q503 PolarHBondContact O-N 2.84Å
504	N	78.6	Confident	78.8	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-76	-34.8	176	-77.5	-22.7	0	0	0	112.1	A491 Y495 N496 K499 S500 I501	A491-N504 PolarHBondContact N-O 2.82Å; Y495-N504 HydrophobicContact CD2-CB 4.25Å; Y495-N504 HydrophobicContact CE2-CB 3.98Å; Y495-N504 VanDerWaalsContact CE2-ND2 3.33Å; Y495-N504 WeakPolarHBondContact CE2-ND2 3.43Å; N496-N504 PolarHBondContact O-ND2 2.79Å; K499-N504 VanDerWaalsContact CB-OD1 3.28Å; K499-N504 WeakPolarHBondContact CB-OD1 3.27Å; K499-N504 PolarHBondContact O-ND2 2.81Å; S500-N504 PolarHBondContact O-N 2.87Å; S500-N504 VanDerWaalsContact O-N 3.09Å; I501-N504 PolarHBondContact O-N 2.91Å
505	I	73.8	Confident	79.2	Confident	11 Å²	11	61.1 Å²	61.1	6%	0.056	32%	0.317	C	S	.	.	S	Bend	trans	-108.5	100.6	-177.9	-57.3	165	0	0	0	106.9	M380 I501 E502 L507 L512	M380-I505 HydrophobicContact CE-CD1 4.06Å; M380-I505 HydrophobicContact CE-CG1 4.29Å; M380-I505 HydrophobicContact CE-CG2 3.42Å; M380-I505 VanDerWaalsContact CE-CG2 3.42Å; M380-I505 HydrophobicContact SD-CD1 3.37Å; M380-I505 WeakPolarHBondContact SD-CD1 3.49Å; M380-I505 HydrophobicContact SD-CG1 3.83Å; M380-I505 HydrophobicContact SD-CG2 4.1Å; I501-I505 HydrophobicContact CG2-CD1 3.49Å; I501-I505 VanDerWaalsContact CG2-CD1 3.49Å; I501-I505 WeakPolarHBondContact O-CB 3.47Å; I501-I505 WeakPolarHBondContact O-CG1 3.24Å; I501-I505 PolarHBondContact O-N 3.03Å; E502-I505 CarbonylContact O-C 3.58Å; I505-L507 HydrophobicContact CG2-CB 3.83Å; I505-L507 HydrophobicContact CG2-CD1 3.75Å; I505-L507 HydrophobicContact CG2-CG 3.79Å; I505-L507 PolarHBondContact O-N 3.02Å; I505-L512 HydrophobicContact CG2-CD2 4.36Å
506	Q	77.9	Confident	79.6	Confident	151 Å²	151	60.1 Å²	60.1	71%	0.706	31%	0.314	S	S	*	.			trans	-70.4	46.8	178.8	-164.4	-178	-14.6	0	0	112.5
507	L	77.3	Confident	79.9	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.068	30%	0.298	C	S	.	.	S	Bend	trans	-122.4	138.8	177.7	-61.9	175.6	0	0	0	109.4	M380 F447 I505 L512	M380-L507 HydrophobicContact CE-CD1 3.75Å; F447-L507 HydrophobicContact CD1-CD1 4Å; F447-L507 HydrophobicContact CD1-CD2 4.04Å; F447-L507 HydrophobicContact CE1-CD1 4.08Å; F447-L507 HydrophobicContact CE1-CD2 3.93Å; I505-L507 HydrophobicContact CG2-CB 3.83Å; I505-L507 HydrophobicContact CG2-CD1 3.75Å; I505-L507 HydrophobicContact CG2-CG 3.79Å; I505-L507 PolarHBondContact O-N 3.02Å; L507-L512 HydrophobicContact CB-CD2 4.31Å; L507-L512 HydrophobicContact CB-CG 4.47Å; L507-L512 HydrophobicContact CD1-CD2 4.16Å
508	P	80.3	Confident	80.5	Confident	60 Å²	60	53.6 Å²	53.6	39%	0.39	27%	0.273	S	S	.	.			trans	-66.8	141.1	177.5	27.3	-32.6	0	0	0	110.8	A510 L511 L512	P508-A510 PolarHBondContact O-N 2.78Å; P508-A510 VanDerWaalsContact O-N 3.07Å; P508-L511 HydrophobicContact CG-CB 4.14Å; P508-L511 WeakPolarHBondContact O-CB 3.13Å; P508-L511 PolarHBondContact O-N 2.91Å; P508-L512 PolarHBondContact O-N 3.32Å
509	A	76.9	Confident	80.9	Confident	46 Å²	46	42.2 Å²	42.2	38%	0.38	23%	0.23	S	C	.	.	H	α-helix	trans	-56	-28.7	178.5	0	0	0	0	0	113.3	L511 L512 S513	A509-L511 PolarHBondContact O-N 2.84Å; A509-L512 PolarHBondContact O-N 3.36Å; A509-S513 PolarHBondContact O-N 2.86Å
510	A	81.2	Confident	81.2	Confident	59 Å²	59	39.2 Å²	39.2	49%	0.488	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-33.8	174	0	0	0	0	0	112.9	P508 S513 R514	P508-A510 PolarHBondContact O-N 2.78Å; P508-A510 VanDerWaalsContact O-N 3.07Å; A510-S513 PolarHBondContact O-OG 2.92Å; A510-R514 WeakPolarHBondContact O-CD 3.48Å
511	L	83.8	Confident	81.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-78.7	-45.4	176.9	-161.2	143.6	0	0	0	111.1	F447 H459 P508 A509 S513 R514 F515	F447-L511 HydrophobicContact CE1-CD1 4.09Å; F447-L511 HydrophobicContact CE1-CD2 3.57Å; F447-L511 HydrophobicContact CZ-CD1 3.91Å; F447-L511 HydrophobicContact CZ-CD2 3.69Å; F447-L511 HydrophobicContact CZ-CG 4.4Å; H459-L511 VanDerWaalsContact CE1-CB 3.48Å; H459-L511 WeakPolarHBondContact CE1-CB 3.25Å; P508-L511 HydrophobicContact CG-CB 4.14Å; P508-L511 WeakPolarHBondContact O-CB 3.13Å; P508-L511 PolarHBondContact O-N 2.91Å; A509-L511 PolarHBondContact O-N 2.84Å; L511-S513 PolarHBondContact O-N 2.9Å; L511-R514 WeakPolarHBondContact O-CB 2.83Å; L511-R514 PolarHBondContact O-N 3Å; L511-F515 HydrophobicContact CD2-CD2 4.02Å; L511-F515 HydrophobicContact CD2-CE2 3.3Å; L511-F515 HydrophobicContact CD2-CZ 4.11Å
512	L	81.9	Confident	82.3	Confident	34 Å²	34	39.6 Å²	39.6	18%	0.178	21%	0.213	C	C	.	.	H	α-helix	trans	-57.6	-38.2	178.6	-62.7	177.1	0	0	0	111.9	M380 I505 L507 P508 A509 R514 F515 L518	M380-L512 HydrophobicContact CE-CD2 3.96Å; I505-L512 HydrophobicContact CG2-CD2 4.36Å; L507-L512 HydrophobicContact CB-CD2 4.31Å; L507-L512 HydrophobicContact CB-CG 4.47Å; L507-L512 HydrophobicContact CD1-CD2 4.16Å; P508-L512 PolarHBondContact O-N 3.32Å; A509-L512 PolarHBondContact O-N 3.36Å; L512-R514 PolarHBondContact O-N 2.89Å; L512-R514 VanDerWaalsContact O-N 3.1Å; L512-F515 PolarHBondContact O-N 2.9Å; L512-L518 HydrophobicContact CD2-CD1 3.76Å
513	S	82.4	Confident	82.9	Confident	32 Å²	32	38.5 Å²	38.5	22%	0.224	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-11.5	177.3	75.3	0	0	0	0	115.1	A509 A510 L511 R604	A509-S513 PolarHBondContact O-N 2.86Å; A510-S513 PolarHBondContact O-OG 2.92Å; L511-S513 PolarHBondContact O-N 2.9Å; S513-R604 WeakPolarHBondContact O-CD 3.29Å; S513-R604 PolarHBondContact OG-NH1 3.42Å
514	R	86.9	Confident	83.2	Confident	36 Å²	36	37.1 Å²	37.1	14%	0.136	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-16.6	-179.4	-66	164.1	171.9	-94.4	7.9	112.8	R372 H459 M462 E463 A510 L511 L512	R372-R514 PolarHBondContact NH1-O 3.27Å; R372-R514 PolarHBondContact NH2-O 3.13Å; H459-R514 PolarHBondContact ND1-NE 3.14Å; H459-R514 VanDerWaalsContact O-CZ 3.27Å; H459-R514 PolarHBondContact O-NH1 2.94Å; H459-R514 PolarHBondContact O-NH2 2.98Å; M462-R514 HydrophobicContact CB-CB 4.32Å; M462-R514 HydrophobicContact CE-CB 3.82Å; M462-R514 WeakPolarHBondContact CE-O 2.98Å; M462-R514 HydrophobicContact SD-CB 3.87Å; E463-R514 IonicContact OE2-CZ 3.12Å; E463-R514 IonicContact OE2-NH1 3.11Å; E463-R514 PolarHBondContact OE2-NH1 3.38Å; E463-R514 IonicContact OE2-NH2 2.7Å; A510-R514 WeakPolarHBondContact O-CD 3.48Å; L511-R514 WeakPolarHBondContact O-CB 2.83Å; L511-R514 PolarHBondContact O-N 3Å; L512-R514 PolarHBondContact O-N 2.89Å; L512-R514 VanDerWaalsContact O-N 3.1Å
515	F	88.5	Confident	83.3	Confident	14 Å²	14	42.9 Å²	42.9	6%	0.061	24%	0.24	C	C	.	.			trans	-77.3	138.5	168.8	-71.7	-67.1	0	0	0	109.6	N376 C378 F447 M462 I484 A486 L511 L512	N376-F515 HydrophobicContact CB-CD1 3.72Å; N376-F515 HydrophobicContact CB-CE1 4.2Å; C378-F515 HydrophobicContact CB-CD1 4.03Å; C378-F515 HydrophobicContact CB-CD2 4.02Å; C378-F515 HydrophobicContact CB-CE1 4.1Å; C378-F515 HydrophobicContact CB-CE2 4.02Å; C378-F515 HydrophobicContact CB-CG 4.01Å; C378-F515 HydrophobicContact CB-CZ 4.1Å; F447-F515 HydrophobicContact CE2-CZ 4.43Å; F447-F515 HydrophobicContact CZ-CZ 4.23Å; M462-F515 HydrophobicContact CE-CD1 3.63Å; M462-F515 HydrophobicContact CE-CE1 3.66Å; M462-F515 HydrophobicContact CE-CG 4.08Å; M462-F515 HydrophobicContact CE-CZ 4.17Å; I484-F515 HydrophobicContact CG2-CE1 4.43Å; A486-F515 HydrophobicContact CB-CE1 4.23Å; A486-F515 HydrophobicContact CB-CZ 3.98Å; L511-F515 HydrophobicContact CD2-CD2 4.02Å; L511-F515 HydrophobicContact CD2-CE2 3.3Å; L511-F515 HydrophobicContact CD2-CZ 4.11Å; L512-F515 PolarHBondContact O-N 2.9Å
516	D	89.6	Confident	83.9	Confident	9 Å²	9	46.3 Å²	46.3	5%	0.048	26%	0.258	C	S	.	.	S	Bend	trans	-83.8	-37.2	179.5	-63.8	-65	0	0	0	110.3	R372 I375 N376 S608 R611	R372-D516 IonicContact NH2-OD1 3.49Å; R372-D516 PolarHBondContact NH2-OD1 2.81Å; R372-D516 IonicContact NH2-OD2 2.69Å; R372-D516 PolarHBondContact NH2-OD2 3.35Å; I375-D516 HydrophobicContact CG2-CB 4.19Å; N376-D516 PolarHBondContact N-OD2 3.26Å; N376-D516 VanDerWaalsContact N-OD2 3.07Å; N376-D516 PolarHBondContact O-N 3.15Å; D516-S608 WeakPolarHBondContact OD1-CB 3.33Å; D516-S608 PolarHBondContact OD1-OG 3.18Å; D516-R611 IonicContact OD1-NH1 3.15Å; D516-R611 PolarHBondContact OD1-NH1 2.9Å; D516-R611 IonicContact OD2-NH1 3.73Å
517	L	88.4	Confident	84.5	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.7	173.5	-66.1	174.4	0	0	0	110.8	A353 N376 I377 C378 L612 M637	A353-L517 HydrophobicContact CB-CD1 3.85Å; N376-L517 PolarHBondContact O-N 2.99Å; I377-L517 WeakPolarHBondContact CA-O 3.5Å; I377-L517 HydrophobicContact CD1-CD1 4.4Å; I377-L517 HydrophobicContact CG1-CB 4.35Å; C378-L517 PolarHBondContact N-O 3.43Å; L517-L612 HydrophobicContact CD1-CD1 4.23Å; L517-L612 HydrophobicContact CD1-CD2 3.92Å; L517-L612 HydrophobicContact CD2-CD1 3.99Å; L517-L612 HydrophobicContact CG-CD1 4.16Å; L517-M637 HydrophobicContact CD2-CG 3.9Å
518	L	88	Confident	85.1	Confident	32 Å²	32	47.1 Å²	47.1	17%	0.168	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.9	171.9	-174.3	153.2	0	0	0	107.7	M380 L512 S640	M380-L518 HydrophobicContact CE-CD1 4.02Å; M380-L518 HydrophobicContact SD-CD1 3.85Å; M380-L518 HydrophobicContact SD-CD2 3.88Å; M380-L518 HydrophobicContact SD-CG 3.97Å; L512-L518 HydrophobicContact CD2-CD1 3.76Å; L518-S640 WeakPolarHBondContact O-CB 3.47Å
519	W	88.8	Confident	85.2	Confident	9 Å²	9	46.4 Å²	46.4	3%	0.034	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	122.7	177	-76.8	108.2	0	0	0	109.5	D349 V350 A353 C378 L379 M380 L636 M639	D349-W519 HydrophobicContact CB-CH2 3.83Å; D349-W519 HydrophobicContact CB-CZ2 4.31Å; D349-W519 HydrophobicContact CB-CZ3 4.47Å; V350-W519 HydrophobicContact CG2-CD2 4.19Å; V350-W519 HydrophobicContact CG2-CE3 4.36Å; V350-W519 HydrophobicContact CG2-CG 4.32Å; A353-W519 HydrophobicContact CB-CZ2 4.35Å; C378-W519 PolarHBondContact O-N 3.15Å; L379-W519 HydrophobicContact CD2-CB 3.92Å; L379-W519 HydrophobicContact CD2-CG 4.33Å; M380-W519 WeakPolarHBondContact CA-O 3.36Å; M380-W519 WeakPolarHBondContact CB-O 3.44Å; M380-W519 PolarHBondContact N-O 3.36Å; W519-L636 HydrophobicContact CZ2-CD2 4.43Å; W519-M639 HydrophobicContact CH2-CB 3.86Å; W519-M639 HydrophobicContact CZ3-CB 4.16Å
520	L	85.5	Confident	85.8	Confident	9 Å²	9	47.7 Å²	47.7	5%	0.047	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	108	169.3	-171.5	125	0	0	0	109.2	M380 Y495 Q522 S643 L644	M380-L520 CarbonylContact O-C 3.59Å; M380-L520 WeakPolarHBondContact O-CA 3.4Å; Y495-L520 HydrophobicContact CD2-CD1 3.64Å; Y495-L520 HydrophobicContact CE2-CD1 3.62Å; Y495-L520 HydrophobicContact CG-CD1 4.39Å; L520-Q522 HydrophobicContact CD2-CB 4.32Å; L520-S643 WeakPolarHBondContact O-CB 3.47Å; L520-L644 HydrophobicContact CB-CD2 4.41Å; L520-L644 HydrophobicContact CD1-CD2 3.95Å; L520-L644 HydrophobicContact CD2-CD2 4.02Å; L520-L644 HydrophobicContact CG-CD2 4.33Å
521	I	86.4	Confident	86.3	Confident	11 Å²	11	49.6 Å²	49.6	6%	0.056	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	104.9	177.3	-50.8	175.5	0	0	0	107.6	H347 V350 M380 G381 D382 V385 K387	H347-I521 WeakPolarHBondContact CE1-CG2 3.29Å; V350-I521 HydrophobicContact CG2-CD1 4.32Å; M380-I521 PolarHBondContact O-N 3.31Å; G381-I521 WeakPolarHBondContact CA-O 3.37Å; D382-I521 PolarHBondContact N-O 3.34Å; V385-I521 HydrophobicContact CB-CG2 3.9Å; V385-I521 HydrophobicContact CG1-CG2 3.8Å; V385-I521 HydrophobicContact CG2-CB 4.29Å; V385-I521 HydrophobicContact CG2-CG2 4.08Å; K387-I521 HydrophobicContact CG-CD1 4.4Å
522	Q	83.9	Confident	86.5	Confident	73 Å²	73	56.4 Å²	56.4	34%	0.341	31%	0.305	S	S	.	.			trans	-95.3	132.8	173.3	-172.4	179	15.5	0	0	109.7	L520 K524	L520-Q522 HydrophobicContact CD2-CB 4.32Å; Q522-K524 HydrophobicContact CG-CG 4.09Å; Q522-K524 PolarHBondContact O-N 2.83Å
523	D	83.9	Confident	86.7	Confident	82 Å²	82	58 Å²	58	44%	0.439	31%	0.313	S	S	.	.			trans	-85.6	92.9	170.6	-174.2	20.8	0	0	0	108.9	D382 V385	D382-D523 HydrophobicContact CB-CB 4.41Å; D382-D523 PolarHBondContact OD2-N 3.12Å; V385-D523 HydrophobicContact CG1-CB 4.22Å
524	K	82.6	Confident	87.1	Confident	96 Å²	96	58.9 Å²	58.9	42%	0.417	32%	0.322	S	S	.	.			trans	-88.3	123.7	174.5	-67.9	-179.8	-176.2	170.9	0	107.8	Q522 D526 D647	Q522-K524 HydrophobicContact CG-CG 4.09Å; Q522-K524 PolarHBondContact O-N 2.83Å; K524-D526 PolarHBondContact O-N 3.12Å; K524-D647 IonicContact NZ-OD2 3.28Å
525	P	82.1	Confident	87.2	Confident	122 Å²	122	62.6 Å²	62.6	79%	0.792	34%	0.341	S	S	*	.			trans	-68.5	108.4	179.4	28.1	-33.2	0	0	0	109.5
526	D	86.3	Confident	87.2	Confident	83 Å²	83	62.8 Å²	62.8	44%	0.444	34%	0.342	S	S	.	.			trans	-129.8	122.9	177.3	179.9	21.2	0	0	0	109.6	K524 D528 A529 D530	K524-D526 PolarHBondContact O-N 3.12Å; D526-D528 VanDerWaalsContact C-N 3.29Å; D526-D528 PolarHBondContact O-N 3.34Å; D526-A529 HydrophobicContact CB-CB 4.02Å; D526-A529 PolarHBondContact O-N 3.33Å; D526-D530 VanDerWaalsContact O-CB 3.31Å; D526-D530 WeakPolarHBondContact O-CB 3.32Å; D526-D530 PolarHBondContact O-N 3.34Å
527	A	89.4	Confident	87.1	Confident	77 Å²	77	66.1 Å²	66.1	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-62.9	-35.4	-170.8	0	0	0	0	0	112.7	L531	A527-L531 WeakPolarHBondContact O-CB 3.3Å; A527-L531 PolarHBondContact O-N 3.19Å; A527-L531 VanDerWaalsContact O-N 3.1Å
528	D	89.9	Confident	87.2	Confident	104 Å²	104	69.5 Å²	69.5	56%	0.556	38%	0.38	S	S	*	.	H	α-helix	trans	-76.6	-41.5	-179.2	-73.1	-18.1	0	0	0	111.7	D526 L531 R532	D526-D528 VanDerWaalsContact C-N 3.29Å; D526-D528 PolarHBondContact O-N 3.34Å; D528-L531 PolarHBondContact O-N 3.02Å; D528-R532 WeakPolarHBondContact O-CG 3.25Å; D528-R532 PolarHBondContact O-N 2.96Å; D528-R532 VanDerWaalsContact O-N 3.13Å
529	A	83.5	Confident	87.3	Confident	44 Å²	44	71.2 Å²	71.2	36%	0.364	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-43.4	175.8	0	0	0	0	0	111.3	D526 L531 R532 L533	D526-A529 HydrophobicContact CB-CB 4.02Å; D526-A529 PolarHBondContact O-N 3.33Å; A529-L531 PolarHBondContact O-N 2.99Å; A529-R532 PolarHBondContact O-N 3.41Å; A529-L533 WeakPolarHBondContact O-CB 3.35Å; A529-L533 PolarHBondContact O-N 2.91Å
530	D	89.1	Confident	87.3	Confident	74 Å²	74	72.1 Å²	72.1	40%	0.396	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-41.6	177.5	-71.6	-20.1	0	0	0	111.6	D526 L533 A534	D526-D530 VanDerWaalsContact O-CB 3.31Å; D526-D530 WeakPolarHBondContact O-CB 3.32Å; D526-D530 PolarHBondContact O-N 3.34Å; D530-L533 PolarHBondContact O-N 3.33Å; D530-A534 VanDerWaalsContact O-CB 3.25Å; D530-A534 WeakPolarHBondContact O-CB 3.34Å; D530-A534 PolarHBondContact O-N 3.13Å
531	L	91.1	Very high	87.4	Confident	98 Å²	98	78.9 Å²	78.9	51%	0.513	42%	0.422	S	S	.	.	H	α-helix	trans	-61.8	-46.2	176.5	-177.5	66.1	0	0	0	111.5	A527 D528 A529 A534 Q535	A527-L531 WeakPolarHBondContact O-CB 3.3Å; A527-L531 PolarHBondContact O-N 3.19Å; A527-L531 VanDerWaalsContact O-N 3.1Å; D528-L531 PolarHBondContact O-N 3.02Å; A529-L531 PolarHBondContact O-N 2.99Å; L531-A534 PolarHBondContact O-N 3.44Å; L531-Q535 WeakPolarHBondContact O-CB 3.4Å; L531-Q535 VanDerWaalsContact O-CG 3.29Å; L531-Q535 WeakPolarHBondContact O-CG 3.36Å; L531-Q535 PolarHBondContact O-N 3.41Å
532	R	87.8	Confident	87.6	Confident	143 Å²	143	85 Å²	85	54%	0.54	45%	0.451	S	S	.	.	H	α-helix	trans	-64.6	-42.7	178.3	-69.2	177.4	-168.6	165.9	6.7	111.6	Y345 D528 A529 Q535 H536	Y345-R532 HydrophobicContact CE1-CB 3.84Å; D528-R532 WeakPolarHBondContact O-CG 3.25Å; D528-R532 PolarHBondContact O-N 2.96Å; D528-R532 VanDerWaalsContact O-N 3.13Å; A529-R532 PolarHBondContact O-N 3.41Å; R532-Q535 PolarHBondContact O-N 2.85Å; R532-H536 WeakPolarHBondContact O-CB 3.41Å; R532-H536 PolarHBondContact O-N 2.97Å
