A0A077Z5J5_TRITR Loading...

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 A0A077Z5J5, Species TRITR (Trichuris trichiura, Whipworm), Gene MCM7, Length 729 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	47.8	Very low	248 Å²	248	135.7 Å²	135.7	100%	1.222	70%	0.702	S	S	*	*				0	90.7	0	-77.1	-179.8	174.3	0	0	108.6
2	V	36.6	Very low	49.8	Very low	122 Å²	122	138.2 Å²	138.2	74%	0.739	70%	0.696	S	S	*	*			trans	-124	93.6	168.4	179.7	0	0	0	0	104.9	F4	V2-F4 HydrophobicContact CG1-CE2 4.49Å; V2-F4 PolarHBondContact O-N 3.08Å; V2-F4 VanDerWaalsContact O-N 3.17Å
3	K	38.7	Very low	51.7	Low	209 Å²	209	134.8 Å²	134.8	91%	0.909	67%	0.67	S	S	*	*			trans	-72	103.3	169	-81.8	-177.4	174.9	179.8	0	105.9	L5	K3-L5 PolarHBondContact O-N 3.28Å; K3-L5 VanDerWaalsContact O-N 3.09Å
4	F	43.1	Very low	53.5	Low	188 Å²	188	133 Å²	133	83%	0.825	66%	0.663	S	S	*	*			trans	-56.2	112.5	169	-81.5	-94.1	0	0	0	108.2	V2	V2-F4 HydrophobicContact CG1-CE2 4.49Å; V2-F4 PolarHBondContact O-N 3.08Å; V2-F4 VanDerWaalsContact O-N 3.17Å
5	L	39	Very low	55.3	Low	152 Å²	152	131.1 Å²	131.1	80%	0.796	66%	0.655	S	S	*	*			trans	-54.8	134.1	164.6	-78.2	152.7	0	0	0	107.9	K3 T7	K3-L5 PolarHBondContact O-N 3.28Å; K3-L5 VanDerWaalsContact O-N 3.09Å; L5-T7 PolarHBondContact O-N 3.44Å
6	P	42.4	Very low	56.9	Low	95 Å²	95	124.7 Å²	124.7	62%	0.617	63%	0.625	S	S	*	*			trans	-60.4	113.9	174.8	24.5	-29.8	0	0	0	107.8
7	T	45.2	Very low	58.4	Low	97 Å²	97	118.1 Å²	118.1	60%	0.595	59%	0.593	S	S	*	*			trans	-57	142.6	-179.4	46.6	0	0	0	0	110.1	L5 H9 S10	L5-T7 PolarHBondContact O-N 3.44Å; T7-H9 PolarHBondContact O-N 3.22Å; T7-S10 PolarHBondContact O-N 3.44Å; T7-S10 PolarHBondContact O-OG 3.28Å
8	D	53.4	Low	59.8	Low	116 Å²	116	117.8 Å²	117.8	62%	0.62	59%	0.59	S	S	*	*	H	α-helix	trans	-44.4	-23.3	-179.4	-72	-30.3	0	0	0	114.7	S10 R12	D8-S10 VanDerWaalsContact C-N 3.32Å; D8-S10 PolarHBondContact O-N 3.2Å; D8-R12 WeakPolarHBondContact O-CG 3.35Å; D8-R12 PolarHBondContact O-N 3.33Å; D8-R12 VanDerWaalsContact O-N 3.11Å
9	H	59.2	Low	61.1	Low	118 Å²	118	116.2 Å²	116.2	55%	0.546	58%	0.579	S	S	.	*	H	α-helix	trans	-62.7	-30.2	174.9	-73.1	-57	0	0	0	115.1	T7 R13 R79	T7-H9 PolarHBondContact O-N 3.22Å; H9-R13 WeakPolarHBondContact O-CB 3.3Å; H9-R13 PolarHBondContact O-N 3Å; H9-R13 VanDerWaalsContact O-N 3.17Å; H9-R79 PolarHBondContact O-NH2 3.48Å
10	S	63.3	Low	62.2	Low	47 Å²	47	110.4 Å²	110.4	33%	0.329	55%	0.55	S	S	.	.	H	α-helix	trans	-75.5	-46.3	179.5	58.6	0	0	0	0	111.7	T7 D8 R12 R13 L14	T7-S10 PolarHBondContact O-N 3.44Å; T7-S10 PolarHBondContact O-OG 3.28Å; D8-S10 VanDerWaalsContact C-N 3.32Å; D8-S10 PolarHBondContact O-N 3.2Å; S10-R12 PolarHBondContact O-N 3.45Å; S10-R13 WeakPolarHBondContact O-CB 3.4Å; S10-R13 PolarHBondContact O-N 2.98Å; S10-R13 VanDerWaalsContact O-N 3.12Å; S10-L14 PolarHBondContact O-N 3.2Å; S10-L14 VanDerWaalsContact O-N 3.09Å
11	L	65.3	Low	63.3	Low	101 Å²	101	107 Å²	107	53%	0.529	53%	0.532	S	S	.	.	H	α-helix	trans	-60.3	-45.1	173.8	-72.1	168.8	0	0	0	111.5	R13 L14 L15	L11-R13 VanDerWaalsContact C-N 3.26Å; L11-R13 PolarHBondContact O-N 3.18Å; L11-L14 PolarHBondContact O-N 3.37Å; L11-L15 WeakPolarHBondContact O-CG 3.33Å; L11-L15 PolarHBondContact O-N 3.24Å
12	R	72.2	Confident	65.5	Low	165 Å²	165	99.9 Å²	99.9	62%	0.623	50%	0.495	S	S	*	.	H	α-helix	trans	-60.4	-35.9	174.6	-73.3	-177.5	-175.3	-173.8	3.5	112.6	D8 S10 V16	D8-R12 WeakPolarHBondContact O-CG 3.35Å; D8-R12 PolarHBondContact O-N 3.33Å; D8-R12 VanDerWaalsContact O-N 3.11Å; S10-R12 PolarHBondContact O-N 3.45Å; R12-V16 WeakPolarHBondContact O-CB 3.23Å; R12-V16 WeakPolarHBondContact O-CG2 3.36Å; R12-V16 PolarHBondContact O-N 2.91Å
13	R	74.6	Confident	67.8	Low	95 Å²	95	94.1 Å²	94.1	36%	0.358	46%	0.46	S	S	.	.	H	α-helix	trans	-65.9	-40.9	177	-174.1	-178.8	177	169.7	-0.1	111.5	H9 S10 L11 S17 I83 E86	H9-R13 WeakPolarHBondContact O-CB 3.3Å; H9-R13 PolarHBondContact O-N 3Å; H9-R13 VanDerWaalsContact O-N 3.17Å; S10-R13 WeakPolarHBondContact O-CB 3.4Å; S10-R13 PolarHBondContact O-N 2.98Å; S10-R13 VanDerWaalsContact O-N 3.12Å; L11-R13 VanDerWaalsContact C-N 3.26Å; L11-R13 PolarHBondContact O-N 3.18Å; R13-S17 WeakPolarHBondContact O-CB 3.39Å; R13-S17 PolarHBondContact O-N 2.79Å; R13-I83 HydrophobicContact CG-CD1 4.27Å; R13-I83 HydrophobicContact CG-CG1 4.32Å; R13-E86 IonicContact CZ-OE1 2.78Å; R13-E86 IonicContact CZ-OE2 2.6Å; R13-E86 IonicContact NE-OE2 3.97Å; R13-E86 IonicContact NH2-OE1 2.7Å; R13-E86 PolarHBondContact NH2-OE1 2.89Å; R13-E86 IonicContact NH2-OE2 3.73Å; R13-E86 PolarHBondContact NH2-OE2 3.47Å
14	L	76.6	Confident	70	Confident	109 Å²	109	84.2 Å²	84.2	57%	0.571	42%	0.417	S	S	*	.	H	α-helix	trans	-65.3	-47.9	177.9	-70.2	169.4	0	0	0	111.2	S10 L11 V16 S17 E18	S10-L14 PolarHBondContact O-N 3.2Å; S10-L14 VanDerWaalsContact O-N 3.09Å; L11-L14 PolarHBondContact O-N 3.37Å; L14-V16 VanDerWaalsContact C-N 3.31Å; L14-V16 PolarHBondContact O-N 3.11Å; L14-S17 WeakPolarHBondContact O-CA 3.46Å; L14-S17 WeakPolarHBondContact O-CB 3.29Å; L14-S17 PolarHBondContact O-N 3.24Å; L14-E18 PolarHBondContact O-N 2.88Å
15	L	80	Confident	71.9	Confident	105 Å²	105	77.5 Å²	77.5	55%	0.55	39%	0.392	S	S	.	.	H	α-helix	trans	-57.7	-42.7	176.6	-71.6	167.3	0	0	0	112.3	L11 S17 E18 K19	L11-L15 WeakPolarHBondContact O-CG 3.33Å; L11-L15 PolarHBondContact O-N 3.24Å; L15-S17 VanDerWaalsContact C-N 3.35Å; L15-E18 PolarHBondContact O-N 2.93Å; L15-K19 WeakPolarHBondContact O-CG 3.45Å; L15-K19 PolarHBondContact O-N 3.48Å
16	V	81.3	Confident	74.1	Confident	28 Å²	28	74.6 Å²	74.6	17%	0.17	38%	0.377	C	S	.	.	H	α-helix	trans	-67	-37.1	176.3	172.4	0	0	0	0	111.5	R12 L14 K19 A20 L69 Y80 I83	R12-V16 WeakPolarHBondContact O-CB 3.23Å; R12-V16 WeakPolarHBondContact O-CG2 3.36Å; R12-V16 PolarHBondContact O-N 2.91Å; L14-V16 VanDerWaalsContact C-N 3.31Å; L14-V16 PolarHBondContact O-N 3.11Å; V16-K19 PolarHBondContact O-N 2.73Å; V16-A20 WeakPolarHBondContact O-CB 3.47Å; V16-A20 PolarHBondContact O-N 2.77Å; V16-L69 HydrophobicContact CG1-CD1 4.46Å; V16-Y80 HydrophobicContact CG1-CD1 4.07Å; V16-Y80 HydrophobicContact CG1-CE1 3.49Å; V16-Y80 VanDerWaalsContact CG1-CE1 3.49Å; V16-I83 HydrophobicContact CG1-CD1 4.09Å; V16-I83 HydrophobicContact CG1-CG2 4.17Å
17	S	82	Confident	76	Confident	13 Å²	13	70.9 Å²	70.9	9%	0.091	35%	0.351	C	S	.	.	H	α-helix	trans	-65.7	-38.4	175.4	-172	0	0	0	0	112	R13 L14 L15 A20 K21	R13-S17 WeakPolarHBondContact O-CB 3.39Å; R13-S17 PolarHBondContact O-N 2.79Å; L14-S17 WeakPolarHBondContact O-CA 3.46Å; L14-S17 WeakPolarHBondContact O-CB 3.29Å; L14-S17 PolarHBondContact O-N 3.24Å; L15-S17 VanDerWaalsContact C-N 3.35Å; S17-A20 PolarHBondContact O-N 2.92Å; S17-K21 WeakPolarHBondContact O-CG 3.44Å; S17-K21 PolarHBondContact O-N 3.32Å
18	E	84.6	Confident	77.8	Confident	112 Å²	112	70.8 Å²	70.8	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-66.2	-47.3	175.6	-73.1	175.8	169.3	0	0	110.8	L14 L15 A20 K21 E22	L14-E18 PolarHBondContact O-N 2.88Å; L15-E18 PolarHBondContact O-N 2.93Å; E18-A20 VanDerWaalsContact C-N 3.28Å; E18-A20 PolarHBondContact O-N 3.37Å; E18-K21 WeakPolarHBondContact O-CB 3.39Å; E18-K21 PolarHBondContact O-N 3.15Å; E18-E22 WeakPolarHBondContact O-CG 3.2Å; E18-E22 PolarHBondContact O-N 2.98Å
19	K	84.6	Confident	79	Confident	88 Å²	88	67.9 Å²	67.9	38%	0.383	33%	0.327	S	S	.	.	H	α-helix	trans	-55.1	-42.1	172.1	-77	-172.7	164.1	-152.4	0	112.8	L15 V16 K21 E22 F23 D66	L15-K19 WeakPolarHBondContact O-CG 3.45Å; L15-K19 PolarHBondContact O-N 3.48Å; V16-K19 PolarHBondContact O-N 2.73Å; K19-K21 VanDerWaalsContact C-N 3.34Å; K19-E22 PolarHBondContact O-N 2.94Å; K19-F23 WeakPolarHBondContact O-CB 3.46Å; K19-F23 PolarHBondContact O-N 3.15Å; K19-D66 IonicContact NZ-OD2 2.79Å; K19-D66 PolarHBondContact NZ-OD2 3.14Å
20	A	82.5	Confident	79.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-38.6	177.2	0	0	0	0	0	111.9	V16 S17 E18 I24 F84 A87	V16-A20 WeakPolarHBondContact O-CB 3.47Å; V16-A20 PolarHBondContact O-N 2.77Å; S17-A20 PolarHBondContact O-N 2.92Å; E18-A20 VanDerWaalsContact C-N 3.28Å; E18-A20 PolarHBondContact O-N 3.37Å; A20-I24 WeakPolarHBondContact O-CD1 3.44Å; A20-I24 VanDerWaalsContact O-CG1 3.23Å; A20-I24 WeakPolarHBondContact O-CG1 3.48Å; A20-I24 PolarHBondContact O-N 3.27Å; A20-I24 VanDerWaalsContact O-N 3.08Å; A20-F84 HydrophobicContact CB-CD1 4.07Å; A20-F84 HydrophobicContact CB-CE1 3.83Å; A20-F84 HydrophobicContact CB-CE2 4.42Å; A20-F84 HydrophobicContact CB-CG 4.49Å; A20-F84 HydrophobicContact CB-CZ 4.02Å; A20-A87 HydrophobicContact CB-CB 4.19Å
21	K	85.2	Confident	79.9	Confident	40 Å²	40	69.3 Å²	69.3	17%	0.174	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-45.2	173.6	-75.6	-173.5	171.9	-165.6	0	112.2	S17 E18 K19 F23 I24 T25 A87 L91 E94	S17-K21 WeakPolarHBondContact O-CG 3.44Å; S17-K21 PolarHBondContact O-N 3.32Å; E18-K21 WeakPolarHBondContact O-CB 3.39Å; E18-K21 PolarHBondContact O-N 3.15Å; K19-K21 VanDerWaalsContact C-N 3.34Å; K21-F23 VanDerWaalsContact C-N 3.29Å; K21-F23 PolarHBondContact O-N 3.3Å; K21-I24 PolarHBondContact O-N 3.42Å; K21-T25 WeakPolarHBondContact O-CB 3.49Å; K21-T25 WeakPolarHBondContact O-CG2 3.38Å; K21-T25 PolarHBondContact O-N 2.88Å; K21-T25 PolarHBondContact O-OG1 2.87Å; K21-A87 HydrophobicContact CG-CB 3.98Å; K21-L91 HydrophobicContact CG-CG 4.38Å; K21-E94 IonicContact NZ-OE1 3.99Å; K21-E94 PolarHBondContact NZ-OE1 2.89Å
22	E	85.6	Confident	79.7	Confident	98 Å²	98	68.8 Å²	68.8	46%	0.458	35%	0.354	S	S	.	.	H	α-helix	trans	-58.8	-42.9	176.5	-72.7	178.8	174.7	0	0	111	E18 K19 T25 N26 F65	E18-E22 WeakPolarHBondContact O-CG 3.2Å; E18-E22 PolarHBondContact O-N 2.98Å; K19-E22 PolarHBondContact O-N 2.94Å; E22-T25 WeakPolarHBondContact CA-OG1 3.5Å; E22-T25 PolarHBondContact O-N 2.92Å; E22-T25 PolarHBondContact O-OG1 3.38Å; E22-N26 WeakPolarHBondContact O-CB 3.37Å; E22-N26 PolarHBondContact O-N 3.26Å; E22-N26 PolarHBondContact O-ND2 3.29Å; E22-F65 HydrophobicContact CB-CZ 4.31Å
23	F	86.1	Confident	79.2	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-59.2	-50.6	174.6	174.2	-104.9	0	0	0	112.1	K19 K21 T25 F27 Y40 I57 D61 V62 F65 F84	K19-F23 WeakPolarHBondContact O-CB 3.46Å; K19-F23 PolarHBondContact O-N 3.15Å; K21-F23 VanDerWaalsContact C-N 3.29Å; K21-F23 PolarHBondContact O-N 3.3Å; F23-T25 VanDerWaalsContact C-N 3.27Å; F23-T25 PolarHBondContact O-N 3.43Å; F23-F27 HydrophobicContact CD2-CB 4.4Å; F23-F27 HydrophobicContact CD2-CD2 4.49Å; F23-F27 HydrophobicContact CE2-CB 4.16Å; F23-F27 AromaticContact CE2-CD2 3.77Å; F23-F27 HydrophobicContact CE2-CD2 3.77Å; F23-F27 HydrophobicContact CE2-CE2 4.44Å; F23-F27 HydrophobicContact CE2-CG 4.04Å; F23-F27 HydrophobicContact CZ-CD2 4.44Å; F23-F27 HydrophobicContact CZ-CG 4.4Å; F23-F27 WeakPolarHBondContact O-CB 3.45Å; F23-F27 PolarHBondContact O-N 2.97Å; F23-F27 VanDerWaalsContact O-N 3.15Å; F23-Y40 HydrophobicContact CE1-CD2 4.15Å; F23-Y40 AromaticContact CE1-CE2 3.84Å; F23-Y40 HydrophobicContact CE1-CE2 3.84Å; F23-Y40 HydrophobicContact CZ-CD2 4.2Å; F23-Y40 AromaticContact CZ-CE2 3.6Å; F23-Y40 HydrophobicContact CZ-CE2 3.6Å; F23-I57 HydrophobicContact CE1-CG2 4.18Å; F23-D61 HydrophobicContact CE2-CB 4.36Å; F23-D61 WeakPolarHBondContact CE2-O 3.39Å; F23-D61 HydrophobicContact CZ-CB 3.91Å; F23-V62 HydrophobicContact CD1-CG2 4.41Å; F23-V62 HydrophobicContact CE1-CG2 3.68Å; F23-V62 HydrophobicContact CE2-CB 4.44Å; F23-V62 HydrophobicContact CE2-CG2 4.16Å; F23-V62 HydrophobicContact CZ-CB 4.26Å; F23-V62 HydrophobicContact CZ-CG2 3.53Å; F23-F65 HydrophobicContact CB-CD1 4.11Å; F23-F65 HydrophobicContact CB-CE1 4.17Å; F23-F65 HydrophobicContact CD2-CB 3.57Å; F23-F65 AromaticContact CD2-CD1 3.9Å; F23-F65 HydrophobicContact CD2-CD1 3.9Å; F23-F65 HydrophobicContact CD2-CD2 4.31Å; F23-F65 AromaticContact CD2-CG 3.68Å; F23-F65 HydrophobicContact CD2-CG 3.68Å; F23-F65 HydrophobicContact CE2-CB 3.88Å; F23-F65 HydrophobicContact CE2-CG 4.45Å; F23-F65 HydrophobicContact CG-CD1 4.47Å; F23-F84 HydrophobicContact CD1-CE1 4.31Å
24	I	83.8	Confident	78.5	Confident	2 Å²	2	75.5 Å²	75.5	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-63.7	-34.4	-177.6	-66.7	163	0	0	0	111.8	A20 K21 V44 F84 A87 V88 L91	A20-I24 WeakPolarHBondContact O-CD1 3.44Å; A20-I24 VanDerWaalsContact O-CG1 3.23Å; A20-I24 WeakPolarHBondContact O-CG1 3.48Å; A20-I24 PolarHBondContact O-N 3.27Å; A20-I24 VanDerWaalsContact O-N 3.08Å; K21-I24 PolarHBondContact O-N 3.42Å; I24-V44 HydrophobicContact CG2-CG2 3.87Å; I24-F84 HydrophobicContact CD1-CD1 4.28Å; I24-A87 HydrophobicContact CD1-CB 4.4Å; I24-V88 HydrophobicContact CD1-CG2 3.85Å; I24-L91 HydrophobicContact CB-CD1 3.7Å; I24-L91 HydrophobicContact CD1-CD1 3.91Å; I24-L91 HydrophobicContact CG1-CD1 4.43Å; I24-L91 HydrophobicContact CG2-CD1 3.36Å
25	T	83.1	Confident	78.4	Confident	47 Å²	47	73 Å²	73	29%	0.288	39%	0.388	S	S	.	.	H	α-helix	trans	-84.5	-39.5	-176.5	49.4	0	0	0	0	113.1	K21 E22 F23 L91	K21-T25 WeakPolarHBondContact O-CB 3.49Å; K21-T25 WeakPolarHBondContact O-CG2 3.38Å; K21-T25 PolarHBondContact O-N 2.88Å; K21-T25 PolarHBondContact O-OG1 2.87Å; E22-T25 WeakPolarHBondContact CA-OG1 3.5Å; E22-T25 PolarHBondContact O-N 2.92Å; E22-T25 PolarHBondContact O-OG1 3.38Å; F23-T25 VanDerWaalsContact C-N 3.27Å; F23-T25 PolarHBondContact O-N 3.43Å; T25-L91 HydrophobicContact CG2-CD1 4.4Å; T25-L91 HydrophobicContact CG2-CD2 3.69Å
26	N	84.4	Confident	78.4	Confident	91 Å²	91	73.5 Å²	73.5	49%	0.487	39%	0.385	S	S	.	.	H	α-helix	trans	-92.6	-19.4	-171.4	-64.6	-33.6	0	0	0	113.9	E22 Y28	E22-N26 WeakPolarHBondContact O-CB 3.37Å; E22-N26 PolarHBondContact O-N 3.26Å; E22-N26 PolarHBondContact O-ND2 3.29Å; N26-Y28 WeakPolarHBondContact O-CD1 3.38Å; N26-Y28 PolarHBondContact O-N 3.04Å
27	F	83.3	Confident	78.3	Confident	16 Å²	16	76.3 Å²	76.3	7%	0.07	40%	0.395	C	S	.	.			trans	-70.6	122	-175.1	-171.3	-93.3	0	0	0	112.1	F23 V29 Y40 D61 E64	F23-F27 HydrophobicContact CD2-CB 4.4Å; F23-F27 HydrophobicContact CD2-CD2 4.49Å; F23-F27 HydrophobicContact CE2-CB 4.16Å; F23-F27 AromaticContact CE2-CD2 3.77Å; F23-F27 HydrophobicContact CE2-CD2 3.77Å; F23-F27 HydrophobicContact CE2-CE2 4.44Å; F23-F27 HydrophobicContact CE2-CG 4.04Å; F23-F27 HydrophobicContact CZ-CD2 4.44Å; F23-F27 HydrophobicContact CZ-CG 4.4Å; F23-F27 WeakPolarHBondContact O-CB 3.45Å; F23-F27 PolarHBondContact O-N 2.97Å; F23-F27 VanDerWaalsContact O-N 3.15Å; F27-V29 HydrophobicContact CE1-CG2 3.7Å; F27-V29 HydrophobicContact CZ-CG2 4.31Å; F27-Y40 HydrophobicContact CB-CD2 3.99Å; F27-Y40 HydrophobicContact CB-CE2 4.38Å; F27-Y40 AromaticContact CD1-CD2 3.6Å; F27-Y40 HydrophobicContact CD1-CD2 3.6Å; F27-Y40 AromaticContact CD1-CE2 3.41Å; F27-Y40 HydrophobicContact CD1-CE2 3.41Å; F27-Y40 VanDerWaalsContact CD1-CE2 3.41Å; F27-Y40 HydrophobicContact CE1-CD2 4.46Å; F27-Y40 AromaticContact CE1-CE2 3.88Å; F27-Y40 HydrophobicContact CE1-CE2 3.88Å; F27-Y40 HydrophobicContact CG-CD2 4.07Å; F27-Y40 AromaticContact CG-CE2 4Å; F27-Y40 HydrophobicContact CG-CE2 4Å; F27-D61 HydrophobicContact CD1-CB 4.31Å; F27-D61 HydrophobicContact CD2-CB 4.36Å; F27-D61 HydrophobicContact CE1-CB 3.63Å; F27-D61 VanDerWaalsContact CE1-CG 3.47Å; F27-D61 WeakPolarHBondContact CE1-OD2 3.34Å; F27-D61 HydrophobicContact CE2-CB 3.71Å; F27-D61 HydrophobicContact CZ-CB 3.3Å; F27-E64 HydrophobicContact CE2-CB 4.46Å
28	Y	82.3	Confident	78.3	Confident	95 Å²	95	79.8 Å²	79.8	37%	0.373	41%	0.409	S	S	.	.			trans	-126.8	146	177.5	64.5	-93.4	0	0	0	110.8	N26 E30 K36 K37 F38	N26-Y28 WeakPolarHBondContact O-CD1 3.38Å; N26-Y28 PolarHBondContact O-N 3.04Å; Y28-E30 HydrophobicContact CD2-CG 3.99Å; Y28-E30 HydrophobicContact CE2-CG 3.8Å; Y28-K36 HydrophobicContact CD1-CD 4.31Å; Y28-K36 HydrophobicContact CD2-CB 3.99Å; Y28-K36 HydrophobicContact CD2-CD 3.74Å; Y28-K36 HydrophobicContact CD2-CG 3.76Å; Y28-K36 HydrophobicContact CE1-CD 4.28Å; Y28-K36 HydrophobicContact CE2-CD 3.71Å; Y28-K36 HydrophobicContact CE2-CG 4.04Å; Y28-K36 HydrophobicContact CG-CB 4.15Å; Y28-K36 HydrophobicContact CG-CD 4.06Å; Y28-K36 HydrophobicContact CG-CG 4.29Å; Y28-K36 PolarHBondContact OH-NZ 3.04Å; Y28-K37 WeakPolarHBondContact CA-O 3.38Å; Y28-F38 HydrophobicContact CD1-CE1 4.44Å
29	V	78.9	Confident	78.3	Confident	56 Å²	56	77.2 Å²	77.2	34%	0.339	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.9	169.6	179.2	0	0	0	0	108.3	F27 S31 K37 V39	F27-V29 HydrophobicContact CE1-CG2 3.7Å; F27-V29 HydrophobicContact CZ-CG2 4.31Å; V29-S31 PolarHBondContact O-N 3.5Å; V29-K37 PolarHBondContact N-O 3.18Å; V29-K37 PolarHBondContact O-N 3.33Å; V29-V39 HydrophobicContact CB-CG2 4.03Å; V29-V39 HydrophobicContact CG2-CG2 3.61Å
30	E	75.8	Confident	78.3	Confident	134 Å²	134	73.4 Å²	73.4	63%	0.626	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	95.3	173	-66.5	-171.5	170.7	0	0	109.4	Y28 K36	Y28-E30 HydrophobicContact CD2-CG 3.99Å; Y28-E30 HydrophobicContact CE2-CG 3.8Å; E30-K36 HydrophobicContact CG-CG 4.48Å
31	S	65.6	Low	78.3	Confident	60 Å²	60	77.3 Å²	77.3	42%	0.42	40%	0.404	S	S	.	.			trans	-85.2	111.4	167.5	-77	0	0	0	0	108.4	V29 R33 Q34	V29-S31 PolarHBondContact O-N 3.5Å; S31-R33 PolarHBondContact O-N 3.38Å; S31-Q34 PolarHBondContact O-N 2.9Å
32	G	60.8	Low	78.3	Confident	90 Å²	90	78.4 Å²	78.4	93%	0.928	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	0.2	-166	0	0	0	0	0	119.1
33	R	62.1	Low	78.2	Confident	247 Å²	247	74.7 Å²	74.7	93%	0.932	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-12.2	172	-74.5	-174.7	175.7	172.2	-0.5	115.3	S31	S31-R33 PolarHBondContact O-N 3.38Å
34	Q	60.3	Low	78.1	Confident	154 Å²	154	75 Å²	75	72%	0.72	40%	0.398	S	S	*	.	S	Bend	trans	-136.6	61	-172.7	-69.5	-171.5	-12	0	0	111.5	S31	S31-Q34 PolarHBondContact O-N 2.9Å
35	G	73.5	Confident	78.1	Confident	58 Å²	58	78.4 Å²	78.4	60%	0.598	42%	0.419	S	S	*	.			trans	52.1	-166.6	169	0	0	0	0	0	116.1	K37	G35-K37 PolarHBondContact O-N 3.03Å
36	K	80.5	Confident	78.1	Confident	115 Å²	115	79 Å²	79	50%	0.5	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	117.7	171.6	-65.6	-173.2	176.7	-166	0	108.5	Y28 E30	Y28-K36 HydrophobicContact CD1-CD 4.31Å; Y28-K36 HydrophobicContact CD2-CB 3.99Å; Y28-K36 HydrophobicContact CD2-CD 3.74Å; Y28-K36 HydrophobicContact CD2-CG 3.76Å; Y28-K36 HydrophobicContact CE1-CD 4.28Å; Y28-K36 HydrophobicContact CE2-CD 3.71Å; Y28-K36 HydrophobicContact CE2-CG 4.04Å; Y28-K36 HydrophobicContact CG-CB 4.15Å; Y28-K36 HydrophobicContact CG-CD 4.06Å; Y28-K36 HydrophobicContact CG-CG 4.29Å; Y28-K36 PolarHBondContact OH-NZ 3.04Å; E30-K36 HydrophobicContact CG-CG 4.48Å
37	K	78.4	Confident	78	Confident	86 Å²	86	75.3 Å²	75.3	37%	0.374	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	116.1	179.9	-161.6	177.9	-175.6	-157.4	0	110.1	Y28 V29 G35 V39 E42	Y28-K37 WeakPolarHBondContact CA-O 3.38Å; V29-K37 PolarHBondContact N-O 3.18Å; V29-K37 PolarHBondContact O-N 3.33Å; G35-K37 PolarHBondContact O-N 3.03Å; K37-V39 PolarHBondContact O-N 3.09Å; K37-V39 VanDerWaalsContact O-N 3.15Å; K37-E42 WeakPolarHBondContact CE-OE2 3.3Å; K37-E42 IonicContact NZ-OE1 2.71Å; K37-E42 IonicContact NZ-OE2 3.88Å; K37-E42 PolarHBondContact NZ-OE2 3.12Å
38	F	83.4	Confident	77.8	Confident	87 Å²	87	75.8 Å²	75.8	38%	0.382	41%	0.405	S	S	.	.			trans	-79.3	93.4	176.8	-61.4	-83.2	0	0	0	110.2	Y28 L41 E42	Y28-F38 HydrophobicContact CD1-CE1 4.44Å; F38-L41 HydrophobicContact CB-CB 3.9Å; F38-E42 PolarHBondContact O-N 3.49Å; F38-E42 VanDerWaalsContact O-N 3.1Å
39	V	84	Confident	77.6	Confident	58 Å²	58	73.2 Å²	73.2	35%	0.352	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-46.9	-172.6	179.8	0	0	0	0	111.5	V29 K37 E42 A43	V29-V39 HydrophobicContact CB-CG2 4.03Å; V29-V39 HydrophobicContact CG2-CG2 3.61Å; K37-V39 PolarHBondContact O-N 3.09Å; K37-V39 VanDerWaalsContact O-N 3.15Å; V39-E42 PolarHBondContact O-N 3.42Å; V39-A43 PolarHBondContact O-N 2.86Å
40	Y	84.7	Confident	77.4	Confident	8 Å²	8	73.3 Å²	73.3	3%	0.031	40%	0.395	C	S	.	.	H	α-helix	trans	-73.6	-35.2	-176.2	-66.4	-68.6	0	0	0	112.9	F23 F27 A43 V44 F55 I57 D58 D61	F23-Y40 HydrophobicContact CE1-CD2 4.15Å; F23-Y40 AromaticContact CE1-CE2 3.84Å; F23-Y40 HydrophobicContact CE1-CE2 3.84Å; F23-Y40 HydrophobicContact CZ-CD2 4.2Å; F23-Y40 AromaticContact CZ-CE2 3.6Å; F23-Y40 HydrophobicContact CZ-CE2 3.6Å; F27-Y40 HydrophobicContact CB-CD2 3.99Å; F27-Y40 HydrophobicContact CB-CE2 4.38Å; F27-Y40 AromaticContact CD1-CD2 3.6Å; F27-Y40 HydrophobicContact CD1-CD2 3.6Å; F27-Y40 AromaticContact CD1-CE2 3.41Å; F27-Y40 HydrophobicContact CD1-CE2 3.41Å; F27-Y40 VanDerWaalsContact CD1-CE2 3.41Å; F27-Y40 HydrophobicContact CE1-CD2 4.46Å; F27-Y40 AromaticContact CE1-CE2 3.88Å; F27-Y40 HydrophobicContact CE1-CE2 3.88Å; F27-Y40 HydrophobicContact CG-CD2 4.07Å; F27-Y40 AromaticContact CG-CE2 4Å; F27-Y40 HydrophobicContact CG-CE2 4Å; Y40-A43 CarbonylContact O-C 3.56Å; Y40-A43 WeakPolarHBondContact O-CB 3.49Å; Y40-A43 PolarHBondContact O-N 2.88Å; Y40-V44 WeakPolarHBondContact O-CG2 3.41Å; Y40-V44 PolarHBondContact O-N 2.78Å; Y40-F55 HydrophobicContact CD1-CE1 4.49Å; Y40-F55 HydrophobicContact CD1-CE2 4.41Å; Y40-F55 AromaticContact CD1-CZ 3.84Å; Y40-F55 HydrophobicContact CD1-CZ 3.84Å; Y40-I57 HydrophobicContact CE1-CG2 4.41Å; Y40-D58 PolarHBondContact OH-N 3.11Å; Y40-D58 VanDerWaalsContact OH-N 3.17Å; Y40-D61 HydrophobicContact CE2-CB 3.96Å; Y40-D61 WeakPolarHBondContact CE2-OD2 3.12Å; Y40-D61 WeakPolarHBondContact OH-CB 3.44Å; Y40-D61 PolarHBondContact OH-OD2 3.06Å
41	L	83.5	Confident	77.6	Confident	82 Å²	82	76.5 Å²	76.5	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-67.2	-38	174.7	-167.2	144.3	0	0	0	111.6	F38 A43 V44 T45	F38-L41 HydrophobicContact CB-CB 3.9Å; L41-A43 VanDerWaalsContact C-N 3.34Å; L41-V44 PolarHBondContact O-N 3.32Å; L41-T45 WeakPolarHBondContact O-CB 3.47Å; L41-T45 PolarHBondContact O-N 2.82Å; L41-T45 PolarHBondContact O-OG1 3.17Å
42	E	84	Confident	78.3	Confident	62 Å²	62	77.8 Å²	77.8	29%	0.29	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-42.4	170.8	-165.5	-167.6	149.5	0	0	110.9	K37 F38 V39 T45 K46	K37-E42 WeakPolarHBondContact CE-OE2 3.3Å; K37-E42 IonicContact NZ-OE1 2.71Å; K37-E42 IonicContact NZ-OE2 3.88Å; K37-E42 PolarHBondContact NZ-OE2 3.12Å; F38-E42 PolarHBondContact O-N 3.49Å; F38-E42 VanDerWaalsContact O-N 3.1Å; V39-E42 PolarHBondContact O-N 3.42Å; E42-T45 WeakPolarHBondContact O-CB 3.4Å; E42-T45 PolarHBondContact O-N 3Å; E42-K46 WeakPolarHBondContact O-CG 3.49Å; E42-K46 PolarHBondContact O-N 3.16Å; E42-K46 WeakPolarHBondContact OE1-CE 3.33Å; E42-K46 IonicContact OE1-NZ 2.86Å; E42-K46 PolarHBondContact OE1-NZ 3.33Å
43	A	84.4	Confident	79.2	Confident	20 Å²	20	77.9 Å²	77.9	17%	0.165	38%	0.377	C	S	.	.	H	α-helix	trans	-63.5	-43.3	176.3	0	0	0	0	0	112.1	V39 Y40 L41 T45 K46 V47 F55	V39-A43 PolarHBondContact O-N 2.86Å; Y40-A43 CarbonylContact O-C 3.56Å; Y40-A43 WeakPolarHBondContact O-CB 3.49Å; Y40-A43 PolarHBondContact O-N 2.88Å; L41-A43 VanDerWaalsContact C-N 3.34Å; A43-T45 VanDerWaalsContact C-N 3.27Å; A43-T45 PolarHBondContact O-N 3.09Å; A43-K46 WeakPolarHBondContact O-CB 3.49Å; A43-K46 PolarHBondContact O-N 3.34Å; A43-K46 VanDerWaalsContact O-N 3.13Å; A43-V47 WeakPolarHBondContact O-CG2 3.41Å; A43-V47 PolarHBondContact O-N 3.39Å; A43-F55 HydrophobicContact CB-CD2 4.09Å; A43-F55 HydrophobicContact CB-CE2 3.74Å
44	V	84.2	Confident	80.3	Confident	7 Å²	7	67.4 Å²	67.4	4%	0.042	34%	0.341	C	S	.	.	H	α-helix	trans	-59.6	-40.7	172.7	172.1	0	0	0	0	110.5	I24 Y40 L41 K46 V47 A48 F55 V88 L91 I92	I24-V44 HydrophobicContact CG2-CG2 3.87Å; Y40-V44 WeakPolarHBondContact O-CG2 3.41Å; Y40-V44 PolarHBondContact O-N 2.78Å; L41-V44 PolarHBondContact O-N 3.32Å; V44-K46 PolarHBondContact O-N 2.96Å; V44-V47 PolarHBondContact O-N 3.21Å; V44-A48 VanDerWaalsContact O-CB 3.29Å; V44-A48 WeakPolarHBondContact O-CB 3.41Å; V44-A48 PolarHBondContact O-N 3.4Å; V44-F55 HydrophobicContact CG2-CE2 3.87Å; V44-F55 HydrophobicContact CG2-CZ 4.24Å; V44-V88 HydrophobicContact CG2-CG1 4.46Å; V44-L91 HydrophobicContact CG1-CB 4.4Å; V44-I92 HydrophobicContact CG1-CG1 3.89Å
45	T	82.9	Confident	81.5	Confident	73 Å²	73	60.2 Å²	60.2	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-37.8	176	-53.4	0	0	0	0	111.9	L41 E42 A43 A48 S49	L41-T45 WeakPolarHBondContact O-CB 3.47Å; L41-T45 PolarHBondContact O-N 2.82Å; L41-T45 PolarHBondContact O-OG1 3.17Å; E42-T45 WeakPolarHBondContact O-CB 3.4Å; E42-T45 PolarHBondContact O-N 3Å; A43-T45 VanDerWaalsContact C-N 3.27Å; A43-T45 PolarHBondContact O-N 3.09Å; T45-A48 PolarHBondContact O-N 3.46Å; T45-S49 WeakPolarHBondContact O-CB 3.38Å; T45-S49 PolarHBondContact O-N 3.03Å; T45-S49 PolarHBondContact O-OG 2.97Å
46	K	83.2	Confident	82.2	Confident	61 Å²	61	60.6 Å²	60.6	27%	0.265	30%	0.298	S	S	.	.	H	α-helix	trans	-66.5	-39.6	173.7	-73.6	174.8	-174	166.3	0	112.2	E42 A43 V44 S49 R50 R51 E52	E42-K46 WeakPolarHBondContact O-CG 3.49Å; E42-K46 PolarHBondContact O-N 3.16Å; E42-K46 WeakPolarHBondContact OE1-CE 3.33Å; E42-K46 IonicContact OE1-NZ 2.86Å; E42-K46 PolarHBondContact OE1-NZ 3.33Å; A43-K46 WeakPolarHBondContact O-CB 3.49Å; A43-K46 PolarHBondContact O-N 3.34Å; A43-K46 VanDerWaalsContact O-N 3.13Å; V44-K46 PolarHBondContact O-N 2.96Å; K46-S49 WeakPolarHBondContact CA-OG 3.4Å; K46-S49 PolarHBondContact O-OG 2.7Å; K46-R50 PolarHBondContact O-N 2.92Å; K46-R51 PolarHBondContact O-N 2.97Å; K46-E52 HydrophobicContact CB-CB 4.45Å; K46-E52 HydrophobicContact CB-CG 4.39Å
47	V	82.6	Confident	82.5	Confident	12 Å²	12	55.1 Å²	55.1	7%	0.073	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-45.4	174.3	171.9	0	0	0	0	110.6	A43 V44 S49 R50 F55 I92 F144	A43-V47 WeakPolarHBondContact O-CG2 3.41Å; A43-V47 PolarHBondContact O-N 3.39Å; V44-V47 PolarHBondContact O-N 3.21Å; V47-S49 VanDerWaalsContact C-N 3.34Å; V47-S49 PolarHBondContact O-N 2.89Å; V47-R50 WeakPolarHBondContact O-CA 3.25Å; V47-R50 PolarHBondContact O-N 3.1Å; V47-F55 HydrophobicContact CG2-CD2 4.34Å; V47-I92 HydrophobicContact CG1-CD1 3.87Å; V47-F144 HydrophobicContact CG1-CB 3.58Å; V47-F144 HydrophobicContact CG1-CD1 3.69Å; V47-F144 HydrophobicContact CG1-CG 3.72Å
48	A	79.3	Confident	82.9	Confident	26 Å²	26	52 Å²	52	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-41.2	176.8	0	0	0	0	0	112	V44 T45 R50 I92	V44-A48 VanDerWaalsContact O-CB 3.29Å; V44-A48 WeakPolarHBondContact O-CB 3.41Å; V44-A48 PolarHBondContact O-N 3.4Å; T45-A48 PolarHBondContact O-N 3.46Å; A48-R50 PolarHBondContact O-N 3.45Å; A48-I92 HydrophobicContact CB-CG2 4.23Å
49	S	76.9	Confident	83	Confident	41 Å²	41	47.9 Å²	47.9	29%	0.287	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	3.1	174.1	66.8	0	0	0	0	114.3	T45 K46 V47 R51 K104	T45-S49 WeakPolarHBondContact O-CB 3.38Å; T45-S49 PolarHBondContact O-N 3.03Å; T45-S49 PolarHBondContact O-OG 2.97Å; K46-S49 WeakPolarHBondContact CA-OG 3.4Å; K46-S49 PolarHBondContact O-OG 2.7Å; V47-S49 VanDerWaalsContact C-N 3.34Å; V47-S49 PolarHBondContact O-N 2.89Å; S49-R51 VanDerWaalsContact C-N 3.28Å; S49-R51 PolarHBondContact O-N 2.78Å; S49-K104 PolarHBondContact O-NZ 3.02Å
50	R	74.6	Confident	83	Confident	58 Å²	58	48.7 Å²	48.7	22%	0.219	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	41.1	-179.5	-59.1	178.2	170.4	164.4	-10.2	112.6	K46 V47 A48 P101 P102 K104 D108	K46-R50 PolarHBondContact O-N 2.92Å; V47-R50 WeakPolarHBondContact O-CA 3.25Å; V47-R50 PolarHBondContact O-N 3.1Å; A48-R50 PolarHBondContact O-N 3.45Å; R50-P101 VanDerWaalsContact CZ-CB 3.41Å; R50-P101 PolarHBondContact NH1-O 3.17Å; R50-P102 PolarHBondContact NH1-O 3.46Å; R50-K104 HydrophobicContact CB-CD 4.27Å; R50-K104 PolarHBondContact O-NZ 2.82Å; R50-D108 IonicContact CZ-OD1 3.96Å; R50-D108 IonicContact CZ-OD2 2.82Å; R50-D108 IonicContact NE-OD1 2.89Å; R50-D108 IonicContact NE-OD2 3.24Å; R50-D108 PolarHBondContact NE-OD2 2.94Å; R50-D108 IonicContact NH1-OD1 3.94Å; R50-D108 PolarHBondContact NH1-OD1 3.42Å; R50-D108 IonicContact NH1-OD2 2.83Å; R50-D108 PolarHBondContact NH1-OD2 3.47Å; R50-D108 IonicContact NH2-OD1 2.94Å; R50-D108 PolarHBondContact NH2-OD1 3.17Å; R50-D108 IonicContact NH2-OD2 2.73Å
51	R	80.1	Confident	83.1	Confident	202 Å²	202	49.8 Å²	49.8	76%	0.762	25%	0.249	S	C	*	.	S	Bend	trans	-92.9	-36.5	172.8	-71.9	-176.7	179.4	-178.1	1.8	111.4	K46 S49	K46-R51 PolarHBondContact O-N 2.97Å; S49-R51 VanDerWaalsContact C-N 3.28Å; S49-R51 PolarHBondContact O-N 2.78Å
52	E	80.8	Confident	83.1	Confident	86 Å²	86	45.9 Å²	45.9	40%	0.402	23%	0.228	S	C	.	.			trans	-121.9	139.6	178.6	-69.1	175.2	177.3	0	0	109.4	K46	K46-E52 HydrophobicContact CB-CB 4.45Å; K46-E52 HydrophobicContact CB-CG 4.39Å
53	Q	81	Confident	83.1	Confident	93 Å²	93	48 Å²	48	44%	0.435	24%	0.238	S	C	.	.	S	Bend	trans	-103	-18.9	173.9	-53.8	-174.7	4.3	0	0	111.5	F144 E145 E270	Q53-F144 CarbonylContact O-C 3.59Å; Q53-F144 WeakPolarHBondContact O-CA 3.41Å; Q53-F144 WeakPolarHBondContact O-CB 3.42Å; Q53-E145 PolarHBondContact O-N 3.39Å; Q53-E270 HydrophobicContact CB-CG 4.19Å; Q53-E270 PolarHBondContact OE1-OE1 2.87Å
54	C	84.4	Confident	83.1	Confident	27 Å²	27	54.4 Å²	54.4	18%	0.182	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	125.1	176.4	-60	0	0	0	0	111.4	V56 Y147 E270	C54-V56 HydrophobicContact CB-CG2 4.4Å; C54-Y147 HydrophobicContact CB-CD2 4.22Å; C54-Y147 HydrophobicContact CB-CE2 4.24Å; C54-E270 WeakPolarHBondContact SG-CB 3.39Å; C54-E270 PolarHBondContact SG-OE2 3.44Å
55	F	86.1	Confident	83	Confident	3 Å²	3	57.9 Å²	57.9	1%	0.013	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	100	167.8	-169.4	-102.8	0	0	0	108.7	Y40 A43 V44 V47 I57 V88 F144 E145 V146 Y147	Y40-F55 HydrophobicContact CD1-CE1 4.49Å; Y40-F55 HydrophobicContact CD1-CE2 4.41Å; Y40-F55 AromaticContact CD1-CZ 3.84Å; Y40-F55 HydrophobicContact CD1-CZ 3.84Å; A43-F55 HydrophobicContact CB-CD2 4.09Å; A43-F55 HydrophobicContact CB-CE2 3.74Å; V44-F55 HydrophobicContact CG2-CE2 3.87Å; V44-F55 HydrophobicContact CG2-CZ 4.24Å; V47-F55 HydrophobicContact CG2-CD2 4.34Å; F55-I57 HydrophobicContact CD1-CD1 3.96Å; F55-I57 HydrophobicContact CD1-CG1 3.67Å; F55-I57 HydrophobicContact CE1-CD1 3.69Å; F55-I57 HydrophobicContact CE1-CG1 3.43Å; F55-I57 VanDerWaalsContact CE1-CG1 3.43Å; F55-I57 HydrophobicContact CZ-CG1 4.47Å; F55-V88 HydrophobicContact CD1-CG2 4.16Å; F55-V88 HydrophobicContact CE1-CG2 3.91Å; F55-V88 HydrophobicContact CZ-CG2 4.25Å; F55-F144 HydrophobicContact CB-CD2 4.41Å; F55-E145 PolarHBondContact N-O 3.27Å; F55-V146 HydrophobicContact CB-CG2 4.36Å; F55-V146 HydrophobicContact CD1-CG1 4.31Å; F55-V146 HydrophobicContact CD1-CG2 4.29Å; F55-V146 WeakPolarHBondContact O-CA 3.3Å; F55-Y147 PolarHBondContact O-N 3.25Å
56	V	86.7	Confident	83.1	Confident	66 Å²	66	55.6 Å²	55.6	40%	0.4	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.8	-179.3	-175.3	0	0	0	0	109.1	C54 Y147 K149	C54-V56 HydrophobicContact CB-CG2 4.4Å; V56-Y147 WeakPolarHBondContact CA-O 3.2Å; V56-K149 HydrophobicContact CG1-CB 3.99Å
57	I	87.7	Confident	83.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.4	176.4	-57.1	171.4	0	0	0	108.2	F23 Y40 F55 V62 F84 V146 Y147 F148 K149	F23-I57 HydrophobicContact CE1-CG2 4.18Å; Y40-I57 HydrophobicContact CE1-CG2 4.41Å; F55-I57 HydrophobicContact CD1-CD1 3.96Å; F55-I57 HydrophobicContact CD1-CG1 3.67Å; F55-I57 HydrophobicContact CE1-CD1 3.69Å; F55-I57 HydrophobicContact CE1-CG1 3.43Å; F55-I57 VanDerWaalsContact CE1-CG1 3.43Å; F55-I57 HydrophobicContact CZ-CG1 4.47Å; I57-V62 HydrophobicContact CG2-CG2 3.68Å; I57-F84 HydrophobicContact CD1-CB 4.19Å; I57-F84 HydrophobicContact CD1-CD1 3.44Å; I57-F84 VanDerWaalsContact CD1-CD1 3.44Å; I57-F84 HydrophobicContact CD1-CE1 3.92Å; I57-F84 HydrophobicContact CD1-CG 3.88Å; I57-V146 HydrophobicContact CD1-CG1 3.69Å; I57-V146 HydrophobicContact CG1-CG1 4.34Å; I57-Y147 PolarHBondContact N-O 2.99Å; I57-F148 HydrophobicContact CB-CD1 3.93Å; I57-F148 HydrophobicContact CB-CE1 4.12Å; I57-F148 HydrophobicContact CD1-CD1 4.39Å; I57-F148 HydrophobicContact CD1-CE1 3.79Å; I57-F148 HydrophobicContact CG2-CD1 4.26Å; I57-F148 HydrophobicContact CG2-CE1 4.26Å; I57-K149 PolarHBondContact O-N 3.34Å
58	D	87	Confident	83.3	Confident	21 Å²	21	60.6 Å²	60.6	11%	0.112	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120.1	173.4	-156.4	-35.3	0	0	0	109.2	Y40 K60 D61 V62 K149	Y40-D58 PolarHBondContact OH-N 3.11Å; Y40-D58 VanDerWaalsContact OH-N 3.17Å; D58-K60 PolarHBondContact O-N 3.31Å; D58-K60 WeakPolarHBondContact OD1-CB 3.39Å; D58-K60 WeakPolarHBondContact OD1-CG 3.46Å; D58-K60 PolarHBondContact OD1-N 3.49Å; D58-K60 VanDerWaalsContact OD1-N 3.13Å; D58-D61 WeakPolarHBondContact O-CB 3.2Å; D58-D61 PolarHBondContact O-N 3.15Å; D58-D61 VanDerWaalsContact O-N 3.15Å; D58-V62 PolarHBondContact O-N 3.3Å; D58-K149 WeakPolarHBondContact OD2-CD 3.36Å; D58-K149 WeakPolarHBondContact OD2-CE 3.44Å; D58-K149 IonicContact OD2-NZ 3.45Å; D58-K149 PolarHBondContact OD2-NZ 3.25Å
59	L	85.5	Confident	83.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68	-15.3	179.4	-70.5	178.7	0	0	0	112.6	V62 Q63 I73 V74 F148 K149 P151 L170	L59-V62 HydrophobicContact CD2-CB 4.44Å; L59-V62 HydrophobicContact CD2-CG2 4.26Å; L59-Q63 WeakPolarHBondContact O-CB 3.23Å; L59-Q63 PolarHBondContact O-N 3.5Å; L59-I73 HydrophobicContact CD2-CD1 4.06Å; L59-I73 HydrophobicContact CD2-CG2 4.01Å; L59-V74 HydrophobicContact CD1-CG2 4.47Å; L59-F148 HydrophobicContact CD1-CB 4.45Å; L59-F148 HydrophobicContact CD2-CD1 3.88Å; L59-F148 HydrophobicContact CD2-CE1 4.43Å; L59-F148 HydrophobicContact CD2-CG 4.49Å; L59-F148 HydrophobicContact CG-CB 4.46Å; L59-F148 HydrophobicContact CG-CD1 4.47Å; L59-K149 VanDerWaalsContact CB-O 3.3Å; L59-K149 WeakPolarHBondContact CB-O 3.02Å; L59-K149 VanDerWaalsContact CG-O 3.23Å; L59-K149 WeakPolarHBondContact CG-O 3.3Å; L59-K149 PolarHBondContact N-O 3.05Å; L59-P151 HydrophobicContact CB-CB 4.41Å; L59-P151 HydrophobicContact CB-CG 4.45Å; L59-L170 HydrophobicContact CD1-CD2 3.56Å
60	K	84.4	Confident	83.9	Confident	75 Å²	75	58.1 Å²	58.1	33%	0.326	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-46.7	168.8	-66.1	179.3	179.5	-169.9	0	111.9	D58 V62 Q63 E64 P151 S152	D58-K60 PolarHBondContact O-N 3.31Å; D58-K60 WeakPolarHBondContact OD1-CB 3.39Å; D58-K60 WeakPolarHBondContact OD1-CG 3.46Å; D58-K60 PolarHBondContact OD1-N 3.49Å; D58-K60 VanDerWaalsContact OD1-N 3.13Å; K60-V62 VanDerWaalsContact C-N 3.27Å; K60-V62 PolarHBondContact O-N 3.2Å; K60-Q63 WeakPolarHBondContact O-CA 3.47Å; K60-Q63 VanDerWaalsContact O-CB 3.25Å; K60-Q63 WeakPolarHBondContact O-CB 3.4Å; K60-Q63 PolarHBondContact O-N 2.91Å; K60-E64 PolarHBondContact O-N 2.88Å; K60-P151 HydrophobicContact CG-CB 4.41Å; K60-S152 WeakPolarHBondContact CE-OG 3.47Å; K60-S152 PolarHBondContact NZ-OG 2.92Å
61	D	85.4	Confident	84.4	Confident	30 Å²	30	61 Å²	61	16%	0.16	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-39.3	-178.7	-61.5	-1.7	0	0	0	109.7	F23 F27 Y40 D58 Q63 E64 F65	F23-D61 HydrophobicContact CE2-CB 4.36Å; F23-D61 WeakPolarHBondContact CE2-O 3.39Å; F23-D61 HydrophobicContact CZ-CB 3.91Å; F27-D61 HydrophobicContact CD1-CB 4.31Å; F27-D61 HydrophobicContact CD2-CB 4.36Å; F27-D61 HydrophobicContact CE1-CB 3.63Å; F27-D61 VanDerWaalsContact CE1-CG 3.47Å; F27-D61 WeakPolarHBondContact CE1-OD2 3.34Å; F27-D61 HydrophobicContact CE2-CB 3.71Å; F27-D61 HydrophobicContact CZ-CB 3.3Å; Y40-D61 HydrophobicContact CE2-CB 3.96Å; Y40-D61 WeakPolarHBondContact CE2-OD2 3.12Å; Y40-D61 WeakPolarHBondContact OH-CB 3.44Å; Y40-D61 PolarHBondContact OH-OD2 3.06Å; D58-D61 WeakPolarHBondContact O-CB 3.2Å; D58-D61 PolarHBondContact O-N 3.15Å; D58-D61 VanDerWaalsContact O-N 3.15Å; D61-Q63 VanDerWaalsContact C-N 3.29Å; D61-Q63 PolarHBondContact O-N 3.31Å; D61-E64 PolarHBondContact O-N 3.4Å; D61-F65 PolarHBondContact O-N 3.03Å
62	V	84	Confident	84.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-37.9	173.1	-174.3	0	0	0	0	111.1	F23 I57 D58 L59 K60 E64 F65 D66 L69 V70 I73	F23-V62 HydrophobicContact CD1-CG2 4.41Å; F23-V62 HydrophobicContact CE1-CG2 3.68Å; F23-V62 HydrophobicContact CE2-CB 4.44Å; F23-V62 HydrophobicContact CE2-CG2 4.16Å; F23-V62 HydrophobicContact CZ-CB 4.26Å; F23-V62 HydrophobicContact CZ-CG2 3.53Å; I57-V62 HydrophobicContact CG2-CG2 3.68Å; D58-V62 PolarHBondContact O-N 3.3Å; L59-V62 HydrophobicContact CD2-CB 4.44Å; L59-V62 HydrophobicContact CD2-CG2 4.26Å; K60-V62 VanDerWaalsContact C-N 3.27Å; K60-V62 PolarHBondContact O-N 3.2Å; V62-E64 VanDerWaalsContact C-N 3.34Å; V62-E64 PolarHBondContact O-N 3.08Å; V62-F65 PolarHBondContact O-N 3.41Å; V62-D66 CarbonylContact O-C 3.59Å; V62-D66 PolarHBondContact O-N 3.15Å; V62-L69 HydrophobicContact CG1-CB 4.26Å; V62-L69 HydrophobicContact CG1-CD2 3.89Å; V62-L69 HydrophobicContact CG1-CG 4.13Å; V62-V70 HydrophobicContact CB-CG2 3.93Å; V62-V70 HydrophobicContact CG1-CG2 3.71Å; V62-I73 HydrophobicContact CG1-CD1 4.02Å
63	Q	85	Confident	85	Confident	107 Å²	107	51.4 Å²	51.4	50%	0.5	27%	0.265	S	S	.	.	H	α-helix	trans	-65	-36.1	177.7	-167.3	176.2	5.1	0	0	112.5	L59 K60 D61 F65 V70	L59-Q63 WeakPolarHBondContact O-CB 3.23Å; L59-Q63 PolarHBondContact O-N 3.5Å; K60-Q63 WeakPolarHBondContact O-CA 3.47Å; K60-Q63 VanDerWaalsContact O-CB 3.25Å; K60-Q63 WeakPolarHBondContact O-CB 3.4Å; K60-Q63 PolarHBondContact O-N 2.91Å; D61-Q63 VanDerWaalsContact C-N 3.29Å; D61-Q63 PolarHBondContact O-N 3.31Å; Q63-F65 VanDerWaalsContact C-N 3.31Å; Q63-V70 HydrophobicContact CB-CG2 3.88Å; Q63-V70 HydrophobicContact CG-CG2 4.47Å
64	E	84.3	Confident	85.3	Confident	154 Å²	154	48.5 Å²	48.5	72%	0.72	25%	0.253	S	S	*	.	H	α-helix	trans	-67.9	-31.8	175.5	-71.1	-178.4	179.1	0	0	112.5	F27 K60 D61 V62	F27-E64 HydrophobicContact CE2-CB 4.46Å; K60-E64 PolarHBondContact O-N 2.88Å; D61-E64 PolarHBondContact O-N 3.4Å; V62-E64 VanDerWaalsContact C-N 3.34Å; V62-E64 PolarHBondContact O-N 3.08Å
65	F	82.2	Confident	85.3	Confident	81 Å²	81	49 Å²	49	36%	0.355	26%	0.263	S	S	.	.	H	α-helix	trans	-83.3	-53	179.4	-173.7	-99.7	0	0	0	112.8	E22 F23 D61 V62 Q63	E22-F65 HydrophobicContact CB-CZ 4.31Å; F23-F65 HydrophobicContact CB-CD1 4.11Å; F23-F65 HydrophobicContact CB-CE1 4.17Å; F23-F65 HydrophobicContact CD2-CB 3.57Å; F23-F65 AromaticContact CD2-CD1 3.9Å; F23-F65 HydrophobicContact CD2-CD1 3.9Å; F23-F65 HydrophobicContact CD2-CD2 4.31Å; F23-F65 AromaticContact CD2-CG 3.68Å; F23-F65 HydrophobicContact CD2-CG 3.68Å; F23-F65 HydrophobicContact CE2-CB 3.88Å; F23-F65 HydrophobicContact CE2-CG 4.45Å; F23-F65 HydrophobicContact CG-CD1 4.47Å; D61-F65 PolarHBondContact O-N 3.03Å; V62-F65 PolarHBondContact O-N 3.41Å; Q63-F65 VanDerWaalsContact C-N 3.31Å
66	D	84	Confident	85.4	Confident	24 Å²	24	52.5 Å²	52.5	13%	0.128	28%	0.282	C	S	.	.			trans	-149.6	103	-178.3	-167	-4.5	0	0	0	110.4	K19 V62 D68 L69	K19-D66 IonicContact NZ-OD2 2.79Å; K19-D66 PolarHBondContact NZ-OD2 3.14Å; V62-D66 CarbonylContact O-C 3.59Å; V62-D66 PolarHBondContact O-N 3.15Å; D66-D68 VanDerWaalsContact C-N 3.27Å; D66-D68 PolarHBondContact O-N 3.28Å; D66-D68 PolarHBondContact OD1-N 2.92Å; D66-L69 HydrophobicContact CB-CB 3.99Å; D66-L69 WeakPolarHBondContact O-CB 3.22Å; D66-L69 PolarHBondContact O-N 3.25Å
67	P	84.1	Confident	85.3	Confident	73 Å²	73	49.4 Å²	49.4	47%	0.474	26%	0.263	S	S	.	.	H	α-helix	trans	-63.5	-32.1	-179.1	25.4	-33.7	0	0	0	112.5	L69 V70 D71	P67-L69 PolarHBondContact O-N 3.07Å; P67-V70 WeakPolarHBondContact O-CB 3.4Å; P67-V70 PolarHBondContact O-N 3.37Å; P67-V70 VanDerWaalsContact O-N 3.17Å; P67-D71 PolarHBondContact O-N 2.97Å
68	D	85.5	Confident	85.3	Confident	106 Å²	106	54.6 Å²	54.6	57%	0.567	28%	0.282	S	S	*	.	H	α-helix	trans	-65.9	-32	179	-69.3	-18.1	0	0	0	111.4	D66 V70 N72	D66-D68 VanDerWaalsContact C-N 3.27Å; D66-D68 PolarHBondContact O-N 3.28Å; D66-D68 PolarHBondContact OD1-N 2.92Å; D68-V70 VanDerWaalsContact C-N 3.3Å; D68-V70 PolarHBondContact O-N 3.34Å; D68-N72 WeakPolarHBondContact O-CB 3.33Å; D68-N72 PolarHBondContact O-N 3.19Å; D68-N72 PolarHBondContact O-ND2 3.49Å
69	L	84.3	Confident	85.3	Confident	6 Å²	6	57.8 Å²	57.8	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-35.5	178	-171.7	62.3	0	0	0	110.9	V16 V62 D66 P67 N72 I73 Y80 F84	V16-L69 HydrophobicContact CG1-CD1 4.46Å; V62-L69 HydrophobicContact CG1-CB 4.26Å; V62-L69 HydrophobicContact CG1-CD2 3.89Å; V62-L69 HydrophobicContact CG1-CG 4.13Å; D66-L69 HydrophobicContact CB-CB 3.99Å; D66-L69 WeakPolarHBondContact O-CB 3.22Å; D66-L69 PolarHBondContact O-N 3.25Å; P67-L69 PolarHBondContact O-N 3.07Å; L69-N72 PolarHBondContact O-N 3.34Å; L69-I73 HydrophobicContact CD2-CD1 4.49Å; L69-I73 HydrophobicContact CG-CD1 3.89Å; L69-I73 HydrophobicContact CG-CG1 4.42Å; L69-I73 WeakPolarHBondContact O-CB 3.37Å; L69-I73 WeakPolarHBondContact O-CD1 3.38Å; L69-I73 WeakPolarHBondContact O-CG1 3.02Å; L69-I73 PolarHBondContact O-N 3.13Å; L69-Y80 HydrophobicContact CD1-CD1 4.41Å; L69-Y80 HydrophobicContact CD1-CE1 3.85Å; L69-F84 HydrophobicContact CD2-CZ 4.37Å