533	L	87.6	Confident	87.8	Confident	68 Å²	68	86.5 Å²	86.5	36%	0.356	46%	0.457	S	S	.	.	H	α-helix	trans	-61.9	-45.9	176.5	-179.5	63.2	0	0	0	111.3	A529 D530 H536 I537	A529-L533 WeakPolarHBondContact O-CB 3.35Å; A529-L533 PolarHBondContact O-N 2.91Å; D530-L533 PolarHBondContact O-N 3.33Å; L533-H536 WeakPolarHBondContact O-CB 3.37Å; L533-H536 PolarHBondContact O-N 3.36Å; L533-I537 HydrophobicContact CD1-CD1 3.92Å; L533-I537 HydrophobicContact CD1-CG1 4.3Å; L533-I537 HydrophobicContact CG-CD1 3.84Å; L533-I537 WeakPolarHBondContact O-CG1 3.46Å; L533-I537 PolarHBondContact O-N 3.36Å
534	A	89.8	Confident	87.8	Confident	50 Å²	50	88 Å²	88	41%	0.413	47%	0.474	S	S	.	.	H	α-helix	trans	-63.9	-42.8	178.7	0	0	0	0	0	112.1	D530 L531 H536 I537 T538	D530-A534 VanDerWaalsContact O-CB 3.25Å; D530-A534 WeakPolarHBondContact O-CB 3.34Å; D530-A534 PolarHBondContact O-N 3.13Å; L531-A534 PolarHBondContact O-N 3.44Å; A534-H536 VanDerWaalsContact C-N 3.3Å; A534-H536 PolarHBondContact O-N 3.02Å; A534-I537 PolarHBondContact O-N 2.98Å; A534-T538 WeakPolarHBondContact O-CB 3.37Å; A534-T538 VanDerWaalsContact O-CG2 3.3Å; A534-T538 WeakPolarHBondContact O-CG2 3.26Å; A534-T538 PolarHBondContact O-N 3.47Å; A534-T538 PolarHBondContact O-OG1 2.94Å
535	Q	90.1	Very high	87.7	Confident	114 Å²	114	91.3 Å²	91.3	53%	0.533	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-40.7	174.1	-74.9	175.9	-1.2	0	0	111.6	L531 R532 T538 Y539	L531-Q535 WeakPolarHBondContact O-CB 3.4Å; L531-Q535 VanDerWaalsContact O-CG 3.29Å; L531-Q535 WeakPolarHBondContact O-CG 3.36Å; L531-Q535 PolarHBondContact O-N 3.41Å; R532-Q535 PolarHBondContact O-N 2.85Å; Q535-T538 WeakPolarHBondContact CA-OG1 3.45Å; Q535-T538 PolarHBondContact O-OG1 2.93Å; Q535-Y539 WeakPolarHBondContact O-CB 3.4Å; Q535-Y539 PolarHBondContact O-N 2.94Å
536	H	87.2	Confident	87.4	Confident	18 Å²	18	86.7 Å²	86.7	8%	0.083	45%	0.452	C	S	.	.	H	α-helix	trans	-65.7	-48.8	177.7	-169.6	-85.6	0	0	0	112.2	P342 E343 Y345 R532 L533 A534 T538 Y539 V540 P547	P342-H536 PolarHBondContact O-CE1 3.43Å; E343-H536 PolarHBondContact O-CE1 3.43Å; E343-H536 PolarHBondContact O-ND1 2.96Å; Y345-H536 AromaticContact CD2-CD2 3.87Å; Y345-H536 HydrophobicContact CG-CB 4.29Å; R532-H536 WeakPolarHBondContact O-CB 3.41Å; R532-H536 PolarHBondContact O-N 2.97Å; L533-H536 WeakPolarHBondContact O-CB 3.37Å; L533-H536 PolarHBondContact O-N 3.36Å; A534-H536 VanDerWaalsContact C-N 3.3Å; A534-H536 PolarHBondContact O-N 3.02Å; H536-T538 PolarHBondContact O-N 3.44Å; H536-Y539 WeakPolarHBondContact O-CB 3.41Å; H536-Y539 PolarHBondContact O-N 2.95Å; H536-V540 WeakPolarHBondContact O-CG2 3.34Å; H536-V540 PolarHBondContact O-N 2.91Å; H536-P547 WeakPolarHBondContact CD2-CG 3.39Å; H536-P547 WeakPolarHBondContact NE2-CD 3.36Å
537	I	88.4	Confident	86.9	Confident	79 Å²	79	84.2 Å²	84.2	41%	0.405	44%	0.44	S	S	.	.	H	α-helix	trans	-62.6	-46.2	-179.6	-67.8	168.8	0	0	0	110.5	L533 A534 Y539 V540 H541	L533-I537 HydrophobicContact CD1-CD1 3.92Å; L533-I537 HydrophobicContact CD1-CG1 4.3Å; L533-I537 HydrophobicContact CG-CD1 3.84Å; L533-I537 WeakPolarHBondContact O-CG1 3.46Å; L533-I537 PolarHBondContact O-N 3.36Å; A534-I537 PolarHBondContact O-N 2.98Å; I537-Y539 VanDerWaalsContact C-N 3.28Å; I537-Y539 PolarHBondContact O-N 3.01Å; I537-V540 PolarHBondContact O-N 2.87Å; I537-H541 PolarHBondContact O-CD2 3.47Å; I537-H541 VanDerWaalsContact O-CD2 3.26Å; I537-H541 PolarHBondContact O-N 3.08Å
538	T	90.3	Very high	86.1	Confident	73 Å²	73	86.1 Å²	86.1	45%	0.448	45%	0.446	S	S	.	.	H	α-helix	trans	-61	-39.5	178.1	50.4	0	0	0	0	111.7	A534 Q535 H536 H541 Q542	A534-T538 WeakPolarHBondContact O-CB 3.37Å; A534-T538 VanDerWaalsContact O-CG2 3.3Å; A534-T538 WeakPolarHBondContact O-CG2 3.26Å; A534-T538 PolarHBondContact O-N 3.47Å; A534-T538 PolarHBondContact O-OG1 2.94Å; Q535-T538 WeakPolarHBondContact CA-OG1 3.45Å; Q535-T538 PolarHBondContact O-OG1 2.93Å; H536-T538 PolarHBondContact O-N 3.44Å; T538-H541 PolarHBondContact O-N 3.2Å; T538-Q542 VanDerWaalsContact O-CG 3.24Å; T538-Q542 WeakPolarHBondContact O-CG 3.34Å; T538-Q542 PolarHBondContact O-N 2.66Å
539	Y	89.9	Confident	85	Confident	68 Å²	68	84.1 Å²	84.1	27%	0.267	44%	0.438	S	S	.	.	H	α-helix	trans	-63.2	-46.7	175.3	-172.8	-81.2	0	0	0	112.5	Q535 H536 I537 H541 Q542 H543 R545 Q546 P547	Q535-Y539 WeakPolarHBondContact O-CB 3.4Å; Q535-Y539 PolarHBondContact O-N 2.94Å; H536-Y539 WeakPolarHBondContact O-CB 3.41Å; H536-Y539 PolarHBondContact O-N 2.95Å; I537-Y539 VanDerWaalsContact C-N 3.28Å; I537-Y539 PolarHBondContact O-N 3.01Å; Y539-H541 VanDerWaalsContact C-N 3.28Å; Y539-H541 PolarHBondContact O-N 2.99Å; Y539-Q542 PolarHBondContact O-N 2.96Å; Y539-Q542 VanDerWaalsContact O-N 3.11Å; Y539-H543 HydrophobicContact CD1-CB 4.5Å; Y539-H543 AromaticContact CD2-CE1 3.96Å; Y539-H543 AromaticContact CD2-ND1 3.69Å; Y539-H543 HydrophobicContact CE1-CB 4Å; Y539-H543 AromaticContact CE1-ND1 3.86Å; Y539-H543 AromaticContact CE2-CE1 3.68Å; Y539-H543 AromaticContact CE2-ND1 3.55Å; Y539-H543 AromaticContact CG-ND1 3.95Å; Y539-H543 AromaticContact CZ-CG 3.89Å; Y539-H543 AromaticContact CZ-ND1 3.65Å; Y539-H543 PolarHBondContact O-N 3.22Å; Y539-H543 PolarHBondContact O-ND1 3.02Å; Y539-R545 VanDerWaalsContact CD1-O 3.25Å; Y539-R545 WeakPolarHBondContact CD1-O 3.45Å; Y539-R545 VanDerWaalsContact CE1-O 3.25Å; Y539-R545 WeakPolarHBondContact CE1-O 3.42Å; Y539-Q546 VanDerWaalsContact CE1-C 3.47Å; Y539-Q546 WeakPolarHBondContact CE1-O 3.2Å; Y539-P547 HydrophobicContact CD1-CB 3.85Å; Y539-P547 HydrophobicContact CD1-CG 4.26Å; Y539-P547 VanDerWaalsContact CD1-N 3.31Å; Y539-P547 HydrophobicContact CD2-CB 4.42Å; Y539-P547 HydrophobicContact CE1-CB 4.03Å; Y539-P547 VanDerWaalsContact CE1-N 3.33Å; Y539-P547 HydrophobicContact CG-CB 4.06Å
540	V	88.6	Confident	84	Confident	28 Å²	28	92 Å²	92	17%	0.17	47%	0.467	C	S	.	.	H	α-helix	trans	-58.4	-41.8	177.9	170.9	0	0	0	0	110.7	H536 I537 S544	H536-V540 WeakPolarHBondContact O-CG2 3.34Å; H536-V540 PolarHBondContact O-N 2.91Å; I537-V540 PolarHBondContact O-N 2.87Å; V540-S544 WeakPolarHBondContact O-CA 3.46Å; V540-S544 PolarHBondContact O-N 3.03Å
541	H	87.4	Confident	83	Confident	152 Å²	152	91.2 Å²	91.2	70%	0.704	46%	0.46	S	S	*	.	H	α-helix	trans	-70.2	-31.1	176.7	-81.1	-76.1	0	0	0	113.9	I537 T538 Y539	I537-H541 PolarHBondContact O-CD2 3.47Å; I537-H541 VanDerWaalsContact O-CD2 3.26Å; I537-H541 PolarHBondContact O-N 3.08Å; T538-H541 PolarHBondContact O-N 3.2Å; Y539-H541 VanDerWaalsContact C-N 3.28Å; Y539-H541 PolarHBondContact O-N 2.99Å
542	Q	90.9	Very high	82.1	Confident	140 Å²	140	92.3 Å²	92.3	65%	0.654	47%	0.471	S	S	*	.	H	α-helix	trans	-74.8	-41.4	178.5	-75.2	171.6	14	0	0	112.9	T538 Y539	T538-Q542 VanDerWaalsContact O-CG 3.24Å; T538-Q542 WeakPolarHBondContact O-CG 3.34Å; T538-Q542 PolarHBondContact O-N 2.66Å; Y539-Q542 PolarHBondContact O-N 2.96Å; Y539-Q542 VanDerWaalsContact O-N 3.11Å
543	H	87.6	Confident	81.3	Confident	103 Å²	103	87.5 Å²	87.5	48%	0.477	46%	0.458	S	S	.	.	H	α-helix	trans	-110.4	-6.4	-170.4	-60.7	86.8	0	0	0	113.7	Y539 R545	Y539-H543 HydrophobicContact CD1-CB 4.5Å; Y539-H543 AromaticContact CD2-CE1 3.96Å; Y539-H543 AromaticContact CD2-ND1 3.69Å; Y539-H543 HydrophobicContact CE1-CB 4Å; Y539-H543 AromaticContact CE1-ND1 3.86Å; Y539-H543 AromaticContact CE2-CE1 3.68Å; Y539-H543 AromaticContact CE2-ND1 3.55Å; Y539-H543 AromaticContact CG-ND1 3.95Å; Y539-H543 AromaticContact CZ-CG 3.89Å; Y539-H543 AromaticContact CZ-ND1 3.65Å; Y539-H543 PolarHBondContact O-N 3.22Å; Y539-H543 PolarHBondContact O-ND1 3.02Å; H543-R545 PolarHBondContact O-N 3.07Å
544	S	84.2	Confident	81	Confident	113 Å²	113	86 Å²	86	79%	0.79	45%	0.45	S	S	*	.	S	Bend	trans	51.6	25.8	-170.4	-56.5	0	0	0	0	113.2	V540	V540-S544 WeakPolarHBondContact O-CA 3.46Å; V540-S544 PolarHBondContact O-N 3.03Å
545	R	80.6	Confident	80.6	Confident	167 Å²	167	88.7 Å²	88.7	63%	0.63	46%	0.458	S	S	*	.	S	Bend	trans	-145.6	148.6	179.8	-168.9	174	179.5	173.7	1.1	108.7	Y539 H543	Y539-R545 VanDerWaalsContact CD1-O 3.25Å; Y539-R545 WeakPolarHBondContact CD1-O 3.45Å; Y539-R545 VanDerWaalsContact CE1-O 3.25Å; Y539-R545 WeakPolarHBondContact CE1-O 3.42Å; H543-R545 PolarHBondContact O-N 3.07Å
546	Q	76.7	Confident	80.2	Confident	25 Å²	25	85.9 Å²	85.9	12%	0.117	45%	0.445	C	S	.	.			trans	-59.8	150.9	171.9	73.7	-154.8	66.3	0	0	111.5	Y539	Y539-Q546 VanDerWaalsContact CE1-C 3.47Å; Y539-Q546 WeakPolarHBondContact CE1-O 3.2Å
547	P	76	Confident	79.9	Confident	30 Å²	30	88.7 Å²	88.7	20%	0.195	46%	0.457	C	S	.	.			trans	-57.3	147	170.3	22.4	-29.9	0	0	0	110.9	H536 Y539 T549	H536-P547 WeakPolarHBondContact CD2-CG 3.39Å; H536-P547 WeakPolarHBondContact NE2-CD 3.36Å; Y539-P547 HydrophobicContact CD1-CB 3.85Å; Y539-P547 HydrophobicContact CD1-CG 4.26Å; Y539-P547 VanDerWaalsContact CD1-N 3.31Å; Y539-P547 HydrophobicContact CD2-CB 4.42Å; Y539-P547 HydrophobicContact CE1-CB 4.03Å; Y539-P547 VanDerWaalsContact CE1-N 3.33Å; Y539-P547 HydrophobicContact CG-CB 4.06Å; P547-T549 PolarHBondContact O-N 3.41Å
548	P	71	Confident	79.6	Confident	117 Å²	117	86.5 Å²	86.5	76%	0.76	45%	0.446	S	S	*	.			trans	-62.3	104.5	179.9	25.4	-32.9	0	0	0	109.7
549	T	66.9	Low	79.3	Confident	62 Å²	62	83.1 Å²	83.1	38%	0.38	43%	0.425	S	S	.	.			trans	-79.5	167.3	171.8	40.7	0	0	0	0	110.8	P547 F551	P547-T549 PolarHBondContact O-N 3.41Å; T549-F551 PolarHBondContact O-N 2.8Å; T549-F551 PolarHBondContact OG1-O 3.31Å
550	H	63.8	Low	79	Confident	211 Å²	211	81.3 Å²	81.3	98%	0.977	42%	0.418	S	S	*	.	S	Bend	trans	-56	-21.6	175.1	-71.9	-74.1	0	0	0	113.9
551	F	66.9	Low	78.7	Confident	56 Å²	56	82.9 Å²	82.9	25%	0.246	42%	0.421	C	S	.	.	S	Bend	trans	-119.6	149.5	176.4	67.3	-87.3	0	0	0	111.5	K335 G338 T549	K335-F551 HydrophobicContact CG-CB 4.46Å; G338-F551 VanDerWaalsContact C-CZ 3.43Å; G338-F551 VanDerWaalsContact CA-CZ 3.47Å; T549-F551 PolarHBondContact O-N 2.8Å; T549-F551 PolarHBondContact OG1-O 3.31Å
552	T	71.5	Confident	78.5	Confident	122 Å²	122	76 Å²	76	75%	0.748	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-80.4	126.4	167.9	48.8	0	0	0	0	109.7
553	P	72.9	Confident	78.2	Confident	42 Å²	42	70 Å²	70	27%	0.273	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-64.3	140.1	178.1	29.3	-36	0	0	0	110.2
554	I	79.4	Confident	78	Confident	36 Å²	36	66.6 Å²	66.6	19%	0.185	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-74.9	141.5	176.2	-65.4	160.5	0	0	0	109.2	L336 S339 L558 M559	L336-I554 HydrophobicContact CD2-CD1 3.72Å; S339-I554 PolarHBondContact OG-N 2.98Å; S339-I554 VanDerWaalsContact OG-N 3.14Å; I554-L558 HydrophobicContact CG2-CB 3.96Å; I554-L558 HydrophobicContact CG2-CD2 3.57Å; I554-L558 HydrophobicContact CG2-CG 4.26Å; I554-M559 HydrophobicContact CG2-CB 4.34Å
555	D	83.1	Confident	78	Confident	107 Å²	107	63.4 Å²	63.4	57%	0.572	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-63.9	145.3	176.3	-176.9	38.5	0	0	0	111.9	K557 L558 M559	D555-K557 PolarHBondContact O-N 2.7Å; D555-K557 VanDerWaalsContact OD2-CB 3.3Å; D555-K557 WeakPolarHBondContact OD2-CB 3.38Å; D555-K557 PolarHBondContact OD2-N 3.19Å; D555-L558 PolarHBondContact O-N 2.91Å; D555-M559 WeakPolarHBondContact O-CB 3.2Å; D555-M559 PolarHBondContact O-N 3.47Å
556	M	81.3	Confident	78.2	Confident	55 Å²	55	55.4 Å²	55.4	27%	0.271	29%	0.294	S	S	.	.	H	α-helix	trans	-60.8	-33.1	-177.4	-65.6	-176.5	74.6	0	0	111.8	Y393 R396 L397 R560	Y393-M556 HydrophobicContact CE2-CE 4.15Å; Y393-M556 HydrophobicContact CE2-SD 4.31Å; R396-M556 HydrophobicContact CB-CE 4.21Å; L397-M556 HydrophobicContact CB-CE 4.26Å; L397-M556 HydrophobicContact CD1-CB 4.43Å; L397-M556 HydrophobicContact CD1-CE 4.28Å; M556-R560 WeakPolarHBondContact O-CB 3.41Å; M556-R560 PolarHBondContact O-N 2.9Å
557	K	81.3	Confident	78.6	Confident	76 Å²	76	58.2 Å²	58.2	33%	0.33	31%	0.306	S	S	.	.	H	α-helix	trans	-66.4	-49.3	179.1	-161.9	176.9	-168.6	-178.8	0	111.1	L314 D555 R560 R561	L314-K557 VanDerWaalsContact CD1-NZ 3.28Å; D555-K557 PolarHBondContact O-N 2.7Å; D555-K557 VanDerWaalsContact OD2-CB 3.3Å; D555-K557 WeakPolarHBondContact OD2-CB 3.38Å; D555-K557 PolarHBondContact OD2-N 3.19Å; K557-R560 PolarHBondContact O-N 3.4Å; K557-R561 VanDerWaalsContact CE-NH2 3.34Å; K557-R561 WeakPolarHBondContact O-CG 3.34Å; K557-R561 PolarHBondContact O-N 3.32Å
558	L	82.1	Confident	79	Confident	33 Å²	33	64.9 Å²	64.9	17%	0.173	33%	0.332	C	S	.	.	H	α-helix	trans	-61.5	-44.7	176.5	-165.3	85	0	0	0	110.9	L319 E323 I327 I554 D555 R560 R561 Y562	L319-L558 HydrophobicContact CD2-CD1 4.23Å; E323-L558 HydrophobicContact CB-CD1 4.44Å; E323-L558 HydrophobicContact CG-CD1 4.3Å; E323-L558 WeakPolarHBondContact OE2-CD1 3.17Å; I327-L558 HydrophobicContact CD1-CD2 3.85Å; I327-L558 HydrophobicContact CD1-CG 4.25Å; I327-L558 HydrophobicContact CG1-CD2 4.24Å; I554-L558 HydrophobicContact CG2-CB 3.96Å; I554-L558 HydrophobicContact CG2-CD2 3.57Å; I554-L558 HydrophobicContact CG2-CG 4.26Å; D555-L558 PolarHBondContact O-N 2.91Å; L558-R560 VanDerWaalsContact C-N 3.33Å; L558-R560 PolarHBondContact O-N 3.44Å; L558-R561 PolarHBondContact O-N 3.18Å; L558-Y562 WeakPolarHBondContact O-CB 3.42Å; L558-Y562 PolarHBondContact O-N 2.99Å
559	M	83.4	Confident	79.7	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-59.9	-42.6	179.1	-170.6	178.2	-173.2	0	0	111.9	L336 I340 L355 L397 I554 D555 Y562 I563	L336-M559 HydrophobicContact CD2-CE 4.28Å; L336-M559 HydrophobicContact CD2-CG 4.33Å; I340-M559 HydrophobicContact CD1-CE 3.72Å; I340-M559 HydrophobicContact CG1-CE 3.35Å; I340-M559 HydrophobicContact CG1-SD 4.27Å; L355-M559 HydrophobicContact CD1-CE 3.71Å; L397-M559 HydrophobicContact CD1-CB 4.35Å; L397-M559 HydrophobicContact CD1-CG 4.28Å; L397-M559 HydrophobicContact CD1-SD 3.98Å; L397-M559 HydrophobicContact CD2-CE 3.95Å; L397-M559 HydrophobicContact CD2-SD 3.69Å; L397-M559 HydrophobicContact CG-SD 4.47Å; I554-M559 HydrophobicContact CG2-CB 4.34Å; D555-M559 WeakPolarHBondContact O-CB 3.2Å; D555-M559 PolarHBondContact O-N 3.47Å; M559-Y562 PolarHBondContact O-N 3.45Å; M559-I563 HydrophobicContact CE-CD1 4.13Å; M559-I563 HydrophobicContact CG-CD1 3.9Å; M559-I563 WeakPolarHBondContact O-CD1 3.47Å; M559-I563 VanDerWaalsContact O-CG1 3.26Å; M559-I563 WeakPolarHBondContact O-CG1 3.44Å; M559-I563 PolarHBondContact O-N 3.16Å
560	R	84.3	Confident	80.7	Confident	30 Å²	30	68.3 Å²	68.3	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-65.1	-42.3	178.9	-167	-177	-66.8	149.1	-3.1	112.1	T309 R396 L397 L399 M556 K557 L558 I563 A564	T309-R560 PolarHBondContact OG1-NH1 2.86Å; R396-R560 PolarHBondContact O-NH2 3.39Å; L397-R560 PolarHBondContact O-NE 3.23Å; L399-R560 HydrophobicContact CD1-CG 4.4Å; L399-R560 VanDerWaalsContact CD2-CD 3.44Å; L399-R560 HydrophobicContact CD2-CG 3.89Å; L399-R560 HydrophobicContact CG-CG 3.73Å; M556-R560 WeakPolarHBondContact O-CB 3.41Å; M556-R560 PolarHBondContact O-N 2.9Å; K557-R560 PolarHBondContact O-N 3.4Å; L558-R560 VanDerWaalsContact C-N 3.33Å; L558-R560 PolarHBondContact O-N 3.44Å; R560-I563 PolarHBondContact O-N 3.16Å; R560-A564 WeakPolarHBondContact O-CB 3.24Å; R560-A564 PolarHBondContact O-N 3.37Å
561	R	80.9	Confident	82	Confident	62 Å²	62	58.4 Å²	58.4	23%	0.234	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-45.2	174.7	-67.5	179.7	-163.6	162.4	1.6	111.2	L319 K557 L558 I563 A564 L565	L319-R561 HydrophobicContact CD1-CB 4.36Å; K557-R561 VanDerWaalsContact CE-NH2 3.34Å; K557-R561 WeakPolarHBondContact O-CG 3.34Å; K557-R561 PolarHBondContact O-N 3.32Å; L558-R561 PolarHBondContact O-N 3.18Å; R561-I563 PolarHBondContact O-N 3.04Å; R561-A564 WeakPolarHBondContact O-CB 3.34Å; R561-A564 PolarHBondContact O-N 2.95Å; R561-L565 PolarHBondContact O-N 3.08Å