70	V	84.5	Confident	85.4	Confident	9 Å²	9	59 Å²	59	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-48.7	177.9	179.6	0	0	0	0	111.2	V62 Q63 P67 D68 N72 I73 V74	V62-V70 HydrophobicContact CB-CG2 3.93Å; V62-V70 HydrophobicContact CG1-CG2 3.71Å; Q63-V70 HydrophobicContact CB-CG2 3.88Å; Q63-V70 HydrophobicContact CG-CG2 4.47Å; P67-V70 WeakPolarHBondContact O-CB 3.4Å; P67-V70 PolarHBondContact O-N 3.37Å; P67-V70 VanDerWaalsContact O-N 3.17Å; D68-V70 VanDerWaalsContact C-N 3.3Å; D68-V70 PolarHBondContact O-N 3.34Å; V70-N72 PolarHBondContact O-N 3.17Å; V70-I73 PolarHBondContact O-N 2.71Å; V70-I73 VanDerWaalsContact O-N 3.13Å; V70-V74 HydrophobicContact CG1-CG2 4.22Å; V70-V74 WeakPolarHBondContact O-CB 3.45Å; V70-V74 VanDerWaalsContact O-CG2 3.29Å; V70-V74 WeakPolarHBondContact O-CG2 3.13Å; V70-V74 PolarHBondContact O-N 3.47Å
71	D	85.2	Confident	85.6	Confident	119 Å²	119	56.9 Å²	56.9	64%	0.636	29%	0.291	S	S	*	.	H	α-helix	trans	-60.2	-38.9	179.1	-77.4	-16.3	0	0	0	111.8	P67 V74 G75	P67-D71 PolarHBondContact O-N 2.97Å; D71-V74 PolarHBondContact O-N 2.92Å; D71-G75 PolarHBondContact O-N 3.4Å
72	N	86.6	Confident	85.6	Confident	86 Å²	86	59.1 Å²	59.1	46%	0.46	30%	0.301	S	S	.	.	H	α-helix	trans	-66.9	-43.2	175.3	-79	-51.6	0	0	0	112.8	D68 L69 V70 G75 N76 Y80	D68-N72 WeakPolarHBondContact O-CB 3.33Å; D68-N72 PolarHBondContact O-N 3.19Å; D68-N72 PolarHBondContact O-ND2 3.49Å; L69-N72 PolarHBondContact O-N 3.34Å; V70-N72 PolarHBondContact O-N 3.17Å; N72-G75 PolarHBondContact O-N 3.44Å; N72-N76 PolarHBondContact O-N 3.34Å; N72-Y80 VanDerWaalsContact C-CE2 3.42Å; N72-Y80 HydrophobicContact CB-CE2 3.98Å; N72-Y80 WeakPolarHBondContact CB-OH 3.34Å; N72-Y80 WeakPolarHBondContact O-CE2 3.33Å
73	I	87.1	Confident	85.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-46.5	174.8	-68.8	162.1	0	0	0	109.8	L59 V62 L69 V70 G75 N76 T77 Y80 F84 F148	L59-I73 HydrophobicContact CD2-CD1 4.06Å; L59-I73 HydrophobicContact CD2-CG2 4.01Å; V62-I73 HydrophobicContact CG1-CD1 4.02Å; L69-I73 HydrophobicContact CD2-CD1 4.49Å; L69-I73 HydrophobicContact CG-CD1 3.89Å; L69-I73 HydrophobicContact CG-CG1 4.42Å; L69-I73 WeakPolarHBondContact O-CB 3.37Å; L69-I73 WeakPolarHBondContact O-CD1 3.38Å; L69-I73 WeakPolarHBondContact O-CG1 3.02Å; L69-I73 PolarHBondContact O-N 3.13Å; V70-I73 PolarHBondContact O-N 2.71Å; V70-I73 VanDerWaalsContact O-N 3.13Å; I73-G75 VanDerWaalsContact C-N 3.26Å; I73-G75 PolarHBondContact O-N 2.85Å; I73-N76 CarbonylContact O-C 3.53Å; I73-N76 PolarHBondContact O-N 2.85Å; I73-T77 WeakPolarHBondContact O-CA 3.43Å; I73-T77 WeakPolarHBondContact O-CG2 3.47Å; I73-T77 PolarHBondContact O-N 3.47Å; I73-Y80 HydrophobicContact CB-CD2 4.36Å; I73-Y80 HydrophobicContact CB-CG 4.29Å; I73-Y80 HydrophobicContact CG1-CD1 3.68Å; I73-Y80 HydrophobicContact CG1-CD2 4.08Å; I73-Y80 HydrophobicContact CG1-CE1 4.27Å; I73-Y80 HydrophobicContact CG1-CG 3.6Å; I73-F84 HydrophobicContact CD1-CE2 3.87Å; I73-F84 HydrophobicContact CD1-CZ 4.21Å; I73-F84 HydrophobicContact CG1-CE2 4.35Å; I73-F148 HydrophobicContact CD1-CE1 4.47Å; I73-F148 HydrophobicContact CG2-CD1 4.37Å; I73-F148 HydrophobicContact CG2-CD2 4.17Å; I73-F148 HydrophobicContact CG2-CE1 4.24Å; I73-F148 HydrophobicContact CG2-CE2 4Å; I73-F148 HydrophobicContact CG2-CG 4.36Å; I73-F148 HydrophobicContact CG2-CZ 4.06Å
74	V	86.5	Confident	85.9	Confident	32 Å²	32	54.1 Å²	54.1	19%	0.194	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-34.5	178.7	173.1	0	0	0	0	111	L59 V70 D71 K169 L170	L59-V74 HydrophobicContact CD1-CG2 4.47Å; V70-V74 HydrophobicContact CG1-CG2 4.22Å; V70-V74 WeakPolarHBondContact O-CB 3.45Å; V70-V74 VanDerWaalsContact O-CG2 3.29Å; V70-V74 WeakPolarHBondContact O-CG2 3.13Å; V70-V74 PolarHBondContact O-N 3.47Å; D71-V74 PolarHBondContact O-N 2.92Å; V74-K169 CarbonylContact O-C 3.58Å; V74-K169 WeakPolarHBondContact O-CA 3.29Å; V74-K169 WeakPolarHBondContact O-CB 3.43Å; V74-L170 PolarHBondContact O-N 2.93Å
75	G	86	Confident	86	Confident	38 Å²	38	47.3 Å²	47.3	39%	0.392	25%	0.247	S	C	.	.	H	α-helix	trans	-72.5	-35.5	178.1	0	0	0	0	0	115.1	D71 N72 I73	D71-G75 PolarHBondContact O-N 3.4Å; N72-G75 PolarHBondContact O-N 3.44Å; I73-G75 VanDerWaalsContact C-N 3.26Å; I73-G75 PolarHBondContact O-N 2.85Å
76	N	87.3	Confident	86.2	Confident	76 Å²	76	46 Å²	46	41%	0.406	24%	0.242	S	C	.	.	S	Bend	trans	-146.5	62	-178.4	-168.6	-11.6	0	0	0	112.6	N72 I73 R78 R79 Y80	N72-N76 PolarHBondContact O-N 3.34Å; I73-N76 CarbonylContact O-C 3.53Å; I73-N76 PolarHBondContact O-N 2.85Å; N76-R78 VanDerWaalsContact C-N 3.3Å; N76-R78 PolarHBondContact O-N 2.95Å; N76-R79 PolarHBondContact O-N 3.33Å; N76-Y80 VanDerWaalsContact O-CD2 3.22Å; N76-Y80 WeakPolarHBondContact O-CD2 2.86Å; N76-Y80 PolarHBondContact O-N 3.36Å
77	T	85.7	Confident	86.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-50.2	-45.6	-175.4	48.2	0	0	0	0	113.6	I73 R79 Y80 V81 G168 L170 V286	I73-T77 WeakPolarHBondContact O-CA 3.43Å; I73-T77 WeakPolarHBondContact O-CG2 3.47Å; I73-T77 PolarHBondContact O-N 3.47Å; T77-R79 VanDerWaalsContact C-N 3.28Å; T77-R79 PolarHBondContact O-N 3.35Å; T77-Y80 CarbonylContact O-C 3.55Å; T77-Y80 PolarHBondContact O-N 2.64Å; T77-V81 WeakPolarHBondContact O-CG2 3.47Å; T77-V81 PolarHBondContact O-N 2.76Å; T77-G168 PolarHBondContact OG1-O 3.02Å; T77-L170 HydrophobicContact CG2-CB 3.43Å; T77-L170 VanDerWaalsContact CG2-CB 3.43Å; T77-L170 HydrophobicContact CG2-CD1 3.77Å; T77-L170 HydrophobicContact CG2-CG 4.09Å; T77-V286 HydrophobicContact CG2-CG2 4.19Å; T77-V286 WeakPolarHBondContact OG1-CG1 3.27Å; T77-V286 WeakPolarHBondContact OG1-CG2 3.36Å
78	R	85.7	Confident	86.3	Confident	109 Å²	109	41.4 Å²	41.4	41%	0.411	21%	0.214	S	C	.	.	H	α-helix	trans	-58	-40.9	-174.2	-174.8	176.4	178.9	83.3	3.5	112.2	N76 Q82 E309	N76-R78 VanDerWaalsContact C-N 3.3Å; N76-R78 PolarHBondContact O-N 2.95Å; R78-Q82 PolarHBondContact O-N 2.84Å; R78-E309 IonicContact NH1-OE2 3.25Å; R78-E309 PolarHBondContact NH1-OE2 2.86Å
79	R	87.2	Confident	86.1	Confident	88 Å²	88	38.5 Å²	38.5	33%	0.332	20%	0.198	S	C	.	.	H	α-helix	trans	-68	-42.3	176.8	-175.1	179	176.4	176	-0.7	111	H9 N76 T77 Q82 I83	H9-R79 PolarHBondContact O-NH2 3.48Å; N76-R79 PolarHBondContact O-N 3.33Å; T77-R79 VanDerWaalsContact C-N 3.28Å; T77-R79 PolarHBondContact O-N 3.35Å; R79-Q82 PolarHBondContact O-N 3.15Å; R79-I83 HydrophobicContact CG-CD1 3.98Å; R79-I83 WeakPolarHBondContact O-CG1 3.4Å; R79-I83 PolarHBondContact O-N 2.88Å
80	Y	88	Confident	86.1	Confident	26 Å²	26	42.4 Å²	42.4	10%	0.102	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-38.5	178	-74.8	-82.1	0	0	0	112.1	V16 L69 N72 I73 N76 T77 Q82 I83 F84	V16-Y80 HydrophobicContact CG1-CD1 4.07Å; V16-Y80 HydrophobicContact CG1-CE1 3.49Å; V16-Y80 VanDerWaalsContact CG1-CE1 3.49Å; L69-Y80 HydrophobicContact CD1-CD1 4.41Å; L69-Y80 HydrophobicContact CD1-CE1 3.85Å; N72-Y80 VanDerWaalsContact C-CE2 3.42Å; N72-Y80 HydrophobicContact CB-CE2 3.98Å; N72-Y80 WeakPolarHBondContact CB-OH 3.34Å; N72-Y80 WeakPolarHBondContact O-CE2 3.33Å; I73-Y80 HydrophobicContact CB-CD2 4.36Å; I73-Y80 HydrophobicContact CB-CG 4.29Å; I73-Y80 HydrophobicContact CG1-CD1 3.68Å; I73-Y80 HydrophobicContact CG1-CD2 4.08Å; I73-Y80 HydrophobicContact CG1-CE1 4.27Å; I73-Y80 HydrophobicContact CG1-CG 3.6Å; N76-Y80 VanDerWaalsContact O-CD2 3.22Å; N76-Y80 WeakPolarHBondContact O-CD2 2.86Å; N76-Y80 PolarHBondContact O-N 3.36Å; T77-Y80 CarbonylContact O-C 3.55Å; T77-Y80 PolarHBondContact O-N 2.64Å; Y80-Q82 VanDerWaalsContact C-N 3.25Å; Y80-Q82 PolarHBondContact O-N 3.39Å; Y80-I83 PolarHBondContact O-N 3.02Å; Y80-I83 VanDerWaalsContact O-N 3.12Å; Y80-F84 HydrophobicContact CD1-CE2 4.32Å; Y80-F84 WeakPolarHBondContact O-CB 3.25Å; Y80-F84 VanDerWaalsContact O-CD2 3.29Å; Y80-F84 WeakPolarHBondContact O-CD2 3.48Å; Y80-F84 PolarHBondContact O-N 2.82Å
81	V	88.1	Confident	85.9	Confident	31 Å²	31	42.7 Å²	42.7	19%	0.188	22%	0.217	C	C	.	.	H	α-helix	trans	-53.6	-45.4	172.8	174.2	0	0	0	0	110.8	T77 A85 V146 F148	T77-V81 WeakPolarHBondContact O-CG2 3.47Å; T77-V81 PolarHBondContact O-N 2.76Å; V81-A85 VanDerWaalsContact O-CB 3.3Å; V81-A85 WeakPolarHBondContact O-CB 3.27Å; V81-A85 PolarHBondContact O-N 2.86Å; V81-V146 HydrophobicContact CG1-CB 4.43Å; V81-F148 HydrophobicContact CB-CE2 4.33Å; V81-F148 HydrophobicContact CG2-CD2 3.81Å; V81-F148 HydrophobicContact CG2-CE2 3.44Å; V81-F148 VanDerWaalsContact CG2-CE2 3.44Å
82	Q	86.4	Confident	85.5	Confident	77 Å²	77	38.9 Å²	38.9	36%	0.36	20%	0.196	S	C	.	.	H	α-helix	trans	-66.3	-42.2	178.3	-68.8	-179	-20.9	0	0	112.7	R78 R79 Y80 A85 E86	R78-Q82 PolarHBondContact O-N 2.84Å; R79-Q82 PolarHBondContact O-N 3.15Å; Y80-Q82 VanDerWaalsContact C-N 3.25Å; Y80-Q82 PolarHBondContact O-N 3.39Å; Q82-A85 PolarHBondContact O-N 3.49Å; Q82-E86 WeakPolarHBondContact O-CG 3.26Å; Q82-E86 PolarHBondContact O-N 2.96Å
83	I	87.6	Confident	85	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-45.3	179	-64.9	166.4	0	0	0	110.8	R13 V16 R79 Y80 A85 E86 A87	R13-I83 HydrophobicContact CG-CD1 4.27Å; R13-I83 HydrophobicContact CG-CG1 4.32Å; V16-I83 HydrophobicContact CG1-CD1 4.09Å; V16-I83 HydrophobicContact CG1-CG2 4.17Å; R79-I83 HydrophobicContact CG-CD1 3.98Å; R79-I83 WeakPolarHBondContact O-CG1 3.4Å; R79-I83 PolarHBondContact O-N 2.88Å; Y80-I83 PolarHBondContact O-N 3.02Å; Y80-I83 VanDerWaalsContact O-N 3.12Å; I83-A85 VanDerWaalsContact C-N 3.32Å; I83-A85 PolarHBondContact O-N 3.22Å; I83-E86 PolarHBondContact O-N 3.22Å; I83-A87 PolarHBondContact O-N 2.79Å
84	F	87.3	Confident	84.3	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-38.4	176	-86.4	-87.1	0	0	0	111.4	A20 F23 I24 I57 L69 I73 Y80 E86 A87 V88 V146 F148	A20-F84 HydrophobicContact CB-CD1 4.07Å; A20-F84 HydrophobicContact CB-CE1 3.83Å; A20-F84 HydrophobicContact CB-CE2 4.42Å; A20-F84 HydrophobicContact CB-CG 4.49Å; A20-F84 HydrophobicContact CB-CZ 4.02Å; F23-F84 HydrophobicContact CD1-CE1 4.31Å; I24-F84 HydrophobicContact CD1-CD1 4.28Å; I57-F84 HydrophobicContact CD1-CB 4.19Å; I57-F84 HydrophobicContact CD1-CD1 3.44Å; I57-F84 VanDerWaalsContact CD1-CD1 3.44Å; I57-F84 HydrophobicContact CD1-CE1 3.92Å; I57-F84 HydrophobicContact CD1-CG 3.88Å; L69-F84 HydrophobicContact CD2-CZ 4.37Å; I73-F84 HydrophobicContact CD1-CE2 3.87Å; I73-F84 HydrophobicContact CD1-CZ 4.21Å; I73-F84 HydrophobicContact CG1-CE2 4.35Å; Y80-F84 HydrophobicContact CD1-CE2 4.32Å; Y80-F84 WeakPolarHBondContact O-CB 3.25Å; Y80-F84 VanDerWaalsContact O-CD2 3.29Å; Y80-F84 WeakPolarHBondContact O-CD2 3.48Å; Y80-F84 PolarHBondContact O-N 2.82Å; F84-E86 PolarHBondContact O-N 3.13Å; F84-A87 PolarHBondContact O-N 3.29Å; F84-V88 WeakPolarHBondContact O-CB 3.5Å; F84-V88 VanDerWaalsContact O-CG2 3.26Å; F84-V88 WeakPolarHBondContact O-CG2 3.48Å; F84-V88 PolarHBondContact O-N 2.86Å; F84-V146 HydrophobicContact CB-CG1 4.26Å; F84-F148 HydrophobicContact CD2-CE1 4.17Å; F84-F148 AromaticContact CD2-CZ 3.72Å; F84-F148 HydrophobicContact CD2-CZ 3.72Å; F84-F148 HydrophobicContact CE2-CE1 4.26Å; F84-F148 HydrophobicContact CE2-CZ 4.11Å; F84-F148 HydrophobicContact CG-CZ 4.26Å
85	A	86.5	Confident	83.4	Confident	10 Å²	10	48.8 Å²	48.8	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-41	173.5	0	0	0	0	0	112.3	V81 Q82 I83 V88 D89 F144 V146	V81-A85 VanDerWaalsContact O-CB 3.3Å; V81-A85 WeakPolarHBondContact O-CB 3.27Å; V81-A85 PolarHBondContact O-N 2.86Å; Q82-A85 PolarHBondContact O-N 3.49Å; I83-A85 VanDerWaalsContact C-N 3.32Å; I83-A85 PolarHBondContact O-N 3.22Å; A85-V88 PolarHBondContact O-N 2.91Å; A85-D89 VanDerWaalsContact O-CG 3.25Å; A85-D89 PolarHBondContact O-N 3.28Å; A85-F144 HydrophobicContact CB-CE2 4.49Å; A85-V146 HydrophobicContact CB-CG2 4.19Å
86	E	85.9	Confident	82.4	Confident	55 Å²	55	48.5 Å²	48.5	26%	0.257	24%	0.238	S	C	.	.	H	α-helix	trans	-65.1	-41	174.1	-73.1	171.5	179.7	0	0	112.5	R13 Q82 I83 F84 D89 Q90	R13-E86 IonicContact CZ-OE1 2.78Å; R13-E86 IonicContact CZ-OE2 2.6Å; R13-E86 IonicContact NE-OE2 3.97Å; R13-E86 IonicContact NH2-OE1 2.7Å; R13-E86 PolarHBondContact NH2-OE1 2.89Å; R13-E86 IonicContact NH2-OE2 3.73Å; R13-E86 PolarHBondContact NH2-OE2 3.47Å; Q82-E86 WeakPolarHBondContact O-CG 3.26Å; Q82-E86 PolarHBondContact O-N 2.96Å; I83-E86 PolarHBondContact O-N 3.22Å; F84-E86 PolarHBondContact O-N 3.13Å; E86-D89 PolarHBondContact O-N 3.42Å; E86-Q90 WeakPolarHBondContact O-CG 3.38Å; E86-Q90 PolarHBondContact O-N 2.83Å; E86-Q90 VanDerWaalsContact O-N 3.15Å
87	A	85	Confident	81	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-44.1	176.7	0	0	0	0	0	111.3	A20 K21 I24 I83 F84 Q90 L91	A20-A87 HydrophobicContact CB-CB 4.19Å; K21-A87 HydrophobicContact CG-CB 3.98Å; I24-A87 HydrophobicContact CD1-CB 4.4Å; I83-A87 PolarHBondContact O-N 2.79Å; F84-A87 PolarHBondContact O-N 3.29Å; A87-Q90 PolarHBondContact O-N 3Å; A87-L91 WeakPolarHBondContact O-CG 3.29Å; A87-L91 PolarHBondContact O-N 2.8Å
88	V	85.1	Confident	79.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-40.6	176.4	175.1	0	0	0	0	111.2	I24 V44 F55 F84 A85 Q90 L91 I92 F144	I24-V88 HydrophobicContact CD1-CG2 3.85Å; V44-V88 HydrophobicContact CG2-CG1 4.46Å; F55-V88 HydrophobicContact CD1-CG2 4.16Å; F55-V88 HydrophobicContact CE1-CG2 3.91Å; F55-V88 HydrophobicContact CZ-CG2 4.25Å; F84-V88 WeakPolarHBondContact O-CB 3.5Å; F84-V88 VanDerWaalsContact O-CG2 3.26Å; F84-V88 WeakPolarHBondContact O-CG2 3.48Å; F84-V88 PolarHBondContact O-N 2.86Å; A85-V88 PolarHBondContact O-N 2.91Å; V88-Q90 VanDerWaalsContact C-N 3.27Å; V88-Q90 PolarHBondContact O-N 3.25Å; V88-L91 PolarHBondContact O-N 3.21Å; V88-I92 HydrophobicContact CG1-CD1 3.75Å; V88-I92 HydrophobicContact CG1-CG1 4.2Å; V88-I92 VanDerWaalsContact O-CG1 3.25Å; V88-I92 WeakPolarHBondContact O-CG1 3.3Å; V88-I92 PolarHBondContact O-N 3.34Å; V88-F144 HydrophobicContact CB-CE2 3.73Å; V88-F144 HydrophobicContact CB-CZ 3.66Å; V88-F144 HydrophobicContact CG1-CD2 4.18Å; V88-F144 HydrophobicContact CG1-CE1 3.96Å; V88-F144 HydrophobicContact CG1-CE2 3.49Å; V88-F144 VanDerWaalsContact CG1-CE2 3.49Å; V88-F144 HydrophobicContact CG1-CZ 3.38Å; V88-F144 HydrophobicContact CG2-CE2 4.46Å
89	D	82.7	Confident	78.1	Confident	44 Å²	44	59 Å²	59	24%	0.235	30%	0.302	C	S	.	.	H	α-helix	trans	-56.4	-42.8	174.7	-76	-30.2	0	0	0	111.7	A85 E86 Y93 R142 F144	A85-D89 VanDerWaalsContact O-CG 3.25Å; A85-D89 PolarHBondContact O-N 3.28Å; E86-D89 PolarHBondContact O-N 3.42Å; D89-Y93 PolarHBondContact O-N 2.82Å; D89-Y93 VanDerWaalsContact O-N 3.17Å; D89-R142 WeakPolarHBondContact OD1-CG 3.48Å; D89-R142 IonicContact OD1-NE 3.62Å; D89-R142 IonicContact OD2-CZ 3.56Å; D89-R142 VanDerWaalsContact OD2-CZ 3.24Å; D89-R142 IonicContact OD2-NE 3.98Å; D89-R142 PolarHBondContact OD2-NE 2.85Å; D89-R142 IonicContact OD2-NH2 2.64Å; D89-R142 PolarHBondContact OD2-NH2 2.86Å; D89-F144 VanDerWaalsContact OD1-CE1 3.25Å; D89-F144 WeakPolarHBondContact OD1-CE1 3.39Å; D89-F144 WeakPolarHBondContact OD1-CZ 2.87Å
90	Q	82.6	Confident	76.6	Confident	89 Å²	89	60 Å²	60	42%	0.416	31%	0.314	S	S	.	.	H	α-helix	trans	-69.7	-41.6	179	-68.5	176.9	19.4	0	0	111.8	E86 A87 V88 I92 Y93 E94	E86-Q90 WeakPolarHBondContact O-CG 3.38Å; E86-Q90 PolarHBondContact O-N 2.83Å; E86-Q90 VanDerWaalsContact O-N 3.15Å; A87-Q90 PolarHBondContact O-N 3Å; V88-Q90 VanDerWaalsContact C-N 3.27Å; V88-Q90 PolarHBondContact O-N 3.25Å; Q90-I92 VanDerWaalsContact C-N 3.35Å; Q90-I92 PolarHBondContact O-N 3.38Å; Q90-Y93 WeakPolarHBondContact O-CB 3.47Å; Q90-Y93 PolarHBondContact O-N 3.2Å; Q90-Y93 VanDerWaalsContact O-N 3.15Å; Q90-E94 WeakPolarHBondContact O-CG 3.46Å; Q90-E94 PolarHBondContact O-N 2.96Å
91	L	80.4	Confident	75.1	Confident	14 Å²	14	61.5 Å²	61.5	7%	0.073	33%	0.327	C	S	.	.	H	α-helix	trans	-65.9	-35.9	176.3	-70.6	173.4	0	0	0	112.6	K21 I24 T25 V44 A87 V88 Y93 E94 A95	K21-L91 HydrophobicContact CG-CG 4.38Å; I24-L91 HydrophobicContact CB-CD1 3.7Å; I24-L91 HydrophobicContact CD1-CD1 3.91Å; I24-L91 HydrophobicContact CG1-CD1 4.43Å; I24-L91 HydrophobicContact CG2-CD1 3.36Å; T25-L91 HydrophobicContact CG2-CD1 4.4Å; T25-L91 HydrophobicContact CG2-CD2 3.69Å; V44-L91 HydrophobicContact CG1-CB 4.4Å; A87-L91 WeakPolarHBondContact O-CG 3.29Å; A87-L91 PolarHBondContact O-N 2.8Å; V88-L91 PolarHBondContact O-N 3.21Å; L91-Y93 VanDerWaalsContact C-N 3.28Å; L91-Y93 PolarHBondContact O-N 3.25Å; L91-E94 PolarHBondContact O-N 3.49Å; L91-A95 VanDerWaalsContact O-CB 3.23Å; L91-A95 WeakPolarHBondContact O-CB 3.38Å; L91-A95 PolarHBondContact O-N 2.7Å
92	I	78.1	Confident	73.9	Confident	40 Å²	40	63 Å²	63	21%	0.205	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-39.6	172.9	-69.8	168.2	0	0	0	110.3	V44 V47 A48 V88 Q90 A96 F144	V44-I92 HydrophobicContact CG1-CG1 3.89Å; V47-I92 HydrophobicContact CG1-CD1 3.87Å; A48-I92 HydrophobicContact CB-CG2 4.23Å; V88-I92 HydrophobicContact CG1-CD1 3.75Å; V88-I92 HydrophobicContact CG1-CG1 4.2Å; V88-I92 VanDerWaalsContact O-CG1 3.25Å; V88-I92 WeakPolarHBondContact O-CG1 3.3Å; V88-I92 PolarHBondContact O-N 3.34Å; Q90-I92 VanDerWaalsContact C-N 3.35Å; Q90-I92 PolarHBondContact O-N 3.38Å; I92-A96 PolarHBondContact O-N 2.98Å; I92-F144 HydrophobicContact CD1-CD1 3.97Å; I92-F144 HydrophobicContact CD1-CE1 3.62Å; I92-F144 HydrophobicContact CD1-CZ 4.35Å
93	Y	74.7	Confident	72.9	Confident	142 Å²	142	63.1 Å²	63.1	56%	0.557	34%	0.343	S	S	*	.	H	α-helix	trans	-66.4	-42.4	176.9	-176.5	-99.7	0	0	0	112.2	D89 Q90 L91	D89-Y93 PolarHBondContact O-N 2.82Å; D89-Y93 VanDerWaalsContact O-N 3.17Å; Q90-Y93 WeakPolarHBondContact O-CB 3.47Å; Q90-Y93 PolarHBondContact O-N 3.2Å; Q90-Y93 VanDerWaalsContact O-N 3.15Å; L91-Y93 VanDerWaalsContact C-N 3.28Å; L91-Y93 PolarHBondContact O-N 3.25Å
94	E	72.7	Confident	72	Confident	114 Å²	114	68.9 Å²	68.9	53%	0.533	37%	0.368	S	S	.	.	H	α-helix	trans	-68.6	-37.5	178	-69.9	166.7	-155.7	0	0	112.5	K21 Q90 L91	K21-E94 IonicContact NZ-OE1 3.99Å; K21-E94 PolarHBondContact NZ-OE1 2.89Å; Q90-E94 WeakPolarHBondContact O-CG 3.46Å; Q90-E94 PolarHBondContact O-N 2.96Å; L91-E94 PolarHBondContact O-N 3.49Å
95	A	67.9	Low	71.1	Confident	70 Å²	70	72.7 Å²	72.7	58%	0.579	39%	0.388	S	S	*	.	H	α-helix	trans	-75.6	-25.3	-178.4	0	0	0	0	0	113.9	L91	L91-A95 VanDerWaalsContact O-CB 3.23Å; L91-A95 WeakPolarHBondContact O-CB 3.38Å; L91-A95 PolarHBondContact O-N 2.7Å
96	A	65	Low	70.5	Confident	31 Å²	31	76.7 Å²	76.7	26%	0.256	41%	0.414	S	S	.	.			trans	-138.5	65.6	-176.8	0	0	0	0	0	112.5	I92 D98	I92-A96 PolarHBondContact O-N 2.98Å; A96-D98 VanDerWaalsContact C-N 3.29Å; A96-D98 PolarHBondContact O-N 3.21Å
97	P	59.1	Low	70.1	Confident	90 Å²	90	75.9 Å²	75.9	58%	0.584	41%	0.409	S	S	*	.	S	Bend	trans	-63.8	-31.4	-178.7	22.2	-30.7	0	0	0	113.2
98	D	52.5	Low	69.6	Low	156 Å²	156	76 Å²	76	83%	0.834	41%	0.41	S	S	*	.	S	Bend	trans	-120.1	-2.7	-170.8	-70.3	-36.4	0	0	0	115.9	A96 L100	A96-D98 VanDerWaalsContact C-N 3.29Å; A96-D98 PolarHBondContact O-N 3.21Å; D98-L100 PolarHBondContact O-N 2.59Å
99	Q	56.8	Low	69.2	Low	160 Å²	160	78.3 Å²	78.3	75%	0.748	42%	0.424	S	S	*	.			trans	-92.3	106.1	173.9	-78	-179.9	3.4	0	0	109.8	P101	Q99-P101 VanDerWaalsContact O-N 3.17Å
100	L	56.4	Low	69	Low	110 Å²	110	79.9 Å²	79.9	58%	0.576	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-54.3	123.8	163.8	-72.8	172.3	0	0	0	107.8	D98 Y112	D98-L100 PolarHBondContact O-N 2.59Å; L100-Y112 HydrophobicContact CD1-CE2 3.72Å; L100-Y112 WeakPolarHBondContact CD1-OH 3.25Å; L100-Y112 HydrophobicContact CD2-CD2 4.25Å; L100-Y112 HydrophobicContact CD2-CE2 3.6Å; L100-Y112 HydrophobicContact CG-CE2 4.18Å
101	P	57.1	Low	68.7	Low	56 Å²	56	76.2 Å²	76.2	36%	0.364	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-63	136.3	-175	28.7	-36.4	0	0	0	108.2	R50 Q99 V103	R50-P101 VanDerWaalsContact CZ-CB 3.41Å; R50-P101 PolarHBondContact NH1-O 3.17Å; Q99-P101 VanDerWaalsContact O-N 3.17Å; P101-V103 PolarHBondContact O-N 2.94Å; P101-V103 VanDerWaalsContact O-N 3.13Å
102	P	61.9	Low	68.5	Low	64 Å²	64	79.9 Å²	79.9	42%	0.416	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-57	124.4	-172.8	22.3	-33.4	0	0	0	109.5	R50 K104	R50-P102 PolarHBondContact NH1-O 3.46Å; P102-K104 HydrophobicContact CB-CG 4.4Å; P102-K104 PolarHBondContact O-N 3.38Å
103	V	66	Low	68.6	Low	79 Å²	79	83.1 Å²	83.1	48%	0.479	44%	0.438	S	S	.	.			trans	-67.8	97.1	175.6	-179.2	0	0	0	0	107.4	P101 D108 T109	P101-V103 PolarHBondContact O-N 2.94Å; P101-V103 VanDerWaalsContact O-N 3.13Å; V103-D108 HydrophobicContact CG1-CB 4.47Å; V103-T109 HydrophobicContact CG1-CG2 4.33Å; V103-T109 WeakPolarHBondContact CG1-OG1 3.48Å
104	K	68.1	Low	68.6	Low	122 Å²	122	77.4 Å²	77.4	53%	0.53	42%	0.416	S	S	.	.			trans	-100.5	-25.3	178	-67.7	-172.5	-171.8	172.4	0	112.6	S49 R50 P102	S49-K104 PolarHBondContact O-NZ 3.02Å; R50-K104 HydrophobicContact CB-CD 4.27Å; R50-K104 PolarHBondContact O-NZ 2.82Å; P102-K104 HydrophobicContact CB-CG 4.4Å; P102-K104 PolarHBondContact O-N 3.38Å
105	D	68.7	Low	68.8	Low	81 Å²	81	72.6 Å²	72.6	43%	0.433	39%	0.394	S	S	.	.	S	Bend	trans	-135.7	152.2	-166.5	-169.3	12	0	0	0	111.6	Y107 D108 T109 R143	D105-Y107 PolarHBondContact O-N 2.76Å; D105-D108 WeakPolarHBondContact O-CA 3.45Å; D105-D108 VanDerWaalsContact O-CB 3.3Å; D105-D108 WeakPolarHBondContact O-CB 3.35Å; D105-D108 PolarHBondContact O-N 3.07Å; D105-T109 PolarHBondContact O-N 2.91Å; D105-T109 VanDerWaalsContact O-N 3.15Å; D105-T109 PolarHBondContact O-OG1 2.89Å; D105-R143 IonicContact OD2-NH1 2.98Å
106	C	74.9	Confident	69.3	Low	93 Å²	93	71.4 Å²	71.4	63%	0.628	38%	0.38	S	S	*	.	H	α-helix	trans	-56	-40.2	-177.7	-68	0	0	0	0	111.9	D108 T109 Y110	C106-D108 PolarHBondContact O-N 3.12Å; C106-T109 PolarHBondContact O-N 3.15Å; C106-Y110 WeakPolarHBondContact O-CD2 3.34Å; C106-Y110 PolarHBondContact O-N 3.36Å
107	Y	76.9	Confident	70	Confident	38 Å²	38	75 Å²	75	15%	0.149	39%	0.394	C	S	.	.	H	α-helix	trans	-64.4	-29	178.1	-176.7	-115.3	0	0	0	112	D105 Y110 I111 L140 R143	D105-Y107 PolarHBondContact O-N 2.76Å; Y107-Y110 PolarHBondContact O-N 3.23Å; Y107-I111 HydrophobicContact CD1-CD1 3.78Å; Y107-I111 HydrophobicContact CE1-CD1 3.27Å; Y107-I111 HydrophobicContact CE1-CG1 4.28Å; Y107-I111 HydrophobicContact CE2-CD1 4.2Å; Y107-I111 HydrophobicContact CE2-CG1 4.41Å; Y107-I111 HydrophobicContact CG-CD1 4.41Å; Y107-I111 WeakPolarHBondContact O-CG1 3.46Å; Y107-I111 PolarHBondContact O-N 3.39Å; Y107-L140 WeakPolarHBondContact OH-CG 3.43Å; Y107-L140 PolarHBondContact OH-O 3.05Å; Y107-L140 VanDerWaalsContact OH-O 3.09Å; Y107-R143 VanDerWaalsContact CB-NH2 3.31Å; Y107-R143 VanDerWaalsContact CD1-NH2 3.27Å
108	D	73.9	Confident	70.8	Confident	4 Å²	4	72.8 Å²	72.8	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-75.5	-43	178.4	-87.3	-38.8	0	0	0	111.1	R50 V103 D105 C106 Y110 I111 Y112 R143	R50-D108 IonicContact CZ-OD1 3.96Å; R50-D108 IonicContact CZ-OD2 2.82Å; R50-D108 IonicContact NE-OD1 2.89Å; R50-D108 IonicContact NE-OD2 3.24Å; R50-D108 PolarHBondContact NE-OD2 2.94Å; R50-D108 IonicContact NH1-OD1 3.94Å; R50-D108 PolarHBondContact NH1-OD1 3.42Å; R50-D108 IonicContact NH1-OD2 2.83Å; R50-D108 PolarHBondContact NH1-OD2 3.47Å; R50-D108 IonicContact NH2-OD1 2.94Å; R50-D108 PolarHBondContact NH2-OD1 3.17Å; R50-D108 IonicContact NH2-OD2 2.73Å; V103-D108 HydrophobicContact CG1-CB 4.47Å; D105-D108 WeakPolarHBondContact O-CA 3.45Å; D105-D108 VanDerWaalsContact O-CB 3.3Å; D105-D108 WeakPolarHBondContact O-CB 3.35Å; D105-D108 PolarHBondContact O-N 3.07Å; C106-D108 PolarHBondContact O-N 3.12Å; D108-Y110 PolarHBondContact O-N 3.17Å; D108-I111 PolarHBondContact O-N 2.74Å; D108-Y112 WeakPolarHBondContact O-CB 2.99Å; D108-Y112 PolarHBondContact O-N 3.42Å; D108-R143 VanDerWaalsContact CA-NH2 3.34Å; D108-R143 VanDerWaalsContact CG-NE 3.25Å; D108-R143 WeakPolarHBondContact OD1-CD 3.18Å; D108-R143 IonicContact OD1-CZ 3.56Å; D108-R143 IonicContact OD1-NE 3.62Å; D108-R143 PolarHBondContact OD1-NE 3.32Å; D108-R143 IonicContact OD1-NH1 3.61Å; D108-R143 IonicContact OD1-NH2 3.24Å; D108-R143 PolarHBondContact OD1-NH2 3.01Å; D108-R143 IonicContact OD2-CZ 2.7Å; D108-R143 IonicContact OD2-NE 3.49Å; D108-R143 PolarHBondContact OD2-NE 3.49Å; D108-R143 IonicContact OD2-NH1 3.02Å; D108-R143 PolarHBondContact OD2-NH1 3.45Å; D108-R143 IonicContact OD2-NH2 3.54Å; D108-R143 PolarHBondContact OD2-NH2 3.04Å; D108-R143 VanDerWaalsContact OD2-NH2 3.14Å
109	T	76.8	Confident	71.9	Confident	47 Å²	47	69.7 Å²	69.7	29%	0.288	36%	0.355	S	S	.	.	H	α-helix	trans	-56.6	-44.1	172.8	-41.5	0	0	0	0	110.1	V103 D105 C106 Y112 H113	V103-T109 HydrophobicContact CG1-CG2 4.33Å; V103-T109 WeakPolarHBondContact CG1-OG1 3.48Å; D105-T109 PolarHBondContact O-N 2.91Å; D105-T109 VanDerWaalsContact O-N 3.15Å; D105-T109 PolarHBondContact O-OG1 2.89Å; C106-T109 PolarHBondContact O-N 3.15Å; T109-Y112 PolarHBondContact O-N 3.42Å; T109-H113 WeakPolarHBondContact O-CB 3.38Å; T109-H113 PolarHBondContact O-CD2 3.37Å; T109-H113 VanDerWaalsContact O-CG 3.25Å; T109-H113 PolarHBondContact O-N 2.92Å
110	Y	78.3	Confident	73	Confident	77 Å²	77	65.3 Å²	65.3	30%	0.302	34%	0.336	S	S	.	.	H	α-helix	trans	-62.7	-48.5	177.7	-97	-74.2	0	0	0	112.9	C106 Y107 D108 Y112 H113 R114 R235	C106-Y110 WeakPolarHBondContact O-CD2 3.34Å; C106-Y110 PolarHBondContact O-N 3.36Å; Y107-Y110 PolarHBondContact O-N 3.23Å; D108-Y110 PolarHBondContact O-N 3.17Å; Y110-Y112 VanDerWaalsContact C-N 3.34Å; Y110-H113 PolarHBondContact O-N 3.24Å; Y110-R114 WeakPolarHBondContact O-CG 3.46Å; Y110-R114 PolarHBondContact O-N 3Å; Y110-R235 HydrophobicContact CE1-CB 4.42Å; Y110-R235 HydrophobicContact CE2-CB 4.18Å; Y110-R235 WeakPolarHBondContact OH-CD 3.49Å; Y110-R235 PolarHBondContact OH-NH1 3.5Å
111	I	77.1	Confident	73.9	Confident	13 Å²	13	66.1 Å²	66.1	7%	0.067	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-44.4	176	-72.4	173.1	0	0	0	110.6	Y107 D108 H113 R114 V115 L140 M141	Y107-I111 HydrophobicContact CD1-CD1 3.78Å; Y107-I111 HydrophobicContact CE1-CD1 3.27Å; Y107-I111 HydrophobicContact CE1-CG1 4.28Å; Y107-I111 HydrophobicContact CE2-CD1 4.2Å; Y107-I111 HydrophobicContact CE2-CG1 4.41Å; Y107-I111 HydrophobicContact CG-CD1 4.41Å; Y107-I111 WeakPolarHBondContact O-CG1 3.46Å; Y107-I111 PolarHBondContact O-N 3.39Å; D108-I111 PolarHBondContact O-N 2.74Å; I111-H113 PolarHBondContact O-N 3.15Å; I111-R114 WeakPolarHBondContact O-CB 3.11Å; I111-R114 PolarHBondContact O-N 2.87Å; I111-R114 VanDerWaalsContact O-N 3.15Å; I111-V115 HydrophobicContact CG2-CG2 4.12Å; I111-V115 WeakPolarHBondContact O-CG2 3.39Å; I111-V115 PolarHBondContact O-N 3.13Å; I111-L140 HydrophobicContact CD1-CD2 4.07Å; I111-L140 HydrophobicContact CG1-CD2 4.1Å; I111-M141 HydrophobicContact CD1-SD 4.46Å; I111-M141 HydrophobicContact CG2-CE 3.57Å; I111-M141 HydrophobicContact CG2-SD 3.46Å; I111-M141 WeakPolarHBondContact CG2-SD 3.22Å
112	Y	76.7	Confident	74.6	Confident	91 Å²	91	64.8 Å²	64.8	36%	0.357	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-45.8	-179.9	178.8	-103.3	0	0	0	111.3	L100 D108 T109 Y110 R114 V115 T116	L100-Y112 HydrophobicContact CD1-CE2 3.72Å; L100-Y112 WeakPolarHBondContact CD1-OH 3.25Å; L100-Y112 HydrophobicContact CD2-CD2 4.25Å; L100-Y112 HydrophobicContact CD2-CE2 3.6Å; L100-Y112 HydrophobicContact CG-CE2 4.18Å; D108-Y112 WeakPolarHBondContact O-CB 2.99Å; D108-Y112 PolarHBondContact O-N 3.42Å; T109-Y112 PolarHBondContact O-N 3.42Å; Y110-Y112 VanDerWaalsContact C-N 3.34Å; Y112-R114 VanDerWaalsContact C-N 3.33Å; Y112-R114 PolarHBondContact O-N 3.3Å; Y112-V115 PolarHBondContact O-N 3.23Å; Y112-T116 WeakPolarHBondContact O-CB 3.36Å; Y112-T116 PolarHBondContact O-N 2.79Å; Y112-T116 PolarHBondContact O-OG1 3.44Å
113	H	79.4	Confident	75.3	Confident	108 Å²	108	70.3 Å²	70.3	50%	0.5	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-43.3	173.6	-74.7	-169.2	0	0	0	111.5	T109 Y110 I111 T116 L117	T109-H113 WeakPolarHBondContact O-CB 3.38Å; T109-H113 PolarHBondContact O-CD2 3.37Å; T109-H113 VanDerWaalsContact O-CG 3.25Å; T109-H113 PolarHBondContact O-N 2.92Å; Y110-H113 PolarHBondContact O-N 3.24Å; I111-H113 PolarHBondContact O-N 3.15Å; H113-T116 PolarHBondContact O-N 3.35Å; H113-L117 WeakPolarHBondContact O-CB 3.42Å; H113-L117 VanDerWaalsContact O-CG 3.22Å; H113-L117 WeakPolarHBondContact O-CG 3.46Å; H113-L117 PolarHBondContact O-N 2.9Å
114	R	75.1	Confident	75.8	Confident	22 Å²	22	73.2 Å²	73.2	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-46.9	177.4	-77.3	178.4	171.4	172.9	-6.1	113.2	Y110 I111 Y112 T116 L117 E118 E200 G236	Y110-R114 WeakPolarHBondContact O-CG 3.46Å; Y110-R114 PolarHBondContact O-N 3Å; I111-R114 WeakPolarHBondContact O-CB 3.11Å; I111-R114 PolarHBondContact O-N 2.87Å; I111-R114 VanDerWaalsContact O-N 3.15Å; Y112-R114 VanDerWaalsContact C-N 3.33Å; Y112-R114 PolarHBondContact O-N 3.3Å; R114-T116 PolarHBondContact O-N 2.84Å; R114-L117 PolarHBondContact O-N 2.96Å; R114-E118 WeakPolarHBondContact O-CB 3.41Å; R114-E118 PolarHBondContact O-N 3.49Å; R114-E200 IonicContact CZ-OE1 2.76Å; R114-E200 IonicContact CZ-OE2 3.58Å; R114-E200 IonicContact NE-OE1 3.96Å; R114-E200 PolarHBondContact NE-OE1 3.39Å; R114-E200 VanDerWaalsContact NE-OE1 3.15Å; R114-E200 IonicContact NE-OE2 2.74Å; R114-E200 PolarHBondContact NE-OE2 3.39Å; R114-E200 IonicContact NH1-OE2 2.97Å; R114-E200 VanDerWaalsContact NH2-CD 3.28Å; R114-E200 IonicContact NH2-OE1 3.7Å; R114-E200 PolarHBondContact NH2-OE1 2.95Å; R114-E200 IonicContact NH2-OE2 2.84Å; R114-E200 PolarHBondContact NH2-OE2 2.75Å; R114-G236 PolarHBondContact NH1-O 2.85Å; R114-G236 VanDerWaalsContact NH1-O 3.15Å
115	V	76.7	Confident	75.8	Confident	13 Å²	13	74.8 Å²	74.8	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-63.8	-35.9	178.3	173.5	0	0	0	0	110.5	I111 Y112 K119 F136 M141	I111-V115 HydrophobicContact CG2-CG2 4.12Å; I111-V115 WeakPolarHBondContact O-CG2 3.39Å; I111-V115 PolarHBondContact O-N 3.13Å; Y112-V115 PolarHBondContact O-N 3.23Å; V115-K119 WeakPolarHBondContact O-CB 3.45Å; V115-K119 VanDerWaalsContact O-CG 3.3Å; V115-K119 WeakPolarHBondContact O-CG 3.27Å; V115-K119 PolarHBondContact O-N 2.66Å; V115-F136 HydrophobicContact CG2-CD2 4.48Å; V115-F136 HydrophobicContact CG2-CE2 4.17Å; V115-M141 HydrophobicContact CG2-CE 4.13Å
116	T	78.9	Confident	75.7	Confident	45 Å²	45	77.9 Å²	77.9	28%	0.276	37%	0.365	S	S	.	.	H	α-helix	trans	-68.6	-48.1	176	-53.4	0	0	0	0	111.1	Y112 H113 R114 E118 K119 D120	Y112-T116 WeakPolarHBondContact O-CB 3.36Å; Y112-T116 PolarHBondContact O-N 2.79Å; Y112-T116 PolarHBondContact O-OG1 3.44Å; H113-T116 PolarHBondContact O-N 3.35Å; R114-T116 PolarHBondContact O-N 2.84Å; T116-E118 VanDerWaalsContact C-N 3.29Å; T116-E118 PolarHBondContact O-N 3.25Å; T116-K119 WeakPolarHBondContact O-CB 3.4Å; T116-K119 PolarHBondContact O-N 3.36Å; T116-K119 VanDerWaalsContact O-N 3.16Å; T116-D120 PolarHBondContact O-N 3.14Å
117	L	79.1	Confident	75.2	Confident	107 Å²	107	77.4 Å²	77.4	56%	0.56	35%	0.354	S	S	*	.	H	α-helix	trans	-59.7	-38.4	176	-74.3	167.3	0	0	0	112.5	H113 R114 D120 R121	H113-L117 WeakPolarHBondContact O-CB 3.42Å; H113-L117 VanDerWaalsContact O-CG 3.22Å; H113-L117 WeakPolarHBondContact O-CG 3.46Å; H113-L117 PolarHBondContact O-N 2.9Å; R114-L117 PolarHBondContact O-N 2.96Å; L117-D120 PolarHBondContact O-N 2.98Å; L117-R121 WeakPolarHBondContact O-CG 3.2Å; L117-R121 PolarHBondContact O-N 3.47Å
118	E	75.3	Confident	74.2	Confident	42 Å²	42	82.2 Å²	82.2	20%	0.196	39%	0.387	C	S	.	.	H	α-helix	trans	-71.5	-36.9	177.4	-165.8	61.1	-161.8	0	0	111.7	R114 T116 D120 R121 Q122 P132 F136	R114-E118 WeakPolarHBondContact O-CB 3.41Å; R114-E118 PolarHBondContact O-N 3.49Å; T116-E118 VanDerWaalsContact C-N 3.29Å; T116-E118 PolarHBondContact O-N 3.25Å; E118-D120 VanDerWaalsContact C-N 3.31Å; E118-D120 PolarHBondContact O-N 2.94Å; E118-R121 PolarHBondContact O-N 3.19Å; E118-R121 IonicContact OE2-NH1 3.92Å; E118-Q122 WeakPolarHBondContact O-CB 3.42Å; E118-Q122 VanDerWaalsContact O-CG 3.3Å; E118-Q122 WeakPolarHBondContact O-CG 3.44Å; E118-Q122 PolarHBondContact O-N 2.93Å; E118-P132 HydrophobicContact CG-CB 4.4Å; E118-F136 HydrophobicContact CB-CE2 4.44Å; E118-F136 HydrophobicContact CB-CZ 4.22Å; E118-F136 HydrophobicContact CG-CZ 4.36Å
119	K	76.4	Confident	73.3	Confident	92 Å²	92	89.6 Å²	89.6	40%	0.4	43%	0.427	S	S	.	.	H	α-helix	trans	-59.6	-42.4	170.6	-80.3	176.4	177	-171	0	111.8	V115 T116 Q122 R123 P132	V115-K119 WeakPolarHBondContact O-CB 3.45Å; V115-K119 VanDerWaalsContact O-CG 3.3Å; V115-K119 WeakPolarHBondContact O-CG 3.27Å; V115-K119 PolarHBondContact O-N 2.66Å; T116-K119 WeakPolarHBondContact O-CB 3.4Å; T116-K119 PolarHBondContact O-N 3.36Å; T116-K119 VanDerWaalsContact O-N 3.16Å; K119-Q122 PolarHBondContact O-N 3.33Å; K119-R123 WeakPolarHBondContact O-CG 3.45Å; K119-R123 PolarHBondContact O-N 3.09Å; K119-P132 HydrophobicContact CD-CG 4.35Å; K119-P132 HydrophobicContact CG-CB 3.98Å; K119-P132 HydrophobicContact CG-CG 3.63Å
120	D	80.2	Confident	72.5	Confident	67 Å²	67	92.8 Å²	92.8	36%	0.358	44%	0.437	S	S	.	.	H	α-helix	trans	-66.7	-42.4	178.1	-66	-26.6	0	0	0	111	T116 L117 E118 Q122 R123 D124	T116-D120 PolarHBondContact O-N 3.14Å; L117-D120 PolarHBondContact O-N 2.98Å; E118-D120 VanDerWaalsContact C-N 3.31Å; E118-D120 PolarHBondContact O-N 2.94Å; D120-Q122 VanDerWaalsContact C-N 3.33Å; D120-Q122 PolarHBondContact O-N 3.15Å; D120-R123 WeakPolarHBondContact O-CB 3.44Å; D120-R123 PolarHBondContact O-N 2.88Å; D120-R123 IonicContact OD1-NH1 3.85Å; D120-D124 PolarHBondContact O-N 2.77Å
121	R	75.3	Confident	71.6	Confident	128 Å²	128	92.8 Å²	92.8	48%	0.483	44%	0.442	S	S	.	.	H	α-helix	trans	-61.8	-37.1	173	-75.8	176.1	169.9	-176.6	-3.4	113.6	L117 E118 D124 R125	L117-R121 WeakPolarHBondContact O-CG 3.2Å; L117-R121 PolarHBondContact O-N 3.47Å; E118-R121 PolarHBondContact O-N 3.19Å; E118-R121 IonicContact OE2-NH1 3.92Å; R121-D124 PolarHBondContact O-N 3.06Å; R121-R125 WeakPolarHBondContact O-CG 3.45Å; R121-R125 PolarHBondContact O-N 3.37Å; R121-R125 VanDerWaalsContact O-N 3.11Å
122	Q	72	Confident	70.7	Confident	27 Å²	27	92.9 Å²	92.9	13%	0.126	44%	0.443	C	S	.	.	H	α-helix	trans	-68.1	-38.9	176	-76.8	-178.8	-19.9	0	0	111.8	E118 K119 D120 D124 R125 N126 E127 K130	E118-Q122 WeakPolarHBondContact O-CB 3.42Å; E118-Q122 VanDerWaalsContact O-CG 3.3Å; E118-Q122 WeakPolarHBondContact O-CG 3.44Å; E118-Q122 PolarHBondContact O-N 2.93Å; K119-Q122 PolarHBondContact O-N 3.33Å; D120-Q122 VanDerWaalsContact C-N 3.33Å; D120-Q122 PolarHBondContact O-N 3.15Å; Q122-D124 VanDerWaalsContact C-N 3.35Å; Q122-R125 PolarHBondContact O-N 3.26Å; Q122-N126 PolarHBondContact O-N 3.11Å; Q122-E127 PolarHBondContact O-N 3.38Å; Q122-K130 PolarHBondContact NE2-O 3.42Å; Q122-K130 PolarHBondContact OE1-O 3.17Å
123	R	75.1	Confident	69.9	Low	181 Å²	181	93.5 Å²	93.5	68%	0.683	45%	0.448	S	S	*	.	H	α-helix	trans	-60.1	-45.6	172.3	-74.7	171.3	170.9	-178.1	-5.6	111	K119 D120 R125 N126	K119-R123 WeakPolarHBondContact O-CG 3.45Å; K119-R123 PolarHBondContact O-N 3.09Å; D120-R123 WeakPolarHBondContact O-CB 3.44Å; D120-R123 PolarHBondContact O-N 2.88Å; D120-R123 IonicContact OD1-NH1 3.85Å; R123-R125 PolarHBondContact O-N 2.52Å; R123-N126 PolarHBondContact O-N 3.15Å
124	D	76	Confident	69.1	Low	140 Å²	140	96.1 Å²	96.1	75%	0.749	46%	0.458	S	S	*	.	H	α-helix	trans	-63.4	-28.7	177	-67.7	-19.2	0	0	0	112.9	D120 R121 Q122	D120-D124 PolarHBondContact O-N 2.77Å; R121-D124 PolarHBondContact O-N 3.06Å; Q122-D124 VanDerWaalsContact C-N 3.35Å
125	R	69.5	Low	68.6	Low	154 Å²	154	98 Å²	98	58%	0.581	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	0.6	178.9	-71.8	176.7	177	-172.5	-2.6	114.3	R121 Q122 R123 E127 E220	R121-R125 WeakPolarHBondContact O-CG 3.45Å; R121-R125 PolarHBondContact O-N 3.37Å; R121-R125 VanDerWaalsContact O-N 3.11Å; Q122-R125 PolarHBondContact O-N 3.26Å; R123-R125 PolarHBondContact O-N 2.52Å; R125-E127 HydrophobicContact CB-CG 4.49Å; R125-E127 PolarHBondContact O-N 3.39Å; R125-E127 VanDerWaalsContact O-N 3.08Å; R125-E220 IonicContact NH2-OE1 2.92Å
126	N	65.7	Low	68.5	Low	146 Å²	146	98.3 Å²	98.3	78%	0.781	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	23.5	-173.3	-74.2	-23	0	0	0	114.3	Q122 R123 T128	Q122-N126 PolarHBondContact O-N 3.11Å; R123-N126 PolarHBondContact O-N 3.15Å; N126-T128 PolarHBondContact O-N 3.27Å
127	E	63.8	Low	68.3	Low	84 Å²	84	98 Å²	98	39%	0.393	48%	0.477	S	S	.	.			trans	-95.5	84.7	174.6	-70.2	-164.8	155.5	0	0	109.1	Q122 R125 D129 K130	Q122-E127 PolarHBondContact O-N 3.38Å; R125-E127 HydrophobicContact CB-CG 4.49Å; R125-E127 PolarHBondContact O-N 3.39Å; R125-E127 VanDerWaalsContact O-N 3.08Å; E127-D129 VanDerWaalsContact C-N 3.28Å; E127-D129 PolarHBondContact O-N 3.15Å; E127-K130 IonicContact OE1-NZ 3.97Å; E127-K130 PolarHBondContact OE1-NZ 2.61Å; E127-K130 IonicContact OE2-NZ 2.82Å; E127-K130 PolarHBondContact OE2-NZ 3.4Å
128	T	57.5	Low	68.1	Low	139 Å²	139	95.3 Å²	95.3	85%	0.853	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.7	179.4	44.3	0	0	0	0	114.4	N126	N126-T128 PolarHBondContact O-N 3.27Å
129	D	54.4	Low	68.1	Low	158 Å²	158	96.3 Å²	96.3	85%	0.845	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	2.5	-163.2	-129	14.7	0	0	0	114.9	E127	E127-D129 VanDerWaalsContact C-N 3.28Å; E127-D129 PolarHBondContact O-N 3.15Å
130	K	59	Low	68.2	Low	115 Å²	115	92.1 Å²	92.1	50%	0.5	46%	0.457	S	S	.	.	S	Bend	trans	-112.8	114.8	178.3	-67.1	179.3	-165.7	151.8	0	110.2	Q122 E127 P132	Q122-K130 PolarHBondContact NE2-O 3.42Å; Q122-K130 PolarHBondContact OE1-O 3.17Å; E127-K130 IonicContact OE1-NZ 3.97Å; E127-K130 PolarHBondContact OE1-NZ 2.61Å; E127-K130 IonicContact OE2-NZ 2.82Å; E127-K130 PolarHBondContact OE2-NZ 3.4Å; K130-P132 VanDerWaalsContact O-N 3.12Å
131	D	59.4	Low	68	Low	76 Å²	76	91.8 Å²	91.8	41%	0.406	45%	0.454	S	S	.	.			trans	-52.2	122.5	172.6	-63.5	-55.5	0	0	0	110.2	K133 K134	D131-K133 PolarHBondContact O-N 2.86Å; D131-K134 HydrophobicContact CB-CD 4.04Å; D131-K134 HydrophobicContact CB-CG 4.08Å; D131-K134 WeakPolarHBondContact O-CB 3.19Å; D131-K134 PolarHBondContact O-N 3.05Å; D131-K134 VanDerWaalsContact OD2-CE 3.29Å; D131-K134 WeakPolarHBondContact OD2-CE 3.33Å; D131-K134 IonicContact OD2-NZ 2.82Å; D131-K134 PolarHBondContact OD2-NZ 2.94Å
132	P	59	Low	68	Low	16 Å²	16	87.1 Å²	87.1	10%	0.104	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-59.3	-24.1	-179	24.3	-35.7	0	0	0	111.7	E118 K119 K130 F136	E118-P132 HydrophobicContact CG-CB 4.4Å; K119-P132 HydrophobicContact CD-CG 4.35Å; K119-P132 HydrophobicContact CG-CB 3.98Å; K119-P132 HydrophobicContact CG-CG 3.63Å; K130-P132 VanDerWaalsContact O-N 3.12Å; P132-F136 WeakPolarHBondContact O-CD2 3.08Å; P132-F136 WeakPolarHBondContact O-CE2 3.3Å
133	K	60.3	Low	68.3	Low	104 Å²	104	88.6 Å²	88.6	45%	0.452	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-72.4	-24.5	178.9	-64.8	-178.6	179.9	177.3	0	113.3	D131 A135 F136	D131-K133 PolarHBondContact O-N 2.86Å; K133-A135 PolarHBondContact O-N 2.89Å; K133-F136 PolarHBondContact O-N 2.68Å
134	K	62.3	Low	68.8	Low	163 Å²	163	80.7 Å²	80.7	71%	0.709	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-69.7	-17.6	179.5	-77.3	172.3	176.6	149	0	112.9	D131 F136	D131-K134 HydrophobicContact CB-CD 4.04Å; D131-K134 HydrophobicContact CB-CG 4.08Å; D131-K134 WeakPolarHBondContact O-CB 3.19Å; D131-K134 PolarHBondContact O-N 3.05Å; D131-K134 VanDerWaalsContact OD2-CE 3.29Å; D131-K134 WeakPolarHBondContact OD2-CE 3.33Å; D131-K134 IonicContact OD2-NZ 2.82Å; D131-K134 PolarHBondContact OD2-NZ 2.94Å; K134-F136 VanDerWaalsContact C-N 3.31Å
135	A	65.1	Low	69.2	Low	61 Å²	61	76.1 Å²	76.1	50%	0.504	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-72.8	-24.9	175.4	0	0	0	0	0	112.8	K133	K133-A135 PolarHBondContact O-N 2.89Å
136	F	73.8	Confident	70.1	Confident	20 Å²	20	69.2 Å²	69.2	9%	0.088	36%	0.361	C	S	.	.	S	Bend	trans	-99.5	138.4	-177.6	-53.5	-66.5	0	0	0	110.7	V115 E118 P132 K133 K134 A138 M141 Y202	V115-F136 HydrophobicContact CG2-CD2 4.48Å; V115-F136 HydrophobicContact CG2-CE2 4.17Å; E118-F136 HydrophobicContact CB-CE2 4.44Å; E118-F136 HydrophobicContact CB-CZ 4.22Å; E118-F136 HydrophobicContact CG-CZ 4.36Å; P132-F136 WeakPolarHBondContact O-CD2 3.08Å; P132-F136 WeakPolarHBondContact O-CE2 3.3Å; K133-F136 PolarHBondContact O-N 2.68Å; K134-F136 VanDerWaalsContact C-N 3.31Å; F136-A138 PolarHBondContact O-N 3.21Å; F136-M141 HydrophobicContact CB-CG 4.49Å; F136-Y202 HydrophobicContact CD1-CD2 4.33Å; F136-Y202 AromaticContact CD1-CE2 3.45Å; F136-Y202 HydrophobicContact CD1-CE2 3.45Å; F136-Y202 VanDerWaalsContact CD1-CE2 3.45Å; F136-Y202 AromaticContact CD1-CZ 3.59Å; F136-Y202 WeakPolarHBondContact CD1-OH 3.32Å; F136-Y202 AromaticContact CE1-CE2 3.8Å; F136-Y202 HydrophobicContact CE1-CE2 3.8Å; F136-Y202 AromaticContact CE1-CZ 3.77Å; F136-Y202 WeakPolarHBondContact CE1-OH 3.11Å
137	P	75	Confident	71.3	Confident	39 Å²	39	62.7 Å²	62.7	25%	0.253	33%	0.325	S	S	.	.			trans	-56.7	132.8	171.6	-24.2	33.7	0	0	0	110.9	E139 L140 Y202	P137-E139 PolarHBondContact O-N 3.05Å; P137-E139 VanDerWaalsContact O-N 3.1Å; P137-L140 WeakPolarHBondContact O-CB 3.32Å; P137-L140 PolarHBondContact O-N 2.79Å; P137-Y202 HydrophobicContact CG-CG 4.33Å
138	A	74.8	Confident	72.5	Confident	50 Å²	50	58.7 Å²	58.7	41%	0.413	31%	0.306	S	S	.	.	H	α-helix	trans	-54.9	-33.7	179.5	0	0	0	0	0	112.1	F136 L140 M141 R142	F136-A138 PolarHBondContact O-N 3.21Å; A138-L140 PolarHBondContact O-N 3.1Å; A138-M141 PolarHBondContact O-N 3.36Å; A138-R142 VanDerWaalsContact O-CG 3.3Å; A138-R142 WeakPolarHBondContact O-CG 3.36Å; A138-R142 PolarHBondContact O-N 2.89Å