562	Y	83.3	Confident	83	Confident	8 Å²	8	60.6 Å²	60.6	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-45.8	178.5	-173.6	-91	0	0	0	112.2	I327 F332 L336 L558 M559 A564 L565 C566 L619 M621	I327-Y562 HydrophobicContact CD1-CD2 3.9Å; I327-Y562 HydrophobicContact CG2-CD2 3.92Å; I327-Y562 HydrophobicContact CG2-CE2 3.64Å; F332-Y562 AromaticContact CE1-CE1 3.68Å; F332-Y562 HydrophobicContact CE1-CE1 3.68Å; F332-Y562 AromaticContact CE1-CZ 3.66Å; F332-Y562 VanDerWaalsContact CE1-OH 3.24Å; F332-Y562 WeakPolarHBondContact CE1-OH 3.39Å; F332-Y562 HydrophobicContact CE2-CE1 4.26Å; F332-Y562 AromaticContact CZ-CD1 3.88Å; F332-Y562 HydrophobicContact CZ-CD1 3.88Å; F332-Y562 AromaticContact CZ-CE1 3.17Å; F332-Y562 HydrophobicContact CZ-CE1 3.17Å; F332-Y562 HydrophobicContact CZ-CE2 4.11Å; F332-Y562 AromaticContact CZ-CZ 3.27Å; F332-Y562 WeakPolarHBondContact CZ-OH 3.4Å; L336-Y562 HydrophobicContact CD1-CD1 4.36Å; L336-Y562 HydrophobicContact CD1-CE1 4.29Å; L558-Y562 WeakPolarHBondContact O-CB 3.42Å; L558-Y562 PolarHBondContact O-N 2.99Å; M559-Y562 PolarHBondContact O-N 3.45Å; Y562-A564 VanDerWaalsContact C-N 3.29Å; Y562-A564 PolarHBondContact O-N 3.08Å; Y562-L565 PolarHBondContact O-N 3.48Å; Y562-L565 VanDerWaalsContact O-N 3.16Å; Y562-C566 VanDerWaalsContact CD1-SG 3.56Å; Y562-C566 WeakPolarHBondContact CE1-SG 3.2Å; Y562-C566 PolarHBondContact O-N 2.77Å; Y562-C566 PolarHBondContact O-SG 2.84Å; Y562-L619 PolarHBondContact OH-O 3.46Å; Y562-M621 HydrophobicContact CD2-CE 4.2Å; Y562-M621 HydrophobicContact CE1-CE 4.01Å; Y562-M621 HydrophobicContact CE2-CE 3.6Å; Y562-M621 VanDerWaalsContact CZ-CE 3.5Å
563	I	85.7	Confident	83.8	Confident	12 Å²	12	56.7 Å²	56.7	6%	0.062	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-39.7	176.1	-67.5	163	0	0	0	110.9	L358 V359 M559 R560 R561 L565 C566 K567	L358-I563 HydrophobicContact CB-CD1 4.16Å; L358-I563 HydrophobicContact CB-CG2 4.38Å; L358-I563 HydrophobicContact CD1-CD1 4.21Å; V359-I563 HydrophobicContact CG2-CG2 4.49Å; M559-I563 HydrophobicContact CE-CD1 4.13Å; M559-I563 HydrophobicContact CG-CD1 3.9Å; M559-I563 WeakPolarHBondContact O-CD1 3.47Å; M559-I563 VanDerWaalsContact O-CG1 3.26Å; M559-I563 WeakPolarHBondContact O-CG1 3.44Å; M559-I563 PolarHBondContact O-N 3.16Å; R560-I563 PolarHBondContact O-N 3.16Å; R561-I563 PolarHBondContact O-N 3.04Å; I563-L565 VanDerWaalsContact C-N 3.32Å; I563-L565 PolarHBondContact O-N 2.94Å; I563-C566 WeakPolarHBondContact O-CB 3.35Å; I563-C566 PolarHBondContact O-N 2.95Å; I563-K567 WeakPolarHBondContact O-CG 3.31Å; I563-K567 PolarHBondContact O-N 3.48Å; I563-K567 VanDerWaalsContact O-N 3.08Å
564	A	83.6	Confident	84.6	Confident	32 Å²	32	56.8 Å²	56.8	26%	0.264	28%	0.277	S	S	.	.	H	α-helix	trans	-63.8	-37.8	176.4	0	0	0	0	0	112.1	L399 R560 R561 Y562 K567	L399-A564 HydrophobicContact CD1-CB 4.15Å; R560-A564 WeakPolarHBondContact O-CB 3.24Å; R560-A564 PolarHBondContact O-N 3.37Å; R561-A564 WeakPolarHBondContact O-CB 3.34Å; R561-A564 PolarHBondContact O-N 2.95Å; Y562-A564 VanDerWaalsContact C-N 3.29Å; Y562-A564 PolarHBondContact O-N 3.08Å; A564-K567 PolarHBondContact O-N 2.97Å
565	L	83.6	Confident	85	Confident	46 Å²	46	63.6 Å²	63.6	24%	0.241	31%	0.308	C	S	.	.	H	α-helix	trans	-66.4	-44.4	174.2	-161	153.4	0	0	0	111.2	L319 L324 R561 Y562 I563 K567 K568 M621	L319-L565 HydrophobicContact CD1-CB 4.27Å; L319-L565 HydrophobicContact CD1-CD1 3.53Å; L324-L565 HydrophobicContact CD1-CD1 4.42Å; R561-L565 PolarHBondContact O-N 3.08Å; Y562-L565 PolarHBondContact O-N 3.48Å; Y562-L565 VanDerWaalsContact O-N 3.16Å; I563-L565 VanDerWaalsContact C-N 3.32Å; I563-L565 PolarHBondContact O-N 2.94Å; L565-K567 PolarHBondContact O-N 2.81Å; L565-K568 WeakPolarHBondContact O-CB 3.49Å; L565-K568 PolarHBondContact O-N 2.85Å; L565-K568 VanDerWaalsContact O-N 3.11Å; L565-M621 HydrophobicContact CB-CE 4.13Å; L565-M621 HydrophobicContact CD2-CE 3.26Å; L565-M621 HydrophobicContact CD2-SD 3.51Å; L565-M621 VanDerWaalsContact CD2-SD 3.51Å; L565-M621 HydrophobicContact CG-CE 4.24Å
566	C	84.3	Confident	85.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-55.6	-40.8	176.3	-65.3	0	0	0	0	112	V359 Y562 I563 K568 R569 M621	V359-C566 HydrophobicContact CG1-CB 4.04Å; Y562-C566 VanDerWaalsContact CD1-SG 3.56Å; Y562-C566 WeakPolarHBondContact CE1-SG 3.2Å; Y562-C566 PolarHBondContact O-N 2.77Å; Y562-C566 PolarHBondContact O-SG 2.84Å; I563-C566 WeakPolarHBondContact O-CB 3.35Å; I563-C566 PolarHBondContact O-N 2.95Å; C566-K568 VanDerWaalsContact C-N 3.25Å; C566-K568 PolarHBondContact O-N 2.94Å; C566-R569 PolarHBondContact O-N 3.18Å; C566-M621 HydrophobicContact CB-CE 4.18Å; C566-M621 WeakPolarHBondContact SG-CE 3.49Å
567	K	84.8	Confident	85.7	Confident	83 Å²	83	63 Å²	63	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-63.7	-26.6	-179.1	-79.7	-176	178.1	-173	0	113.9	L358 V359 I563 A564 L565 R569	L358-K567 WeakPolarHBondContact O-CE 3.49Å; L358-K567 PolarHBondContact O-NZ 3.25Å; V359-K567 VanDerWaalsContact O-CE 3.31Å; V359-K567 WeakPolarHBondContact O-CE 3.39Å; V359-K567 VanDerWaalsContact O-CG 3.29Å; V359-K567 WeakPolarHBondContact O-CG 3.42Å; I563-K567 WeakPolarHBondContact O-CG 3.31Å; I563-K567 PolarHBondContact O-N 3.48Å; I563-K567 VanDerWaalsContact O-N 3.08Å; A564-K567 PolarHBondContact O-N 2.97Å; L565-K567 PolarHBondContact O-N 2.81Å; K567-R569 VanDerWaalsContact C-N 3.25Å; K567-R569 PolarHBondContact O-N 3.46Å
568	K	84.8	Confident	86	Confident	171 Å²	171	61.5 Å²	61.5	74%	0.743	31%	0.313	S	S	*	.	H	α-helix	trans	-68.7	-25.9	178.3	-66.4	-179.1	-179.3	179	0	112	L565 C566	L565-K568 WeakPolarHBondContact O-CB 3.49Å; L565-K568 PolarHBondContact O-N 2.85Å; L565-K568 VanDerWaalsContact O-N 3.11Å; C566-K568 VanDerWaalsContact C-N 3.25Å; C566-K568 PolarHBondContact O-N 2.94Å
569	R	86	Confident	86.4	Confident	111 Å²	111	66 Å²	66	42%	0.419	34%	0.337	S	S	.	.			trans	-79.1	143.5	-178.6	-64.5	-69.1	178.1	172.8	-3.8	112	C566 K567 R618 M621 D623	C566-R569 PolarHBondContact O-N 3.18Å; K567-R569 VanDerWaalsContact C-N 3.25Å; K567-R569 PolarHBondContact O-N 3.46Å; R569-R618 PolarHBondContact O-NE 3.39Å; R569-R618 PolarHBondContact O-NH2 2.75Å; R569-M621 HydrophobicContact CG-SD 4.25Å; R569-D623 IonicContact NH1-OD1 2.97Å
570	Q	88	Confident	86.7	Confident	139 Å²	139	69.4 Å²	69.4	65%	0.65	35%	0.35	S	S	*	.			trans	-128.6	82.1	-179.2	-63.9	-176.9	8	0	0	109.8
571	P	90.4	Very high	87	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.019	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-66.9	148.4	-179.5	24.6	-33.8	0	0	0	112.7	V362 T614 A617 R618 D623 V625	V362-P571 HydrophobicContact CG2-CG 3.93Å; P571-T614 WeakPolarHBondContact CG-O 3.34Å; P571-A617 HydrophobicContact CB-CB 3.86Å; P571-A617 HydrophobicContact CG-CB 3.92Å; P571-R618 HydrophobicContact CG-CG 3.81Å; P571-D623 CarbonylContact C-O 3.51Å; P571-D623 VanDerWaalsContact CA-O 3.25Å; P571-D623 WeakPolarHBondContact CA-O 3.43Å; P571-V625 HydrophobicContact CB-CG2 4.49Å
572	V	88.9	Confident	87.4	Confident	103 Å²	103	68.6 Å²	68.6	62%	0.624	36%	0.355	S	S	*	.	B	Isolated β-bridge	trans	-104	142.6	176.9	-175.2	0	0	0	0	110	P574 D623 A624 V625	V572-P574 WeakPolarHBondContact O-CD 3.46Å; V572-D623 PolarHBondContact N-O 2.66Å; V572-A624 WeakPolarHBondContact O-CA 3.45Å; V572-V625 PolarHBondContact O-N 3.38Å; V572-V625 VanDerWaalsContact O-N 3.15Å
573	V	87.5	Confident	87.7	Confident	39 Å²	39	71 Å²	71	24%	0.236	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-84.4	119.7	174.3	-178.5	0	0	0	0	108.7	I581 L610 T614 V625	V573-I581 HydrophobicContact CG1-CD1 4.34Å; V573-L610 HydrophobicContact CG1-CD2 4.3Å; V573-L610 HydrophobicContact CG2-CD2 4.3Å; V573-T614 HydrophobicContact CG2-CG2 3.98Å; V573-V625 HydrophobicContact CG2-CG2 4.14Å
574	P	90.9	Very high	87.6	Confident	44 Å²	44	70.8 Å²	70.8	29%	0.286	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-73.1	145.7	178.2	29.9	-34.4	0	0	0	111.7	V572 V576 L577 V625	V572-P574 WeakPolarHBondContact O-CD 3.46Å; P574-V576 VanDerWaalsContact C-N 3.25Å; P574-V576 PolarHBondContact O-N 2.64Å; P574-L577 HydrophobicContact CG-CB 4.36Å; P574-L577 HydrophobicContact CG-CD1 3.64Å; P574-L577 HydrophobicContact CG-CG 3.88Å; P574-L577 PolarHBondContact O-N 2.91Å; P574-V625 WeakPolarHBondContact CD-O 3.29Å; P574-V625 WeakPolarHBondContact CG-O 3.42Å
575	E	87.4	Confident	87.8	Confident	179 Å²	179	70.4 Å²	70.4	84%	0.836	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-62.4	-30.9	-177.5	-64.8	-174.1	168	0	0	113.1	L577 A578	E575-L577 PolarHBondContact O-N 3.23Å; E575-L577 VanDerWaalsContact O-N 3.16Å; E575-A578 VanDerWaalsContact O-CB 3.24Å; E575-A578 WeakPolarHBondContact O-CB 3.34Å; E575-A578 PolarHBondContact O-N 3.03Å
576	V	89.8	Confident	88	Confident	131 Å²	131	72.6 Å²	72.6	79%	0.794	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-59.6	-29	178.9	-176.3	0	0	0	0	112.3	P574	P574-V576 VanDerWaalsContact C-N 3.25Å; P574-V576 PolarHBondContact O-N 2.64Å
577	L	88.9	Confident	88	Confident	18 Å²	18	79.3 Å²	79.3	9%	0.094	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-84.5	-12.3	179	-66.5	179.5	0	0	0	113.1	P574 E575 D579 Y580 I581 V625 K627 V630	P574-L577 HydrophobicContact CG-CB 4.36Å; P574-L577 HydrophobicContact CG-CD1 3.64Å; P574-L577 HydrophobicContact CG-CG 3.88Å; P574-L577 PolarHBondContact O-N 2.91Å; E575-L577 PolarHBondContact O-N 3.23Å; E575-L577 VanDerWaalsContact O-N 3.16Å; L577-D579 PolarHBondContact O-N 3.45Å; L577-Y580 PolarHBondContact O-N 3.06Å; L577-Y580 VanDerWaalsContact O-N 3.17Å; L577-I581 HydrophobicContact CB-CD1 4.14Å; L577-I581 WeakPolarHBondContact O-CD1 3.36Å; L577-I581 WeakPolarHBondContact O-CG1 3.33Å; L577-I581 PolarHBondContact O-N 3.33Å; L577-V625 HydrophobicContact CD1-CG1 4.37Å; L577-V625 VanDerWaalsContact CD1-O 3.27Å; L577-V625 WeakPolarHBondContact CD1-O 3.25Å; L577-K627 HydrophobicContact CD2-CB 3.87Å; L577-K627 HydrophobicContact CD2-CG 4.25Å; L577-V630 HydrophobicContact CD1-CG2 4.44Å
578	A	88.3	Confident	87.8	Confident	45 Å²	45	76.1 Å²	76.1	37%	0.372	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-42.7	-177.5	0	0	0	0	0	112	E575 Y580 I581 T582	E575-A578 VanDerWaalsContact O-CB 3.24Å; E575-A578 WeakPolarHBondContact O-CB 3.34Å; E575-A578 PolarHBondContact O-N 3.03Å; A578-Y580 VanDerWaalsContact C-N 3.3Å; A578-Y580 PolarHBondContact O-N 3.28Å; A578-I581 PolarHBondContact O-N 3.1Å; A578-T582 WeakPolarHBondContact O-CB 3.32Å; A578-T582 VanDerWaalsContact O-CG2 3.25Å; A578-T582 WeakPolarHBondContact O-CG2 3.45Å; A578-T582 PolarHBondContact O-N 2.92Å; A578-T582 PolarHBondContact O-OG1 3.42Å
579	D	89.5	Confident	87.6	Confident	127 Å²	127	73.2 Å²	73.2	68%	0.679	39%	0.386	S	S	*	.	H	α-helix	trans	-64.8	-36.6	176.8	-68.3	-20	0	0	0	111.6	L577 T582 A583	L577-D579 PolarHBondContact O-N 3.45Å; D579-T582 WeakPolarHBondContact CA-OG1 3.31Å; D579-T582 PolarHBondContact O-OG1 3Å; D579-A583 WeakPolarHBondContact O-CB 3.25Å; D579-A583 PolarHBondContact O-N 3.43Å
580	Y	90.4	Very high	87.6	Confident	74 Å²	74	75.2 Å²	75.2	29%	0.29	40%	0.398	S	S	.	.	H	α-helix	trans	-68.8	-46.7	177.6	-175.8	-112	0	0	0	112	L577 A578 T582 A583 A584 K627 V630 N631 M634	L577-Y580 PolarHBondContact O-N 3.06Å; L577-Y580 VanDerWaalsContact O-N 3.17Å; A578-Y580 VanDerWaalsContact C-N 3.3Å; A578-Y580 PolarHBondContact O-N 3.28Å; Y580-T582 VanDerWaalsContact C-N 3.31Å; Y580-T582 PolarHBondContact O-N 3.18Å; Y580-A583 PolarHBondContact O-N 3.33Å; Y580-A584 WeakPolarHBondContact O-CB 3.42Å; Y580-A584 PolarHBondContact O-N 3.05Å; Y580-K627 HydrophobicContact CD1-CG 4.16Å; Y580-K627 HydrophobicContact CE1-CD 4.49Å; Y580-K627 HydrophobicContact CE1-CG 3.91Å; Y580-K627 VanDerWaalsContact CZ-CE 3.43Å; Y580-V630 HydrophobicContact CD1-CG1 4.17Å; Y580-V630 HydrophobicContact CE1-CG1 4.11Å; Y580-N631 WeakPolarHBondContact CE1-OD1 3.35Å; Y580-N631 PolarHBondContact OH-OD1 3.31Å; Y580-M634 HydrophobicContact CE1-CE 3.94Å
581	I	89.1	Confident	87	Confident	6 Å²	6	73.2 Å²	73.2	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-64.6	-38.6	179.5	-63.6	161.9	0	0	0	110.5	V573 L577 A578 Y585 L606 I609 L610 V630	V573-I581 HydrophobicContact CG1-CD1 4.34Å; L577-I581 HydrophobicContact CB-CD1 4.14Å; L577-I581 WeakPolarHBondContact O-CD1 3.36Å; L577-I581 WeakPolarHBondContact O-CG1 3.33Å; L577-I581 PolarHBondContact O-N 3.33Å; A578-I581 PolarHBondContact O-N 3.1Å; I581-Y585 WeakPolarHBondContact O-CB 3.34Å; I581-Y585 PolarHBondContact O-N 3.49Å; I581-L606 HydrophobicContact CG2-CD1 3.53Å; I581-I609 HydrophobicContact CG2-CG2 4.41Å; I581-L610 HydrophobicContact CD1-CD2 3.84Å; I581-V630 HydrophobicContact CD1-CG2 4.25Å; I581-V630 HydrophobicContact CG1-CG1 3.87Å; I581-V630 HydrophobicContact CG1-CG2 4.18Å
582	T	89.4	Confident	86.2	Confident	69 Å²	69	74 Å²	74	42%	0.423	40%	0.395	S	S	.	.	H	α-helix	trans	-68.3	-42.9	177.3	52.7	0	0	0	0	112	A578 D579 Y580 Y585 V586	A578-T582 WeakPolarHBondContact O-CB 3.32Å; A578-T582 VanDerWaalsContact O-CG2 3.25Å; A578-T582 WeakPolarHBondContact O-CG2 3.45Å; A578-T582 PolarHBondContact O-N 2.92Å; A578-T582 PolarHBondContact O-OG1 3.42Å; D579-T582 WeakPolarHBondContact CA-OG1 3.31Å; D579-T582 PolarHBondContact O-OG1 3Å; Y580-T582 VanDerWaalsContact C-N 3.31Å; Y580-T582 PolarHBondContact O-N 3.18Å; T582-Y585 PolarHBondContact O-N 3.01Å; T582-V586 VanDerWaalsContact O-CG2 3.31Å; T582-V586 WeakPolarHBondContact O-CG2 3.5Å; T582-V586 PolarHBondContact O-N 3.31Å
583	A	89.6	Confident	85.5	Confident	58 Å²	58	78.2 Å²	78.2	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-59	-47.6	174.3	0	0	0	0	0	111.7	D579 Y580 Y585 V586 E587	D579-A583 WeakPolarHBondContact O-CB 3.25Å; D579-A583 PolarHBondContact O-N 3.43Å; Y580-A583 PolarHBondContact O-N 3.33Å; A583-Y585 PolarHBondContact O-N 3Å; A583-V586 PolarHBondContact O-N 3.37Å; A583-E587 PolarHBondContact O-N 3.24Å
584	A	84.8	Confident	84.9	Confident	8 Å²	8	82.3 Å²	82.3	7%	0.066	43%	0.425	C	S	.	.	H	α-helix	trans	-58.9	-44.4	176.4	0	0	0	0	0	112.7	Y580 V586 E587 M588 M634	Y580-A584 WeakPolarHBondContact O-CB 3.42Å; Y580-A584 PolarHBondContact O-N 3.05Å; A584-V586 VanDerWaalsContact C-N 3.33Å; A584-V586 PolarHBondContact O-N 3.42Å; A584-E587 WeakPolarHBondContact O-CB 3.39Å; A584-E587 PolarHBondContact O-N 3.33Å; A584-M588 WeakPolarHBondContact O-CG 3.31Å; A584-M588 PolarHBondContact O-N 3.07Å; A584-M634 HydrophobicContact CB-CE 4.43Å; A584-M634 HydrophobicContact CB-SD 3.37Å; A584-M634 WeakPolarHBondContact CB-SD 3.5Å
585	Y	86.6	Confident	83.7	Confident	25 Å²	25	81.9 Å²	81.9	10%	0.098	42%	0.423	C	S	.	.	H	α-helix	trans	-61.9	-40.1	176.5	172.9	-104.7	0	0	0	112.6	I581 T582 A583 E587 R589 S602 A603 T605 L606	I581-Y585 WeakPolarHBondContact O-CB 3.34Å; I581-Y585 PolarHBondContact O-N 3.49Å; T582-Y585 PolarHBondContact O-N 3.01Å; A583-Y585 PolarHBondContact O-N 3Å; Y585-E587 VanDerWaalsContact C-N 3.33Å; Y585-R589 WeakPolarHBondContact O-CB 3.31Å; Y585-R589 PolarHBondContact O-N 2.88Å; Y585-S602 PolarHBondContact OH-O 3.05Å; Y585-A603 WeakPolarHBondContact OH-CA 3.38Å; Y585-T605 WeakPolarHBondContact CE2-OG1 3.4Å; Y585-L606 HydrophobicContact CD2-CB 3.88Å; Y585-L606 HydrophobicContact CE2-CB 4.1Å; Y585-L606 HydrophobicContact CG-CB 4.25Å; Y585-L606 HydrophobicContact CG-CD1 4.26Å
586	V	88.3	Confident	82.4	Confident	92 Å²	92	83.2 Å²	83.2	56%	0.558	43%	0.426	S	S	*	.	H	α-helix	trans	-64.3	-40.2	176.7	171.5	0	0	0	0	111	T582 A583 A584 R589 K590	T582-V586 VanDerWaalsContact O-CG2 3.31Å; T582-V586 WeakPolarHBondContact O-CG2 3.5Å; T582-V586 PolarHBondContact O-N 3.31Å; A583-V586 PolarHBondContact O-N 3.37Å; A584-V586 VanDerWaalsContact C-N 3.33Å; A584-V586 PolarHBondContact O-N 3.42Å; V586-R589 PolarHBondContact O-N 3.26Å; V586-K590 WeakPolarHBondContact O-CB 3.46Å; V586-K590 PolarHBondContact O-N 3.19Å
587	E	85.1	Confident	80.9	Confident	140 Å²	140	83.1 Å²	83.1	65%	0.654	42%	0.421	S	S	*	.	H	α-helix	trans	-62.4	-51.4	176.3	-175	165.1	-157.1	0	0	111.7	A583 A584 Y585 R589 K590 E591	A583-E587 PolarHBondContact O-N 3.24Å; A584-E587 WeakPolarHBondContact O-CB 3.39Å; A584-E587 PolarHBondContact O-N 3.33Å; Y585-E587 VanDerWaalsContact C-N 3.33Å; E587-R589 PolarHBondContact O-N 3.17Å; E587-R589 VanDerWaalsContact O-N 3.17Å; E587-K590 WeakPolarHBondContact O-CB 3.47Å; E587-K590 PolarHBondContact O-N 2.7Å; E587-E591 PolarHBondContact O-N 3.32Å