139	E	75.9	Confident	73.9	Confident	63 Å²	63	55.4 Å²	55.4	29%	0.294	28%	0.28	S	S	.	.	H	α-helix	trans	-57.9	-30.4	176.1	-65.1	-177.1	173.6	0	0	114.1	P137 V189 K238	P137-E139 PolarHBondContact O-N 3.05Å; P137-E139 VanDerWaalsContact O-N 3.1Å; E139-V189 HydrophobicContact CB-CG2 4Å; E139-K238 WeakPolarHBondContact O-CD 3.48Å; E139-K238 PolarHBondContact O-NZ 2.92Å
140	L	78.7	Confident	75.3	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-74.2	-36.9	176.8	-170.2	145.8	0	0	0	111	Y107 I111 P137 A138 V189 Y202	Y107-L140 WeakPolarHBondContact OH-CG 3.43Å; Y107-L140 PolarHBondContact OH-O 3.05Å; Y107-L140 VanDerWaalsContact OH-O 3.09Å; I111-L140 HydrophobicContact CD1-CD2 4.07Å; I111-L140 HydrophobicContact CG1-CD2 4.1Å; P137-L140 WeakPolarHBondContact O-CB 3.32Å; P137-L140 PolarHBondContact O-N 2.79Å; A138-L140 PolarHBondContact O-N 3.1Å; L140-V189 HydrophobicContact CB-CG2 4.48Å; L140-V189 HydrophobicContact CD1-CG1 3.96Å; L140-Y202 HydrophobicContact CD1-CD1 3.49Å; L140-Y202 VanDerWaalsContact CD1-CD1 3.49Å; L140-Y202 HydrophobicContact CD1-CE1 3.71Å; L140-Y202 HydrophobicContact CD1-CG 4.33Å
141	M	75.2	Confident	76.3	Confident	61 Å²	61	44 Å²	44	30%	0.3	23%	0.226	S	C	.	.	H	α-helix	trans	-79.9	-26.5	179.2	-61.2	-61.4	-71.4	0	0	112.8	I111 V115 F136 A138 R143	I111-M141 HydrophobicContact CD1-SD 4.46Å; I111-M141 HydrophobicContact CG2-CE 3.57Å; I111-M141 HydrophobicContact CG2-SD 3.46Å; I111-M141 WeakPolarHBondContact CG2-SD 3.22Å; V115-M141 HydrophobicContact CG2-CE 4.13Å; F136-M141 HydrophobicContact CB-CG 4.49Å; A138-M141 PolarHBondContact O-N 3.36Å; M141-R143 PolarHBondContact O-N 2.79Å
142	R	76.1	Confident	76.9	Confident	30 Å²	30	45 Å²	45	11%	0.113	24%	0.239	C	C	.	.			trans	-63.9	117.9	177.5	-78.9	173.2	-171	171.4	5.7	110.7	D89 A138 K238	D89-R142 WeakPolarHBondContact OD1-CG 3.48Å; D89-R142 IonicContact OD1-NE 3.62Å; D89-R142 IonicContact OD2-CZ 3.56Å; D89-R142 VanDerWaalsContact OD2-CZ 3.24Å; D89-R142 IonicContact OD2-NE 3.98Å; D89-R142 PolarHBondContact OD2-NE 2.85Å; D89-R142 IonicContact OD2-NH2 2.64Å; D89-R142 PolarHBondContact OD2-NH2 2.86Å; A138-R142 VanDerWaalsContact O-CG 3.3Å; A138-R142 WeakPolarHBondContact O-CG 3.36Å; A138-R142 PolarHBondContact O-N 2.89Å; R142-K238 PolarHBondContact O-NZ 2.76Å
143	R	77.3	Confident	77.3	Confident	57 Å²	57	47.6 Å²	47.6	22%	0.215	27%	0.269	C	S	.	.			trans	-107.4	-6.1	173.5	-78.8	-177.8	158.1	-115.4	3.3	114.4	D105 Y107 D108 M141	D105-R143 IonicContact OD2-NH1 2.98Å; Y107-R143 VanDerWaalsContact CB-NH2 3.31Å; Y107-R143 VanDerWaalsContact CD1-NH2 3.27Å; D108-R143 VanDerWaalsContact CA-NH2 3.34Å; D108-R143 VanDerWaalsContact CG-NE 3.25Å; D108-R143 WeakPolarHBondContact OD1-CD 3.18Å; D108-R143 IonicContact OD1-CZ 3.56Å; D108-R143 IonicContact OD1-NE 3.62Å; D108-R143 PolarHBondContact OD1-NE 3.32Å; D108-R143 IonicContact OD1-NH1 3.61Å; D108-R143 IonicContact OD1-NH2 3.24Å; D108-R143 PolarHBondContact OD1-NH2 3.01Å; D108-R143 IonicContact OD2-CZ 2.7Å; D108-R143 IonicContact OD2-NE 3.49Å; D108-R143 PolarHBondContact OD2-NE 3.49Å; D108-R143 IonicContact OD2-NH1 3.02Å; D108-R143 PolarHBondContact OD2-NH1 3.45Å; D108-R143 IonicContact OD2-NH2 3.54Å; D108-R143 PolarHBondContact OD2-NH2 3.04Å; D108-R143 VanDerWaalsContact OD2-NH2 3.14Å; M141-R143 PolarHBondContact O-N 2.79Å
144	F	84.9	Confident	77.9	Confident	15 Å²	15	44.7 Å²	44.7	7%	0.066	26%	0.257	C	S	.	.			trans	-107.9	157.4	175.8	66.3	-86.1	0	0	0	110.4	V47 Q53 F55 A85 V88 D89 I92 V146	V47-F144 HydrophobicContact CG1-CB 3.58Å; V47-F144 HydrophobicContact CG1-CD1 3.69Å; V47-F144 HydrophobicContact CG1-CG 3.72Å; Q53-F144 CarbonylContact O-C 3.59Å; Q53-F144 WeakPolarHBondContact O-CA 3.41Å; Q53-F144 WeakPolarHBondContact O-CB 3.42Å; F55-F144 HydrophobicContact CB-CD2 4.41Å; A85-F144 HydrophobicContact CB-CE2 4.49Å; V88-F144 HydrophobicContact CB-CE2 3.73Å; V88-F144 HydrophobicContact CB-CZ 3.66Å; V88-F144 HydrophobicContact CG1-CD2 4.18Å; V88-F144 HydrophobicContact CG1-CE1 3.96Å; V88-F144 HydrophobicContact CG1-CE2 3.49Å; V88-F144 VanDerWaalsContact CG1-CE2 3.49Å; V88-F144 HydrophobicContact CG1-CZ 3.38Å; V88-F144 HydrophobicContact CG2-CE2 4.46Å; D89-F144 VanDerWaalsContact OD1-CE1 3.25Å; D89-F144 WeakPolarHBondContact OD1-CE1 3.39Å; D89-F144 WeakPolarHBondContact OD1-CZ 2.87Å; I92-F144 HydrophobicContact CD1-CD1 3.97Å; I92-F144 HydrophobicContact CD1-CE1 3.62Å; I92-F144 HydrophobicContact CD1-CZ 4.35Å; F144-V146 HydrophobicContact CD2-CG2 3.96Å; F144-V146 HydrophobicContact CE2-CG2 3.75Å
145	E	86.4	Confident	78.8	Confident	44 Å²	44	43 Å²	43	21%	0.206	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.3	176	-65.7	171.5	158.8	0	0	107.9	Q53 F55 Y147 V240 G269 E270	Q53-E145 PolarHBondContact O-N 3.39Å; F55-E145 PolarHBondContact N-O 3.27Å; E145-Y147 HydrophobicContact CB-CE2 4.14Å; E145-Y147 PolarHBondContact OE2-OH 3.27Å; E145-V240 VanDerWaalsContact OE1-CG1 3.27Å; E145-V240 WeakPolarHBondContact OE1-CG1 3.36Å; E145-G269 VanDerWaalsContact OE1-CA 3.32Å; E145-G269 WeakPolarHBondContact OE1-CA 3.48Å; E145-G269 WeakPolarHBondContact OE2-CA 3.23Å; E145-E270 PolarHBondContact OE2-N 2.72Å
146	V	87.9	Confident	79.8	Confident	10 Å²	10	43 Å²	43	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.4	179.1	179.4	0	0	0	0	108.5	F55 I57 V81 F84 A85 F144	F55-V146 HydrophobicContact CB-CG2 4.36Å; F55-V146 HydrophobicContact CD1-CG1 4.31Å; F55-V146 HydrophobicContact CD1-CG2 4.29Å; F55-V146 WeakPolarHBondContact O-CA 3.3Å; I57-V146 HydrophobicContact CD1-CG1 3.69Å; I57-V146 HydrophobicContact CG1-CG1 4.34Å; V81-V146 HydrophobicContact CG1-CB 4.43Å; F84-V146 HydrophobicContact CB-CG1 4.26Å; A85-V146 HydrophobicContact CB-CG2 4.19Å; F144-V146 HydrophobicContact CD2-CG2 3.96Å; F144-V146 HydrophobicContact CE2-CG2 3.75Å
147	Y	90.7	Very high	80.4	Confident	9 Å²	9	43.7 Å²	43.7	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.9	175.7	-61.4	-60	0	0	0	110.6	C54 F55 V56 I57 E145 S268 N271 H311	C54-Y147 HydrophobicContact CB-CD2 4.22Å; C54-Y147 HydrophobicContact CB-CE2 4.24Å; F55-Y147 PolarHBondContact O-N 3.25Å; V56-Y147 WeakPolarHBondContact CA-O 3.2Å; I57-Y147 PolarHBondContact N-O 2.99Å; E145-Y147 HydrophobicContact CB-CE2 4.14Å; E145-Y147 PolarHBondContact OE2-OH 3.27Å; Y147-S268 PolarHBondContact OH-O 3.13Å; Y147-N271 WeakPolarHBondContact CE2-ND2 3.48Å; Y147-N271 VanDerWaalsContact CZ-ND2 3.34Å; Y147-H311 WeakPolarHBondContact CB-O 3.13Å; Y147-H311 HydrophobicContact CD1-CB 4.24Å; Y147-H311 WeakPolarHBondContact CD1-O 3.29Å
148	F	89.7	Confident	81	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	129.5	172.6	-68.2	-64.2	0	0	0	110.2	I57 L59 I73 V81 F84 L170 H311	I57-F148 HydrophobicContact CB-CD1 3.93Å; I57-F148 HydrophobicContact CB-CE1 4.12Å; I57-F148 HydrophobicContact CD1-CD1 4.39Å; I57-F148 HydrophobicContact CD1-CE1 3.79Å; I57-F148 HydrophobicContact CG2-CD1 4.26Å; I57-F148 HydrophobicContact CG2-CE1 4.26Å; L59-F148 HydrophobicContact CD1-CB 4.45Å; L59-F148 HydrophobicContact CD2-CD1 3.88Å; L59-F148 HydrophobicContact CD2-CE1 4.43Å; L59-F148 HydrophobicContact CD2-CG 4.49Å; L59-F148 HydrophobicContact CG-CB 4.46Å; L59-F148 HydrophobicContact CG-CD1 4.47Å; I73-F148 HydrophobicContact CD1-CE1 4.47Å; I73-F148 HydrophobicContact CG2-CD1 4.37Å; I73-F148 HydrophobicContact CG2-CD2 4.17Å; I73-F148 HydrophobicContact CG2-CE1 4.24Å; I73-F148 HydrophobicContact CG2-CE2 4Å; I73-F148 HydrophobicContact CG2-CG 4.36Å; I73-F148 HydrophobicContact CG2-CZ 4.06Å; V81-F148 HydrophobicContact CB-CE2 4.33Å; V81-F148 HydrophobicContact CG2-CD2 3.81Å; V81-F148 HydrophobicContact CG2-CE2 3.44Å; V81-F148 VanDerWaalsContact CG2-CE2 3.44Å; F84-F148 HydrophobicContact CD2-CE1 4.17Å; F84-F148 AromaticContact CD2-CZ 3.72Å; F84-F148 HydrophobicContact CD2-CZ 3.72Å; F84-F148 HydrophobicContact CE2-CE1 4.26Å; F84-F148 HydrophobicContact CE2-CZ 4.11Å; F84-F148 HydrophobicContact CG-CZ 4.26Å; F148-L170 HydrophobicContact CB-CD2 4.31Å; F148-H311 AromaticContact CD2-ND1 3.94Å
149	K	86.7	Confident	81.8	Confident	70 Å²	70	40.6 Å²	40.6	30%	0.304	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131.6	169.5	-179.9	-178.7	169.4	-152.6	0	108.6	V56 I57 D58 L59	V56-K149 HydrophobicContact CG1-CB 3.99Å; I57-K149 PolarHBondContact O-N 3.34Å; D58-K149 WeakPolarHBondContact OD2-CD 3.36Å; D58-K149 WeakPolarHBondContact OD2-CE 3.44Å; D58-K149 IonicContact OD2-NZ 3.45Å; D58-K149 PolarHBondContact OD2-NZ 3.25Å; L59-K149 VanDerWaalsContact CB-O 3.3Å; L59-K149 WeakPolarHBondContact CB-O 3.02Å; L59-K149 VanDerWaalsContact CG-O 3.23Å; L59-K149 WeakPolarHBondContact CG-O 3.3Å; L59-K149 PolarHBondContact N-O 3.05Å
150	P	83.7	Confident	82.4	Confident	13 Å²	13	40.4 Å²	40.4	8%	0.084	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-66.7	153.2	-175.4	30.9	-36.5	0	0	0	111.3	Q154 T172 T284	P150-Q154 VanDerWaalsContact CB-OE1 3.29Å; P150-T172 HydrophobicContact CB-CG2 3.65Å; P150-T172 HydrophobicContact CG-CG2 3.76Å; P150-T284 HydrophobicContact CB-CG2 3.94Å; P150-T284 HydrophobicContact CG-CG2 3.93Å; P150-T284 WeakPolarHBondContact CG-OG1 3.48Å
151	P	78.9	Confident	82.9	Confident	19 Å²	19	45 Å²	45	12%	0.123	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-67.1	149.7	171.9	29.9	-31.7	0	0	0	109.9	L59 K60 G153 Q154	L59-P151 HydrophobicContact CB-CB 4.41Å; L59-P151 HydrophobicContact CB-CG 4.45Å; K60-P151 HydrophobicContact CG-CB 4.41Å; P151-G153 PolarHBondContact O-N 2.82Å; P151-G153 VanDerWaalsContact O-N 3.09Å; P151-Q154 HydrophobicContact CG-CB 4.14Å; P151-Q154 PolarHBondContact O-N 3.42Å; P151-Q154 VanDerWaalsContact O-N 3.08Å
152	S	72.4	Confident	83.5	Confident	98 Å²	98	43.2 Å²	43.2	69%	0.685	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.4	-177.6	-89.1	0	0	0	0	114.4	K60	K60-S152 WeakPolarHBondContact CE-OG 3.47Å; K60-S152 PolarHBondContact NZ-OG 2.92Å
153	G	67.8	Low	84	Confident	70 Å²	70	48.4 Å²	48.4	72%	0.722	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-1.2	177.8	0	0	0	0	0	114.7	P151 D155	P151-G153 PolarHBondContact O-N 2.82Å; P151-G153 VanDerWaalsContact O-N 3.09Å; G153-D155 PolarHBondContact O-N 3.02Å
154	Q	73.6	Confident	84.4	Confident	44 Å²	44	49.8 Å²	49.8	21%	0.206	29%	0.286	C	S	.	.			trans	-71.6	127.2	-177.1	-169.7	172.2	4	0	0	111.5	P150 P151 V156 L170 T172	P150-Q154 VanDerWaalsContact CB-OE1 3.29Å; P151-Q154 HydrophobicContact CG-CB 4.14Å; P151-Q154 PolarHBondContact O-N 3.42Å; P151-Q154 VanDerWaalsContact O-N 3.08Å; Q154-V156 PolarHBondContact O-N 3.23Å; Q154-L170 PolarHBondContact NE2-O 3.2Å; Q154-T172 HydrophobicContact CG-CG2 4.43Å
155	D	80.7	Confident	84.6	Confident	128 Å²	128	56.2 Å²	56.2	68%	0.684	32%	0.317	S	S	*	.			trans	-59.9	126.5	176.5	-69.5	-28.1	0	0	0	111.4	G153 L157 T172	G153-D155 PolarHBondContact O-N 3.02Å; D155-L157 PolarHBondContact O-N 3.26Å; D155-T172 PolarHBondContact O-OG1 2.84Å
156	V	84.9	Confident	84.6	Confident	60 Å²	60	56 Å²	56	36%	0.364	32%	0.315	S	S	.	.			trans	-79.4	107.9	174.4	-175.6	0	0	0	0	108.4	Q154 R174	Q154-V156 PolarHBondContact O-N 3.23Å; V156-R174 HydrophobicContact CG1-CB 3.54Å
157	L	87.6	Confident	84.7	Confident	34 Å²	34	58.7 Å²	58.7	18%	0.178	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-81.4	146.4	-179.7	-60.1	-175.8	0	0	0	111	D155 Q161 V171 T172 V173 R174	D155-L157 PolarHBondContact O-N 3.26Å; L157-Q161 HydrophobicContact CB-CB 4.39Å; L157-V171 HydrophobicContact CB-CG1 4.32Å; L157-V171 HydrophobicContact CD1-CG1 3.74Å; L157-V171 HydrophobicContact CG-CG1 4.31Å; L157-T172 PolarHBondContact N-O 2.82Å; L157-V173 WeakPolarHBondContact O-CA 3.04Å; L157-R174 PolarHBondContact O-N 2.91Å
158	S	88.1	Confident	84.6	Confident	12 Å²	12	59.1 Å²	59.1	8%	0.084	34%	0.339	C	S	.	.			trans	-75.8	153.7	163.5	63.5	0	0	0	0	110.2	R160 Q161	S158-R160 PolarHBondContact O-N 3.36Å; S158-R160 VanDerWaalsContact O-N 3.1Å; S158-Q161 PolarHBondContact O-N 2.9Å; S158-Q161 VanDerWaalsContact OG-CD 3.26Å; S158-Q161 VanDerWaalsContact OG-CG 3.28Å; S158-Q161 WeakPolarHBondContact OG-CG 3.34Å; S158-Q161 PolarHBondContact OG-OE1 3.48Å
159	I	90.1	Very high	84.5	Confident	13 Å²	13	63.2 Å²	63.2	7%	0.067	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-54.9	-34.5	179.2	-56.8	176.3	0	0	0	110.7	Q161 V162 V173 L247 Q248 E249 R261 L263	I159-Q161 VanDerWaalsContact C-N 3.34Å; I159-Q161 PolarHBondContact O-N 2.81Å; I159-V162 WeakPolarHBondContact O-CB 3.25Å; I159-V162 PolarHBondContact O-N 2.92Å; I159-V173 HydrophobicContact CB-CG1 4.41Å; I159-V173 HydrophobicContact CD1-CG1 4.47Å; I159-V173 HydrophobicContact CG1-CG1 3.46Å; I159-V173 VanDerWaalsContact CG1-CG1 3.46Å; I159-L247 HydrophobicContact CD1-CB 4.44Å; I159-L247 HydrophobicContact CD1-CD2 4.09Å; I159-L247 HydrophobicContact CD1-CG 4.12Å; I159-Q248 VanDerWaalsContact CD1-C 3.47Å; I159-E249 HydrophobicContact CB-CG 3.55Å; I159-E249 WeakPolarHBondContact CB-OE1 3.16Å; I159-E249 HydrophobicContact CD1-CG 3.94Å; I159-E249 HydrophobicContact CG1-CG 3.94Å; I159-E249 HydrophobicContact CG2-CG 4.43Å; I159-R261 HydrophobicContact CG2-CB 4.44Å; I159-L263 HydrophobicContact CD1-CB 4.12Å; I159-L263 HydrophobicContact CG2-CB 3.85Å
160	R	88.7	Confident	84.7	Confident	58 Å²	58	60 Å²	60	22%	0.219	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-64.7	-34.7	177.7	-167.4	169.8	-65.8	-131.5	-3.1	113.8	S158 V162 E249 S258 I259	S158-R160 PolarHBondContact O-N 3.36Å; S158-R160 VanDerWaalsContact O-N 3.1Å; R160-V162 PolarHBondContact O-N 3.37Å; R160-E249 VanDerWaalsContact CA-OE1 3.31Å; R160-E249 WeakPolarHBondContact CA-OE1 3.42Å; R160-E249 VanDerWaalsContact CB-OE1 3.24Å; R160-E249 WeakPolarHBondContact CB-OE1 2.92Å; R160-E249 PolarHBondContact N-OE1 3.03Å; R160-E249 IonicContact NE-OE2 2.84Å; R160-E249 IonicContact NH2-OE2 3.42Å; R160-E249 PolarHBondContact NH2-OE2 3.42Å; R160-S258 VanDerWaalsContact NH1-CB 3.31Å; R160-S258 PolarHBondContact NH1-OG 3.29Å; R160-I259 PolarHBondContact NH2-O 3.23Å
161	Q	88.9	Confident	85.1	Confident	101 Å²	101	59.5 Å²	59.5	47%	0.472	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-75.1	-15.4	-179.1	-73.6	166.9	-21	0	0	112.2	L157 S158 I159 K163 H166	L157-Q161 HydrophobicContact CB-CB 4.39Å; S158-Q161 PolarHBondContact O-N 2.9Å; S158-Q161 VanDerWaalsContact OG-CD 3.26Å; S158-Q161 VanDerWaalsContact OG-CG 3.28Å; S158-Q161 WeakPolarHBondContact OG-CG 3.34Å; S158-Q161 PolarHBondContact OG-OE1 3.48Å; I159-Q161 VanDerWaalsContact C-N 3.34Å; I159-Q161 PolarHBondContact O-N 2.81Å; Q161-K163 VanDerWaalsContact C-N 3.33Å; Q161-K163 PolarHBondContact O-N 3.06Å; Q161-H166 PolarHBondContact O-CE1 3.32Å
162	V	88.1	Confident	85.8	Confident	22 Å²	22	58.7 Å²	58.7	13%	0.133	33%	0.334	C	S	.	.			trans	-69.4	89.6	174.6	-172.1	0	0	0	0	110	I159 R160 H166 V171 V173 F287	I159-V162 WeakPolarHBondContact O-CB 3.25Å; I159-V162 PolarHBondContact O-N 2.92Å; R160-V162 PolarHBondContact O-N 3.37Å; V162-H166 HydrophobicContact CG1-CB 4.36Å; V162-V171 HydrophobicContact CG2-CG1 4.32Å; V162-V173 HydrophobicContact CG2-CG2 4Å; V162-F287 HydrophobicContact CG1-CD1 3.88Å; V162-F287 HydrophobicContact CG1-CD2 3.84Å; V162-F287 HydrophobicContact CG1-CE1 3.9Å; V162-F287 HydrophobicContact CG1-CE2 3.84Å; V162-F287 HydrophobicContact CG1-CG 3.84Å; V162-F287 HydrophobicContact CG1-CZ 3.85Å
163	K	86.9	Confident	86.7	Confident	140 Å²	140	54 Å²	54	61%	0.609	30%	0.302	S	S	*	.			trans	-92.3	171.6	173.9	-65	178.9	-176.9	177.4	0	112	Q161 Q165 H166	Q161-K163 VanDerWaalsContact C-N 3.33Å; Q161-K163 PolarHBondContact O-N 3.06Å; K163-Q165 PolarHBondContact O-N 3.23Å; K163-H166 PolarHBondContact N-ND1 2.95Å; K163-H166 WeakPolarHBondContact O-CB 3.32Å; K163-H166 PolarHBondContact O-N 2.9Å; K163-H166 PolarHBondContact O-ND1 3.27Å
164	A	85.8	Confident	87.7	Confident	86 Å²	86	55.2 Å²	55.2	71%	0.711	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-53.3	-26.4	177.7	0	0	0	0	0	114.8	H166 V167	A164-H166 PolarHBondContact O-N 3.32Å; A164-V167 WeakPolarHBondContact O-CB 3.33Å; A164-V167 VanDerWaalsContact O-CG2 3.31Å; A164-V167 WeakPolarHBondContact O-CG2 3.33Å; A164-V167 PolarHBondContact O-N 3.05Å
165	Q	88.5	Confident	88.4	Confident	150 Å²	150	53.1 Å²	53.1	70%	0.701	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-64.6	-15.6	176.2	-64.7	176.1	-7.3	0	0	114	K163 K169	K163-Q165 PolarHBondContact O-N 3.23Å; Q165-K169 WeakPolarHBondContact O-CE 3.49Å; Q165-K169 PolarHBondContact O-NZ 3.29Å
166	H	88	Confident	88.7	Confident	39 Å²	39	48.4 Å²	48.4	18%	0.181	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-97.3	1.5	180	-53.9	97.8	0	0	0	113.3	Q161 V162 K163 A164 G168 K169 V171	Q161-H166 PolarHBondContact O-CE1 3.32Å; V162-H166 HydrophobicContact CG1-CB 4.36Å; K163-H166 PolarHBondContact N-ND1 2.95Å; K163-H166 WeakPolarHBondContact O-CB 3.32Å; K163-H166 PolarHBondContact O-N 2.9Å; K163-H166 PolarHBondContact O-ND1 3.27Å; A164-H166 PolarHBondContact O-N 3.32Å; H166-G168 PolarHBondContact O-N 3.33Å; H166-K169 WeakPolarHBondContact O-CB 3.48Å; H166-K169 PolarHBondContact O-N 3.04Å; H166-V171 HydrophobicContact CB-CG2 3.87Å
167	V	89.2	Confident	88.8	Confident	67 Å²	67	45.5 Å²	45.5	41%	0.406	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	126.8	176.3	175.9	0	0	0	0	109.6	A164 K169 F287	A164-V167 WeakPolarHBondContact O-CB 3.33Å; A164-V167 VanDerWaalsContact O-CG2 3.31Å; A164-V167 WeakPolarHBondContact O-CG2 3.33Å; A164-V167 PolarHBondContact O-N 3.05Å; V167-K169 VanDerWaalsContact C-N 3.26Å; V167-K169 PolarHBondContact O-N 3.21Å; V167-F287 HydrophobicContact CG2-CD1 3.83Å; V167-F287 HydrophobicContact CG2-CE1 3.93Å
168	G	87.4	Confident	88.5	Confident	18 Å²	18	46.4 Å²	46.4	19%	0.186	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	-5.9	-176.5	0	0	0	0	0	115.2	T77 H166 F287	T77-G168 PolarHBondContact OG1-O 3.02Å; H166-G168 PolarHBondContact O-N 3.33Å; G168-F287 PolarHBondContact N-O 2.84Å
169	K	89.5	Confident	88.2	Confident	85 Å²	85	46.8 Å²	46.8	37%	0.37	24%	0.236	S	C	.	.	S	Bend	trans	-87.3	155.6	178.8	-60.7	-169.8	-178.3	176	0	112.6	V74 Q165 H166 V167 V171 F287	V74-K169 CarbonylContact O-C 3.58Å; V74-K169 WeakPolarHBondContact O-CA 3.29Å; V74-K169 WeakPolarHBondContact O-CB 3.43Å; Q165-K169 WeakPolarHBondContact O-CE 3.49Å; Q165-K169 PolarHBondContact O-NZ 3.29Å; H166-K169 WeakPolarHBondContact O-CB 3.48Å; H166-K169 PolarHBondContact O-N 3.04Å; V167-K169 VanDerWaalsContact C-N 3.26Å; V167-K169 PolarHBondContact O-N 3.21Å; K169-V171 HydrophobicContact CB-CG2 4.43Å; K169-V171 PolarHBondContact O-N 2.9Å; K169-F287 PolarHBondContact O-N 3.05Å
170	L	90.9	Very high	87.9	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	116.5	166.1	-158	67.1	0	0	0	109.2	L59 V74 T77 F148 Q154 T284 V286	L59-L170 HydrophobicContact CD1-CD2 3.56Å; V74-L170 PolarHBondContact O-N 2.93Å; T77-L170 HydrophobicContact CG2-CB 3.43Å; T77-L170 VanDerWaalsContact CG2-CB 3.43Å; T77-L170 HydrophobicContact CG2-CD1 3.77Å; T77-L170 HydrophobicContact CG2-CG 4.09Å; F148-L170 HydrophobicContact CB-CD2 4.31Å; Q154-L170 PolarHBondContact NE2-O 3.2Å; L170-T284 HydrophobicContact CD1-CG2 4.04Å; L170-T284 HydrophobicContact CD2-CG2 4.03Å; L170-T284 HydrophobicContact CG-CG2 3.81Å; L170-V286 HydrophobicContact CD1-CG2 4.32Å
171	V	92	Very high	87.7	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134	179.4	-174.2	0	0	0	0	110.4	L157 V162 H166 K169 V173 T284 G285	L157-V171 HydrophobicContact CB-CG1 4.32Å; L157-V171 HydrophobicContact CD1-CG1 3.74Å; L157-V171 HydrophobicContact CG-CG1 4.31Å; V162-V171 HydrophobicContact CG2-CG1 4.32Å; H166-V171 HydrophobicContact CB-CG2 3.87Å; K169-V171 HydrophobicContact CB-CG2 4.43Å; K169-V171 PolarHBondContact O-N 2.9Å; V171-V173 HydrophobicContact CB-CG2 4.47Å; V171-V173 HydrophobicContact CG1-CG2 3.71Å; V171-T284 WeakPolarHBondContact O-CA 3.46Å; V171-G285 PolarHBondContact N-O 2.96Å; V171-G285 PolarHBondContact O-N 2.83Å
172	T	92.3	Very high	87.5	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.3	168.7	37.7	0	0	0	0	109.7	P150 Q154 D155 L157 T284	P150-T172 HydrophobicContact CB-CG2 3.65Å; P150-T172 HydrophobicContact CG-CG2 3.76Å; Q154-T172 HydrophobicContact CG-CG2 4.43Å; D155-T172 PolarHBondContact O-OG1 2.84Å; L157-T172 PolarHBondContact N-O 2.82Å; T172-T284 HydrophobicContact CG2-CG2 3.73Å; T172-T284 WeakPolarHBondContact CG2-OG1 3.48Å
173	V	91.5	Very high	87.6	Confident	1 Å²	1	50 Å²	50	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.6	179.9	-176.2	0	0	0	0	109.7	L157 I159 V162 V171 L247 L263 Q282 M283 L308	L157-V173 WeakPolarHBondContact O-CA 3.04Å; I159-V173 HydrophobicContact CB-CG1 4.41Å; I159-V173 HydrophobicContact CD1-CG1 4.47Å; I159-V173 HydrophobicContact CG1-CG1 3.46Å; I159-V173 VanDerWaalsContact CG1-CG1 3.46Å; V162-V173 HydrophobicContact CG2-CG2 4Å; V171-V173 HydrophobicContact CB-CG2 4.47Å; V171-V173 HydrophobicContact CG1-CG2 3.71Å; V173-L247 HydrophobicContact CG1-CD2 3.97Å; V173-L263 HydrophobicContact CG1-CD2 4.46Å; V173-Q282 WeakPolarHBondContact O-CA 3.49Å; V173-M283 PolarHBondContact N-O 2.87Å; V173-M283 PolarHBondContact O-N 2.83Å; V173-L308 HydrophobicContact CG2-CD2 4.49Å
174	R	89.4	Confident	87.7	Confident	94 Å²	94	46.5 Å²	46.5	36%	0.355	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	136.6	172.6	-177.6	176.2	177.4	-173.8	-2.1	110.8	V156 L157 L316	V156-R174 HydrophobicContact CG1-CB 3.54Å; L157-R174 PolarHBondContact O-N 2.91Å; R174-L316 HydrophobicContact CG-CD1 4.32Å
175	G	87.7	Confident	88	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168	-178.1	175.9	0	0	0	0	0	113.8	L247 Q248 A281	G175-L247 VanDerWaalsContact C-CD1 3.49Å; G175-Q248 CarbonylContact C-O 3.53Å; G175-Q248 WeakPolarHBondContact CA-O 3.32Å; G175-A281 PolarHBondContact N-O 2.92Å; G175-A281 PolarHBondContact O-N 2.9Å
176	I	86.5	Confident	88	Confident	28 Å²	28	43.5 Å²	43.5	14%	0.144	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.9	176.2	-58.8	168.5	0	0	0	108.1	I178 L247 Q248 H280	I176-I178 PolarHBondContact O-N 3.33Å; I176-L247 CarbonylContact O-C 3.54Å; I176-Q248 PolarHBondContact N-O 2.86Å; I176-Q248 PolarHBondContact O-N 2.88Å; I176-H280 WeakPolarHBondContact CG1-ND1 3.43Å
177	V	86.8	Confident	88.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	116.6	174.8	175	0	0	0	0	109.7	I245 L247 V275 P277 G278 D279 A281 M283	V177-I245 HydrophobicContact CB-CG2 4.18Å; V177-I245 HydrophobicContact CG1-CG2 3.32Å; V177-I245 HydrophobicContact CG2-CG2 3.82Å; V177-L247 HydrophobicContact CG2-CD1 3.89Å; V177-V275 HydrophobicContact CB-CG1 4.08Å; V177-V275 HydrophobicContact CG2-CB 4.38Å; V177-V275 HydrophobicContact CG2-CG1 3.43Å; V177-V275 VanDerWaalsContact CG2-CG1 3.43Å; V177-P277 CarbonylContact O-C 3.44Å; V177-P277 WeakPolarHBondContact O-CA 3.47Å; V177-G278 PolarHBondContact O-N 3.44Å; V177-D279 PolarHBondContact N-O 2.87Å; V177-A281 HydrophobicContact CG2-CB 4.33Å; V177-M283 HydrophobicContact CG2-CE 3.72Å
178	I	82.3	Confident	88	Confident	53 Å²	53	42.8 Å²	42.8	27%	0.272	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-48.7	175	-59.5	167.3	0	0	0	109.7	I176 R246 Q248 T262 P277	I176-I178 PolarHBondContact O-N 3.33Å; I178-R246 PolarHBondContact N-O 3.43Å; I178-Q248 HydrophobicContact CD1-CB 3.59Å; I178-Q248 HydrophobicContact CD1-CG 4.03Å; I178-Q248 HydrophobicContact CG1-CB 3.79Å; I178-T262 HydrophobicContact CD1-CG2 3.86Å; I178-P277 WeakPolarHBondContact O-CB 3.28Å
179	R	81.4	Confident	88.1	Confident	20 Å²	20	41.9 Å²	41.9	8%	0.075	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	130.9	-168	-171.5	172.5	180	-127.9	-17.6	109.9	I245 R246 D432 T439	R179-I245 CarbonylContact O-C 3.5Å; R179-I245 WeakPolarHBondContact O-CA 3.46Å; R179-I245 WeakPolarHBondContact O-CG2 3.48Å; R179-R246 HydrophobicContact CB-CB 4.35Å; R179-R246 PolarHBondContact O-N 3.19Å; R179-D432 IonicContact CZ-OD1 2.96Å; R179-D432 IonicContact CZ-OD2 2.81Å; R179-D432 IonicContact NH1-OD1 3.37Å; R179-D432 PolarHBondContact NH1-OD1 3.41Å; R179-D432 IonicContact NH1-OD2 3.23Å; R179-D432 PolarHBondContact NH1-OD2 3.31Å; R179-D432 IonicContact NH2-OD1 3.69Å; R179-D432 PolarHBondContact NH2-OD1 2.93Å; R179-D432 IonicContact NH2-OD2 3.84Å; R179-D432 PolarHBondContact NH2-OD2 3.23Å; R179-T439 VanDerWaalsContact CZ-OG1 3.24Å; R179-T439 PolarHBondContact NE-OG1 3.14Å; R179-T439 PolarHBondContact NH2-OG1 3.43Å
180	A	83.5	Confident	88.2	Confident	31 Å²	31	37.9 Å²	37.9	26%	0.256	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.6	169.4	0	0	0	0	0	108.1	I245	A180-I245 HydrophobicContact CB-CD1 4.22Å; A180-I245 HydrophobicContact CB-CG1 4.13Å
181	T	85.2	Confident	88.1	Confident	20 Å²	20	37.7 Å²	37.7	12%	0.123	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-77.2	163.8	173.1	54.4	0	0	0	0	110.5	Q243 E244	T181-Q243 VanDerWaalsContact O-CG 3.28Å; T181-Q243 WeakPolarHBondContact O-CG 3.36Å; T181-Q243 PolarHBondContact O-NE2 3.29Å; T181-E244 HydrophobicContact CG2-CB 4.35Å; T181-E244 PolarHBondContact N-O 3.47Å; T181-E244 WeakPolarHBondContact OG1-CA 3.27Å; T181-E244 PolarHBondContact OG1-N 3.26Å; T181-E244 PolarHBondContact OG1-O 2.87Å
182	E	85.6	Confident	88	Confident	170 Å²	170	37.8 Å²	37.8	79%	0.794	19%	0.194	S	C	*	.	P	Polyproline II helix	trans	-70.2	159	168.9	-63.5	-169.6	170.4	0	0	111.3	K184	E182-K184 PolarHBondContact O-N 2.89Å
183	V	89.3	Confident	87.9	Confident	39 Å²	39	39.9 Å²	39.9	24%	0.236	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-72.3	120.9	-178.8	-178.7	0	0	0	0	109.8	K241 T272 R273	V183-K241 HydrophobicContact CG1-CB 3.68Å; V183-K241 HydrophobicContact CG1-CD 4.48Å; V183-K241 HydrophobicContact CG1-CG 3.98Å; V183-T272 HydrophobicContact CG1-CG2 4.46Å; V183-T272 HydrophobicContact CG2-CG2 4.49Å; V183-R273 HydrophobicContact CG2-CG 3.63Å
184	K	89.2	Confident	87.7	Confident	68 Å²	68	39.9 Å²	39.9	30%	0.296	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149.9	178.5	-65.5	173.9	-175.3	168.8	0	110.7	E182 F242	E182-K184 PolarHBondContact O-N 2.89Å; K184-F242 PolarHBondContact N-O 2.82Å; K184-F242 PolarHBondContact O-N 2.9Å
185	P	91.1	Very high	87.6	Confident	102 Å²	102	39.6 Å²	39.6	66%	0.662	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	128	170.4	28.6	-30.9	0	0	0	111.2	I239	P185-I239 HydrophobicContact CB-CG2 3.29Å
186	L	90	Very high	87.4	Confident	70 Å²	70	42.4 Å²	42.4	37%	0.366	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.1	172.7	-178.8	71.2	0	0	0	110	I239 V240 F242	L186-I239 CarbonylContact O-C 3.49Å; L186-I239 WeakPolarHBondContact O-CA 3.26Å; L186-V240 PolarHBondContact N-O 2.9Å; L186-V240 PolarHBondContact O-N 2.88Å; L186-F242 HydrophobicContact CB-CB 3.65Å; L186-F242 HydrophobicContact CB-CG 4.25Å; L186-F242 HydrophobicContact CD2-CB 4.38Å; L186-F242 HydrophobicContact CD2-CD2 3.93Å; L186-F242 HydrophobicContact CD2-CG 4.31Å
187	F	88.7	Confident	87.1	Confident	56 Å²	56	42.5 Å²	42.5	25%	0.246	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	128.3	173.5	-76.5	-77.2	0	0	0	110.7	L232 I239	F187-L232 HydrophobicContact CZ-CD2 4.47Å; F187-I239 HydrophobicContact CD1-CD1 4.44Å; F187-I239 HydrophobicContact CD1-CG1 3.84Å; F187-I239 HydrophobicContact CE1-CD1 3.84Å; F187-I239 HydrophobicContact CE1-CG1 3.73Å; F187-I239 HydrophobicContact CZ-CD1 4.17Å; F187-I239 HydrophobicContact CZ-CG1 4.42Å
188	T	87.6	Confident	87	Confident	35 Å²	35	44.1 Å²	44.1	22%	0.215	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-41.9	168.4	-48.3	0	0	0	0	110.7	P204 V205 K238 V240	T188-P204 WeakPolarHBondContact O-CA 3.14Å; T188-V205 PolarHBondContact O-N 3.43Å; T188-K238 PolarHBondContact N-O 3.32Å; T188-V240 WeakPolarHBondContact OG1-CG2 3.42Å
189	V	90.2	Very high	86.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	117.3	176.9	-174.5	0	0	0	0	109	E139 L140 S237 K238	E139-V189 HydrophobicContact CB-CG2 4Å; L140-V189 HydrophobicContact CB-CG2 4.48Å; L140-V189 HydrophobicContact CD1-CG1 3.96Å; V189-S237 CarbonylContact O-C 3.44Å; V189-S237 VanDerWaalsContact O-CA 3.25Å; V189-S237 WeakPolarHBondContact O-CA 3.41Å; V189-S237 VanDerWaalsContact O-CB 3.25Å; V189-S237 WeakPolarHBondContact O-CB 3.39Å; V189-K238 HydrophobicContact CB-CB 4.21Å; V189-K238 PolarHBondContact N-O 3.38Å; V189-K238 PolarHBondContact O-N 3.44Å
190	A	90.7	Very high	87	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	127.8	173.7	0	0	0	0	0	109.6	F192 Q203 V205 F210 L232	A190-F192 HydrophobicContact CB-CE2 3.79Å; A190-F192 HydrophobicContact CB-CZ 4.14Å; A190-Q203 PolarHBondContact N-O 3.08Å; A190-Q203 PolarHBondContact O-N 3.09Å; A190-V205 HydrophobicContact CB-CG2 4.38Å; A190-F210 HydrophobicContact CB-CE2 4.31Å; A190-L232 HydrophobicContact CB-CD1 3.79Å
191	T	89.5	Confident	87.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.1	173.8	-54.3	0	0	0	0	110.2	E200 I201 Y202 Q233 G236 S237	T191-E200 HydrophobicContact CG2-CB 4.2Å; T191-I201 CarbonylContact C-O 3.59Å; T191-I201 WeakPolarHBondContact CA-O 3.45Å; T191-Y202 HydrophobicContact CG2-CD1 3.8Å; T191-Y202 HydrophobicContact CG2-CE1 3.44Å; T191-Y202 VanDerWaalsContact CG2-CE1 3.44Å; T191-Y202 WeakPolarHBondContact OG1-CD1 3.46Å; T191-Y202 WeakPolarHBondContact OG1-CE1 3.37Å; T191-Q233 PolarHBondContact O-N 2.91Å; T191-G236 PolarHBondContact OG1-O 3.48Å; T191-S237 PolarHBondContact N-OG 2.88Å
192	F	90.5	Very high	87.2	Confident	5 Å²	5	47.7 Å²	47.7	2%	0.022	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142	174.6	-60.3	-88.2	0	0	0	110.4	A190 E200 I201 Q203 F210 P212 L230 I231 L232	A190-F192 HydrophobicContact CB-CE2 3.79Å; A190-F192 HydrophobicContact CB-CZ 4.14Å; F192-E200 CarbonylContact O-C 3.58Å; F192-E200 VanDerWaalsContact O-CA 3.27Å; F192-E200 WeakPolarHBondContact O-CA 3.16Å; F192-I201 HydrophobicContact CB-CB 4.34Å; F192-I201 PolarHBondContact N-O 3.04Å; F192-I201 PolarHBondContact O-N 3.38Å; F192-Q203 HydrophobicContact CE2-CB 4.07Å; F192-Q203 VanDerWaalsContact CE2-OE1 3.3Å; F192-F210 HydrophobicContact CZ-CE2 4.35Å; F192-P212 HydrophobicContact CE1-CB 3.73Å; F192-P212 HydrophobicContact CZ-CB 3.74Å; F192-L230 HydrophobicContact CB-CB 4.18Å; F192-L230 HydrophobicContact CD1-CB 4.49Å; F192-I231 CarbonylContact C-O 3.54Å; F192-I231 WeakPolarHBondContact CA-O 3.41Å; F192-L232 HydrophobicContact CD1-CB 4.01Å; F192-L232 HydrophobicContact CD1-CD1 4.2Å; F192-L232 HydrophobicContact CE1-CB 3.84Å; F192-L232 HydrophobicContact CE1-CD1 3.81Å; F192-L232 HydrophobicContact CE1-CG 4.4Å; F192-L232 HydrophobicContact CE2-CD1 4.42Å; F192-L232 HydrophobicContact CZ-CD1 3.93Å
193	I	89.4	Confident	87.3	Confident	44 Å²	44	42 Å²	42	23%	0.226	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.6	174.6	-58.7	-173.4	0	0	0	108.7	E200 L230 I231 Q233	I193-E200 HydrophobicContact CD1-CG 4.44Å; I193-E200 HydrophobicContact CG1-CG 4.13Å; I193-L230 WeakPolarHBondContact O-CA 3.49Å; I193-I231 PolarHBondContact N-O 3.49Å; I193-I231 PolarHBondContact O-N 3.41Å; I193-Q233 HydrophobicContact CD1-CB 4.14Å; I193-Q233 VanDerWaalsContact CD1-CD 3.48Å; I193-Q233 HydrophobicContact CD1-CG 4.28Å; I193-Q233 HydrophobicContact CG1-CB 4.28Å
194	C	87.4	Confident	87.2	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.007	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	127.6	171	-173.6	0	0	0	0	111.3	A196 C197 G198 H199 C216 C221 L230	C194-A196 PolarHBondContact O-N 3.41Å; C194-C197 WeakPolarHBondContact CB-SG 3.44Å; C194-G198 WeakPolarHBondContact O-CA 3.42Å; C194-G198 PolarHBondContact O-N 3.37Å; C194-H199 PolarHBondContact N-O 2.75Å; C194-C216 HydrophobicContact CB-CB 4.27Å; C194-C221 VanDerWaalsContact SG-SG 3.61Å; C194-L230 HydrophobicContact CB-CD2 3.66Å
195	T	87.1	Confident	87	Confident	89 Å²	89	41 Å²	41	55%	0.546	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-22.3	177.8	57.9	0	0	0	0	113.9	R229 I231	T195-R229 PolarHBondContact N-O 3.05Å; T195-R229 PolarHBondContact OG1-N 3.43Å; T195-R229 PolarHBondContact OG1-O 3.39Å; T195-I231 HydrophobicContact CG2-CD1 3.46Å; T195-I231 VanDerWaalsContact CG2-CD1 3.46Å; T195-I231 HydrophobicContact CG2-CG1 3.98Å
196	A	83.5	Confident	86.4	Confident	59 Å²	59	42.1 Å²	42.1	49%	0.488	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-53	-175.9	0	0	0	0	0	112.5	C194 A226	C194-A196 PolarHBondContact O-N 3.41Å; A196-A226 HydrophobicContact CB-CB 4.33Å
197	C	81.4	Confident	85.8	Confident	30 Å²	30	40.2 Å²	40.2	20%	0.203	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-11.6	-179	63.6	0	0	0	0	114.2	C194 H199 C216 S218 E220 C221	C194-C197 WeakPolarHBondContact CB-SG 3.44Å; C197-H199 PolarHBondContact O-N 3.44Å; C197-H199 WeakPolarHBondContact SG-CB 2.97Å; C197-H199 PolarHBondContact SG-N 3.33Å; C197-C216 VanDerWaalsContact SG-SG 3.7Å; C197-S218 PolarHBondContact SG-OG 2.8Å; C197-E220 HydrophobicContact CB-CB 4.36Å; C197-C221 PolarHBondContact SG-SG 3.03Å
198	G	82.7	Confident	85.3	Confident	35 Å²	35	41.6 Å²	41.6	36%	0.361	26%	0.257	S	S	.	.			trans	67.8	10.4	-174.9	0	0	0	0	0	114.4	C194	C194-G198 WeakPolarHBondContact O-CA 3.42Å; C194-G198 PolarHBondContact O-N 3.37Å
199	H	81	Confident	85	Confident	85 Å²	85	44.7 Å²	44.7	39%	0.394	28%	0.276	S	S	.	.			trans	-71.8	132.5	177.4	-165.6	71	0	0	0	110.8	C194 C197	C194-H199 PolarHBondContact N-O 2.75Å; C197-H199 PolarHBondContact O-N 3.44Å; C197-H199 WeakPolarHBondContact SG-CB 2.97Å; C197-H199 PolarHBondContact SG-N 3.33Å
200	E	83.3	Confident	84.8	Confident	50 Å²	50	48.3 Å²	48.3	23%	0.234	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.8	175.3	-54.4	-163.2	157.7	0	0	110.3	R114 T191 F192 I193 Y202	R114-E200 IonicContact CZ-OE1 2.76Å; R114-E200 IonicContact CZ-OE2 3.58Å; R114-E200 IonicContact NE-OE1 3.96Å; R114-E200 PolarHBondContact NE-OE1 3.39Å; R114-E200 VanDerWaalsContact NE-OE1 3.15Å; R114-E200 IonicContact NE-OE2 2.74Å; R114-E200 PolarHBondContact NE-OE2 3.39Å; R114-E200 IonicContact NH1-OE2 2.97Å; R114-E200 VanDerWaalsContact NH2-CD 3.28Å; R114-E200 IonicContact NH2-OE1 3.7Å; R114-E200 PolarHBondContact NH2-OE1 2.95Å; R114-E200 IonicContact NH2-OE2 2.84Å; R114-E200 PolarHBondContact NH2-OE2 2.75Å; T191-E200 HydrophobicContact CG2-CB 4.2Å; F192-E200 CarbonylContact O-C 3.58Å; F192-E200 VanDerWaalsContact O-CA 3.27Å; F192-E200 WeakPolarHBondContact O-CA 3.16Å; I193-E200 HydrophobicContact CD1-CG 4.44Å; I193-E200 HydrophobicContact CG1-CG 4.13Å; E200-Y202 HydrophobicContact CB-CE1 4.46Å; E200-Y202 HydrophobicContact CB-CE2 4.4Å; E200-Y202 PolarHBondContact OE2-OH 3.48Å
201	I	86	Confident	84.6	Confident	23 Å²	23	55 Å²	55	12%	0.118	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.1	178.2	-58.7	160.2	0	0	0	108.1	T191 F192 C216 P217 L230	T191-I201 CarbonylContact C-O 3.59Å; T191-I201 WeakPolarHBondContact CA-O 3.45Å; F192-I201 HydrophobicContact CB-CB 4.34Å; F192-I201 PolarHBondContact N-O 3.04Å; F192-I201 PolarHBondContact O-N 3.38Å; I201-C216 HydrophobicContact CD1-CB 4.45Å; I201-P217 HydrophobicContact CD1-CG 4.25Å; I201-P217 HydrophobicContact CG1-CG 4.28Å; I201-L230 HydrophobicContact CD1-CD1 3.38Å; I201-L230 HydrophobicContact CD1-CD2 3.42Å; I201-L230 VanDerWaalsContact CD1-CD2 3.42Å; I201-L230 HydrophobicContact CD1-CG 4.06Å
202	Y	87.2	Confident	84.4	Confident	41 Å²	41	58 Å²	58	16%	0.161	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.9	178.3	-52.6	-72.2	0	0	0	110	F136 P137 L140 T191 E200	F136-Y202 HydrophobicContact CD1-CD2 4.33Å; F136-Y202 AromaticContact CD1-CE2 3.45Å; F136-Y202 HydrophobicContact CD1-CE2 3.45Å; F136-Y202 VanDerWaalsContact CD1-CE2 3.45Å; F136-Y202 AromaticContact CD1-CZ 3.59Å; F136-Y202 WeakPolarHBondContact CD1-OH 3.32Å; F136-Y202 AromaticContact CE1-CE2 3.8Å; F136-Y202 HydrophobicContact CE1-CE2 3.8Å; F136-Y202 AromaticContact CE1-CZ 3.77Å; F136-Y202 WeakPolarHBondContact CE1-OH 3.11Å; P137-Y202 HydrophobicContact CG-CG 4.33Å; L140-Y202 HydrophobicContact CD1-CD1 3.49Å; L140-Y202 VanDerWaalsContact CD1-CD1 3.49Å; L140-Y202 HydrophobicContact CD1-CE1 3.71Å; L140-Y202 HydrophobicContact CD1-CG 4.33Å; T191-Y202 HydrophobicContact CG2-CD1 3.8Å; T191-Y202 HydrophobicContact CG2-CE1 3.44Å; T191-Y202 VanDerWaalsContact CG2-CE1 3.44Å; T191-Y202 WeakPolarHBondContact OG1-CD1 3.46Å; T191-Y202 WeakPolarHBondContact OG1-CE1 3.37Å; E200-Y202 HydrophobicContact CB-CE1 4.46Å; E200-Y202 HydrophobicContact CB-CE2 4.4Å; E200-Y202 PolarHBondContact OE2-OH 3.48Å
203	Q	87.1	Confident	84.1	Confident	51 Å²	51	59.3 Å²	59.3	24%	0.238	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112	176.5	-173.1	178.7	3.4	0	0	109.2	A190 F192 I211	A190-Q203 PolarHBondContact N-O 3.08Å; A190-Q203 PolarHBondContact O-N 3.09Å; F192-Q203 HydrophobicContact CE2-CB 4.07Å; F192-Q203 VanDerWaalsContact CE2-OE1 3.3Å; Q203-I211 PolarHBondContact NE2-O 2.99Å; Q203-I211 PolarHBondContact OE1-O 3.45Å
204	P	87.5	Confident	83.6	Confident	66 Å²	66	64.8 Å²	64.8	43%	0.429	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	134.5	172	28.9	-32.6	0	0	0	110.2	T188	T188-P204 WeakPolarHBondContact O-CA 3.14Å
205	V	85.5	Confident	83.3	Confident	20 Å²	20	70.4 Å²	70.4	12%	0.121	42%	0.416	C	S	.	.			trans	-106.6	106.3	-178	179.5	0	0	0	0	108.4	T188 A190 G207 F210	T188-V205 PolarHBondContact O-N 3.43Å; A190-V205 HydrophobicContact CB-CG2 4.38Å; V205-G207 WeakPolarHBondContact CG1-O 3.1Å; V205-F210 HydrophobicContact CB-CD1 4.4Å; V205-F210 HydrophobicContact CG1-CB 4.14Å; V205-F210 HydrophobicContact CG1-CD1 3.61Å; V205-F210 HydrophobicContact CG1-CE1 4.32Å; V205-F210 HydrophobicContact CG1-CG 4.08Å; V205-F210 HydrophobicContact CG2-CB 4.31Å; V205-F210 HydrophobicContact CG2-CD1 3.8Å; V205-F210 HydrophobicContact CG2-CD2 4.13Å; V205-F210 HydrophobicContact CG2-CE1 4.1Å; V205-F210 HydrophobicContact CG2-CE2 4.4Å; V205-F210 HydrophobicContact CG2-CG 3.82Å; V205-F210 HydrophobicContact CG2-CZ 4.39Å
206	T	78.8	Confident	83	Confident	124 Å²	124	66.6 Å²	66.6	76%	0.761	39%	0.392	S	S	*	.			trans	-100.1	-22.3	179.2	54.1	0	0	0	0	113.3
207	G	77.9	Confident	82.8	Confident	30 Å²	30	68.1 Å²	68.1	31%	0.309	40%	0.397	S	S	.	.	S	Bend	trans	-101.4	165.7	-177.8	0	0	0	0	0	113.4	V205 T209	V205-G207 WeakPolarHBondContact CG1-O 3.1Å; G207-T209 PolarHBondContact O-N 3Å
208	P	76.5	Confident	82.7	Confident	86 Å²	86	67.1 Å²	67.1	56%	0.558	39%	0.391	S	S	*	.	S	Bend	trans	-67.2	-20	174	29.2	-35.8	0	0	0	112.9
209	T	83	Confident	82.5	Confident	100 Å²	100	73.4 Å²	73.4	61%	0.613	41%	0.408	S	S	*	.	S	Bend	trans	-130.7	135.8	178.2	55	0	0	0	0	108.5	G207	G207-T209 PolarHBondContact O-N 3Å
210	F	85.4	Confident	82.4	Confident	75 Å²	75	74.4 Å²	74.4	33%	0.329	41%	0.413	S	S	.	.			trans	-133.7	152.4	172.4	70	-82.2	0	0	0	109.8	A190 F192 V205	A190-F210 HydrophobicContact CB-CE2 4.31Å; F192-F210 HydrophobicContact CZ-CE2 4.35Å; V205-F210 HydrophobicContact CB-CD1 4.4Å; V205-F210 HydrophobicContact CG1-CB 4.14Å; V205-F210 HydrophobicContact CG1-CD1 3.61Å; V205-F210 HydrophobicContact CG1-CE1 4.32Å; V205-F210 HydrophobicContact CG1-CG 4.08Å; V205-F210 HydrophobicContact CG2-CB 4.31Å; V205-F210 HydrophobicContact CG2-CD1 3.8Å; V205-F210 HydrophobicContact CG2-CD2 4.13Å; V205-F210 HydrophobicContact CG2-CE1 4.1Å; V205-F210 HydrophobicContact CG2-CE2 4.4Å; V205-F210 HydrophobicContact CG2-CG 3.82Å; V205-F210 HydrophobicContact CG2-CZ 4.39Å
211	I	86.1	Confident	82	Confident	140 Å²	140	72.4 Å²	72.4	72%	0.718	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-96.4	126.3	174.2	-58	169.5	0	0	0	106.4	Q203	Q203-I211 PolarHBondContact NE2-O 2.99Å; Q203-I211 PolarHBondContact OE1-O 3.45Å
212	P	86.1	Confident	81.8	Confident	65 Å²	65	75.8 Å²	75.8	42%	0.422	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-65.1	143.8	176.9	28.3	-34.1	0	0	0	110.4	F192 E214	F192-P212 HydrophobicContact CE1-CB 3.73Å; F192-P212 HydrophobicContact CZ-CB 3.74Å; P212-E214 PolarHBondContact O-N 2.83Å
213	A	82.3	Confident	81.6	Confident	31 Å²	31	81.1 Å²	81.1	26%	0.256	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-68.2	123.8	172.7	0	0	0	0	0	109.7	L230	A213-L230 HydrophobicContact CB-CD1 3.86Å; A213-L230 WeakPolarHBondContact O-CB 3.25Å; A213-L230 WeakPolarHBondContact O-CD1 3.11Å
214	E	80.2	Confident	81	Confident	160 Å²	160	82.3 Å²	82.3	75%	0.748	47%	0.466	S	S	*	.			trans	-96.1	-28.2	176.3	-64.1	-172.1	166.1	0	0	112.7	P212	P212-E214 PolarHBondContact O-N 2.83Å
215	V	81.7	Confident	80.3	Confident	119 Å²	119	90.3 Å²	90.3	72%	0.721	49%	0.488	S	S	*	.	S	Bend	trans	-104.8	128.4	-175.6	-174.5	0	0	0	0	110.2	P217 L230	V215-P217 WeakPolarHBondContact O-CD 3.5Å; V215-L230 WeakPolarHBondContact O-CD1 2.95Å
216	C	79.7	Confident	79.6	Confident	8 Å²	8	91.3 Å²	91.3	5%	0.054	50%	0.498	C	S	.	.			trans	-74.7	122.8	174.7	-169.5	0	0	0	0	110.6	C194 C197 I201 S218 C221 L230	C194-C216 HydrophobicContact CB-CB 4.27Å; C197-C216 VanDerWaalsContact SG-SG 3.7Å; I201-C216 HydrophobicContact CD1-CB 4.45Å; C216-S218 PolarHBondContact O-N 2.94Å; C216-S218 PolarHBondContact SG-OG 3.31Å; C216-C221 HydrophobicContact CB-CB 4.17Å; C216-L230 HydrophobicContact CB-CD2 4.01Å
217	P	80.7	Confident	79.1	Confident	92 Å²	92	91.2 Å²	91.2	60%	0.597	50%	0.503	S	S	*	.			trans	-81.6	3	177.9	34.7	-34.9	0	0	0	113.2	I201 V215	I201-P217 HydrophobicContact CD1-CG 4.25Å; I201-P217 HydrophobicContact CG1-CG 4.28Å; V215-P217 WeakPolarHBondContact O-CD 3.5Å