588	M	79.6	Confident	79.5	Confident	17 Å²	17	83.9 Å²	83.9	8%	0.084	43%	0.426	C	S	.	.	H	α-helix	trans	-56.1	-36.5	175.6	-68.2	179.4	83.9	0	0	112.2	A584 A592 I609 M637 K641	A584-M588 WeakPolarHBondContact O-CG 3.31Å; A584-M588 PolarHBondContact O-N 3.07Å; M588-A592 WeakPolarHBondContact O-CB 3.43Å; M588-A592 PolarHBondContact O-N 3.26Å; M588-A592 VanDerWaalsContact O-N 3.1Å; M588-I609 HydrophobicContact SD-CD1 3.9Å; M588-M637 HydrophobicContact CE-CB 4.05Å; M588-M637 HydrophobicContact CE-CE 4.48Å; M588-M637 HydrophobicContact CE-SD 4.3Å; M588-K641 VanDerWaalsContact CE-NZ 3.26Å
589	R	82	Confident	78.2	Confident	109 Å²	109	84 Å²	84	41%	0.411	42%	0.422	S	S	.	.	H	α-helix	trans	-75.2	-32.6	178.5	-166	173.5	-171.7	-175.5	1.1	112.6	Y585 V586 E587 R593	Y585-R589 WeakPolarHBondContact O-CB 3.31Å; Y585-R589 PolarHBondContact O-N 2.88Å; V586-R589 PolarHBondContact O-N 3.26Å; E587-R589 PolarHBondContact O-N 3.17Å; E587-R589 VanDerWaalsContact O-N 3.17Å; R589-R593 WeakPolarHBondContact O-CG 3.39Å; R589-R593 PolarHBondContact O-N 3.18Å
590	K	84.4	Confident	77.1	Confident	154 Å²	154	85.5 Å²	85.5	67%	0.67	42%	0.423	S	S	*	.	H	α-helix	trans	-67.7	-45.5	175.3	-172.7	-178.2	178.1	-173	0	110.2	V586 E587 A592 R593 V594	V586-K590 WeakPolarHBondContact O-CB 3.46Å; V586-K590 PolarHBondContact O-N 3.19Å; E587-K590 WeakPolarHBondContact O-CB 3.47Å; E587-K590 PolarHBondContact O-N 2.7Å; K590-A592 PolarHBondContact O-N 2.98Å; K590-R593 WeakPolarHBondContact O-CB 3.16Å; K590-R593 PolarHBondContact O-N 2.74Å; K590-R593 VanDerWaalsContact O-N 3.14Å; K590-V594 WeakPolarHBondContact O-CG2 3.16Å; K590-V594 PolarHBondContact O-N 2.61Å
591	E	77.1	Confident	76.1	Confident	96 Å²	96	83.3 Å²	83.3	45%	0.449	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-43.9	176.5	-174.1	167	-157.3	0	0	111.9	E587 R593 V594 S595	E587-E591 PolarHBondContact O-N 3.32Å; E591-R593 PolarHBondContact O-N 3.31Å; E591-R593 VanDerWaalsContact O-N 3.17Å; E591-V594 PolarHBondContact O-N 3.1Å; E591-S595 PolarHBondContact O-N 2.97Å; E591-S595 VanDerWaalsContact O-N 3.15Å
592	A	72.8	Confident	75.4	Confident	20 Å²	20	84.5 Å²	84.5	17%	0.165	43%	0.427	C	S	.	.	H	α-helix	trans	-64.8	-18.8	176.5	0	0	0	0	0	114.5	M588 K590 T598 T601	M588-A592 WeakPolarHBondContact O-CB 3.43Å; M588-A592 PolarHBondContact O-N 3.26Å; M588-A592 VanDerWaalsContact O-N 3.1Å; K590-A592 PolarHBondContact O-N 2.98Å; A592-T598 VanDerWaalsContact CA-OG1 3.31Å; A592-T598 WeakPolarHBondContact CA-OG1 3.4Å; A592-T598 PolarHBondContact O-OG1 3.2Å; A592-T601 HydrophobicContact CB-CG2 3.65Å; A592-T601 VanDerWaalsContact CB-OG1 3.29Å; A592-T601 WeakPolarHBondContact CB-OG1 3.47Å
593	R	73.6	Confident	75	Confident	191 Å²	191	84.7 Å²	84.7	72%	0.721	44%	0.435	S	S	*	.	H	α-helix	trans	-82.8	-29.3	172.6	-77.1	177.4	176.5	-171.9	-0.1	112.6	R589 K590 E591	R589-R593 WeakPolarHBondContact O-CG 3.39Å; R589-R593 PolarHBondContact O-N 3.18Å; K590-R593 WeakPolarHBondContact O-CB 3.16Å; K590-R593 PolarHBondContact O-N 2.74Å; K590-R593 VanDerWaalsContact O-N 3.14Å; E591-R593 PolarHBondContact O-N 3.31Å; E591-R593 VanDerWaalsContact O-N 3.17Å
594	V	74.6	Confident	74.7	Confident	125 Å²	125	85.8 Å²	85.8	76%	0.758	43%	0.427	S	S	*	.	H	α-helix	trans	-76.8	-38.3	-178.6	174.2	0	0	0	0	110.2	K590 E591	K590-V594 WeakPolarHBondContact O-CG2 3.16Å; K590-V594 PolarHBondContact O-N 2.61Å; E591-V594 PolarHBondContact O-N 3.1Å
595	S	66.7	Low	74.7	Confident	36 Å²	36	86.5 Å²	86.5	25%	0.252	43%	0.43	S	S	.	.			trans	-93.4	118.7	176.5	-169.8	0	0	0	0	111.4	E591 D597 T598	E591-S595 PolarHBondContact O-N 2.97Å; E591-S595 VanDerWaalsContact O-N 3.15Å; S595-D597 PolarHBondContact O-N 2.74Å; S595-T598 PolarHBondContact O-OG1 3.1Å
596	K	59.2	Low	74.8	Confident	206 Å²	206	87.4 Å²	87.4	90%	0.896	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.2	174.5	-77.8	-175.7	177.9	178.9	0	113.1
597	D	58.2	Low	74.8	Confident	130 Å²	130	86.1 Å²	86.1	70%	0.695	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-4.8	-175.2	-61.2	-31.1	0	0	0	113	I501 S595	I501-D597 WeakPolarHBondContact CD1-O 3.5Å; S595-D597 PolarHBondContact O-N 2.74Å
598	T	60.3	Low	75	Confident	33 Å²	33	79.6 Å²	79.6	20%	0.202	40%	0.396	C	S	.	.	S	Bend	trans	-81	141.3	176.1	48.5	0	0	0	0	111.9	A592 S595	A592-T598 VanDerWaalsContact CA-OG1 3.31Å; A592-T598 WeakPolarHBondContact CA-OG1 3.4Å; A592-T598 PolarHBondContact O-OG1 3.2Å; S595-T598 PolarHBondContact O-OG1 3.1Å
599	T	62	Low	75.5	Confident	47 Å²	47	78.8 Å²	78.8	29%	0.288	39%	0.392	S	S	.	.			trans	-53.3	152.1	178.3	41.2	0	0	0	0	113.5	I501 T601	I501-T599 HydrophobicContact CD1-CG2 3.92Å; I501-T599 HydrophobicContact CG2-CG2 4.4Å; T599-T601 PolarHBondContact O-N 3.29Å
600	F	64.5	Low	75.9	Confident	159 Å²	159	76.1 Å²	76.1	70%	0.697	39%	0.386	S	S	*	.			trans	-59.7	106.1	178.3	-68.6	-89.2	0	0	0	111.8	E502 S602	E502-F600 WeakPolarHBondContact OE1-CE2 3.33Å; F600-S602 PolarHBondContact O-N 3.37Å
601	T	70.6	Confident	76.2	Confident	28 Å²	28	69.8 Å²	69.8	17%	0.172	36%	0.358	C	S	.	.			trans	-79	105.2	170.3	50.2	0	0	0	0	109.7	A592 T599	A592-T601 HydrophobicContact CB-CG2 3.65Å; A592-T601 VanDerWaalsContact CB-OG1 3.29Å; A592-T601 WeakPolarHBondContact CB-OG1 3.47Å; T599-T601 PolarHBondContact O-N 3.29Å
602	S	74.7	Confident	76.9	Confident	32 Å²	32	65.2 Å²	65.2	22%	0.224	34%	0.336	C	S	.	.			trans	-96	173.3	178.8	74.9	0	0	0	0	111.6	Y585 F600 R604 T605	Y585-S602 PolarHBondContact OH-O 3.05Å; F600-S602 PolarHBondContact O-N 3.37Å; S602-R604 PolarHBondContact O-N 3.35Å; S602-R604 WeakPolarHBondContact OG-CB 3.41Å; S602-R604 PolarHBondContact OG-N 3.16Å; S602-R604 VanDerWaalsContact OG-N 3.17Å; S602-T605 PolarHBondContact O-N 3.46Å; S602-T605 PolarHBondContact O-OG1 3.26Å
603	A	81.3	Confident	77.9	Confident	72 Å²	72	64.2 Å²	64.2	60%	0.595	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.9	170	0	0	0	0	0	112.6	Y585 T605 L606	Y585-A603 WeakPolarHBondContact OH-CA 3.38Å; A603-T605 VanDerWaalsContact C-N 3.28Å; A603-T605 PolarHBondContact O-N 3.48Å; A603-L606 WeakPolarHBondContact O-CB 3.47Å; A603-L606 PolarHBondContact O-N 3.13Å
604	R	83.5	Confident	78.7	Confident	81 Å²	81	55.4 Å²	55.4	31%	0.306	30%	0.295	S	S	.	.	H	α-helix	trans	-68.3	-27.4	177.5	-66.4	-179.3	173.4	133.3	-2.2	112.4	E463 S513 S602 L606 L607 S608	E463-R604 IonicContact OE1-CZ 3.29Å; E463-R604 IonicContact OE1-NH2 3.92Å; E463-R604 PolarHBondContact OE1-NH2 3.16Å; E463-R604 IonicContact OE2-CZ 2.93Å; E463-R604 IonicContact OE2-NH2 3.38Å; E463-R604 PolarHBondContact OE2-NH2 3.28Å; S513-R604 WeakPolarHBondContact O-CD 3.29Å; S513-R604 PolarHBondContact OG-NH1 3.42Å; S602-R604 PolarHBondContact O-N 3.35Å; S602-R604 WeakPolarHBondContact OG-CB 3.41Å; S602-R604 PolarHBondContact OG-N 3.16Å; S602-R604 VanDerWaalsContact OG-N 3.17Å; R604-L606 PolarHBondContact O-N 3.15Å; R604-L607 WeakPolarHBondContact O-CA 3.46Å; R604-L607 WeakPolarHBondContact O-CB 3.45Å; R604-L607 PolarHBondContact O-N 3Å; R604-S608 PolarHBondContact O-N 3.36Å; R604-S608 PolarHBondContact O-OG 3.18Å; R604-S608 VanDerWaalsContact O-OG 3.07Å
605	T	84.6	Confident	79.5	Confident	23 Å²	23	49.4 Å²	49.4	14%	0.141	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-31	178.6	63	0	0	0	0	111.7	Y585 S602 A603 L607 S608 I609 M637	Y585-T605 WeakPolarHBondContact CE2-OG1 3.4Å; S602-T605 PolarHBondContact O-N 3.46Å; S602-T605 PolarHBondContact O-OG1 3.26Å; A603-T605 VanDerWaalsContact C-N 3.28Å; A603-T605 PolarHBondContact O-N 3.48Å; T605-L607 VanDerWaalsContact C-N 3.34Å; T605-S608 WeakPolarHBondContact O-CB 3.38Å; T605-S608 PolarHBondContact O-N 2.81Å; T605-I609 WeakPolarHBondContact O-CG1 3.48Å; T605-I609 PolarHBondContact O-N 2.63Å; T605-M637 HydrophobicContact CG2-CE 4.39Å
606	L	88.3	Confident	80.7	Confident	45 Å²	45	48.1 Å²	48.1	24%	0.236	25%	0.25	C	C	.	.	H	α-helix	trans	-61.9	-43.2	171.4	177.5	63.1	0	0	0	111.4	I581 Y585 A603 R604 S608 I609 L610	I581-L606 HydrophobicContact CG2-CD1 3.53Å; Y585-L606 HydrophobicContact CD2-CB 3.88Å; Y585-L606 HydrophobicContact CE2-CB 4.1Å; Y585-L606 HydrophobicContact CG-CB 4.25Å; Y585-L606 HydrophobicContact CG-CD1 4.26Å; A603-L606 WeakPolarHBondContact O-CB 3.47Å; A603-L606 PolarHBondContact O-N 3.13Å; R604-L606 PolarHBondContact O-N 3.15Å; L606-S608 VanDerWaalsContact C-N 3.29Å; L606-S608 PolarHBondContact O-N 2.89Å; L606-I609 PolarHBondContact O-N 3.25Å; L606-L610 PolarHBondContact O-N 3.27Å; L606-L610 VanDerWaalsContact O-N 3.13Å
607	L	88.1	Confident	82.2	Confident	64 Å²	64	38.3 Å²	38.3	34%	0.335	21%	0.207	S	C	.	.	H	α-helix	trans	-65.3	-35	174.8	-60.2	175.7	0	0	0	111.3	R604 T605 L610 R611	R604-L607 WeakPolarHBondContact O-CA 3.46Å; R604-L607 WeakPolarHBondContact O-CB 3.45Å; R604-L607 PolarHBondContact O-N 3Å; T605-L607 VanDerWaalsContact C-N 3.34Å; L607-L610 PolarHBondContact O-N 3.34Å; L607-R611 VanDerWaalsContact O-CG 3.32Å; L607-R611 WeakPolarHBondContact O-CG 3.19Å; L607-R611 PolarHBondContact O-N 3.26Å
608	S	88.8	Confident	83.6	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-44.3	175.1	-51.1	0	0	0	0	111.8	D516 R604 T605 L606 L610 R611 L612	D516-S608 WeakPolarHBondContact OD1-CB 3.33Å; D516-S608 PolarHBondContact OD1-OG 3.18Å; R604-S608 PolarHBondContact O-N 3.36Å; R604-S608 PolarHBondContact O-OG 3.18Å; R604-S608 VanDerWaalsContact O-OG 3.07Å; T605-S608 WeakPolarHBondContact O-CB 3.38Å; T605-S608 PolarHBondContact O-N 2.81Å; L606-S608 VanDerWaalsContact C-N 3.29Å; L606-S608 PolarHBondContact O-N 2.89Å; S608-L610 VanDerWaalsContact C-N 3.34Å; S608-L610 PolarHBondContact O-N 2.6Å; S608-R611 PolarHBondContact O-N 2.9Å; S608-L612 WeakPolarHBondContact O-CB 3.49Å; S608-L612 VanDerWaalsContact O-CG 3.31Å; S608-L612 WeakPolarHBondContact O-CG 3.46Å; S608-L612 PolarHBondContact O-N 3.04Å
609	I	90.4	Very high	85	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-46.6	174.9	-64.5	166.6	0	0	0	110.4	I581 M588 T605 L606 R611 L612 S613 V630 M637	I581-I609 HydrophobicContact CG2-CG2 4.41Å; M588-I609 HydrophobicContact SD-CD1 3.9Å; T605-I609 WeakPolarHBondContact O-CG1 3.48Å; T605-I609 PolarHBondContact O-N 2.63Å; L606-I609 PolarHBondContact O-N 3.25Å; I609-R611 PolarHBondContact O-N 2.98Å; I609-L612 PolarHBondContact O-N 3.38Å; I609-S613 WeakPolarHBondContact O-CB 3.48Å; I609-S613 PolarHBondContact O-N 3.32Å; I609-S613 PolarHBondContact O-OG 2.75Å; I609-S613 VanDerWaalsContact O-OG 3.13Å; I609-V630 HydrophobicContact CG2-CG1 4.35Å; I609-M637 HydrophobicContact CD1-SD 4.09Å; I609-M637 HydrophobicContact CG1-SD 3.34Å; I609-M637 WeakPolarHBondContact CG1-SD 2.91Å
610	L	90.4	Very high	86.1	Confident	52 Å²	52	33.5 Å²	33.5	27%	0.272	17%	0.17	S	C	.	.	H	α-helix	trans	-60.2	-46.7	177.3	-72.1	171.1	0	0	0	111.5	V573 I581 L606 L607 S608 L612 S613 T614	V573-L610 HydrophobicContact CG1-CD2 4.3Å; V573-L610 HydrophobicContact CG2-CD2 4.3Å; I581-L610 HydrophobicContact CD1-CD2 3.84Å; L606-L610 PolarHBondContact O-N 3.27Å; L606-L610 VanDerWaalsContact O-N 3.13Å; L607-L610 PolarHBondContact O-N 3.34Å; S608-L610 VanDerWaalsContact C-N 3.34Å; S608-L610 PolarHBondContact O-N 2.6Å; L610-L612 PolarHBondContact O-N 3.37Å; L610-S613 PolarHBondContact O-N 3.28Å; L610-S613 PolarHBondContact O-OG 2.75Å; L610-T614 WeakPolarHBondContact O-CG2 3.47Å; L610-T614 PolarHBondContact O-N 3.39Å; L610-T614 PolarHBondContact O-OG1 3.29Å
611	R	91.1	Very high	87	Confident	21 Å²	21	28 Å²	28	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-47	177.3	-71.8	173.5	-170.8	139.6	8.2	112.4	R372 I375 D516 L607 S608 I609 T614 A615	R372-R611 VanDerWaalsContact NE-NH1 3.12Å; R372-R611 PolarHBondContact O-NE 3.34Å; R372-R611 PolarHBondContact O-NH2 3.47Å; I375-R611 HydrophobicContact CG1-CB 4.33Å; D516-R611 IonicContact OD1-NH1 3.15Å; D516-R611 PolarHBondContact OD1-NH1 2.9Å; D516-R611 IonicContact OD2-NH1 3.73Å; L607-R611 VanDerWaalsContact O-CG 3.32Å; L607-R611 WeakPolarHBondContact O-CG 3.19Å; L607-R611 PolarHBondContact O-N 3.26Å; S608-R611 PolarHBondContact O-N 2.9Å; I609-R611 PolarHBondContact O-N 2.98Å; R611-T614 PolarHBondContact O-N 3Å; R611-T614 PolarHBondContact O-OG1 3.37Å; R611-A615 WeakPolarHBondContact O-CB 3.43Å; R611-A615 PolarHBondContact O-N 3.03Å
612	L	92	Very high	87.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-44	179.4	-71.2	167.2	0	0	0	111.5	L356 I375 L517 S608 I609 L610 T614 A615 L616 A633 M637	L356-L612 HydrophobicContact CB-CD2 4.35Å; L356-L612 HydrophobicContact CD1-CD2 3.79Å; I375-L612 HydrophobicContact CD1-CD2 4.01Å; I375-L612 HydrophobicContact CG2-CD2 4.4Å; L517-L612 HydrophobicContact CD1-CD1 4.23Å; L517-L612 HydrophobicContact CD1-CD2 3.92Å; L517-L612 HydrophobicContact CD2-CD1 3.99Å; L517-L612 HydrophobicContact CG-CD1 4.16Å; S608-L612 WeakPolarHBondContact O-CB 3.49Å; S608-L612 VanDerWaalsContact O-CG 3.31Å; S608-L612 WeakPolarHBondContact O-CG 3.46Å; S608-L612 PolarHBondContact O-N 3.04Å; I609-L612 PolarHBondContact O-N 3.38Å; L610-L612 PolarHBondContact O-N 3.37Å; L612-T614 PolarHBondContact O-N 2.87Å; L612-A615 PolarHBondContact O-N 3.17Å; L612-L616 WeakPolarHBondContact O-CG 3.28Å; L612-L616 PolarHBondContact O-N 2.78Å; L612-A633 HydrophobicContact CB-CB 3.82Å; L612-M637 HydrophobicContact CD1-CG 4.17Å
613	S	92.1	Very high	88.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-40.5	176.6	66.4	0	0	0	0	112.5	I609 L610 A615 L616 A617	I609-S613 WeakPolarHBondContact O-CB 3.48Å; I609-S613 PolarHBondContact O-N 3.32Å; I609-S613 PolarHBondContact O-OG 2.75Å; I609-S613 VanDerWaalsContact O-OG 3.13Å; L610-S613 PolarHBondContact O-N 3.28Å; L610-S613 PolarHBondContact O-OG 2.75Å; S613-A615 VanDerWaalsContact C-N 3.33Å; S613-A615 PolarHBondContact O-N 2.85Å; S613-L616 PolarHBondContact O-N 3.2Å; S613-A617 PolarHBondContact O-N 2.63Å
614	T	91.9	Very high	88.8	Confident	5 Å²	5	31.5 Å²	31.5	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-67.3	-32.5	174.3	62.6	0	0	0	0	112.8	V362 P571 V573 L610 R611 L612 R618 V625	V362-T614 PolarHBondContact N-OG1 2.91Å; P571-T614 WeakPolarHBondContact CG-O 3.34Å; V573-T614 HydrophobicContact CG2-CG2 3.98Å; L610-T614 WeakPolarHBondContact O-CG2 3.47Å; L610-T614 PolarHBondContact O-N 3.39Å; L610-T614 PolarHBondContact O-OG1 3.29Å; R611-T614 PolarHBondContact O-N 3Å; R611-T614 PolarHBondContact O-OG1 3.37Å; L612-T614 PolarHBondContact O-N 2.87Å; T614-R618 WeakPolarHBondContact O-CG 3.46Å; T614-R618 PolarHBondContact O-N 3.21Å; T614-V625 HydrophobicContact CG2-CG2 4.13Å
615	A	91.4	Very high	89.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.6	-37.4	175.3	0	0	0	0	0	111.9	L356 I375 R611 L612 S613 R618 L619	L356-A615 HydrophobicContact CB-CB 4.49Å; L356-A615 HydrophobicContact CD2-CB 3.97Å; I375-A615 HydrophobicContact CD1-CB 3.91Å; R611-A615 WeakPolarHBondContact O-CB 3.43Å; R611-A615 PolarHBondContact O-N 3.03Å; L612-A615 PolarHBondContact O-N 3.17Å; S613-A615 VanDerWaalsContact C-N 3.33Å; S613-A615 PolarHBondContact O-N 2.85Å; A615-R618 WeakPolarHBondContact O-CB 2.98Å; A615-R618 PolarHBondContact O-N 3.4Å; A615-L619 PolarHBondContact O-N 2.67Å; A615-L619 VanDerWaalsContact O-N 3.09Å
616	L	91	Very high	89.5	Confident	9 Å²	9	30.7 Å²	30.7	5%	0.047	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-45.6	172.3	-76.2	164.9	0	0	0	111.5	Y333 L356 L612 S613 R618 L619 R620 D629 E632 A633	Y333-L616 HydrophobicContact CD2-CD2 4.4Å; Y333-L616 HydrophobicContact CE2-CD2 3.77Å; L356-L616 HydrophobicContact CD1-CD2 4.35Å; L356-L616 HydrophobicContact CD1-CG 4.29Å; L356-L616 HydrophobicContact CD2-CB 4.47Å; L356-L616 HydrophobicContact CD2-CD2 3.65Å; L356-L616 HydrophobicContact CD2-CG 3.65Å; L612-L616 WeakPolarHBondContact O-CG 3.28Å; L612-L616 PolarHBondContact O-N 2.78Å; S613-L616 PolarHBondContact O-N 3.2Å; L616-R618 VanDerWaalsContact C-N 3.28Å; L616-R618 PolarHBondContact O-N 3.06Å; L616-L619 WeakPolarHBondContact O-CB 3.31Å; L616-L619 PolarHBondContact O-N 3.09Å; L616-L619 VanDerWaalsContact O-N 3.1Å; L616-R620 PolarHBondContact O-N 2.69Å; L616-R620 VanDerWaalsContact O-N 3.15Å; L616-D629 HydrophobicContact CB-CB 4.03Å; L616-D629 HydrophobicContact CD1-CB 4.35Å; L616-D629 VanDerWaalsContact CD1-O 3.23Å; L616-D629 WeakPolarHBondContact CD1-O 3.42Å; L616-E632 HydrophobicContact CD1-CB 4.08Å; L616-E632 HydrophobicContact CD1-CG 4.18Å; L616-E632 HydrophobicContact CD2-CG 4.44Å; L616-A633 HydrophobicContact CD1-CB 4.18Å