218	S	77.8	Confident	78.9	Confident	9 Å²	9	90.3 Å²	90.3	6%	0.063	49%	0.493	C	S	.	.			trans	-66.2	136.5	-178	68	0	0	0	0	111.2	C197 C216 E220 C221 V222	C197-S218 PolarHBondContact SG-OG 2.8Å; C216-S218 PolarHBondContact O-N 2.94Å; C216-S218 PolarHBondContact SG-OG 3.31Å; S218-E220 PolarHBondContact O-N 2.86Å; S218-C221 PolarHBondContact O-N 2.77Å; S218-C221 VanDerWaalsContact O-N 3.17Å; S218-C221 WeakPolarHBondContact OG-CB 3.44Å; S218-C221 PolarHBondContact OG-N 2.86Å; S218-V222 WeakPolarHBondContact O-CG2 3.19Å; S218-V222 PolarHBondContact O-N 3.35Å
219	K	79.7	Confident	79.2	Confident	166 Å²	166	95.8 Å²	95.8	72%	0.722	50%	0.503	S	S	*	.	H	α-helix	trans	-55.4	-39.1	176.6	-65.9	-175.9	179.3	-178	0	111.5	C221 V222 E223	K219-C221 PolarHBondContact O-N 2.83Å; K219-V222 PolarHBondContact O-N 3.18Å; K219-E223 VanDerWaalsContact O-CB 3.27Å; K219-E223 WeakPolarHBondContact O-CB 3.34Å; K219-E223 VanDerWaalsContact O-CG 3.27Å; K219-E223 WeakPolarHBondContact O-CG 3.34Å; K219-E223 PolarHBondContact O-N 2.95Å
220	E	77.9	Confident	79.4	Confident	106 Å²	106	92.3 Å²	92.3	50%	0.495	48%	0.48	S	S	.	.	H	α-helix	trans	-59	-43.8	178.4	-65.1	174	-169.1	0	0	112.7	R125 C197 S218 S224	R125-E220 IonicContact NH2-OE1 2.92Å; C197-E220 HydrophobicContact CB-CB 4.36Å; S218-E220 PolarHBondContact O-N 2.86Å; E220-S224 WeakPolarHBondContact O-CB 3.25Å; E220-S224 PolarHBondContact O-N 2.88Å; E220-S224 PolarHBondContact O-OG 2.79Å
221	C	76.1	Confident	79.6	Confident	8 Å²	8	93.7 Å²	93.7	5%	0.054	49%	0.49	C	S	.	.	H	α-helix	trans	-74.3	-37.2	176.7	-85.7	0	0	0	0	112.6	C194 C197 C216 S218 K219 S224 R225 A226	C194-C221 VanDerWaalsContact SG-SG 3.61Å; C197-C221 PolarHBondContact SG-SG 3.03Å; C216-C221 HydrophobicContact CB-CB 4.17Å; S218-C221 PolarHBondContact O-N 2.77Å; S218-C221 VanDerWaalsContact O-N 3.17Å; S218-C221 WeakPolarHBondContact OG-CB 3.44Å; S218-C221 PolarHBondContact OG-N 2.86Å; K219-C221 PolarHBondContact O-N 2.83Å; C221-S224 WeakPolarHBondContact CA-OG 3.34Å; C221-S224 PolarHBondContact O-OG 2.92Å; C221-R225 PolarHBondContact O-N 3.45Å; C221-R225 VanDerWaalsContact O-N 3.15Å; C221-A226 PolarHBondContact O-N 2.96Å
222	V	81	Confident	79.8	Confident	95 Å²	95	90.1 Å²	90.1	58%	0.576	47%	0.472	S	S	*	.	H	α-helix	trans	-66.6	-43.3	-180	175.1	0	0	0	0	110.5	S218 K219	S218-V222 WeakPolarHBondContact O-CG2 3.19Å; S218-V222 PolarHBondContact O-N 3.35Å; K219-V222 PolarHBondContact O-N 3.18Å
223	E	82.6	Confident	79.9	Confident	153 Å²	153	89.6 Å²	89.6	72%	0.715	46%	0.464	S	S	*	.	H	α-helix	trans	-71.4	-41	178.3	-71.2	171.2	-170.5	0	0	112	K219 R225	K219-E223 VanDerWaalsContact O-CB 3.27Å; K219-E223 WeakPolarHBondContact O-CB 3.34Å; K219-E223 VanDerWaalsContact O-CG 3.27Å; K219-E223 WeakPolarHBondContact O-CG 3.34Å; K219-E223 PolarHBondContact O-N 2.95Å; E223-R225 PolarHBondContact O-N 3.1Å
224	S	74.5	Confident	80.2	Confident	76 Å²	76	92 Å²	92	53%	0.531	48%	0.475	S	S	.	.	H	α-helix	trans	-76.4	-4.6	179.5	61.8	0	0	0	0	114.2	E220 C221 A226	E220-S224 WeakPolarHBondContact O-CB 3.25Å; E220-S224 PolarHBondContact O-N 2.88Å; E220-S224 PolarHBondContact O-OG 2.79Å; C221-S224 WeakPolarHBondContact CA-OG 3.34Å; C221-S224 PolarHBondContact O-OG 2.92Å; S224-A226 PolarHBondContact O-N 3.01Å; S224-A226 WeakPolarHBondContact OG-CB 3.33Å
225	R	72.6	Confident	80.4	Confident	234 Å²	234	92.3 Å²	92.3	88%	0.883	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	20.1	-170.5	-64.7	-176.3	177.9	177.4	0	113.6	C221 E223 S227	C221-R225 PolarHBondContact O-N 3.45Å; C221-R225 VanDerWaalsContact O-N 3.15Å; E223-R225 PolarHBondContact O-N 3.1Å; R225-S227 PolarHBondContact O-N 2.71Å
226	A	70.2	Confident	80.4	Confident	41 Å²	41	86.7 Å²	86.7	34%	0.339	44%	0.435	S	S	.	.			trans	-78.4	113.3	177.1	0	0	0	0	0	108.6	A196 C221 S224 G228	A196-A226 HydrophobicContact CB-CB 4.33Å; C221-A226 PolarHBondContact O-N 2.96Å; S224-A226 PolarHBondContact O-N 3.01Å; S224-A226 WeakPolarHBondContact OG-CB 3.33Å; A226-G228 PolarHBondContact O-N 3.46Å
227	S	69.5	Low	80.7	Confident	122 Å²	122	86.5 Å²	86.5	85%	0.853	43%	0.434	S	S	*	.			trans	-75.9	70	172.3	49.3	0	0	0	0	110.5	R225 R229	R225-S227 PolarHBondContact O-N 2.71Å; S227-R229 PolarHBondContact O-N 3.24Å
228	G	73.7	Confident	81	Confident	10 Å²	10	83.6 Å²	83.6	10%	0.103	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-64.5	132.1	172.5	0	0	0	0	0	110.7	A226	A226-G228 PolarHBondContact O-N 3.46Å
229	R	83.4	Confident	81.5	Confident	202 Å²	202	86.5 Å²	86.5	76%	0.762	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-78.4	138.2	174.8	-68	-176.4	179.7	-178.4	-0.3	109.2	T195 S227	T195-R229 PolarHBondContact N-O 3.05Å; T195-R229 PolarHBondContact OG1-N 3.43Å; T195-R229 PolarHBondContact OG1-O 3.39Å; S227-R229 PolarHBondContact O-N 3.24Å
230	L	86.8	Confident	82	Confident	26 Å²	26	79.4 Å²	79.4	14%	0.136	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.4	174.3	-67	-178	0	0	0	109.8	F192 I193 C194 I201 A213 V215 C216	F192-L230 HydrophobicContact CB-CB 4.18Å; F192-L230 HydrophobicContact CD1-CB 4.49Å; I193-L230 WeakPolarHBondContact O-CA 3.49Å; C194-L230 HydrophobicContact CB-CD2 3.66Å; I201-L230 HydrophobicContact CD1-CD1 3.38Å; I201-L230 HydrophobicContact CD1-CD2 3.42Å; I201-L230 VanDerWaalsContact CD1-CD2 3.42Å; I201-L230 HydrophobicContact CD1-CG 4.06Å; A213-L230 HydrophobicContact CB-CD1 3.86Å; A213-L230 WeakPolarHBondContact O-CB 3.25Å; A213-L230 WeakPolarHBondContact O-CD1 3.11Å; V215-L230 WeakPolarHBondContact O-CD1 2.95Å; C216-L230 HydrophobicContact CB-CD2 4.01Å
231	I	89.7	Confident	82.6	Confident	104 Å²	104	79.5 Å²	79.5	53%	0.533	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128.1	177.1	-58.4	176.2	0	0	0	108.5	F192 I193 T195 Q233	F192-I231 CarbonylContact C-O 3.54Å; F192-I231 WeakPolarHBondContact CA-O 3.41Å; I193-I231 PolarHBondContact N-O 3.49Å; I193-I231 PolarHBondContact O-N 3.41Å; T195-I231 HydrophobicContact CG2-CD1 3.46Å; T195-I231 VanDerWaalsContact CG2-CD1 3.46Å; T195-I231 HydrophobicContact CG2-CG1 3.98Å; I231-Q233 PolarHBondContact O-N 2.77Å
232	L	90.2	Very high	83.4	Confident	66 Å²	66	80.7 Å²	80.7	35%	0.346	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.6	173.9	179.5	70.5	0	0	0	110.1	F187 A190 F192	F187-L232 HydrophobicContact CZ-CD2 4.47Å; A190-L232 HydrophobicContact CB-CD1 3.79Å; F192-L232 HydrophobicContact CD1-CB 4.01Å; F192-L232 HydrophobicContact CD1-CD1 4.2Å; F192-L232 HydrophobicContact CE1-CB 3.84Å; F192-L232 HydrophobicContact CE1-CD1 3.81Å; F192-L232 HydrophobicContact CE1-CG 4.4Å; F192-L232 HydrophobicContact CE2-CD1 4.42Å; F192-L232 HydrophobicContact CZ-CD1 3.93Å
233	Q	87.7	Confident	83.7	Confident	53 Å²	53	76.7 Å²	76.7	25%	0.248	38%	0.375	C	S	.	.			trans	-105.7	106.6	175.1	-164.3	-168.2	30.2	0	0	110.5	T191 I193 I231 R235 G236 S237	T191-Q233 PolarHBondContact O-N 2.91Å; I193-Q233 HydrophobicContact CD1-CB 4.14Å; I193-Q233 VanDerWaalsContact CD1-CD 3.48Å; I193-Q233 HydrophobicContact CD1-CG 4.28Å; I193-Q233 HydrophobicContact CG1-CB 4.28Å; I231-Q233 PolarHBondContact O-N 2.77Å; Q233-R235 VanDerWaalsContact C-N 3.33Å; Q233-R235 PolarHBondContact O-N 3.1Å; Q233-G236 PolarHBondContact O-N 2.87Å; Q233-S237 PolarHBondContact O-N 2.85Å; Q233-S237 PolarHBondContact O-OG 2.88Å
234	V	87.6	Confident	84.1	Confident	81 Å²	81	70.5 Å²	70.5	49%	0.491	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-61.2	-39.8	-179.2	-175.3	0	0	0	0	111.9	G236 S237 I239	V234-G236 VanDerWaalsContact C-N 3.25Å; V234-G236 PolarHBondContact O-N 2.89Å; V234-S237 WeakPolarHBondContact O-CB 3.47Å; V234-S237 PolarHBondContact O-N 2.99Å; V234-I239 HydrophobicContact CG1-CD1 3.78Å
235	R	84.3	Confident	84.8	Confident	168 Å²	168	67 Å²	67	63%	0.634	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-62.6	-31	-178	-62.3	-170.8	-177	179.5	1.4	113.8	Y110 Q233	Y110-R235 HydrophobicContact CE1-CB 4.42Å; Y110-R235 HydrophobicContact CE2-CB 4.18Å; Y110-R235 WeakPolarHBondContact OH-CD 3.49Å; Y110-R235 PolarHBondContact OH-NH1 3.5Å; Q233-R235 VanDerWaalsContact C-N 3.33Å; Q233-R235 PolarHBondContact O-N 3.1Å
236	G	81.8	Confident	85.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-87.8	-14	177.1	0	0	0	0	0	113.9	R114 T191 Q233 V234	R114-G236 PolarHBondContact NH1-O 2.85Å; R114-G236 VanDerWaalsContact NH1-O 3.15Å; T191-G236 PolarHBondContact OG1-O 3.48Å; Q233-G236 PolarHBondContact O-N 2.87Å; V234-G236 VanDerWaalsContact C-N 3.25Å; V234-G236 PolarHBondContact O-N 2.89Å
237	S	86.9	Confident	86.7	Confident	5 Å²	5	57.7 Å²	57.7	4%	0.035	28%	0.277	C	S	.	.	S	Bend	trans	-85.5	149.9	-175.6	-60.2	0	0	0	0	110.7	V189 T191 Q233 V234	V189-S237 CarbonylContact O-C 3.44Å; V189-S237 VanDerWaalsContact O-CA 3.25Å; V189-S237 WeakPolarHBondContact O-CA 3.41Å; V189-S237 VanDerWaalsContact O-CB 3.25Å; V189-S237 WeakPolarHBondContact O-CB 3.39Å; T191-S237 PolarHBondContact N-OG 2.88Å; Q233-S237 PolarHBondContact O-N 2.85Å; Q233-S237 PolarHBondContact O-OG 2.88Å; V234-S237 WeakPolarHBondContact O-CB 3.47Å; V234-S237 PolarHBondContact O-N 2.99Å
238	K	86.8	Confident	87.6	Confident	31 Å²	31	54.6 Å²	54.6	14%	0.135	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125	174.8	-176.1	172.6	168.2	179.8	0	109.9	E139 R142 T188 V189	E139-K238 WeakPolarHBondContact O-CD 3.48Å; E139-K238 PolarHBondContact O-NZ 2.92Å; R142-K238 PolarHBondContact O-NZ 2.76Å; T188-K238 PolarHBondContact N-O 3.32Å; V189-K238 HydrophobicContact CB-CB 4.21Å; V189-K238 PolarHBondContact N-O 3.38Å; V189-K238 PolarHBondContact O-N 3.44Å
239	I	89	Confident	88.3	Confident	69 Å²	69	54.3 Å²	54.3	35%	0.354	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.1	179.9	-57.4	173.9	0	0	0	108.3	P185 L186 F187 V234	P185-I239 HydrophobicContact CB-CG2 3.29Å; L186-I239 CarbonylContact O-C 3.49Å; L186-I239 WeakPolarHBondContact O-CA 3.26Å; F187-I239 HydrophobicContact CD1-CD1 4.44Å; F187-I239 HydrophobicContact CD1-CG1 3.84Å; F187-I239 HydrophobicContact CE1-CD1 3.84Å; F187-I239 HydrophobicContact CE1-CG1 3.73Å; F187-I239 HydrophobicContact CZ-CD1 4.17Å; F187-I239 HydrophobicContact CZ-CG1 4.42Å; V234-I239 HydrophobicContact CG1-CD1 3.78Å
240	V	88.9	Confident	88.3	Confident	18 Å²	18	45.9 Å²	45.9	11%	0.109	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	148.1	178.5	177.6	0	0	0	0	109	E145 L186 T188	E145-V240 VanDerWaalsContact OE1-CG1 3.27Å; E145-V240 WeakPolarHBondContact OE1-CG1 3.36Å; L186-V240 PolarHBondContact N-O 2.9Å; L186-V240 PolarHBondContact O-N 2.88Å; T188-V240 WeakPolarHBondContact OG1-CG2 3.42Å
241	K	91.8	Very high	87.8	Confident	107 Å²	107	48.5 Å²	48.5	47%	0.465	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	134.4	173.5	-65.6	172.1	-172.1	163.5	0	109.1	V183 S268 G269 T272	V183-K241 HydrophobicContact CG1-CB 3.68Å; V183-K241 HydrophobicContact CG1-CD 4.48Å; V183-K241 HydrophobicContact CG1-CG 3.98Å; K241-S268 CarbonylContact O-C 3.57Å; K241-S268 WeakPolarHBondContact O-CA 3.22Å; K241-G269 PolarHBondContact O-N 3.24Å; K241-T272 HydrophobicContact CB-CG2 4.01Å
242	F	91.5	Very high	87.3	Confident	33 Å²	33	50 Å²	50	15%	0.145	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	135.1	-179.6	176.5	-100	0	0	0	110	K184 L186 E244 Q266 I267	K184-F242 PolarHBondContact N-O 2.82Å; K184-F242 PolarHBondContact O-N 2.9Å; L186-F242 HydrophobicContact CB-CB 3.65Å; L186-F242 HydrophobicContact CB-CG 4.25Å; L186-F242 HydrophobicContact CD2-CB 4.38Å; L186-F242 HydrophobicContact CD2-CD2 3.93Å; L186-F242 HydrophobicContact CD2-CG 4.31Å; F242-E244 HydrophobicContact CD1-CG 4.38Å; F242-E244 HydrophobicContact CE1-CG 3.36Å; F242-E244 HydrophobicContact CZ-CG 3.45Å; F242-E244 VanDerWaalsContact CZ-CG 3.45Å; F242-E244 WeakPolarHBondContact CZ-OE1 3.45Å; F242-Q266 HydrophobicContact CE2-CB 3.88Å; F242-Q266 HydrophobicContact CE2-CG 4Å; F242-Q266 HydrophobicContact CZ-CB 4.31Å; F242-Q266 HydrophobicContact CZ-CG 3.93Å; F242-I267 CarbonylContact C-O 3.47Å; F242-I267 WeakPolarHBondContact CA-O 3.3Å
243	Q	89.3	Confident	86.8	Confident	11 Å²	11	50.3 Å²	50.3	5%	0.051	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	133.7	179.2	-169.9	179.7	16.5	0	0	109.1	T181 I245 I267 T272	T181-Q243 VanDerWaalsContact O-CG 3.28Å; T181-Q243 WeakPolarHBondContact O-CG 3.36Å; T181-Q243 PolarHBondContact O-NE2 3.29Å; Q243-I245 HydrophobicContact CG-CG1 4.45Å; Q243-I267 HydrophobicContact CB-CB 4.35Å; Q243-I267 PolarHBondContact N-O 2.97Å; Q243-I267 PolarHBondContact O-N 2.85Å; Q243-T272 HydrophobicContact CB-CG2 3.8Å
244	E	89.9	Confident	86.6	Confident	24 Å²	24	49.2 Å²	49.2	11%	0.112	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.3	172.3	-59.6	-168	140.9	0	0	110.2	T181 F242 Q266 R290 L434	T181-E244 HydrophobicContact CG2-CB 4.35Å; T181-E244 PolarHBondContact N-O 3.47Å; T181-E244 WeakPolarHBondContact OG1-CA 3.27Å; T181-E244 PolarHBondContact OG1-N 3.26Å; T181-E244 PolarHBondContact OG1-O 2.87Å; F242-E244 HydrophobicContact CD1-CG 4.38Å; F242-E244 HydrophobicContact CE1-CG 3.36Å; F242-E244 HydrophobicContact CZ-CG 3.45Å; F242-E244 VanDerWaalsContact CZ-CG 3.45Å; F242-E244 WeakPolarHBondContact CZ-OE1 3.45Å; E244-Q266 HydrophobicContact CG-CG 4.31Å; E244-Q266 PolarHBondContact OE1-NE2 2.8Å; E244-R290 IonicContact OE1-NH1 3.66Å; E244-L434 VanDerWaalsContact OE2-CD1 3.26Å; E244-L434 WeakPolarHBondContact OE2-CD1 3.43Å
245	I	89.8	Confident	86.6	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139	178.2	-57.4	-163.4	0	0	0	109.1	V177 R179 A180 Q243 V265 I267 V275 M283	V177-I245 HydrophobicContact CB-CG2 4.18Å; V177-I245 HydrophobicContact CG1-CG2 3.32Å; V177-I245 HydrophobicContact CG2-CG2 3.82Å; R179-I245 CarbonylContact O-C 3.5Å; R179-I245 WeakPolarHBondContact O-CA 3.46Å; R179-I245 WeakPolarHBondContact O-CG2 3.48Å; A180-I245 HydrophobicContact CB-CD1 4.22Å; A180-I245 HydrophobicContact CB-CG1 4.13Å; Q243-I245 HydrophobicContact CG-CG1 4.45Å; I245-V265 HydrophobicContact CB-CB 4.5Å; I245-V265 PolarHBondContact N-O 3.45Å; I245-V265 PolarHBondContact O-N 3.24Å; I245-I267 HydrophobicContact CD1-CD1 3.36Å; I245-I267 HydrophobicContact CD1-CG1 4.39Å; I245-I267 HydrophobicContact CG1-CD1 3.89Å; I245-I267 HydrophobicContact CG1-CG1 4.45Å; I245-V275 HydrophobicContact CD1-CB 4.16Å; I245-V275 HydrophobicContact CD1-CG2 4.47Å; I245-M283 HydrophobicContact CD1-CE 4.44Å; I245-M283 HydrophobicContact CG2-CE 4.26Å
246	R	90.2	Very high	86.6	Confident	80 Å²	80	47.6 Å²	47.6	30%	0.302	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	119.8	170.6	-63.2	-163.2	-69.7	-173	-1.4	109.9	I178 R179 E441	I178-R246 PolarHBondContact N-O 3.43Å; R179-R246 HydrophobicContact CB-CB 4.35Å; R179-R246 PolarHBondContact O-N 3.19Å; R246-E441 IonicContact NH2-OE1 3.95Å; R246-E441 PolarHBondContact NH2-OE1 3.31Å
247	L	91.1	Very high	86.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	139.3	178.7	-167.6	74.7	0	0	0	110.2	I159 V173 G175 I176 V177 T262 L263 V265 M283	I159-L247 HydrophobicContact CD1-CB 4.44Å; I159-L247 HydrophobicContact CD1-CD2 4.09Å; I159-L247 HydrophobicContact CD1-CG 4.12Å; V173-L247 HydrophobicContact CG1-CD2 3.97Å; G175-L247 VanDerWaalsContact C-CD1 3.49Å; I176-L247 CarbonylContact O-C 3.54Å; V177-L247 HydrophobicContact CG2-CD1 3.89Å; L247-T262 CarbonylContact O-C 3.55Å; L247-T262 WeakPolarHBondContact O-CA 3.46Å; L247-L263 PolarHBondContact N-O 3.22Å; L247-L263 PolarHBondContact O-N 2.97Å; L247-V265 HydrophobicContact CB-CG2 4.11Å; L247-M283 HydrophobicContact CD1-CE 4.39Å; L247-M283 HydrophobicContact CD1-SD 4.04Å; L247-M283 HydrophobicContact CD2-SD 4.25Å
248	Q	89.8	Confident	86.8	Confident	58 Å²	58	54 Å²	54	27%	0.271	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	150.1	176.3	-165.8	174.1	20.1	0	0	111.7	I159 G175 I176 I178 P260 T262	I159-Q248 VanDerWaalsContact CD1-C 3.47Å; G175-Q248 CarbonylContact C-O 3.53Å; G175-Q248 WeakPolarHBondContact CA-O 3.32Å; I176-Q248 PolarHBondContact N-O 2.86Å; I176-Q248 PolarHBondContact O-N 2.88Å; I178-Q248 HydrophobicContact CD1-CB 3.59Å; I178-Q248 HydrophobicContact CD1-CG 4.03Å; I178-Q248 HydrophobicContact CG1-CB 3.79Å; Q248-P260 HydrophobicContact CG-CB 4.01Å; Q248-P260 VanDerWaalsContact NE2-CG 3.27Å; Q248-T262 HydrophobicContact CB-CG2 4.48Å; Q248-T262 HydrophobicContact CG-CG2 4.32Å
249	E	88.7	Confident	86.8	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.019	34%	0.336	C	S	.	.			trans	-57.7	144.7	171.3	-71.7	175.2	176.7	0	0	111.4	I159 R160 V254 P260 R261	I159-E249 HydrophobicContact CB-CG 3.55Å; I159-E249 WeakPolarHBondContact CB-OE1 3.16Å; I159-E249 HydrophobicContact CD1-CG 3.94Å; I159-E249 HydrophobicContact CG1-CG 3.94Å; I159-E249 HydrophobicContact CG2-CG 4.43Å; R160-E249 VanDerWaalsContact CA-OE1 3.31Å; R160-E249 WeakPolarHBondContact CA-OE1 3.42Å; R160-E249 VanDerWaalsContact CB-OE1 3.24Å; R160-E249 WeakPolarHBondContact CB-OE1 2.92Å; R160-E249 PolarHBondContact N-OE1 3.03Å; R160-E249 IonicContact NE-OE2 2.84Å; R160-E249 IonicContact NH2-OE2 3.42Å; R160-E249 PolarHBondContact NH2-OE2 3.42Å; E249-V254 HydrophobicContact CB-CG2 4.19Å; E249-P260 HydrophobicContact CB-CB 4.29Å; E249-R261 PolarHBondContact N-O 3.17Å; E249-R261 WeakPolarHBondContact OE1-CB 3.48Å; E249-R261 PolarHBondContact OE2-N 3.3Å
250	H	82.1	Confident	86.8	Confident	24 Å²	24	58.3 Å²	58.3	11%	0.111	33%	0.333	C	S	.	.			trans	-67.1	135.1	170.2	-160.3	-85.1	0	0	0	109.6	D252 Q253 H280	H250-D252 IonicContact CE1-OD1 2.77Å; H250-D252 IonicContact CE1-OD2 3.58Å; H250-D252 PolarHBondContact CE1-OD2 3.15Å; H250-D252 WeakPolarHBondContact ND1-CB 3.34Å; H250-D252 PolarHBondContact ND1-N 3.26Å; H250-D252 IonicContact ND1-OD1 3.62Å; H250-D252 IonicContact ND1-OD2 3.49Å; H250-D252 PolarHBondContact ND1-OD2 2.95Å; H250-D252 PolarHBondContact O-N 2.76Å; H250-Q253 HydrophobicContact CB-CG 4.35Å; H250-Q253 PolarHBondContact O-N 2.81Å; H250-H280 AromaticContact CD2-CE1 3.73Å; H250-H280 AromaticContact CD2-ND1 3.55Å; H250-H280 AromaticContact NE2-CE1 3.43Å; H250-H280 PolarHBondContact NE2-CE1 3.25Å; H250-H280 AromaticContact NE2-ND1 3.63Å
251	P	77.9	Confident	86.8	Confident	82 Å²	82	64.2 Å²	64.2	53%	0.532	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-55.6	-37.9	-177.6	21	-33.3	0	0	0	112.8	Q253 V254	P251-Q253 PolarHBondContact O-N 3.36Å; P251-Q253 VanDerWaalsContact O-N 3.14Å; P251-V254 WeakPolarHBondContact O-CB 3.49Å; P251-V254 PolarHBondContact O-N 3.02Å
252	D	78.3	Confident	86.8	Confident	134 Å²	134	63.2 Å²	63.2	72%	0.717	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-60	-24.3	178.5	-53.5	-4.8	0	0	0	114.4	H250	H250-D252 IonicContact CE1-OD1 2.77Å; H250-D252 IonicContact CE1-OD2 3.58Å; H250-D252 PolarHBondContact CE1-OD2 3.15Å; H250-D252 WeakPolarHBondContact ND1-CB 3.34Å; H250-D252 PolarHBondContact ND1-N 3.26Å; H250-D252 IonicContact ND1-OD1 3.62Å; H250-D252 IonicContact ND1-OD2 3.49Å; H250-D252 PolarHBondContact ND1-OD2 2.95Å; H250-D252 PolarHBondContact O-N 2.76Å
253	Q	79.2	Confident	86.8	Confident	74 Å²	74	62.1 Å²	62.1	35%	0.346	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-93.9	-4.2	-179	-63.6	179.9	-16.8	0	0	112.5	H250 P251 P255	H250-Q253 HydrophobicContact CB-CG 4.35Å; H250-Q253 PolarHBondContact O-N 2.81Å; P251-Q253 PolarHBondContact O-N 3.36Å; P251-Q253 VanDerWaalsContact O-N 3.14Å; Q253-P255 WeakPolarHBondContact O-CD 3.31Å
254	V	84.2	Confident	86.9	Confident	30 Å²	30	64 Å²	64	18%	0.182	36%	0.364	C	S	.	.	S	Bend	trans	-83.7	122.9	-177.5	-175.8	0	0	0	0	108.9	E249 P251 S258 P260	E249-V254 HydrophobicContact CB-CG2 4.19Å; P251-V254 WeakPolarHBondContact O-CB 3.49Å; P251-V254 PolarHBondContact O-N 3.02Å; V254-S258 WeakPolarHBondContact CG1-O 3.1Å; V254-P260 HydrophobicContact CG2-CB 3.97Å
255	P	86.6	Confident	87	Confident	61 Å²	61	62.8 Å²	62.8	40%	0.396	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-59.5	139.9	172.1	-22.3	33.6	0	0	0	110.9	Q253 G257 S258	Q253-P255 WeakPolarHBondContact O-CD 3.31Å; P255-G257 PolarHBondContact O-N 2.83Å; P255-S258 WeakPolarHBondContact O-CB 3.5Å; P255-S258 PolarHBondContact O-N 2.83Å
256	V	85.6	Confident	87.1	Confident	154 Å²	154	64.2 Å²	64.2	93%	0.933	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	128.9	176.7	-66.2	0	0	0	0	110.7	S258	V256-S258 PolarHBondContact O-N 3.05Å
257	G	83.8	Confident	87.2	Confident	88 Å²	88	60.4 Å²	60.4	91%	0.907	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	-6.5	-178.3	0	0	0	0	0	116.2	P255	P255-G257 PolarHBondContact O-N 2.83Å
258	S	88.3	Confident	87.1	Confident	50 Å²	50	61.9 Å²	61.9	35%	0.35	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-92.7	148	171.4	-71	0	0	0	0	112.4	R160 V254 P255 V256	R160-S258 VanDerWaalsContact NH1-CB 3.31Å; R160-S258 PolarHBondContact NH1-OG 3.29Å; V254-S258 WeakPolarHBondContact CG1-O 3.1Å; P255-S258 WeakPolarHBondContact O-CB 3.5Å; P255-S258 PolarHBondContact O-N 2.83Å; V256-S258 PolarHBondContact O-N 3.05Å