617	A	90.3	Very high	89.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-37.8	175.6	0	0	0	0	0	112.5	P571 S613 R620 M621 M622 V625	P571-A617 HydrophobicContact CB-CB 3.86Å; P571-A617 HydrophobicContact CG-CB 3.92Å; S613-A617 PolarHBondContact O-N 2.63Å; A617-R620 PolarHBondContact O-N 3.05Å; A617-M621 PolarHBondContact O-N 3.26Å; A617-M622 PolarHBondContact O-N 3.28Å; A617-M622 VanDerWaalsContact O-N 3.15Å; A617-V625 HydrophobicContact CB-CG2 3.91Å
618	R	89.2	Confident	89.7	Confident	20 Å²	20	37.3 Å²	37.3	8%	0.075	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-41.3	172.5	-79.9	178	167.6	175.1	-2.2	113.1	V359 G360 G361 R569 P571 T614 A615 L616 R620 M621	V359-R618 HydrophobicContact CG1-CB 3.66Å; G360-R618 WeakPolarHBondContact O-CD 3.01Å; G360-R618 PolarHBondContact O-NH1 3.49Å; G361-R618 PolarHBondContact O-NH1 3.22Å; R569-R618 PolarHBondContact O-NE 3.39Å; R569-R618 PolarHBondContact O-NH2 2.75Å; P571-R618 HydrophobicContact CG-CG 3.81Å; T614-R618 WeakPolarHBondContact O-CG 3.46Å; T614-R618 PolarHBondContact O-N 3.21Å; A615-R618 WeakPolarHBondContact O-CB 2.98Å; A615-R618 PolarHBondContact O-N 3.4Å; L616-R618 VanDerWaalsContact C-N 3.28Å; L616-R618 PolarHBondContact O-N 3.06Å; R618-R620 VanDerWaalsContact C-N 3.26Å; R618-R620 PolarHBondContact O-N 3.28Å; R618-M621 PolarHBondContact O-N 3.17Å; R618-M621 VanDerWaalsContact O-N 3.1Å
619	L	88.1	Confident	89.8	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-61.7	-36.5	176.8	-83	170.3	0	0	0	112.2	Y333 L336 L355 L356 V359 Y562 A615 L616 M621	Y333-L619 HydrophobicContact CD2-CD1 4.12Å; Y333-L619 HydrophobicContact CE2-CD1 4.01Å; L336-L619 HydrophobicContact CD1-CD2 4.11Å; L355-L619 HydrophobicContact CD1-CD2 4.33Å; L355-L619 HydrophobicContact CD2-CD1 3.88Å; L355-L619 HydrophobicContact CD2-CD2 4.17Å; L355-L619 HydrophobicContact CG-CD1 4Å; L355-L619 HydrophobicContact CG-CD2 4.13Å; L356-L619 HydrophobicContact CD2-CD1 3.62Å; V359-L619 HydrophobicContact CB-CG 4.48Å; V359-L619 HydrophobicContact CG1-CG 4.45Å; V359-L619 HydrophobicContact CG2-CD1 4.34Å; V359-L619 HydrophobicContact CG2-CD2 3.38Å; V359-L619 HydrophobicContact CG2-CG 3.7Å; Y562-L619 PolarHBondContact OH-O 3.46Å; A615-L619 PolarHBondContact O-N 2.67Å; A615-L619 VanDerWaalsContact O-N 3.09Å; L616-L619 WeakPolarHBondContact O-CB 3.31Å; L616-L619 PolarHBondContact O-N 3.09Å; L616-L619 VanDerWaalsContact O-N 3.1Å; L619-M621 PolarHBondContact O-N 3.32Å
620	R	84.9	Confident	89.8	Confident	84 Å²	84	37.5 Å²	37.5	32%	0.317	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-0.6	176.5	-59.9	-166.2	-63.4	145.4	7.2	113.7	L616 A617 R618 M622 E626 D629	L616-R620 PolarHBondContact O-N 2.69Å; L616-R620 VanDerWaalsContact O-N 3.15Å; A617-R620 PolarHBondContact O-N 3.05Å; R618-R620 VanDerWaalsContact C-N 3.26Å; R618-R620 PolarHBondContact O-N 3.28Å; R620-M622 HydrophobicContact CB-CE 4.17Å; R620-M622 HydrophobicContact CB-CG 4.36Å; R620-M622 PolarHBondContact O-N 2.9Å; R620-E626 IonicContact CZ-OE2 3.83Å; R620-E626 VanDerWaalsContact CZ-OE2 3.29Å; R620-E626 IonicContact NH1-OE2 3.37Å; R620-E626 PolarHBondContact NH1-OE2 3.05Å; R620-E626 IonicContact NH2-OE2 3.72Å; R620-E626 PolarHBondContact NH2-OE2 3.23Å; R620-D629 IonicContact CZ-OD1 3.67Å; R620-D629 IonicContact CZ-OD2 3.41Å; R620-D629 IonicContact NE-OD1 3.25Å; R620-D629 PolarHBondContact NE-OD1 2.96Å; R620-D629 IonicContact NE-OD2 3.87Å; R620-D629 IonicContact NH2-OD1 2.65Å; R620-D629 PolarHBondContact NH2-OD1 3Å; R620-D629 VanDerWaalsContact NH2-OD1 3.09Å; R620-D629 IonicContact NH2-OD2 3.35Å; R620-D629 PolarHBondContact NH2-OD2 2.9Å
621	M	84	Confident	89.9	Confident	44 Å²	44	38 Å²	38	22%	0.217	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	29.9	-176	-58.7	-67.1	-172.9	0	0	113.9	Y562 L565 C566 R569 A617 R618 L619	Y562-M621 HydrophobicContact CD2-CE 4.2Å; Y562-M621 HydrophobicContact CE1-CE 4.01Å; Y562-M621 HydrophobicContact CE2-CE 3.6Å; Y562-M621 VanDerWaalsContact CZ-CE 3.5Å; L565-M621 HydrophobicContact CB-CE 4.13Å; L565-M621 HydrophobicContact CD2-CE 3.26Å; L565-M621 HydrophobicContact CD2-SD 3.51Å; L565-M621 VanDerWaalsContact CD2-SD 3.51Å; L565-M621 HydrophobicContact CG-CE 4.24Å; C566-M621 HydrophobicContact CB-CE 4.18Å; C566-M621 WeakPolarHBondContact SG-CE 3.49Å; R569-M621 HydrophobicContact CG-SD 4.25Å; A617-M621 PolarHBondContact O-N 3.26Å; R618-M621 PolarHBondContact O-N 3.17Å; R618-M621 VanDerWaalsContact O-N 3.1Å; L619-M621 PolarHBondContact O-N 3.32Å
622	M	85.3	Confident	89.8	Confident	61 Å²	61	38.9 Å²	38.9	30%	0.3	19%	0.192	S	C	.	.			trans	-102	146.6	178.1	-68.4	-156.3	-73.2	0	0	111.7	A617 R620 A624 E626	A617-M622 PolarHBondContact O-N 3.28Å; A617-M622 VanDerWaalsContact O-N 3.15Å; R620-M622 HydrophobicContact CB-CE 4.17Å; R620-M622 HydrophobicContact CB-CG 4.36Å; R620-M622 PolarHBondContact O-N 2.9Å; M622-A624 VanDerWaalsContact C-N 3.35Å; M622-E626 HydrophobicContact CE-CG 4.41Å
623	D	88.3	Confident	89.7	Confident	94 Å²	94	38.9 Å²	38.9	50%	0.503	19%	0.192	S	C	.	.	S	Bend	trans	-86.5	-6.1	-178.3	-65.1	-36.2	0	0	0	112.9	R569 P571 V572	R569-D623 IonicContact NH1-OD1 2.97Å; P571-D623 CarbonylContact C-O 3.51Å; P571-D623 VanDerWaalsContact CA-O 3.25Å; P571-D623 WeakPolarHBondContact CA-O 3.43Å; V572-D623 PolarHBondContact N-O 2.66Å
624	A	90.4	Very high	89.6	Confident	51 Å²	51	40.7 Å²	40.7	42%	0.421	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-130.3	141.3	177.2	0	0	0	0	0	111.4	V572 M622	V572-A624 WeakPolarHBondContact O-CA 3.45Å; M622-A624 VanDerWaalsContact C-N 3.35Å
625	V	92.3	Very high	89.5	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.024	21%	0.214	C	C	.	.			trans	-77.2	135	174.1	-179.5	0	0	0	0	109.9	P571 V572 V573 P574 L577 T614 A617 D629 V630	P571-V625 HydrophobicContact CB-CG2 4.49Å; V572-V625 PolarHBondContact O-N 3.38Å; V572-V625 VanDerWaalsContact O-N 3.15Å; V573-V625 HydrophobicContact CG2-CG2 4.14Å; P574-V625 WeakPolarHBondContact CD-O 3.29Å; P574-V625 WeakPolarHBondContact CG-O 3.42Å; L577-V625 HydrophobicContact CD1-CG1 4.37Å; L577-V625 VanDerWaalsContact CD1-O 3.27Å; L577-V625 WeakPolarHBondContact CD1-O 3.25Å; T614-V625 HydrophobicContact CG2-CG2 4.13Å; A617-V625 HydrophobicContact CB-CG2 3.91Å; V625-D629 HydrophobicContact CG1-CB 4.06Å; V625-V630 HydrophobicContact CG1-CG2 4.19Å
626	E	91.2	Very high	89.3	Confident	83 Å²	83	44.3 Å²	44.3	39%	0.388	21%	0.214	S	C	.	.			trans	-104.6	167.1	175.7	-64.4	-178.3	149.5	0	0	112.5	R620 M622 E628 D629 V630	R620-E626 IonicContact CZ-OE2 3.83Å; R620-E626 VanDerWaalsContact CZ-OE2 3.29Å; R620-E626 IonicContact NH1-OE2 3.37Å; R620-E626 PolarHBondContact NH1-OE2 3.05Å; R620-E626 IonicContact NH2-OE2 3.72Å; R620-E626 PolarHBondContact NH2-OE2 3.23Å; M622-E626 HydrophobicContact CE-CG 4.41Å; E626-E628 PolarHBondContact O-N 3.35Å; E626-D629 PolarHBondContact N-OD2 2.96Å; E626-D629 PolarHBondContact O-N 3.5Å; E626-V630 PolarHBondContact O-N 3Å
627	K	91.3	Very high	89.1	Confident	108 Å²	108	44.3 Å²	44.3	47%	0.47	21%	0.214	S	C	.	.	H	α-helix	trans	-60.4	-33.9	178.1	-168.8	179.1	179	-176.1	0	112.3	L577 Y580 V630 N631	L577-K627 HydrophobicContact CD2-CB 3.87Å; L577-K627 HydrophobicContact CD2-CG 4.25Å; Y580-K627 HydrophobicContact CD1-CG 4.16Å; Y580-K627 HydrophobicContact CE1-CD 4.49Å; Y580-K627 HydrophobicContact CE1-CG 3.91Å; Y580-K627 VanDerWaalsContact CZ-CE 3.43Å; K627-V630 PolarHBondContact O-N 2.92Å; K627-N631 VanDerWaalsContact O-CG 3.31Å; K627-N631 PolarHBondContact O-N 3.23Å; K627-N631 PolarHBondContact O-ND2 3.38Å
628	E	89.8	Confident	88.8	Confident	139 Å²	139	47 Å²	47	65%	0.65	23%	0.226	S	C	*	.	H	α-helix	trans	-64.4	-39.2	179.5	-61.6	-176.3	176.1	0	0	112.1	E626 V630 N631 E632	E626-E628 PolarHBondContact O-N 3.35Å; E628-V630 VanDerWaalsContact C-N 3.31Å; E628-V630 PolarHBondContact O-N 3Å; E628-N631 PolarHBondContact O-N 3.45Å; E628-E632 PolarHBondContact O-N 3.1Å
629	D	90.9	Very high	88.5	Confident	8 Å²	8	49.3 Å²	49.3	4%	0.043	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-41	175.7	-61.7	-43	0	0	0	111.5	L616 R620 V625 E626 N631 E632 A633	L616-D629 HydrophobicContact CB-CB 4.03Å; L616-D629 HydrophobicContact CD1-CB 4.35Å; L616-D629 VanDerWaalsContact CD1-O 3.23Å; L616-D629 WeakPolarHBondContact CD1-O 3.42Å; R620-D629 IonicContact CZ-OD1 3.67Å; R620-D629 IonicContact CZ-OD2 3.41Å; R620-D629 IonicContact NE-OD1 3.25Å; R620-D629 PolarHBondContact NE-OD1 2.96Å; R620-D629 IonicContact NE-OD2 3.87Å; R620-D629 IonicContact NH2-OD1 2.65Å; R620-D629 PolarHBondContact NH2-OD1 3Å; R620-D629 VanDerWaalsContact NH2-OD1 3.09Å; R620-D629 IonicContact NH2-OD2 3.35Å; R620-D629 PolarHBondContact NH2-OD2 2.9Å; V625-D629 HydrophobicContact CG1-CB 4.06Å; E626-D629 PolarHBondContact N-OD2 2.96Å; E626-D629 PolarHBondContact O-N 3.5Å; D629-N631 VanDerWaalsContact C-N 3.35Å; D629-E632 PolarHBondContact O-N 3.3Å; D629-A633 WeakPolarHBondContact O-CB 3.45Å; D629-A633 PolarHBondContact O-N 3.11Å
630	V	90.6	Very high	88.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-41.6	178.4	-179	0	0	0	0	110.2	L577 Y580 I581 I609 V625 E626 K627 E628 A633 M634	L577-V630 HydrophobicContact CD1-CG2 4.44Å; Y580-V630 HydrophobicContact CD1-CG1 4.17Å; Y580-V630 HydrophobicContact CE1-CG1 4.11Å; I581-V630 HydrophobicContact CD1-CG2 4.25Å; I581-V630 HydrophobicContact CG1-CG1 3.87Å; I581-V630 HydrophobicContact CG1-CG2 4.18Å; I609-V630 HydrophobicContact CG2-CG1 4.35Å; V625-V630 HydrophobicContact CG1-CG2 4.19Å; E626-V630 PolarHBondContact O-N 3Å; K627-V630 PolarHBondContact O-N 2.92Å; E628-V630 VanDerWaalsContact C-N 3.31Å; E628-V630 PolarHBondContact O-N 3Å; V630-A633 PolarHBondContact O-N 2.65Å; V630-M634 HydrophobicContact CG1-CE 4.29Å; V630-M634 VanDerWaalsContact O-CG 3.29Å; V630-M634 WeakPolarHBondContact O-CG 3.34Å; V630-M634 PolarHBondContact O-N 3.39Å
631	N	91.4	Very high	87.7	Confident	62 Å²	62	47 Å²	47	33%	0.332	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-43.3	176.7	-68.6	-21.2	0	0	0	112.2	Y580 K627 E628 D629 M634 R635	Y580-N631 WeakPolarHBondContact CE1-OD1 3.35Å; Y580-N631 PolarHBondContact OH-OD1 3.31Å; K627-N631 VanDerWaalsContact O-CG 3.31Å; K627-N631 PolarHBondContact O-N 3.23Å; K627-N631 PolarHBondContact O-ND2 3.38Å; E628-N631 PolarHBondContact O-N 3.45Å; D629-N631 VanDerWaalsContact C-N 3.35Å; N631-M634 PolarHBondContact O-N 3.33Å; N631-M634 VanDerWaalsContact OD1-CE 3.28Å; N631-M634 WeakPolarHBondContact OD1-CE 3.41Å; N631-R635 PolarHBondContact O-N 3.25Å
632	E	89.8	Confident	87.1	Confident	41 Å²	41	48.6 Å²	48.6	19%	0.192	24%	0.242	C	C	.	.	H	α-helix	trans	-67.5	-40.3	177.3	-177.6	61.9	-172.8	0	0	111.6	Y333 L616 E628 D629 M634 R635 L636	Y333-E632 HydrophobicContact CE1-CG 4.32Å; L616-E632 HydrophobicContact CD1-CB 4.08Å; L616-E632 HydrophobicContact CD1-CG 4.18Å; L616-E632 HydrophobicContact CD2-CG 4.44Å; E628-E632 PolarHBondContact O-N 3.1Å; D629-E632 PolarHBondContact O-N 3.3Å; E632-M634 VanDerWaalsContact C-N 3.29Å; E632-M634 PolarHBondContact O-N 3.46Å; E632-R635 WeakPolarHBondContact O-CB 3.34Å; E632-R635 PolarHBondContact O-N 3.39Å; E632-R635 IonicContact OE1-CZ 3.19Å; E632-R635 IonicContact OE1-NE 3.98Å; E632-R635 PolarHBondContact OE1-NE 3.36Å; E632-R635 IonicContact OE1-NH2 3.21Å; E632-R635 PolarHBondContact OE1-NH2 2.88Å; E632-R635 IonicContact OE2-CZ 2.98Å; E632-R635 IonicContact OE2-NE 2.73Å; E632-R635 PolarHBondContact OE2-NE 3.45Å; E632-R635 IonicContact OE2-NH2 3.31Å; E632-L636 WeakPolarHBondContact O-CG 3.48Å; E632-L636 PolarHBondContact O-N 2.95Å
633	A	90.5	Very high	86.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-40.7	173.2	0	0	0	0	0	111.9	L612 L616 D629 V630 L636 M637	L612-A633 HydrophobicContact CB-CB 3.82Å; L616-A633 HydrophobicContact CD1-CB 4.18Å; D629-A633 WeakPolarHBondContact O-CB 3.45Å; D629-A633 PolarHBondContact O-N 3.11Å; V630-A633 PolarHBondContact O-N 2.65Å; A633-L636 PolarHBondContact O-N 3.27Å; A633-M637 WeakPolarHBondContact O-CG 3.37Å; A633-M637 PolarHBondContact O-N 3.47Å; A633-M637 VanDerWaalsContact O-N 3.08Å
634	M	88.1	Confident	85	Confident	37 Å²	37	45.3 Å²	45.3	18%	0.182	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-43.1	174.3	-72.6	-170.6	-61.6	0	0	112	Y580 A584 V630 N631 E632 L636 M637 E638	Y580-M634 HydrophobicContact CE1-CE 3.94Å; A584-M634 HydrophobicContact CB-CE 4.43Å; A584-M634 HydrophobicContact CB-SD 3.37Å; A584-M634 WeakPolarHBondContact CB-SD 3.5Å; V630-M634 HydrophobicContact CG1-CE 4.29Å; V630-M634 VanDerWaalsContact O-CG 3.29Å; V630-M634 WeakPolarHBondContact O-CG 3.34Å; V630-M634 PolarHBondContact O-N 3.39Å; N631-M634 PolarHBondContact O-N 3.33Å; N631-M634 VanDerWaalsContact OD1-CE 3.28Å; N631-M634 WeakPolarHBondContact OD1-CE 3.41Å; E632-M634 VanDerWaalsContact C-N 3.29Å; E632-M634 PolarHBondContact O-N 3.46Å; M634-L636 VanDerWaalsContact C-N 3.3Å; M634-L636 PolarHBondContact O-N 3.13Å; M634-M637 PolarHBondContact O-N 3.19Å; M634-M637 VanDerWaalsContact O-N 3.16Å; M634-E638 PolarHBondContact O-N 3.35Å
635	R	90	Very high	83.6	Confident	81 Å²	81	45.5 Å²	45.5	31%	0.306	22%	0.221	S	C	.	.	H	α-helix	trans	-54.7	-48.4	175	-171.1	-174.6	76.5	83.7	5.6	110.4	D349 N631 E632 M637 E638 M639	D349-R635 IonicContact OD1-CZ 2.95Å; D349-R635 IonicContact OD1-NH1 2.74Å; D349-R635 PolarHBondContact OD1-NH1 3.14Å; D349-R635 IonicContact OD1-NH2 3.67Å; D349-R635 PolarHBondContact OD1-NH2 3.42Å; D349-R635 IonicContact OD2-NH1 3.95Å; N631-R635 PolarHBondContact O-N 3.25Å; E632-R635 WeakPolarHBondContact O-CB 3.34Å; E632-R635 PolarHBondContact O-N 3.39Å; E632-R635 IonicContact OE1-CZ 3.19Å; E632-R635 IonicContact OE1-NE 3.98Å; E632-R635 PolarHBondContact OE1-NE 3.36Å; E632-R635 IonicContact OE1-NH2 3.21Å; E632-R635 PolarHBondContact OE1-NH2 2.88Å; E632-R635 IonicContact OE2-CZ 2.98Å; E632-R635 IonicContact OE2-NE 2.73Å; E632-R635 PolarHBondContact OE2-NE 3.45Å; E632-R635 IonicContact OE2-NH2 3.31Å; R635-M637 PolarHBondContact O-N 3.03Å; R635-E638 PolarHBondContact O-N 2.89Å; R635-M639 HydrophobicContact CG-CG 4.33Å; R635-M639 WeakPolarHBondContact O-CB 3.28Å; R635-M639 WeakPolarHBondContact O-CG 3.47Å; R635-M639 PolarHBondContact O-N 3.33Å
636	L	88.5	Confident	81.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-41.2	178.2	-69.5	175.3	0	0	0	112.5	D349 K352 L356 W519 E632 A633 M634 S640	D349-L636 HydrophobicContact CB-CD2 4.39Å; K352-L636 HydrophobicContact CB-CD2 4.33Å; L356-L636 HydrophobicContact CD1-CD1 3.59Å; W519-L636 HydrophobicContact CZ2-CD2 4.43Å; E632-L636 WeakPolarHBondContact O-CG 3.48Å; E632-L636 PolarHBondContact O-N 2.95Å; A633-L636 PolarHBondContact O-N 3.27Å; M634-L636 VanDerWaalsContact C-N 3.3Å; M634-L636 PolarHBondContact O-N 3.13Å; L636-S640 PolarHBondContact O-N 3.28Å; L636-S640 VanDerWaalsContact O-N 3.16Å
637	M	85.6	Confident	79.4	Confident	10 Å²	10	50 Å²	50	5%	0.049	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-36.8	176	-71.3	-163.1	82.3	0	0	112.6	L517 M588 T605 I609 L612 A633 M634 R635 S640	L517-M637 HydrophobicContact CD2-CG 3.9Å; M588-M637 HydrophobicContact CE-CB 4.05Å; M588-M637 HydrophobicContact CE-CE 4.48Å; M588-M637 HydrophobicContact CE-SD 4.3Å; T605-M637 HydrophobicContact CG2-CE 4.39Å; I609-M637 HydrophobicContact CD1-SD 4.09Å; I609-M637 HydrophobicContact CG1-SD 3.34Å; I609-M637 WeakPolarHBondContact CG1-SD 2.91Å; L612-M637 HydrophobicContact CD1-CG 4.17Å; A633-M637 WeakPolarHBondContact O-CG 3.37Å; A633-M637 PolarHBondContact O-N 3.47Å; A633-M637 VanDerWaalsContact O-N 3.08Å; M634-M637 PolarHBondContact O-N 3.19Å; M634-M637 VanDerWaalsContact O-N 3.16Å; R635-M637 PolarHBondContact O-N 3.03Å; M637-S640 PolarHBondContact O-OG 2.95Å
638	E	83.9	Confident	77.3	Confident	57 Å²	57	52.5 Å²	52.5	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-73.6	-43.9	179.9	-163.6	52.8	-144.1	0	0	111.6	M634 R635 S640 K641 D642	M634-E638 PolarHBondContact O-N 3.35Å; R635-E638 PolarHBondContact O-N 2.89Å; E638-S640 PolarHBondContact O-N 2.92Å; E638-K641 CarbonylContact O-C 3.59Å; E638-K641 WeakPolarHBondContact O-CA 3.39Å; E638-K641 WeakPolarHBondContact O-CB 3.25Å; E638-K641 PolarHBondContact O-N 2.96Å; E638-K641 IonicContact OE2-NZ 2.69Å; E638-K641 PolarHBondContact OE2-NZ 2.77Å; E638-D642 PolarHBondContact O-N 3.49Å
639	M	83.6	Confident	75.1	Confident	67 Å²	67	49.7 Å²	49.7	33%	0.33	27%	0.265	S	S	.	.	H	α-helix	trans	-57.4	-34.1	173.9	-68.3	-63.2	-74.3	0	0	112.2	D349 W519 R635 K641 S643	D349-M639 WeakPolarHBondContact OD2-CE 3.44Å; W519-M639 HydrophobicContact CH2-CB 3.86Å; W519-M639 HydrophobicContact CZ3-CB 4.16Å; R635-M639 HydrophobicContact CG-CG 4.33Å; R635-M639 WeakPolarHBondContact O-CB 3.28Å; R635-M639 WeakPolarHBondContact O-CG 3.47Å; R635-M639 PolarHBondContact O-N 3.33Å; M639-K641 PolarHBondContact O-N 3.04Å; M639-S643 PolarHBondContact O-N 2.62Å; M639-S643 PolarHBondContact O-OG 3.23Å
640	S	80.5	Confident	72.7	Confident	13 Å²	13	52.6 Å²	52.6	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-29.3	175	82.8	0	0	0	0	113.4	L518 L636 M637 E638	L518-S640 WeakPolarHBondContact O-CB 3.47Å; L636-S640 PolarHBondContact O-N 3.28Å; L636-S640 VanDerWaalsContact O-N 3.16Å; M637-S640 PolarHBondContact O-OG 2.95Å; E638-S640 PolarHBondContact O-N 2.92Å
641	K	76.2	Confident	70.5	Confident	26 Å²	26	56.7 Å²	56.7	11%	0.113	33%	0.326	C	S	.	.	H	α-helix	trans	-91.7	-37.8	177.3	-61.5	174.5	-168.5	162.5	0	112.2	M588 E638 M639 S643 L644	M588-K641 VanDerWaalsContact CE-NZ 3.26Å; E638-K641 CarbonylContact O-C 3.59Å; E638-K641 WeakPolarHBondContact O-CA 3.39Å; E638-K641 WeakPolarHBondContact O-CB 3.25Å; E638-K641 PolarHBondContact O-N 2.96Å; E638-K641 IonicContact OE2-NZ 2.69Å; E638-K641 PolarHBondContact OE2-NZ 2.77Å; M639-K641 PolarHBondContact O-N 3.04Å; K641-S643 PolarHBondContact O-N 2.91Å; K641-L644 VanDerWaalsContact O-CB 3.28Å; K641-L644 WeakPolarHBondContact O-CB 2.94Å; K641-L644 PolarHBondContact O-N 3.33Å
642	D	70.8	Confident	68.3	Low	78 Å²	78	59.1 Å²	59.1	42%	0.417	34%	0.343	S	S	.	.	H	α-helix	trans	-63.3	-28.2	-177.5	-167.5	40.5	0	0	0	111.6	E638 L644 Q645	E638-D642 PolarHBondContact O-N 3.49Å; D642-L644 PolarHBondContact O-N 2.96Å; D642-Q645 PolarHBondContact O-N 3.21Å; D642-Q645 VanDerWaalsContact O-O 3.13Å
643	S	66.9	Low	66.3	Low	44 Å²	44	65.1 Å²	65.1	31%	0.308	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-22.3	169.5	-60.1	0	0	0	0	114.1	L520 M639 K641	L520-S643 WeakPolarHBondContact O-CB 3.47Å; M639-S643 PolarHBondContact O-N 2.62Å; M639-S643 PolarHBondContact O-OG 3.23Å; K641-S643 PolarHBondContact O-N 2.91Å
644	L	62.5	Low	64.2	Low	43 Å²	43	71.3 Å²	71.3	23%	0.225	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-27.7	176.1	-64.5	158	0	0	0	113.5	Y495 I501 L520 K641 D642 A646	Y495-L644 HydrophobicContact CE2-CD2 4.38Å; Y495-L644 WeakPolarHBondContact OH-CD2 3.47Å; I501-L644 HydrophobicContact CD1-CD1 3.69Å; I501-L644 HydrophobicContact CD1-CD2 4.17Å; I501-L644 HydrophobicContact CG1-CD2 4.21Å; L520-L644 HydrophobicContact CB-CD2 4.41Å; L520-L644 HydrophobicContact CD1-CD2 3.95Å; L520-L644 HydrophobicContact CD2-CD2 4.02Å; L520-L644 HydrophobicContact CG-CD2 4.33Å; K641-L644 VanDerWaalsContact O-CB 3.28Å; K641-L644 WeakPolarHBondContact O-CB 2.94Å; K641-L644 PolarHBondContact O-N 3.33Å; D642-L644 PolarHBondContact O-N 2.96Å; L644-A646 PolarHBondContact O-N 2.8Å
645	Q	61.6	Low	62.6	Low	55 Å²	55	75.6 Å²	75.6	26%	0.257	42%	0.422	S	S	.	.	S	Bend	trans	-78.5	106.8	176.7	-61.6	-162.5	41.1	0	0	106.8	D642 D647	D642-Q645 PolarHBondContact O-N 3.21Å; D642-Q645 VanDerWaalsContact O-O 3.13Å; Q645-D647 PolarHBondContact O-N 2.92Å
646	A	49.8	Very low	61.4	Low	81 Å²	81	79.1 Å²	79.1	67%	0.669	44%	0.435	S	S	*	.			trans	-54.4	113.6	165.9	0	0	0	0	0	107.3	L644 K648	L644-A646 PolarHBondContact O-N 2.8Å; A646-K648 VanDerWaalsContact C-N 3.34Å; A646-K648 PolarHBondContact O-N 3.2Å
647	D	46.1	Very low	60.3	Low	100 Å²	100	81.9 Å²	81.9	54%	0.535	45%	0.453	S	S	.	.			trans	-2.9	82.8	168.5	-80.9	-57.7	0	0	0	113.2	K524 Q645 S649 G650	K524-D647 IonicContact NZ-OD2 3.28Å; Q645-D647 PolarHBondContact O-N 2.92Å; D647-S649 WeakPolarHBondContact CB-OG 3.47Å; D647-S649 PolarHBondContact O-N 3.41Å; D647-S649 PolarHBondContact OD1-OG 3Å; D647-G650 PolarHBondContact O-N 3.12Å
648	K	46.8	Very low	59.6	Low	160 Å²	160	81.8 Å²	81.8	70%	0.696	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-66.1	-4.6	155.1	-76.7	-179.9	-178.4	163	0	110.4	A646 G650 S651	A646-K648 VanDerWaalsContact C-N 3.34Å; A646-K648 PolarHBondContact O-N 3.2Å; K648-G650 PolarHBondContact O-N 3.47Å; K648-S651 PolarHBondContact O-N 3.48Å
649	S	42.8	Very low	59.1	Low	80 Å²	80	81.3 Å²	81.3	56%	0.559	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-63.6	-17.1	162.2	73.9	0	0	0	0	112.5	D647 S651	D647-S649 WeakPolarHBondContact CB-OG 3.47Å; D647-S649 PolarHBondContact O-N 3.41Å; D647-S649 PolarHBondContact OD1-OG 3Å; S649-S651 VanDerWaalsContact C-N 3.25Å; S649-S651 PolarHBondContact O-N 3.11Å
650	G	41.3	Very low	58.8	Low	70 Å²	70	79.2 Å²	79.2	72%	0.722	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-74.8	-1.6	171.3	0	0	0	0	0	115.7	D647 K648	D647-G650 PolarHBondContact O-N 3.12Å; K648-G650 PolarHBondContact O-N 3.47Å
651	S	43.7	Very low	58.6	Low	85 Å²	85	78.7 Å²	78.7	59%	0.594	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-152.6	47.2	166.4	-159.2	0	0	0	0	112.6	K648 S649 R653	K648-S651 PolarHBondContact O-N 3.48Å; S649-S651 VanDerWaalsContact C-N 3.25Å; S649-S651 PolarHBondContact O-N 3.11Å; S651-R653 PolarHBondContact O-N 2.7Å; S651-R653 VanDerWaalsContact O-N 3.15Å
652	T	44.7	Very low	58.7	Low	114 Å²	114	79.6 Å²	79.6	70%	0.699	44%	0.444	S	S	*	.				-75.3	77.6	126.7	-42.2	0	0	0	0	103.5	T654	T652-T654 PolarHBondContact O-N 3.29Å
653	R	47.8	Very low	59	Low	166 Å²	166	77.6 Å²	77.6	63%	0.626	44%	0.437	S	S	*	.			trans	-39.4	119.7	154.6	-90.7	179.2	172.4	179	-1.2	102.6	S651 Q655 D659	S651-R653 PolarHBondContact O-N 2.7Å; S651-R653 VanDerWaalsContact O-N 3.15Å; R653-Q655 WeakPolarHBondContact O-CA 3.31Å; R653-Q655 PolarHBondContact O-N 3.14Å; R653-D659 IonicContact NH1-OD2 3.36Å
654	T	47.2	Very low	59.4	Low	130 Å²	130	75.7 Å²	75.7	80%	0.798	42%	0.423	S	S	*	.			trans	-43.4	99.3	157.4	30.2	0	0	0	0	103.1	T652 R656	T652-T654 PolarHBondContact O-N 3.29Å; T654-R656 VanDerWaalsContact C-N 3.33Å; T654-R656 PolarHBondContact O-N 3.49Å
655	Q	55.1	Low	60.1	Low	127 Å²	127	73.6 Å²	73.6	59%	0.593	41%	0.412	S	S	*	.			trans	-62	112.2	-165.9	-77.2	-179.4	-22.3	0	0	101.4	R653 V660	R653-Q655 WeakPolarHBondContact O-CA 3.31Å; R653-Q655 PolarHBondContact O-N 3.14Å; Q655-V660 HydrophobicContact CB-CG2 3.45Å; Q655-V660 VanDerWaalsContact CB-CG2 3.45Å; Q655-V660 HydrophobicContact CG-CG2 4.38Å
656	R	63.6	Low	60.7	Low	155 Å²	155	77.7 Å²	77.7	59%	0.585	43%	0.425	S	S	*	.			trans	-52.8	138	178.5	-73.2	-176	176.3	-174.4	-1.3	104.3	T654 A658 D659 V660 E705	T654-R656 VanDerWaalsContact C-N 3.33Å; T654-R656 PolarHBondContact O-N 3.49Å; R656-A658 HydrophobicContact CB-CB 4.3Å; R656-A658 CarbonylContact O-C 3.53Å; R656-A658 PolarHBondContact O-N 3.42Å; R656-D659 PolarHBondContact O-N 3.17Å; R656-V660 PolarHBondContact O-N 3.36Å; R656-E705 IonicContact NH1-OE1 3.1Å; R656-E705 PolarHBondContact NH1-OE1 3.12Å
657	P	66.3	Low	61.9	Low	58 Å²	58	77.9 Å²	77.9	38%	0.377	41%	0.412	S	S	.	.	H	α-helix	trans	-44.5	-36.1	175.7	-30	35	0	0	0	111.3	V660 I661 F694	P657-V660 PolarHBondContact O-N 3.13Å; P657-I661 WeakPolarHBondContact O-CB 3.46Å; P657-I661 VanDerWaalsContact O-CD1 3.28Å; P657-I661 WeakPolarHBondContact O-CD1 3.48Å; P657-I661 WeakPolarHBondContact O-CG1 3.31Å; P657-I661 PolarHBondContact O-N 3.03Å; P657-F694 HydrophobicContact CB-CD1 4.19Å; P657-F694 HydrophobicContact CB-CE1 3.96Å
658	A	71.6	Confident	63.2	Low	8 Å²	8	74.5 Å²	74.5	7%	0.066	39%	0.394	C	S	.	.	H	α-helix	trans	-53.7	-49.9	169.5	0	0	0	0	0	115.4	R656 V660 I661 F662 A702 Y706	R656-A658 HydrophobicContact CB-CB 4.3Å; R656-A658 CarbonylContact O-C 3.53Å; R656-A658 PolarHBondContact O-N 3.42Å; A658-V660 VanDerWaalsContact C-N 3.34Å; A658-V660 PolarHBondContact O-N 3.23Å; A658-I661 PolarHBondContact O-N 3.17Å; A658-F662 WeakPolarHBondContact O-CB 3.15Å; A658-F662 PolarHBondContact O-N 3.16Å; A658-A702 HydrophobicContact CB-CB 3.83Å; A658-Y706 HydrophobicContact CB-CE2 3.86Å; A658-Y706 WeakPolarHBondContact O-CE2 3.36Å; A658-Y706 PolarHBondContact O-OH 3.37Å
659	D	73.4	Confident	64.1	Low	48 Å²	48	68.5 Å²	68.5	26%	0.257	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-36.5	179.4	-76.7	-28.8	0	0	0	111.9	R653 R656 S663 Y706	R653-D659 IonicContact NH1-OD2 3.36Å; R656-D659 PolarHBondContact O-N 3.17Å; D659-S663 WeakPolarHBondContact O-CB 3.38Å; D659-S663 PolarHBondContact O-N 2.91Å; D659-Y706 VanDerWaalsContact CA-OH 3.28Å; D659-Y706 WeakPolarHBondContact CA-OH 3.45Å; D659-Y706 PolarHBondContact N-OH 3.41Å; D659-Y706 PolarHBondContact OD1-OH 2.78Å
660	V	75.9	Confident	65.1	Low	23 Å²	23	69.2 Å²	69.2	14%	0.139	37%	0.372	C	S	.	.	H	α-helix	trans	-67.9	-46.9	175.4	-172.1	0	0	0	0	110.1	Q655 R656 P657 A658 F662 S663 L664 F694	Q655-V660 HydrophobicContact CB-CG2 3.45Å; Q655-V660 VanDerWaalsContact CB-CG2 3.45Å; Q655-V660 HydrophobicContact CG-CG2 4.38Å; R656-V660 PolarHBondContact O-N 3.36Å; P657-V660 PolarHBondContact O-N 3.13Å; A658-V660 VanDerWaalsContact C-N 3.34Å; A658-V660 PolarHBondContact O-N 3.23Å; V660-F662 VanDerWaalsContact C-N 3.32Å; V660-F662 PolarHBondContact O-N 2.92Å; V660-S663 PolarHBondContact O-N 3.15Å; V660-S663 PolarHBondContact O-OG 3.45Å; V660-L664 WeakPolarHBondContact O-CB 3.36Å; V660-L664 PolarHBondContact O-N 3.14Å; V660-F694 HydrophobicContact CB-CE2 4.45Å; V660-F694 HydrophobicContact CB-CZ 4.01Å; V660-F694 HydrophobicContact CG1-CE2 3.95Å; V660-F694 HydrophobicContact CG1-CZ 3.85Å; V660-F694 HydrophobicContact CG2-CZ 4.49Å
661	I	77.4	Confident	66.2	Low	1 Å²	1	72.1 Å²	72.1	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-59.6	-45.2	177.1	-70.6	162.8	0	0	0	109.9	P657 A658 S663 L664 V665 F694 F699 A702	P657-I661 WeakPolarHBondContact O-CB 3.46Å; P657-I661 VanDerWaalsContact O-CD1 3.28Å; P657-I661 WeakPolarHBondContact O-CD1 3.48Å; P657-I661 WeakPolarHBondContact O-CG1 3.31Å; P657-I661 PolarHBondContact O-N 3.03Å; A658-I661 PolarHBondContact O-N 3.17Å; I661-S663 PolarHBondContact O-N 3.31Å; I661-L664 WeakPolarHBondContact O-CB 3.35Å; I661-L664 PolarHBondContact O-N 3.07Å; I661-L664 VanDerWaalsContact O-N 3.14Å; I661-V665 HydrophobicContact CG2-CG2 4.37Å; I661-V665 VanDerWaalsContact O-CG2 3.31Å; I661-V665 WeakPolarHBondContact O-CG2 3.39Å; I661-V665 PolarHBondContact O-N 2.93Å; I661-F694 HydrophobicContact CD1-CD1 4.48Å; I661-F694 HydrophobicContact CD1-CG 4.38Å; I661-F694 HydrophobicContact CG1-CD2 4.37Å; I661-F694 HydrophobicContact CG1-CG 4.39Å; I661-F699 HydrophobicContact CG2-CD2 3.55Å; I661-F699 HydrophobicContact CG2-CE2 3.84Å; I661-A702 HydrophobicContact CB-CB 4.37Å; I661-A702 HydrophobicContact CD1-CB 4.11Å; I661-A702 HydrophobicContact CG2-CB 4.16Å
662	F	78.2	Confident	66.8	Low	45 Å²	45	70.6 Å²	70.6	20%	0.197	37%	0.365	C	S	.	.	H	α-helix	trans	-58.4	-47.1	175.1	177.9	-101.2	0	0	0	112.4	A658 V660 L664 V665 R666 Y706 V711 W712 F723	A658-F662 WeakPolarHBondContact O-CB 3.15Å; A658-F662 PolarHBondContact O-N 3.16Å; V660-F662 VanDerWaalsContact C-N 3.32Å; V660-F662 PolarHBondContact O-N 2.92Å; F662-L664 PolarHBondContact O-N 3.01Å; F662-V665 PolarHBondContact O-N 3.22Å; F662-R666 VanDerWaalsContact O-CB 3.31Å; F662-R666 WeakPolarHBondContact O-CB 3.28Å; F662-R666 PolarHBondContact O-N 3.45Å; F662-Y706 HydrophobicContact CB-CD2 4.31Å; F662-Y706 HydrophobicContact CB-CE1 4.46Å; F662-Y706 HydrophobicContact CB-CE2 3.67Å; F662-Y706 HydrophobicContact CD2-CD1 4.33Å; F662-Y706 HydrophobicContact CD2-CD2 4.38Å; F662-Y706 HydrophobicContact CD2-CE1 4.33Å; F662-Y706 HydrophobicContact CD2-CE2 4.41Å; F662-Y706 HydrophobicContact CD2-CG 4.37Å; F662-Y706 HydrophobicContact CG-CE1 4.35Å; F662-Y706 HydrophobicContact CG-CE2 4.31Å; F662-V711 HydrophobicContact CD2-CG1 4.48Å; F662-V711 HydrophobicContact CE2-CG1 3.45Å; F662-V711 VanDerWaalsContact CE2-CG1 3.45Å; F662-V711 HydrophobicContact CZ-CG1 3.88Å; F662-W712 HydrophobicContact CD2-CE3 4.35Å; F662-W712 HydrophobicContact CD2-CH2 4.03Å; F662-W712 AromaticContact CD2-CZ3 3.67Å; F662-W712 HydrophobicContact CD2-CZ3 3.67Å; F662-W712 HydrophobicContact CE2-CZ3 4.24Å; F662-F723 AromaticContact CE2-CE1 3.79Å; F662-F723 HydrophobicContact CE2-CE1 3.79Å; F662-F723 HydrophobicContact CZ-CE1 4.39Å
663	S	77	Confident	67.2	Low	37 Å²	37	69 Å²	69	26%	0.259	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-36.2	176.9	76.1	0	0	0	0	112.4	D659 V660 I661 R666 E667	D659-S663 WeakPolarHBondContact O-CB 3.38Å; D659-S663 PolarHBondContact O-N 2.91Å; V660-S663 PolarHBondContact O-N 3.15Å; V660-S663 PolarHBondContact O-OG 3.45Å; I661-S663 PolarHBondContact O-N 3.31Å; S663-R666 WeakPolarHBondContact O-CB 3.12Å; S663-R666 PolarHBondContact O-N 3.24Å; S663-E667 WeakPolarHBondContact O-CG 3.35Å; S663-E667 PolarHBondContact O-N 3.49Å
664	L	75.6	Confident	67.2	Low	3 Å²	3	66.3 Å²	66.3	2%	0.016	38%	0.376	C	S	.	.	H	α-helix	trans	-76.2	-38.5	-177.4	-154.2	138.7	0	0	0	112.1	V660 I661 F662 R666 E667 L668 R688 R692	V660-L664 WeakPolarHBondContact O-CB 3.36Å; V660-L664 PolarHBondContact O-N 3.14Å; I661-L664 WeakPolarHBondContact O-CB 3.35Å; I661-L664 PolarHBondContact O-N 3.07Å; I661-L664 VanDerWaalsContact O-N 3.14Å; F662-L664 PolarHBondContact O-N 3.01Å; L664-R666 VanDerWaalsContact C-N 3.31Å; L664-E667 PolarHBondContact O-N 3.29Å; L664-L668 PolarHBondContact O-N 2.68Å; L664-L668 VanDerWaalsContact O-N 3.17Å; L664-R688 HydrophobicContact CD2-CB 3.72Å; L664-R688 HydrophobicContact CD2-CG 3.72Å; L664-R692 HydrophobicContact CD1-CG 3.98Å
665	V	75.6	Confident	67	Low	0 Å²	0	63 Å²	63	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-69	-32.5	171.2	-176	0	0	0	0	110.7	I661 F662 L668 T669 V680 A685 F699 W712 F723	I661-V665 HydrophobicContact CG2-CG2 4.37Å; I661-V665 VanDerWaalsContact O-CG2 3.31Å; I661-V665 WeakPolarHBondContact O-CG2 3.39Å; I661-V665 PolarHBondContact O-N 2.93Å; F662-V665 PolarHBondContact O-N 3.22Å; V665-L668 WeakPolarHBondContact O-CB 3.35Å; V665-L668 PolarHBondContact O-N 3.3Å; V665-T669 PolarHBondContact O-N 3.41Å; V665-V680 HydrophobicContact CG1-CG2 4.35Å; V665-A685 HydrophobicContact CG2-CB 4.27Å; V665-F699 HydrophobicContact CG2-CE2 4.26Å; V665-W712 HydrophobicContact CB-CZ3 4.04Å; V665-W712 HydrophobicContact CG1-CE3 4.38Å; V665-W712 HydrophobicContact CG1-CZ3 3.94Å; V665-W712 HydrophobicContact CG2-CZ3 4.42Å; V665-F723 HydrophobicContact CB-CZ 4.25Å; V665-F723 HydrophobicContact CG1-CE2 3.72Å; V665-F723 HydrophobicContact CG1-CZ 3.62Å
666	R	75.1	Confident	66.8	Low	140 Å²	140	69 Å²	69	53%	0.528	39%	0.385	S	S	.	.	H	α-helix	trans	-70.1	-35.8	172.7	-168.5	-176.4	71.1	173.6	0.7	112.9	F662 S663 L664 L668 T669 T670	F662-R666 VanDerWaalsContact O-CB 3.31Å; F662-R666 WeakPolarHBondContact O-CB 3.28Å; F662-R666 PolarHBondContact O-N 3.45Å; S663-R666 WeakPolarHBondContact O-CB 3.12Å; S663-R666 PolarHBondContact O-N 3.24Å; L664-R666 VanDerWaalsContact C-N 3.31Å; R666-L668 VanDerWaalsContact C-N 3.31Å; R666-T669 PolarHBondContact O-N 3.43Å; R666-T669 PolarHBondContact O-OG1 3Å; R666-T670 PolarHBondContact O-N 2.92Å; R666-T670 PolarHBondContact O-OG1 3.36Å
667	E	75.3	Confident	66.4	Low	86 Å²	86	64.4 Å²	64.4	40%	0.402	39%	0.386	S	S	.	.	H	α-helix	trans	-64.2	-39.2	172.6	-79.1	177.1	-178.4	0	0	111.3	S663 L664 T669 T670 E671	S663-E667 WeakPolarHBondContact O-CG 3.35Å; S663-E667 PolarHBondContact O-N 3.49Å; L664-E667 PolarHBondContact O-N 3.29Å; E667-T669 VanDerWaalsContact C-N 3.3Å; E667-T669 PolarHBondContact O-N 3.08Å; E667-T670 WeakPolarHBondContact CA-OG1 3.34Å; E667-T670 PolarHBondContact O-N 2.8Å; E667-T670 VanDerWaalsContact O-N 3.14Å; E667-T670 PolarHBondContact O-OG1 3.25Å; E667-E671 PolarHBondContact O-N 2.76Å
668	L	72.1	Confident	66.2	Low	28 Å²	28	63.2 Å²	63.2	15%	0.147	38%	0.384	C	S	.	.	H	α-helix	trans	-60.8	-36.3	174.8	-80.2	165.8	0	0	0	112.8	L664 V665 R666 G672 V680 A685	L664-L668 PolarHBondContact O-N 2.68Å; L664-L668 VanDerWaalsContact O-N 3.17Å; V665-L668 WeakPolarHBondContact O-CB 3.35Å; V665-L668 PolarHBondContact O-N 3.3Å; R666-L668 VanDerWaalsContact C-N 3.31Å; L668-G672 PolarHBondContact O-N 2.91Å; L668-G672 VanDerWaalsContact O-N 3.07Å; L668-V680 HydrophobicContact CB-CG1 4.29Å; L668-V680 HydrophobicContact CB-CG2 4.49Å; L668-V680 HydrophobicContact CD1-CG1 4.29Å; L668-A685 HydrophobicContact CD1-CB 4.24Å
669	T	66.5	Low	66	Low	35 Å²	35	66.1 Å²	66.1	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-70.4	-34.7	174.5	50.5	0	0	0	0	113.1	V665 R666 E667 A673 V680 F723	V665-T669 PolarHBondContact O-N 3.41Å; R666-T669 PolarHBondContact O-N 3.43Å; R666-T669 PolarHBondContact O-OG1 3Å; E667-T669 VanDerWaalsContact C-N 3.3Å; E667-T669 PolarHBondContact O-N 3.08Å; T669-A673 PolarHBondContact O-N 3.15Å; T669-V680 HydrophobicContact CG2-CG2 3.28Å; T669-F723 HydrophobicContact CG2-CD2 3.45Å; T669-F723 VanDerWaalsContact CG2-CD2 3.45Å; T669-F723 HydrophobicContact CG2-CE2 3.29Å; T669-F723 HydrophobicContact CG2-CG 4.49Å; T669-F723 HydrophobicContact CG2-CZ 4.25Å
670	T	64.9	Low	66	Low	95 Å²	95	64.3 Å²	64.3	58%	0.583	39%	0.391	S	S	*	.	H	α-helix	trans	-73.5	-35.9	177	50.5	0	0	0	0	113.2	R666 E667 G672 A673	R666-T670 PolarHBondContact O-N 2.92Å; R666-T670 PolarHBondContact O-OG1 3.36Å; E667-T670 WeakPolarHBondContact CA-OG1 3.34Å; E667-T670 PolarHBondContact O-N 2.8Å; E667-T670 VanDerWaalsContact O-N 3.14Å; E667-T670 PolarHBondContact O-OG1 3.25Å; T670-G672 VanDerWaalsContact C-N 3.35Å; T670-A673 WeakPolarHBondContact O-CB 3.28Å; T670-A673 PolarHBondContact O-N 3.23Å
671	E	64.2	Low	66	Low	130 Å²	130	70.4 Å²	70.4	61%	0.607	41%	0.412	S	S	*	.	H	α-helix	trans	-71.1	-32.9	175.4	-74.4	176.7	171.9	0	0	111.3	E667 A673 R688	E667-E671 PolarHBondContact O-N 2.76Å; E671-A673 VanDerWaalsContact C-N 3.3Å; E671-A673 PolarHBondContact O-N 3.28Å; E671-R688 IonicContact OE1-NH1 3.88Å; E671-R688 IonicContact OE1-NH2 2.8Å; E671-R688 PolarHBondContact OE1-NH2 2.88Å; E671-R688 VanDerWaalsContact OE1-NH2 3.11Å; E671-R688 IonicContact OE2-CZ 2.67Å; E671-R688 IonicContact OE2-NH1 3.99Å; E671-R688 PolarHBondContact OE2-NH1 3.43Å; E671-R688 IonicContact OE2-NH2 3.13Å; E671-R688 PolarHBondContact OE2-NH2 3.01Å; E671-R688 VanDerWaalsContact OE2-NH2 3.12Å
672	G	56	Low	66	Low	54 Å²	54	71.8 Å²	71.8	56%	0.557	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	2.5	177.5	0	0	0	0	0	115.6	L668 T670 A674	L668-G672 PolarHBondContact O-N 2.91Å; L668-G672 VanDerWaalsContact O-N 3.07Å; T670-G672 VanDerWaalsContact C-N 3.35Å; G672-A674 PolarHBondContact O-N 3.32Å
673	A	51.6	Low	65.9	Low	81 Å²	81	72.5 Å²	72.5	67%	0.669	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	44.5	-171	0	0	0	0	0	115.1	T669 T670 E671	T669-A673 PolarHBondContact O-N 3.15Å; T670-A673 WeakPolarHBondContact O-CB 3.28Å; T670-A673 PolarHBondContact O-N 3.23Å; E671-A673 VanDerWaalsContact C-N 3.3Å; E671-A673 PolarHBondContact O-N 3.28Å
674	A	47.8	Very low	65.9	Low	109 Å²	109	75 Å²	75	90%	0.901	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	3.5	164.7	0	0	0	0	0	113.5	G672	G672-A674 PolarHBondContact O-N 3.32Å
675	G	44.1	Very low	65.8	Low	60 Å²	60	74.9 Å²	74.9	62%	0.619	44%	0.44	S	S	*	.	S	Bend	trans	-165.3	106	178	0	0	0	0	0	115.3
676	R	51.4	Low	66	Low	254 Å²	254	78.8 Å²	78.8	96%	0.958	46%	0.458	S	S	*	.	S	Bend	trans	22	112.6	161.1	-74.5	-176.7	178.7	176.3	-0.3	119.1
677	G	54.9	Low	66.3	Low	58 Å²	58	78.9 Å²	78.9	60%	0.598	47%	0.465	S	S	*	.	S	Bend	trans	92	120.6	161.6	0	0	0	0	0	110.6	V679	G677-V679 PolarHBondContact O-N 2.92Å
678	G	61.5	Low	66.3	Low	33 Å²	33	78.4 Å²	78.4	34%	0.34	46%	0.459	S	S	.	.			trans	-62.3	65.8	-179.3	0	0	0	0	0	113	T722 F723	G678-T722 CarbonylContact O-C 3.3Å; G678-T722 WeakPolarHBondContact O-CA 3.49Å; G678-F723 PolarHBondContact O-N 3.43Å
679	V	67	Low	66.4	Low	69 Å²	69	77.2 Å²	77.2	42%	0.418	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	109.3	-176	-178.5	0	0	0	0	107.1	G677 R720 I721 T722	G677-V679 PolarHBondContact O-N 2.92Å; V679-R720 HydrophobicContact CG1-CB 3.93Å; V679-R720 HydrophobicContact CG1-CG 4.14Å; V679-I721 CarbonylContact C-O 3.45Å; V679-I721 VanDerWaalsContact CA-O 3.29Å; V679-I721 WeakPolarHBondContact CA-O 3.34Å; V679-T722 HydrophobicContact CG2-CG2 3.86Å
680	V	73.5	Confident	67.1	Low	9 Å²	9	79.4 Å²	79.4	6%	0.055	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.9	175	-174.5	0	0	0	0	108.8	V665 L668 T669 A685 R720 I721 F723	V665-V680 HydrophobicContact CG1-CG2 4.35Å; L668-V680 HydrophobicContact CB-CG1 4.29Å; L668-V680 HydrophobicContact CB-CG2 4.49Å; L668-V680 HydrophobicContact CD1-CG1 4.29Å; T669-V680 HydrophobicContact CG2-CG2 3.28Å; V680-A685 HydrophobicContact CG1-CB 4.13Å; V680-R720 WeakPolarHBondContact O-CA 3.49Å; V680-I721 PolarHBondContact N-O 2.71Å; V680-I721 PolarHBondContact O-N 3.49Å; V680-F723 HydrophobicContact CG2-CE2 4.16Å
681	R	76.2	Confident	67.8	Low	152 Å²	152	79.2 Å²	79.2	57%	0.574	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	129.9	172.1	-72.6	176	178.4	166.4	-2.1	109.4	A683 E684 A685	R681-A683 VanDerWaalsContact C-N 3.27Å; R681-A683 PolarHBondContact O-N 3.05Å; R681-E684 HydrophobicContact CB-CB 4.42Å; R681-E684 HydrophobicContact CB-CG 4.31Å; R681-E684 WeakPolarHBondContact CD-OE1 3.42Å; R681-E684 IonicContact NH1-OE1 3.16Å; R681-E684 PolarHBondContact NH1-OE1 3.38Å; R681-E684 VanDerWaalsContact NH1-OE1 3.16Å; R681-E684 PolarHBondContact O-N 3.47Å; R681-E684 VanDerWaalsContact O-N 3.13Å; R681-A685 PolarHBondContact O-N 2.99Å
682	M	77.3	Confident	68.3	Low	29 Å²	29	81.1 Å²	81.1	14%	0.143	47%	0.471	C	S	.	.	H	α-helix	trans	-60	-37.2	-175.9	-170.1	161.3	177.1	0	0	112.4	E684 A685 E686 F699 L703 R718 T719	M682-E684 PolarHBondContact O-N 2.95Å; M682-A685 PolarHBondContact O-N 3.24Å; M682-E686 WeakPolarHBondContact O-CB 3.28Å; M682-E686 PolarHBondContact O-N 2.75Å; M682-F699 HydrophobicContact CE-CE1 4.38Å; M682-F699 HydrophobicContact CG-CE1 4.5Å; M682-L703 HydrophobicContact CE-CD1 3.57Å; M682-R718 HydrophobicContact SD-CB 4.26Å; M682-T719 PolarHBondContact N-O 3.02Å
683	A	77.1	Confident	69.2	Low	61 Å²	61	81.7 Å²	81.7	50%	0.504	48%	0.476	S	S	.	.	H	α-helix	trans	-64.5	-34.9	178.1	0	0	0	0	0	113.9	R681 Q687	R681-A683 VanDerWaalsContact C-N 3.27Å; R681-A683 PolarHBondContact O-N 3.05Å; A683-Q687 WeakPolarHBondContact O-CB 3.33Å; A683-Q687 VanDerWaalsContact O-CG 3.25Å; A683-Q687 WeakPolarHBondContact O-CG 3.36Å; A683-Q687 PolarHBondContact O-N 3.14Å; A683-Q687 VanDerWaalsContact O-N 3.12Å
684	E	76.8	Confident	70.6	Confident	89 Å²	89	79.9 Å²	79.9	42%	0.416	45%	0.453	S	S	.	.	H	α-helix	trans	-75.5	-37.4	179	-71.5	168.9	-165.2	0	0	110.8	R681 M682 R688	R681-E684 HydrophobicContact CB-CB 4.42Å; R681-E684 HydrophobicContact CB-CG 4.31Å; R681-E684 WeakPolarHBondContact CD-OE1 3.42Å; R681-E684 IonicContact NH1-OE1 3.16Å; R681-E684 PolarHBondContact NH1-OE1 3.38Å; R681-E684 VanDerWaalsContact NH1-OE1 3.16Å; R681-E684 PolarHBondContact O-N 3.47Å; R681-E684 VanDerWaalsContact O-N 3.13Å; M682-E684 PolarHBondContact O-N 2.95Å; E684-R688 PolarHBondContact O-N 3.34Å
685	A	73.9	Confident	72.2	Confident	0 Å²	0	78 Å²	78	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-65.4	-44.3	173.8	0	0	0	0	0	112	V665 L668 V680 R681 M682 R688 C689 F699 I721	V665-A685 HydrophobicContact CG2-CB 4.27Å; L668-A685 HydrophobicContact CD1-CB 4.24Å; V680-A685 HydrophobicContact CG1-CB 4.13Å; R681-A685 PolarHBondContact O-N 2.99Å; M682-A685 PolarHBondContact O-N 3.24Å; A685-R688 PolarHBondContact O-N 3.01Å; A685-C689 PolarHBondContact O-N 2.95Å; A685-C689 PolarHBondContact O-SG 3.07Å; A685-F699 HydrophobicContact CB-CE2 4.22Å; A685-F699 HydrophobicContact CB-CZ 3.77Å; A685-I721 HydrophobicContact CB-CD1 4.44Å
686	E	79.8	Confident	73.9	Confident	82 Å²	82	78.7 Å²	78.7	38%	0.383	42%	0.424	S	S	.	.	H	α-helix	trans	-63.3	-46	178.6	-171.4	178.6	-175.8	0	0	111.5	M682 R688 C689 V690 F699	M682-E686 WeakPolarHBondContact O-CB 3.28Å; M682-E686 PolarHBondContact O-N 2.75Å; E686-R688 VanDerWaalsContact C-N 3.33Å; E686-R688 PolarHBondContact O-N 3.36Å; E686-C689 PolarHBondContact O-N 3.16Å; E686-V690 WeakPolarHBondContact O-CG2 3.36Å; E686-V690 PolarHBondContact O-N 2.91Å; E686-F699 HydrophobicContact CB-CD1 4.4Å; E686-F699 HydrophobicContact CB-CE1 4.07Å; E686-F699 HydrophobicContact CG-CD1 4.38Å
687	Q	80.1	Confident	75.2	Confident	143 Å²	143	69.8 Å²	69.8	67%	0.668	41%	0.405	S	S	*	.	H	α-helix	trans	-59.4	-40.9	177.2	-77.4	177.1	0.9	0	0	112.7	A683 V690 S691	A683-Q687 WeakPolarHBondContact O-CB 3.33Å; A683-Q687 VanDerWaalsContact O-CG 3.25Å; A683-Q687 WeakPolarHBondContact O-CG 3.36Å; A683-Q687 PolarHBondContact O-N 3.14Å; A683-Q687 VanDerWaalsContact O-N 3.12Å; Q687-V690 PolarHBondContact O-N 2.87Å; Q687-S691 PolarHBondContact O-N 3.36Å
688	R	75.1	Confident	76.4	Confident	75 Å²	75	70.5 Å²	70.5	28%	0.283	39%	0.393	S	S	.	.	H	α-helix	trans	-71.8	-34.2	179.8	-147.4	177.7	-176	168	1.2	111.6	L664 E671 E684 A685 E686 S691 R692	L664-R688 HydrophobicContact CD2-CB 3.72Å; L664-R688 HydrophobicContact CD2-CG 3.72Å; E671-R688 IonicContact OE1-NH1 3.88Å; E671-R688 IonicContact OE1-NH2 2.8Å; E671-R688 PolarHBondContact OE1-NH2 2.88Å; E671-R688 VanDerWaalsContact OE1-NH2 3.11Å; E671-R688 IonicContact OE2-CZ 2.67Å; E671-R688 IonicContact OE2-NH1 3.99Å; E671-R688 PolarHBondContact OE2-NH1 3.43Å; E671-R688 IonicContact OE2-NH2 3.13Å; E671-R688 PolarHBondContact OE2-NH2 3.01Å; E671-R688 VanDerWaalsContact OE2-NH2 3.12Å; E684-R688 PolarHBondContact O-N 3.34Å; A685-R688 PolarHBondContact O-N 3.01Å; E686-R688 VanDerWaalsContact C-N 3.33Å; E686-R688 PolarHBondContact O-N 3.36Å; R688-S691 PolarHBondContact O-N 3.14Å; R688-S691 PolarHBondContact O-OG 3.26Å; R688-R692 PolarHBondContact O-N 3.18Å
689	C	75.8	Confident	77.3	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.02	38%	0.377	C	S	.	.	H	α-helix	trans	-66.7	-41.4	173.4	-65.9	0	0	0	0	112.1	A685 E686 S691 R692 G693 F694 F699	A685-C689 PolarHBondContact O-N 2.95Å; A685-C689 PolarHBondContact O-SG 3.07Å; E686-C689 PolarHBondContact O-N 3.16Å; C689-S691 VanDerWaalsContact C-N 3.34Å; C689-S691 PolarHBondContact O-N 3.37Å; C689-R692 PolarHBondContact O-N 3.23Å; C689-G693 PolarHBondContact O-N 3.42Å; C689-F694 PolarHBondContact O-N 2.9Å; C689-F694 VanDerWaalsContact O-N 3.15Å; C689-F699 HydrophobicContact CB-CD2 4.01Å; C689-F699 WeakPolarHBondContact SG-CD2 3.11Å; C689-F699 VanDerWaalsContact SG-CE2 3.59Å
690	V	80.1	Confident	78	Confident	81 Å²	81	69.6 Å²	69.6	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-64.3	-39.3	174.1	174.1	0	0	0	0	111.1	E686 Q687 R692 G693	E686-V690 WeakPolarHBondContact O-CG2 3.36Å; E686-V690 PolarHBondContact O-N 2.91Å; Q687-V690 PolarHBondContact O-N 2.87Å; V690-R692 PolarHBondContact O-N 3.33Å; V690-G693 PolarHBondContact O-N 2.73Å
691	S	79.4	Confident	78.3	Confident	92 Å²	92	75.6 Å²	75.6	64%	0.643	40%	0.402	S	S	*	.	H	α-helix	trans	-61.6	-26.2	177.5	78.7	0	0	0	0	113.9	Q687 R688 C689	Q687-S691 PolarHBondContact O-N 3.36Å; R688-S691 PolarHBondContact O-N 3.14Å; R688-S691 PolarHBondContact O-OG 3.26Å; C689-S691 VanDerWaalsContact C-N 3.34Å; C689-S691 PolarHBondContact O-N 3.37Å
692	R	75	Confident	78.4	Confident	170 Å²	170	68.4 Å²	68.4	64%	0.642	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	1.6	176.8	-74.5	-121.2	-178.9	170.8	4.4	113.5	L664 R688 C689 V690 F694	L664-R692 HydrophobicContact CD1-CG 3.98Å; R688-R692 PolarHBondContact O-N 3.18Å; C689-R692 PolarHBondContact O-N 3.23Å; V690-R692 PolarHBondContact O-N 3.33Å; R692-F694 HydrophobicContact CB-CD2 4.18Å; R692-F694 HydrophobicContact CB-CE2 4.22Å
693	G	75.5	Confident	78.5	Confident	65 Å²	65	67.1 Å²	67.1	67%	0.67	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	12.9	172.9	0	0	0	0	0	115.7	C689 V690	C689-G693 PolarHBondContact O-N 3.42Å; V690-G693 PolarHBondContact O-N 2.73Å
694	F	80.8	Confident	78.7	Confident	44 Å²	44	68.3 Å²	68.3	19%	0.193	37%	0.365	C	S	.	.			trans	-85	145.9	174.7	-64.5	-73.8	0	0	0	111.8	P657 V660 I661 C689 R692	P657-F694 HydrophobicContact CB-CD1 4.19Å; P657-F694 HydrophobicContact CB-CE1 3.96Å; V660-F694 HydrophobicContact CB-CE2 4.45Å; V660-F694 HydrophobicContact CB-CZ 4.01Å; V660-F694 HydrophobicContact CG1-CE2 3.95Å; V660-F694 HydrophobicContact CG1-CZ 3.85Å; V660-F694 HydrophobicContact CG2-CZ 4.49Å; I661-F694 HydrophobicContact CD1-CD1 4.48Å; I661-F694 HydrophobicContact CD1-CG 4.38Å; I661-F694 HydrophobicContact CG1-CD2 4.37Å; I661-F694 HydrophobicContact CG1-CG 4.39Å; C689-F694 PolarHBondContact O-N 2.9Å; C689-F694 VanDerWaalsContact O-N 3.15Å; R692-F694 HydrophobicContact CB-CD2 4.18Å; R692-F694 HydrophobicContact CB-CE2 4.22Å
695	T	82.1	Confident	78.9	Confident	68 Å²	68	67.3 Å²	67.3	42%	0.417	36%	0.36	S	S	.	.			trans	-78.8	150.2	176.8	64.7	0	0	0	0	111	A697 Q698 F699	T695-A697 PolarHBondContact O-N 2.98Å; T695-Q698 PolarHBondContact O-N 2.77Å; T695-Q698 VanDerWaalsContact O-N 3.13Å; T695-Q698 WeakPolarHBondContact OG1-CG 3.45Å; T695-Q698 PolarHBondContact OG1-N 3.37Å; T695-F699 PolarHBondContact O-N 3.09Å; T695-F699 VanDerWaalsContact O-N 3.14Å
696	P	77.8	Confident	79.2	Confident	75 Å²	75	68.2 Å²	68.2	49%	0.487	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-26.9	177	23	-33	0	0	0	112.7	F699 Q700	P696-F699 PolarHBondContact O-N 2.88Å; P696-Q700 PolarHBondContact O-N 3.37Å
697	A	79.7	Confident	79.2	Confident	67 Å²	67	68 Å²	68	55%	0.554	36%	0.362	S	S	*	.	H	α-helix	trans	-66.9	-44.7	174.4	0	0	0	0	0	112.5	T695 F699 Q700 E701	T695-A697 PolarHBondContact O-N 2.98Å; A697-F699 VanDerWaalsContact C-N 3.27Å; A697-F699 PolarHBondContact O-N 3.04Å; A697-Q700 PolarHBondContact O-N 3.22Å; A697-E701 WeakPolarHBondContact O-CB 3.49Å; A697-E701 PolarHBondContact O-N 3.18Å
698	Q	80.5	Confident	79.1	Confident	74 Å²	74	69 Å²	69	35%	0.346	37%	0.367	S	S	.	.	H	α-helix	trans	-65.4	-32.9	176	-73.4	171.1	-14.7	0	0	112.1	T695 A702	T695-Q698 PolarHBondContact O-N 2.77Å; T695-Q698 VanDerWaalsContact O-N 3.13Å; T695-Q698 WeakPolarHBondContact OG1-CG 3.45Å; T695-Q698 PolarHBondContact OG1-N 3.37Å; Q698-A702 WeakPolarHBondContact O-CB 3.31Å; Q698-A702 PolarHBondContact O-N 2.73Å; Q698-A702 VanDerWaalsContact O-N 3.08Å
699	F	81	Confident	79.3	Confident	4 Å²	4	70.6 Å²	70.6	2%	0.018	38%	0.38	C	S	.	.	H	α-helix	trans	-66	-43.2	173.3	-179.2	-108.7	0	0	0	112.2	I661 V665 M682 A685 E686 C689 T695 P696 A697 A702 L703 I721	I661-F699 HydrophobicContact CG2-CD2 3.55Å; I661-F699 HydrophobicContact CG2-CE2 3.84Å; V665-F699 HydrophobicContact CG2-CE2 4.26Å; M682-F699 HydrophobicContact CE-CE1 4.38Å; M682-F699 HydrophobicContact CG-CE1 4.5Å; A685-F699 HydrophobicContact CB-CE2 4.22Å; A685-F699 HydrophobicContact CB-CZ 3.77Å; E686-F699 HydrophobicContact CB-CD1 4.4Å; E686-F699 HydrophobicContact CB-CE1 4.07Å; E686-F699 HydrophobicContact CG-CD1 4.38Å; C689-F699 HydrophobicContact CB-CD2 4.01Å; C689-F699 WeakPolarHBondContact SG-CD2 3.11Å; C689-F699 VanDerWaalsContact SG-CE2 3.59Å; T695-F699 PolarHBondContact O-N 3.09Å; T695-F699 VanDerWaalsContact O-N 3.14Å; P696-F699 PolarHBondContact O-N 2.88Å; A697-F699 VanDerWaalsContact C-N 3.27Å; A697-F699 PolarHBondContact O-N 3.04Å; F699-A702 PolarHBondContact O-N 3.46Å; F699-L703 HydrophobicContact CD1-CD1 3.84Å; F699-L703 HydrophobicContact CE1-CD1 3.42Å; F699-L703 VanDerWaalsContact CE1-CD1 3.42Å; F699-L703 HydrophobicContact CE1-CG 4.27Å; F699-L703 HydrophobicContact CZ-CD1 3.78Å; F699-L703 HydrophobicContact CZ-CD2 4.42Å; F699-L703 HydrophobicContact CZ-CG 4.23Å; F699-L703 WeakPolarHBondContact O-CG 3.44Å; F699-L703 PolarHBondContact O-N 2.95Å; F699-I721 HydrophobicContact CZ-CD1 4.48Å
700	Q	80	Confident	79.3	Confident	79 Å²	79	75.9 Å²	75.9	37%	0.369	41%	0.409	S	S	.	.	H	α-helix	trans	-70.1	-39.9	178.5	-169.7	172	-20.3	0	0	112.5	P696 A697 A702 L703 E704	P696-Q700 PolarHBondContact O-N 3.37Å; A697-Q700 PolarHBondContact O-N 3.22Å; Q700-A702 VanDerWaalsContact C-N 3.33Å; Q700-A702 PolarHBondContact O-N 3.23Å; Q700-L703 WeakPolarHBondContact O-CB 3.48Å; Q700-L703 PolarHBondContact O-N 3.42Å; Q700-E704 PolarHBondContact NE2-OE1 3.49Å; Q700-E704 WeakPolarHBondContact O-CG 3.47Å; Q700-E704 PolarHBondContact O-N 3.37Å
701	E	81.1	Confident	79.1	Confident	134 Å²	134	74.3 Å²	74.3	63%	0.626	40%	0.399	S	S	*	.	H	α-helix	trans	-61.2	-41.9	174.8	-171.2	177.1	-171.2	0	0	111.4	A697 E704 E705	A697-E701 WeakPolarHBondContact O-CB 3.49Å; A697-E701 PolarHBondContact O-N 3.18Å; E701-E704 PolarHBondContact O-N 2.95Å; E701-E705 WeakPolarHBondContact O-CB 3.25Å; E701-E705 PolarHBondContact O-N 3.09Å
702	A	78.8	Confident	79	Confident	2 Å²	2	70 Å²	70	2%	0.017	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-40.5	173.6	0	0	0	0	0	112.3	A658 I661 Q698 F699 Q700 E704 E705 Y706	A658-A702 HydrophobicContact CB-CB 3.83Å; I661-A702 HydrophobicContact CB-CB 4.37Å; I661-A702 HydrophobicContact CD1-CB 4.11Å; I661-A702 HydrophobicContact CG2-CB 4.16Å; Q698-A702 WeakPolarHBondContact O-CB 3.31Å; Q698-A702 PolarHBondContact O-N 2.73Å; Q698-A702 VanDerWaalsContact O-N 3.08Å; F699-A702 PolarHBondContact O-N 3.46Å; Q700-A702 VanDerWaalsContact C-N 3.33Å; Q700-A702 PolarHBondContact O-N 3.23Å; A702-E704 VanDerWaalsContact C-N 3.34Å; A702-E704 PolarHBondContact O-N 3.49Å; A702-E705 PolarHBondContact O-N 3.14Å; A702-Y706 WeakPolarHBondContact O-CD2 3.42Å; A702-Y706 PolarHBondContact O-N 3.28Å; A702-Y706 VanDerWaalsContact O-N 3.09Å
703	L	79.3	Confident	79	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-59.5	-44.8	175.8	-78	171.2	0	0	0	112.3	M682 F699 Q700 E707 W712 I714 I721	M682-L703 HydrophobicContact CE-CD1 3.57Å; F699-L703 HydrophobicContact CD1-CD1 3.84Å; F699-L703 HydrophobicContact CE1-CD1 3.42Å; F699-L703 VanDerWaalsContact CE1-CD1 3.42Å; F699-L703 HydrophobicContact CE1-CG 4.27Å; F699-L703 HydrophobicContact CZ-CD1 3.78Å; F699-L703 HydrophobicContact CZ-CD2 4.42Å; F699-L703 HydrophobicContact CZ-CG 4.23Å; F699-L703 WeakPolarHBondContact O-CG 3.44Å; F699-L703 PolarHBondContact O-N 2.95Å; Q700-L703 WeakPolarHBondContact O-CB 3.48Å; Q700-L703 PolarHBondContact O-N 3.42Å; L703-E707 VanDerWaalsContact O-CB 3.25Å; L703-E707 WeakPolarHBondContact O-CB 3.28Å; L703-E707 PolarHBondContact O-N 3.41Å; L703-W712 HydrophobicContact CD2-CD2 4.47Å; L703-W712 HydrophobicContact CD2-CH2 4.2Å; L703-W712 HydrophobicContact CD2-CZ2 3.58Å; L703-W712 HydrophobicContact CG-CZ2 4.35Å; L703-W712 PolarHBondContact O-NE1 3.33Å; L703-I714 HydrophobicContact CB-CD1 4.21Å; L703-I714 HydrophobicContact CD2-CD1 4.33Å; L703-I721 HydrophobicContact CD2-CD1 3.61Å; L703-I721 HydrophobicContact CD2-CG1 4.14Å
704	E	80.1	Confident	78.9	Confident	86 Å²	86	65.8 Å²	65.8	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-66.9	-45.5	178.8	-70.2	171.2	-169.9	0	0	110.9	Q700 E701 A702 Y706 E707 E708	Q700-E704 PolarHBondContact NE2-OE1 3.49Å; Q700-E704 WeakPolarHBondContact O-CG 3.47Å; Q700-E704 PolarHBondContact O-N 3.37Å; E701-E704 PolarHBondContact O-N 2.95Å; A702-E704 VanDerWaalsContact C-N 3.34Å; A702-E704 PolarHBondContact O-N 3.49Å; E704-Y706 PolarHBondContact O-N 3.22Å; E704-E707 PolarHBondContact O-N 2.88Å; E704-E708 WeakPolarHBondContact O-CG 3.39Å; E704-E708 PolarHBondContact O-N 2.84Å
705	E	82	Confident	78.7	Confident	68 Å²	68	67.8 Å²	67.8	32%	0.318	35%	0.352	S	S	.	.	H	α-helix	trans	-58.7	-43.2	177.5	-171.3	177.9	-172.9	0	0	112	R656 E701 A702 L709	R656-E705 IonicContact NH1-OE1 3.1Å; R656-E705 PolarHBondContact NH1-OE1 3.12Å; E701-E705 WeakPolarHBondContact O-CB 3.25Å; E701-E705 PolarHBondContact O-N 3.09Å; A702-E705 PolarHBondContact O-N 3.14Å; E705-L709 HydrophobicContact CG-CD1 4.49Å; E705-L709 WeakPolarHBondContact O-CD1 3.29Å; E705-L709 VanDerWaalsContact O-CG 3.28Å; E705-L709 WeakPolarHBondContact O-CG 3.45Å; E705-L709 PolarHBondContact O-N 3.21Å
706	Y	79.9	Confident	77.8	Confident	19 Å²	19	74 Å²	74	8%	0.075	38%	0.377	C	S	.	.	H	α-helix	trans	-82.3	-19.8	179.1	-71	-66.2	0	0	0	114.4	A658 D659 F662 A702 E704 L709 N710 V711 W712	A658-Y706 HydrophobicContact CB-CE2 3.86Å; A658-Y706 WeakPolarHBondContact O-CE2 3.36Å; A658-Y706 PolarHBondContact O-OH 3.37Å; D659-Y706 VanDerWaalsContact CA-OH 3.28Å; D659-Y706 WeakPolarHBondContact CA-OH 3.45Å; D659-Y706 PolarHBondContact N-OH 3.41Å; D659-Y706 PolarHBondContact OD1-OH 2.78Å; F662-Y706 HydrophobicContact CB-CD2 4.31Å; F662-Y706 HydrophobicContact CB-CE1 4.46Å; F662-Y706 HydrophobicContact CB-CE2 3.67Å; F662-Y706 HydrophobicContact CD2-CD1 4.33Å; F662-Y706 HydrophobicContact CD2-CD2 4.38Å; F662-Y706 HydrophobicContact CD2-CE1 4.33Å; F662-Y706 HydrophobicContact CD2-CE2 4.41Å; F662-Y706 HydrophobicContact CD2-CG 4.37Å; F662-Y706 HydrophobicContact CG-CE1 4.35Å; F662-Y706 HydrophobicContact CG-CE2 4.31Å; A702-Y706 WeakPolarHBondContact O-CD2 3.42Å; A702-Y706 PolarHBondContact O-N 3.28Å; A702-Y706 VanDerWaalsContact O-N 3.09Å; E704-Y706 PolarHBondContact O-N 3.22Å; Y706-L709 HydrophobicContact CD1-CD1 4.01Å; Y706-L709 HydrophobicContact CE1-CD1 4.37Å; Y706-N710 PolarHBondContact O-N 2.85Å; Y706-V711 HydrophobicContact CD1-CG2 4.25Å; Y706-V711 PolarHBondContact O-N 3.01Å; Y706-W712 VanDerWaalsContact CB-CE2 3.49Å; Y706-W712 VanDerWaalsContact CB-CZ2 3.42Å; Y706-W712 AromaticContact CD2-CH2 3.84Å; Y706-W712 HydrophobicContact CD2-CH2 3.84Å; Y706-W712 AromaticContact CD2-CZ2 3.66Å; Y706-W712 HydrophobicContact CD2-CZ2 3.66Å; Y706-W712 HydrophobicContact CG-CH2 4.3Å; Y706-W712 AromaticContact CG-CZ2 3.93Å; Y706-W712 HydrophobicContact CG-CZ2 3.93Å
707	E	78.7	Confident	77.4	Confident	77 Å²	77	73.8 Å²	73.8	36%	0.36	38%	0.381	S	S	.	.	H	α-helix	trans	-70.3	-42.3	168.6	-176.7	169.3	-152.6	0	0	110.3	L703 E704 L709 N710	L703-E707 VanDerWaalsContact O-CB 3.25Å; L703-E707 WeakPolarHBondContact O-CB 3.28Å; L703-E707 PolarHBondContact O-N 3.41Å; E704-E707 PolarHBondContact O-N 2.88Å; E707-L709 PolarHBondContact O-N 2.91Å; E707-N710 PolarHBondContact O-N 3.03Å
708	E	78.1	Confident	76.7	Confident	163 Å²	163	77.4 Å²	77.4	76%	0.762	38%	0.38	S	S	*	.	H	α-helix	trans	-59.9	-35	171.8	-72.7	-174.2	173.5	0	0	112.3	E704 N710	E704-E708 WeakPolarHBondContact O-CG 3.39Å; E704-E708 PolarHBondContact O-N 2.84Å; E708-N710 PolarHBondContact O-N 3.29Å
709	L	79.9	Confident	76.1	Confident	109 Å²	109	77.5 Å²	77.5	57%	0.571	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	1.4	175.6	-66.4	167.8	0	0	0	113.9	E705 Y706 E707 V711	E705-L709 HydrophobicContact CG-CD1 4.49Å; E705-L709 WeakPolarHBondContact O-CD1 3.29Å; E705-L709 VanDerWaalsContact O-CG 3.28Å; E705-L709 WeakPolarHBondContact O-CG 3.45Å; E705-L709 PolarHBondContact O-N 3.21Å; Y706-L709 HydrophobicContact CD1-CD1 4.01Å; Y706-L709 HydrophobicContact CE1-CD1 4.37Å; E707-L709 PolarHBondContact O-N 2.91Å; L709-V711 VanDerWaalsContact C-N 3.25Å; L709-V711 HydrophobicContact CB-CG2 3.95Å; L709-V711 PolarHBondContact O-N 2.98Å
710	N	75.8	Confident	75.7	Confident	115 Å²	115	83.7 Å²	83.7	62%	0.615	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	29.2	-178.2	-65.3	-71	0	0	0	115	Y706 E707 E708	Y706-N710 PolarHBondContact O-N 2.85Å; E707-N710 PolarHBondContact O-N 3.03Å; E708-N710 PolarHBondContact O-N 3.29Å
711	V	74.9	Confident	75.5	Confident	47 Å²	47	79.9 Å²	79.9	29%	0.285	39%	0.392	S	S	.	.	S	Bend	trans	-83.1	-30.5	-179.9	-174.3	0	0	0	0	111.7	F662 Y706 L709 V724	F662-V711 HydrophobicContact CD2-CG1 4.48Å; F662-V711 HydrophobicContact CE2-CG1 3.45Å; F662-V711 VanDerWaalsContact CE2-CG1 3.45Å; F662-V711 HydrophobicContact CZ-CG1 3.88Å; Y706-V711 HydrophobicContact CD1-CG2 4.25Å; Y706-V711 PolarHBondContact O-N 3.01Å; L709-V711 VanDerWaalsContact C-N 3.25Å; L709-V711 HydrophobicContact CB-CG2 3.95Å; L709-V711 PolarHBondContact O-N 2.98Å; V711-V724 PolarHBondContact O-N 3.39Å
712	W	78.9	Confident	75.1	Confident	1 Å²	1	76 Å²	76	0%	0.004	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	158.5	168.9	52.5	43.6	0	0	0	111.1	F662 V665 L703 Y706 I721 T722 F723	F662-W712 HydrophobicContact CD2-CE3 4.35Å; F662-W712 HydrophobicContact CD2-CH2 4.03Å; F662-W712 AromaticContact CD2-CZ3 3.67Å; F662-W712 HydrophobicContact CD2-CZ3 3.67Å; F662-W712 HydrophobicContact CE2-CZ3 4.24Å; V665-W712 HydrophobicContact CB-CZ3 4.04Å; V665-W712 HydrophobicContact CG1-CE3 4.38Å; V665-W712 HydrophobicContact CG1-CZ3 3.94Å; V665-W712 HydrophobicContact CG2-CZ3 4.42Å; L703-W712 HydrophobicContact CD2-CD2 4.47Å; L703-W712 HydrophobicContact CD2-CH2 4.2Å; L703-W712 HydrophobicContact CD2-CZ2 3.58Å; L703-W712 HydrophobicContact CG-CZ2 4.35Å; L703-W712 PolarHBondContact O-NE1 3.33Å; Y706-W712 VanDerWaalsContact CB-CE2 3.49Å; Y706-W712 VanDerWaalsContact CB-CZ2 3.42Å; Y706-W712 AromaticContact CD2-CH2 3.84Å; Y706-W712 HydrophobicContact CD2-CH2 3.84Å; Y706-W712 AromaticContact CD2-CZ2 3.66Å; Y706-W712 HydrophobicContact CD2-CZ2 3.66Å; Y706-W712 HydrophobicContact CG-CH2 4.3Å; Y706-W712 AromaticContact CG-CZ2 3.93Å; Y706-W712 HydrophobicContact CG-CZ2 3.93Å; W712-I721 HydrophobicContact CB-CG2 3.69Å; W712-I721 HydrophobicContact CD2-CG2 3.78Å; W712-I721 HydrophobicContact CE3-CG2 3.93Å; W712-I721 HydrophobicContact CG-CG2 3.67Å; W712-T722 CarbonylContact C-O 3.58Å; W712-T722 VanDerWaalsContact CA-O 3.22Å; W712-T722 WeakPolarHBondContact CA-O 3.39Å; W712-T722 WeakPolarHBondContact CB-O 3.22Å; W712-F723 HydrophobicContact CE3-CD1 4.36Å; W712-F723 AromaticContact CE3-CE1 3.68Å; W712-F723 HydrophobicContact CE3-CE1 3.68Å; W712-F723 HydrophobicContact CE3-CE2 4.32Å; W712-F723 AromaticContact CE3-CZ 3.67Å; W712-F723 HydrophobicContact CE3-CZ 3.67Å; W712-F723 HydrophobicContact CZ3-CE1 4.15Å; W712-F723 AromaticContact CZ3-CZ 3.96Å; W712-F723 HydrophobicContact CZ3-CZ 3.96Å
713	Q	74.5	Confident	74.6	Confident	115 Å²	115	78.1 Å²	78.1	54%	0.537	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129	171.7	-80.1	175.1	8.1	0	0	110.1	T722 V724	Q713-T722 PolarHBondContact N-O 2.74Å; Q713-T722 PolarHBondContact O-N 3.36Å; Q713-T722 PolarHBondContact O-OG1 3.18Å; Q713-V724 HydrophobicContact CB-CG2 4.14Å; Q713-V724 HydrophobicContact CG-CG2 3.59Å
714	I	73.1	Confident	73.8	Confident	32 Å²	32	84.5 Å²	84.5	16%	0.164	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.7	174.7	-55.2	178	0	0	0	108.2	L703 R718	L703-I714 HydrophobicContact CB-CD1 4.21Å; L703-I714 HydrophobicContact CD2-CD1 4.33Å; I714-R718 HydrophobicContact CG2-CB 4.48Å; I714-R718 HydrophobicContact CG2-CG 4.21Å
715	N	75.9	Confident	73.5	Confident	87 Å²	87	84.4 Å²	84.4	47%	0.465	43%	0.426	S	S	.	.			trans	-67.7	150.2	175.8	-162	-16	0	0	0	110.4	A717 R718 R720	N715-A717 PolarHBondContact O-N 3.3Å; N715-R718 PolarHBondContact O-N 2.8Å; N715-R720 PolarHBondContact N-O 2.87Å
716	Q	64.4	Low	73	Confident	199 Å²	199	85.3 Å²	85.3	93%	0.93	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-22.2	-176.8	-67.8	-177.8	-5.4	0	0	114.1
717	A	68.6	Low	72.7	Confident	69 Å²	69	88.9 Å²	88.9	57%	0.57	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	3.2	175.1	0	0	0	0	0	114.9	N715 T719	N715-A717 PolarHBondContact O-N 3.3Å; A717-T719 HydrophobicContact CB-CG2 4.35Å; A717-T719 WeakPolarHBondContact O-CG2 3.39Å; A717-T719 PolarHBondContact O-N 2.63Å; A717-T719 VanDerWaalsContact O-N 3.14Å
718	R	65.8	Low	72.3	Confident	144 Å²	144	89.6 Å²	89.6	54%	0.543	46%	0.457	S	S	.	.	S	Bend	trans	48.9	34.4	-175.8	-67.2	-173	172.6	-159.4	-6.2	114.9	M682 I714 N715	M682-R718 HydrophobicContact SD-CB 4.26Å; I714-R718 HydrophobicContact CG2-CB 4.48Å; I714-R718 HydrophobicContact CG2-CG 4.21Å; N715-R718 PolarHBondContact O-N 2.8Å
719	T	67.8	Low	72	Confident	76 Å²	76	85.1 Å²	85.1	47%	0.466	44%	0.437	S	S	.	.	S	Bend	trans	-104.7	-19.8	-178.2	51.5	0	0	0	0	114.1	M682 A717	M682-T719 PolarHBondContact N-O 3.02Å; A717-T719 HydrophobicContact CB-CG2 4.35Å; A717-T719 WeakPolarHBondContact O-CG2 3.39Å; A717-T719 PolarHBondContact O-N 2.63Å; A717-T719 VanDerWaalsContact O-N 3.14Å
720	R	73.2	Confident	71.4	Confident	133 Å²	133	83.5 Å²	83.5	50%	0.502	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	133.7	-172.4	-63.4	-178	-176.2	178.3	0.9	110.3	V679 V680 N715	V679-R720 HydrophobicContact CG1-CB 3.93Å; V679-R720 HydrophobicContact CG1-CG 4.14Å; V680-R720 WeakPolarHBondContact O-CA 3.49Å; N715-R720 PolarHBondContact N-O 2.87Å
721	I	74.9	Confident	71.1	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.1	172.9	-59.3	161.3	0	0	0	106.5	V679 V680 A685 F699 L703 W712	V679-I721 CarbonylContact C-O 3.45Å; V679-I721 VanDerWaalsContact CA-O 3.29Å; V679-I721 WeakPolarHBondContact CA-O 3.34Å; V680-I721 PolarHBondContact N-O 2.71Å; V680-I721 PolarHBondContact O-N 3.49Å; A685-I721 HydrophobicContact CB-CD1 4.44Å; F699-I721 HydrophobicContact CZ-CD1 4.48Å; L703-I721 HydrophobicContact CD2-CD1 3.61Å; L703-I721 HydrophobicContact CD2-CG1 4.14Å; W712-I721 HydrophobicContact CB-CG2 3.69Å; W712-I721 HydrophobicContact CD2-CG2 3.78Å; W712-I721 HydrophobicContact CE3-CG2 3.93Å; W712-I721 HydrophobicContact CG-CG2 3.67Å
722	T	72	Confident	70.8	Confident	53 Å²	53	83.8 Å²	83.8	33%	0.325	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	115.2	-179.5	-32.2	0	0	0	0	108.1	G678 V679 W712 Q713 V724	G678-T722 CarbonylContact O-C 3.3Å; G678-T722 WeakPolarHBondContact O-CA 3.49Å; V679-T722 HydrophobicContact CG2-CG2 3.86Å; W712-T722 CarbonylContact C-O 3.58Å; W712-T722 VanDerWaalsContact CA-O 3.22Å; W712-T722 WeakPolarHBondContact CA-O 3.39Å; W712-T722 WeakPolarHBondContact CB-O 3.22Å; Q713-T722 PolarHBondContact N-O 2.74Å; Q713-T722 PolarHBondContact O-N 3.36Å; Q713-T722 PolarHBondContact O-OG1 3.18Å; T722-V724 PolarHBondContact O-N 3.48Å
723	F	69.8	Low	70.1	Confident	45 Å²	45	90.8 Å²	90.8	20%	0.197	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	133.9	172.6	-75.7	-95.3	0	0	0	109.6	F662 V665 T669 G678 V680 W712	F662-F723 AromaticContact CE2-CE1 3.79Å; F662-F723 HydrophobicContact CE2-CE1 3.79Å; F662-F723 HydrophobicContact CZ-CE1 4.39Å; V665-F723 HydrophobicContact CB-CZ 4.25Å; V665-F723 HydrophobicContact CG1-CE2 3.72Å; V665-F723 HydrophobicContact CG1-CZ 3.62Å; T669-F723 HydrophobicContact CG2-CD2 3.45Å; T669-F723 VanDerWaalsContact CG2-CD2 3.45Å; T669-F723 HydrophobicContact CG2-CE2 3.29Å; T669-F723 HydrophobicContact CG2-CG 4.49Å; T669-F723 HydrophobicContact CG2-CZ 4.25Å; G678-F723 PolarHBondContact O-N 3.43Å; V680-F723 HydrophobicContact CG2-CE2 4.16Å; W712-F723 HydrophobicContact CE3-CD1 4.36Å; W712-F723 AromaticContact CE3-CE1 3.68Å; W712-F723 HydrophobicContact CE3-CE1 3.68Å; W712-F723 HydrophobicContact CE3-CE2 4.32Å; W712-F723 AromaticContact CE3-CZ 3.67Å; W712-F723 HydrophobicContact CE3-CZ 3.67Å; W712-F723 HydrophobicContact CZ3-CE1 4.15Å; W712-F723 AromaticContact CZ3-CZ 3.96Å; W712-F723 HydrophobicContact CZ3-CZ 3.96Å
724	V	61.8	Low	69.8	Low	136 Å²	136	88.5 Å²	88.5	82%	0.824	45%	0.453	S	S	*	.			trans	-86.3	0	-179.8	178.2	0	0	0	0	110.8	V711 Q713 T722	V711-V724 PolarHBondContact O-N 3.39Å; Q713-V724 HydrophobicContact CB-CG2 4.14Å; Q713-V724 HydrophobicContact CG-CG2 3.59Å; T722-V724 PolarHBondContact O-N 3.48Å

Retrieved 724 of 724 residues in 1009.3 ms (Link to these results)

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