259	I	87.2	Confident	86.9	Confident	145 Å²	145	59.3 Å²	59.3	74%	0.744	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-80.9	139.2	170.3	-57.1	172.5	0	0	0	108.9	R160 R261	R160-I259 PolarHBondContact NH2-O 3.23Å; I259-R261 PolarHBondContact O-N 2.79Å
260	P	88.1	Confident	86.8	Confident	46 Å²	46	62.7 Å²	62.7	30%	0.299	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-60.9	133.2	173.7	23.2	-34.1	0	0	0	111.4	Q248 E249 V254	Q248-P260 HydrophobicContact CG-CB 4.01Å; Q248-P260 VanDerWaalsContact NE2-CG 3.27Å; E249-P260 HydrophobicContact CB-CB 4.29Å; V254-P260 HydrophobicContact CG2-CB 3.97Å
261	R	89.7	Confident	87	Confident	142 Å²	142	62.6 Å²	62.6	54%	0.536	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-83	155.1	176.8	-61.1	-179.2	174.4	-177.6	-1.7	111.2	I159 E249 I259	I159-R261 HydrophobicContact CG2-CB 4.44Å; E249-R261 PolarHBondContact N-O 3.17Å; E249-R261 WeakPolarHBondContact OE1-CB 3.48Å; E249-R261 PolarHBondContact OE2-N 3.3Å; I259-R261 PolarHBondContact O-N 2.79Å
262	T	91.1	Very high	87.5	Confident	86 Å²	86	59.3 Å²	59.3	53%	0.528	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	146.9	173.9	59.2	0	0	0	0	110.5	I178 L247 Q248	I178-T262 HydrophobicContact CD1-CG2 3.86Å; L247-T262 CarbonylContact O-C 3.55Å; L247-T262 WeakPolarHBondContact O-CA 3.46Å; Q248-T262 HydrophobicContact CB-CG2 4.48Å; Q248-T262 HydrophobicContact CG-CG2 4.32Å
263	L	91.1	Very high	87.8	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.058	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.2	177.5	-177.7	68.6	0	0	0	109	I159 V173 L247 F287 L308	I159-L263 HydrophobicContact CD1-CB 4.12Å; I159-L263 HydrophobicContact CG2-CB 3.85Å; V173-L263 HydrophobicContact CG1-CD2 4.46Å; L247-L263 PolarHBondContact N-O 3.22Å; L247-L263 PolarHBondContact O-N 2.97Å; L263-F287 HydrophobicContact CD1-CD2 4.4Å; L263-F287 HydrophobicContact CD1-CE2 3.81Å; L263-L308 HydrophobicContact CD2-CB 4.07Å; L263-L308 HydrophobicContact CD2-CD2 4.27Å
264	T	92	Very high	88.1	Confident	49 Å²	49	62.8 Å²	62.8	30%	0.301	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.3	173.9	-55.6	0	0	0	0	109.1	F307 L308	T264-F307 CarbonylContact O-C 3.33Å; T264-F307 VanDerWaalsContact O-CA 3.29Å; T264-F307 WeakPolarHBondContact O-CA 3.39Å; T264-L308 PolarHBondContact O-N 3.35Å
265	V	92.5	Very high	88	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125.9	178.3	-175.5	0	0	0	0	108.2	I245 L247 I267 M283 L308 L310	I245-V265 HydrophobicContact CB-CB 4.5Å; I245-V265 PolarHBondContact N-O 3.45Å; I245-V265 PolarHBondContact O-N 3.24Å; L247-V265 HydrophobicContact CB-CG2 4.11Å; V265-I267 HydrophobicContact CG1-CG1 4.45Å; V265-M283 HydrophobicContact CB-SD 4.08Å; V265-M283 HydrophobicContact CG1-SD 3.84Å; V265-M283 HydrophobicContact CG2-SD 3.75Å; V265-L308 CarbonylContact C-O 3.58Å; V265-L308 WeakPolarHBondContact CA-O 3.37Å; V265-L308 HydrophobicContact CG1-CB 4.45Å; V265-L308 HydrophobicContact CG1-CD2 4.41Å; V265-L308 HydrophobicContact CG2-CB 4.16Å; V265-L308 HydrophobicContact CG2-CD2 4.17Å; V265-L310 HydrophobicContact CG1-CB 3.85Å; V265-L310 HydrophobicContact CG1-CD1 4.14Å; V265-L310 HydrophobicContact CG1-CG 4.49Å
266	Q	92.4	Very high	87.8	Confident	31 Å²	31	60.4 Å²	60.4	15%	0.145	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.1	175.3	-68.5	-170.2	-19.3	0	0	108.9	F242 E244 F307 L308 L310	F242-Q266 HydrophobicContact CE2-CB 3.88Å; F242-Q266 HydrophobicContact CE2-CG 4Å; F242-Q266 HydrophobicContact CZ-CB 4.31Å; F242-Q266 HydrophobicContact CZ-CG 3.93Å; E244-Q266 HydrophobicContact CG-CG 4.31Å; E244-Q266 PolarHBondContact OE1-NE2 2.8Å; Q266-F307 HydrophobicContact CB-CD2 4.11Å; Q266-F307 HydrophobicContact CG-CD2 3.87Å; Q266-F307 HydrophobicContact CG-CG 4.48Å; Q266-F307 VanDerWaalsContact OE1-CD2 3.29Å; Q266-L308 PolarHBondContact N-O 2.83Å; Q266-L310 WeakPolarHBondContact O-CB 3.43Å; Q266-L310 PolarHBondContact O-N 3.26Å
267	I	91.5	Very high	87.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	117.6	177.4	-51.9	-173.3	0	0	0	107.3	F242 Q243 I245 V265 N271 T272 L310	F242-I267 CarbonylContact C-O 3.47Å; F242-I267 WeakPolarHBondContact CA-O 3.3Å; Q243-I267 HydrophobicContact CB-CB 4.35Å; Q243-I267 PolarHBondContact N-O 2.97Å; Q243-I267 PolarHBondContact O-N 2.85Å; I245-I267 HydrophobicContact CD1-CD1 3.36Å; I245-I267 HydrophobicContact CD1-CG1 4.39Å; I245-I267 HydrophobicContact CG1-CD1 3.89Å; I245-I267 HydrophobicContact CG1-CG1 4.45Å; V265-I267 HydrophobicContact CG1-CG1 4.45Å; I267-N271 VanDerWaalsContact CG2-C 3.49Å; I267-N271 HydrophobicContact CG2-CB 3.74Å; I267-N271 WeakPolarHBondContact CG2-O 3.45Å; I267-T272 HydrophobicContact CB-CG2 4.46Å; I267-T272 HydrophobicContact CG2-CG2 3.93Å; I267-L310 HydrophobicContact CB-CD2 4.33Å; I267-L310 HydrophobicContact CD1-CD2 3.52Å; I267-L310 HydrophobicContact CG1-CB 4.01Å; I267-L310 HydrophobicContact CG1-CD2 3.54Å; I267-L310 HydrophobicContact CG1-CG 4.4Å; I267-L310 HydrophobicContact CG2-CD2 4.08Å
268	S	88.4	Confident	87	Confident	30 Å²	30	53.1 Å²	53.1	21%	0.21	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	148	168.6	46.4	0	0	0	0	109.4	Y147 K241	Y147-S268 PolarHBondContact OH-O 3.13Å; K241-S268 CarbonylContact O-C 3.57Å; K241-S268 WeakPolarHBondContact O-CA 3.22Å
269	G	86.9	Confident	86.7	Confident	4 Å²	4	50.8 Å²	50.8	4%	0.041	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	89.4	-148.4	166.3	0	0	0	0	0	116.2	E145 K241 N271 T272	E145-G269 VanDerWaalsContact OE1-CA 3.32Å; E145-G269 WeakPolarHBondContact OE1-CA 3.48Å; E145-G269 WeakPolarHBondContact OE2-CA 3.23Å; K241-G269 PolarHBondContact O-N 3.24Å; G269-N271 VanDerWaalsContact C-N 3.29Å; G269-N271 PolarHBondContact O-N 3.22Å; G269-T272 WeakPolarHBondContact O-CG2 3.18Å; G269-T272 PolarHBondContact O-OG1 3.44Å
270	E	85.7	Confident	86.5	Confident	75 Å²	75	45.9 Å²	45.9	35%	0.35	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-75.8	-16	-177.4	-53.6	-149.3	123.1	0	0	113.8	Q53 C54 E145 T272	Q53-E270 HydrophobicContact CB-CG 4.19Å; Q53-E270 PolarHBondContact OE1-OE1 2.87Å; C54-E270 WeakPolarHBondContact SG-CB 3.39Å; C54-E270 PolarHBondContact SG-OE2 3.44Å; E145-E270 PolarHBondContact OE2-N 2.72Å; E270-T272 PolarHBondContact O-N 3.14Å
271	N	85.9	Confident	86.4	Confident	22 Å²	22	43.7 Å²	43.7	12%	0.118	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-67.8	-0.6	175.5	-72	-24.6	0	0	0	113.9	Y147 I267 G269 L274 H311	Y147-N271 WeakPolarHBondContact CE2-ND2 3.48Å; Y147-N271 VanDerWaalsContact CZ-ND2 3.34Å; I267-N271 VanDerWaalsContact CG2-C 3.49Å; I267-N271 HydrophobicContact CG2-CB 3.74Å; I267-N271 WeakPolarHBondContact CG2-O 3.45Å; G269-N271 VanDerWaalsContact C-N 3.29Å; G269-N271 PolarHBondContact O-N 3.22Å; N271-L274 HydrophobicContact CB-CD1 3.99Å; N271-L274 WeakPolarHBondContact O-CD1 3.47Å; N271-L274 WeakPolarHBondContact O-CG 3.34Å; N271-H311 PolarHBondContact ND2-O 3.03Å
272	T	88	Confident	86.4	Confident	14 Å²	14	38.8 Å²	38.8	9%	0.086	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	147.1	175.3	52.9	0	0	0	0	111.4	V183 K241 Q243 I267 G269 E270 L274	V183-T272 HydrophobicContact CG1-CG2 4.46Å; V183-T272 HydrophobicContact CG2-CG2 4.49Å; K241-T272 HydrophobicContact CB-CG2 4.01Å; Q243-T272 HydrophobicContact CB-CG2 3.8Å; I267-T272 HydrophobicContact CB-CG2 4.46Å; I267-T272 HydrophobicContact CG2-CG2 3.93Å; G269-T272 WeakPolarHBondContact O-CG2 3.18Å; G269-T272 PolarHBondContact O-OG1 3.44Å; E270-T272 PolarHBondContact O-N 3.14Å; T272-L274 VanDerWaalsContact C-N 3.27Å; T272-L274 PolarHBondContact O-N 3.18Å
273	R	85.9	Confident	86.4	Confident	198 Å²	198	34.7 Å²	34.7	75%	0.747	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.9	10.3	-179.1	-51.2	179.1	176.3	179.6	-2.8	116.6	V183 V275	V183-R273 HydrophobicContact CG2-CG 3.63Å; R273-V275 VanDerWaalsContact C-N 3.35Å
274	L	84.6	Confident	86.4	Confident	82 Å²	82	34.1 Å²	34.1	43%	0.429	18%	0.179	S	C	.	.	S	Bend	trans	-69.6	-30.8	175.7	-68.6	177.6	0	0	0	113.5	N271 T272 C315	N271-L274 HydrophobicContact CB-CD1 3.99Å; N271-L274 WeakPolarHBondContact O-CD1 3.47Å; N271-L274 WeakPolarHBondContact O-CG 3.34Å; T272-L274 VanDerWaalsContact C-N 3.27Å; T272-L274 PolarHBondContact O-N 3.18Å; L274-C315 PolarHBondContact O-SG 2.82Å
275	V	83.7	Confident	86.4	Confident	8 Å²	8	31.8 Å²	31.8	5%	0.048	17%	0.165	C	C	.	.			trans	-114.9	138.6	-173.2	-159.3	0	0	0	0	111.1	V177 I245 R273 D279 A281 M283 C313	V177-V275 HydrophobicContact CB-CG1 4.08Å; V177-V275 HydrophobicContact CG2-CB 4.38Å; V177-V275 HydrophobicContact CG2-CG1 3.43Å; V177-V275 VanDerWaalsContact CG2-CG1 3.43Å; I245-V275 HydrophobicContact CD1-CB 4.16Å; I245-V275 HydrophobicContact CD1-CG2 4.47Å; R273-V275 VanDerWaalsContact C-N 3.35Å; V275-D279 HydrophobicContact CG1-CB 3.92Å; V275-A281 HydrophobicContact CG1-CB 4.06Å; V275-M283 HydrophobicContact CB-CE 4.43Å; V275-M283 HydrophobicContact CG1-CE 4.4Å; V275-M283 HydrophobicContact CG2-CE 3.86Å; V275-C313 WeakPolarHBondContact CG2-SG 3.38Å
276	A	80.6	Confident	86.4	Confident	34 Å²	34	31.9 Å²	31.9	28%	0.281	17%	0.165	S	C	.	.			trans	-105.3	155.6	172.4	0	0	0	0	0	110.5	D279	A276-D279 WeakPolarHBondContact CB-OD2 3.16Å; A276-D279 PolarHBondContact N-OD2 3.34Å; A276-D279 WeakPolarHBondContact O-CB 3.4Å; A276-D279 PolarHBondContact O-N 2.82Å
277	P	79.8	Confident	86.4	Confident	75 Å²	75	31 Å²	31	49%	0.487	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	139.7	169.4	27.2	-34.8	0	0	0	110.9	V177 I178 D279	V177-P277 CarbonylContact O-C 3.44Å; V177-P277 WeakPolarHBondContact O-CA 3.47Å; I178-P277 WeakPolarHBondContact O-CB 3.28Å; P277-D279 VanDerWaalsContact C-N 3.34Å
278	G	74.7	Confident	86.3	Confident	13 Å²	13	32.3 Å²	32.3	13%	0.134	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	-11.9	-174.1	0	0	0	0	0	114.9	V177	V177-G278 PolarHBondContact O-N 3.44Å
279	D	81.1	Confident	86.3	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.173	C	C	.	.			trans	-74.2	136.3	177.6	-77.5	-31.7	0	0	0	111.6	V177 V275 A276 P277 A281 S317 K318 R411	V177-D279 PolarHBondContact N-O 2.87Å; V275-D279 HydrophobicContact CG1-CB 3.92Å; A276-D279 WeakPolarHBondContact CB-OD2 3.16Å; A276-D279 PolarHBondContact N-OD2 3.34Å; A276-D279 WeakPolarHBondContact O-CB 3.4Å; A276-D279 PolarHBondContact O-N 2.82Å; P277-D279 VanDerWaalsContact C-N 3.34Å; D279-A281 PolarHBondContact O-N 3.19Å; D279-S317 VanDerWaalsContact CG-OG 3.23Å; D279-S317 PolarHBondContact OD1-OG 2.69Å; D279-K318 VanDerWaalsContact OD2-CE 3.23Å; D279-K318 WeakPolarHBondContact OD2-CE 3.48Å; D279-K318 IonicContact OD2-NZ 3.36Å; D279-K318 PolarHBondContact OD2-NZ 2.76Å; D279-R411 IonicContact OD1-CZ 3.77Å; D279-R411 IonicContact OD1-NH2 2.89Å; D279-R411 PolarHBondContact OD1-NH2 3.2Å
280	H	82.2	Confident	86.1	Confident	43 Å²	43	36.4 Å²	36.4	20%	0.199	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	115.3	165	-63.4	-91.9	0	0	0	108.2	I176 H250 C315 L316	I176-H280 WeakPolarHBondContact CG1-ND1 3.43Å; H250-H280 AromaticContact CD2-CE1 3.73Å; H250-H280 AromaticContact CD2-ND1 3.55Å; H250-H280 AromaticContact NE2-CE1 3.43Å; H250-H280 PolarHBondContact NE2-CE1 3.25Å; H250-H280 AromaticContact NE2-ND1 3.63Å; H280-C315 CarbonylContact O-C 3.59Å; H280-L316 HydrophobicContact CB-CB 4.4Å; H280-L316 PolarHBondContact O-N 3.3Å
281	A	86.8	Confident	85.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	139.8	-177.6	0	0	0	0	0	111	G175 V177 V275 D279 M283 I314	G175-A281 PolarHBondContact N-O 2.92Å; G175-A281 PolarHBondContact O-N 2.9Å; V177-A281 HydrophobicContact CG2-CB 4.33Å; V275-A281 HydrophobicContact CG1-CB 4.06Å; D279-A281 PolarHBondContact O-N 3.19Å; A281-M283 HydrophobicContact CB-CE 4Å; A281-M283 HydrophobicContact CB-CG 4.27Å; A281-I314 WeakPolarHBondContact CA-O 3.34Å
282	Q	89.8	Confident	84.6	Confident	38 Å²	38	41.5 Å²	41.5	18%	0.178	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.6	162.5	-178.1	173.6	-17.9	0	0	107.4	V173 C313 I314	V173-Q282 WeakPolarHBondContact O-CA 3.49Å; Q282-C313 WeakPolarHBondContact O-CA 3.48Å; Q282-I314 HydrophobicContact CB-CB 4.47Å; Q282-I314 PolarHBondContact N-O 3.33Å; Q282-I314 PolarHBondContact O-N 3.44Å
283	M	91	Very high	83.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.7	-175.7	-71.2	-176.7	172	0	0	108.5	V173 V177 I245 L247 V265 V275 A281 L308 L310	V173-M283 PolarHBondContact N-O 2.87Å; V173-M283 PolarHBondContact O-N 2.83Å; V177-M283 HydrophobicContact CG2-CE 3.72Å; I245-M283 HydrophobicContact CD1-CE 4.44Å; I245-M283 HydrophobicContact CG2-CE 4.26Å; L247-M283 HydrophobicContact CD1-CE 4.39Å; L247-M283 HydrophobicContact CD1-SD 4.04Å; L247-M283 HydrophobicContact CD2-SD 4.25Å; V265-M283 HydrophobicContact CB-SD 4.08Å; V265-M283 HydrophobicContact CG1-SD 3.84Å; V265-M283 HydrophobicContact CG2-SD 3.75Å; V275-M283 HydrophobicContact CB-CE 4.43Å; V275-M283 HydrophobicContact CG1-CE 4.4Å; V275-M283 HydrophobicContact CG2-CE 3.86Å; A281-M283 HydrophobicContact CB-CE 4Å; A281-M283 HydrophobicContact CB-CG 4.27Å; M283-L308 HydrophobicContact CB-CD2 4.28Å; M283-L310 HydrophobicContact CB-CD1 3.52Å; M283-L310 HydrophobicContact CG-CD1 3.75Å; M283-L310 HydrophobicContact SD-CD1 4.33Å
284	T	91.5	Very high	82.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.6	175.1	-45.2	0	0	0	0	108.3	P150 L170 V171 T172 H311 H312	P150-T284 HydrophobicContact CB-CG2 3.94Å; P150-T284 HydrophobicContact CG-CG2 3.93Å; P150-T284 WeakPolarHBondContact CG-OG1 3.48Å; L170-T284 HydrophobicContact CD1-CG2 4.04Å; L170-T284 HydrophobicContact CD2-CG2 4.03Å; L170-T284 HydrophobicContact CG-CG2 3.81Å; V171-T284 WeakPolarHBondContact O-CA 3.46Å; T172-T284 HydrophobicContact CG2-CG2 3.73Å; T172-T284 WeakPolarHBondContact CG2-OG1 3.48Å; T284-H311 PolarHBondContact O-N 3.32Å; T284-H312 PolarHBondContact N-O 3.05Å; T284-H312 PolarHBondContact O-N 3.06Å; T284-H312 VanDerWaalsContact O-N 3.1Å
285	G	91.4	Very high	81.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	178.2	-177.2	0	0	0	0	0	113.5	V171 E309	V171-G285 PolarHBondContact N-O 2.96Å; V171-G285 PolarHBondContact O-N 2.83Å; G285-E309 CarbonylContact C-O 3.57Å; G285-E309 WeakPolarHBondContact CA-O 3.46Å
286	V	92.1	Very high	80.3	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.6	178.9	-168.4	0	0	0	0	108.7	T77 L170 L288 L308 E309	T77-V286 HydrophobicContact CG2-CG2 4.19Å; T77-V286 WeakPolarHBondContact OG1-CG1 3.27Å; T77-V286 WeakPolarHBondContact OG1-CG2 3.36Å; L170-V286 HydrophobicContact CD1-CG2 4.32Å; V286-L288 HydrophobicContact CB-CG 4.39Å; V286-L288 HydrophobicContact CG1-CD1 4.38Å; V286-L288 HydrophobicContact CG1-CD2 3.89Å; V286-L288 HydrophobicContact CG1-CG 3.93Å; V286-L288 PolarHBondContact O-N 3.29Å; V286-L308 WeakPolarHBondContact O-CA 3.48Å; V286-E309 HydrophobicContact CB-CB 4.48Å; V286-E309 PolarHBondContact N-O 3.46Å; V286-E309 PolarHBondContact O-N 2.77Å
287	F	92.4	Very high	79.3	Confident	13 Å²	13	54.6 Å²	54.6	6%	0.057	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	113	178.8	-173.5	-110.4	0	0	0	110.2	V162 V167 G168 K169 L263 T306 L308	V162-F287 HydrophobicContact CG1-CD1 3.88Å; V162-F287 HydrophobicContact CG1-CD2 3.84Å; V162-F287 HydrophobicContact CG1-CE1 3.9Å; V162-F287 HydrophobicContact CG1-CE2 3.84Å; V162-F287 HydrophobicContact CG1-CG 3.84Å; V162-F287 HydrophobicContact CG1-CZ 3.85Å; V167-F287 HydrophobicContact CG2-CD1 3.83Å; V167-F287 HydrophobicContact CG2-CE1 3.93Å; G168-F287 PolarHBondContact N-O 2.84Å; K169-F287 PolarHBondContact O-N 3.05Å; L263-F287 HydrophobicContact CD1-CD2 4.4Å; L263-F287 HydrophobicContact CD1-CE2 3.81Å; F287-T306 HydrophobicContact CE1-CG2 3.86Å; F287-T306 HydrophobicContact CE2-CG2 4.24Å; F287-T306 HydrophobicContact CZ-CG2 3.49Å; F287-T306 VanDerWaalsContact CZ-CG2 3.49Å; F287-T306 WeakPolarHBondContact CZ-OG1 3.43Å; F287-L308 HydrophobicContact CB-CD1 4.22Å
288	L	90.4	Very high	78.2	Confident	27 Å²	27	59 Å²	59	14%	0.141	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.4	-172.8	-65.2	175.2	0	0	0	112	V286 T306 F307 E309	V286-L288 HydrophobicContact CB-CG 4.39Å; V286-L288 HydrophobicContact CG1-CD1 4.38Å; V286-L288 HydrophobicContact CG1-CD2 3.89Å; V286-L288 HydrophobicContact CG1-CG 3.93Å; V286-L288 PolarHBondContact O-N 3.29Å; L288-T306 WeakPolarHBondContact O-CA 3.48Å; L288-F307 HydrophobicContact CB-CD1 4.46Å; L288-F307 HydrophobicContact CB-CE1 3.88Å; L288-F307 HydrophobicContact CB-CE2 4.35Å; L288-F307 HydrophobicContact CB-CZ 3.83Å; L288-F307 HydrophobicContact CD1-CZ 4.23Å; L288-F307 PolarHBondContact N-O 2.82Å; L288-F307 VanDerWaalsContact O-CD1 3.31Å; L288-F307 WeakPolarHBondContact O-CD1 3.49Å; L288-F307 PolarHBondContact O-N 3.35Å; L288-F307 VanDerWaalsContact O-O 3.1Å; L288-E309 HydrophobicContact CD1-CB 4.39Å; L288-E309 WeakPolarHBondContact CD1-OE2 3.41Å
289	P	88.9	Confident	77.6	Confident	50 Å²	50	64.4 Å²	64.4	33%	0.325	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.5	168.5	31.6	-32.3	0	0	0	110.3	D305	P289-D305 CarbonylContact C-O 3.56Å
290	R	82	Confident	76.5	Confident	70 Å²	70	68 Å²	68	26%	0.264	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120.1	171.5	-169.3	172.2	170.2	168.1	-0.3	109.3	E244 K292 D305 F307	E244-R290 IonicContact OE1-NH1 3.66Å; R290-K292 PolarHBondContact O-N 2.91Å; R290-D305 HydrophobicContact CB-CB 4.39Å; R290-D305 WeakPolarHBondContact CB-O 3.29Å; R290-D305 PolarHBondContact N-O 2.82Å; R290-F307 HydrophobicContact CB-CD1 3.75Å; R290-F307 HydrophobicContact CB-CE1 3.97Å; R290-F307 HydrophobicContact CG-CD1 4.48Å
291	L	74.3	Confident	75.8	Confident	141 Å²	141	68.1 Å²	68.1	74%	0.738	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-79.9	118.1	170.2	-60	174.8	0	0	0	108.9
292	K	66.7	Low	75.1	Confident	64 Å²	64	76.6 Å²	76.6	28%	0.278	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-93.6	120	168.7	-77.2	174.6	170.2	166.3	0	108.5	R290 D305	R290-K292 PolarHBondContact O-N 2.91Å; K292-D305 WeakPolarHBondContact CE-OD2 3.31Å; K292-D305 IonicContact NZ-OD1 3.63Å; K292-D305 IonicContact NZ-OD2 3.99Å; K292-D305 PolarHBondContact NZ-OD2 3.16Å
293	A	66.1	Low	74.1	Confident	73 Å²	73	80.9 Å²	80.9	60%	0.603	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-83.8	149	171.3	0	0	0	0	0	111
294	G	65.7	Low	73.1	Confident	50 Å²	50	83.9 Å²	83.9	52%	0.515	45%	0.451	S	S	.	.	S	Bend	trans	102.9	-166	170.4	0	0	0	0	0	115.3	R296 Q297	G294-R296 PolarHBondContact O-N 3.37Å; G294-Q297 VanDerWaalsContact O-CB 3.28Å; G294-Q297 WeakPolarHBondContact O-CB 3.44Å; G294-Q297 PolarHBondContact O-N 2.96Å
295	F	59.6	Low	72.5	Confident	189 Å²	189	87 Å²	87	83%	0.829	47%	0.467	S	S	*	.	H	α-helix	trans	-51.9	-28.8	-175	-94.1	-90.6	0	0	0	114.6	Q297 M298	F295-Q297 VanDerWaalsContact C-N 3.27Å; F295-Q297 PolarHBondContact O-N 3.1Å; F295-M298 PolarHBondContact O-N 2.91Å
296	R	59.3	Low	72.4	Confident	177 Å²	177	89.7 Å²	89.7	67%	0.668	48%	0.484	S	S	*	.	H	α-helix	trans	-65.9	-26.3	177.1	-77.8	-177	173.7	166.1	-2.6	113.5	G294 M298 V299 Q300	G294-R296 PolarHBondContact O-N 3.37Å; R296-M298 VanDerWaalsContact C-N 3.26Å; R296-M298 PolarHBondContact O-N 2.72Å; R296-V299 PolarHBondContact O-N 3.48Å; R296-Q300 PolarHBondContact O-N 3.25Å; R296-Q300 VanDerWaalsContact O-N 3.07Å
297	Q	59.8	Low	72.4	Confident	121 Å²	121	91 Å²	91	57%	0.565	49%	0.49	S	S	*	.	H	α-helix	trans	-65.4	-32.7	175.3	-166.2	176	-3.6	0	0	111.6	G294 F295 G301	G294-Q297 VanDerWaalsContact O-CB 3.28Å; G294-Q297 WeakPolarHBondContact O-CB 3.44Å; G294-Q297 PolarHBondContact O-N 2.96Å; F295-Q297 VanDerWaalsContact C-N 3.27Å; F295-Q297 PolarHBondContact O-N 3.1Å; Q297-G301 PolarHBondContact O-N 2.85Å; Q297-G301 VanDerWaalsContact O-N 3.11Å
298	M	57.1	Low	72.4	Confident	167 Å²	167	90.4 Å²	90.4	82%	0.823	49%	0.487	S	S	*	.	H	α-helix	trans	-74	-31.1	179.3	-165	174.4	164	0	0	112.4	F295 R296	F295-M298 PolarHBondContact O-N 2.91Å; R296-M298 VanDerWaalsContact C-N 3.26Å; R296-M298 PolarHBondContact O-N 2.72Å
299	V	60.8	Low	72.4	Confident	128 Å²	128	91.3 Å²	91.3	78%	0.776	49%	0.49	S	S	*	.	H	α-helix	trans	-83.7	-34.9	179.7	-178.6	0	0	0	0	112.3	R296	R296-V299 PolarHBondContact O-N 3.48Å
300	Q	58.6	Low	72.6	Confident	75 Å²	75	89 Å²	89	35%	0.35	48%	0.475	S	S	.	.	H	α-helix	trans	-95.1	-5.5	-177.1	-66.6	-170.3	-55.8	0	0	114	R296 L302 L303	R296-Q300 PolarHBondContact O-N 3.25Å; R296-Q300 VanDerWaalsContact O-N 3.07Å; Q300-L302 PolarHBondContact O-N 3.28Å; Q300-L303 HydrophobicContact CB-CB 4.44Å; Q300-L303 VanDerWaalsContact O-CB 3.29Å; Q300-L303 WeakPolarHBondContact O-CB 3.46Å; Q300-L303 PolarHBondContact O-N 3.05Å
301	G	68.4	Low	72.9	Confident	47 Å²	47	86 Å²	86	49%	0.485	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-123.3	179.3	0	0	0	0	0	112.2	Q297	Q297-G301 PolarHBondContact O-N 2.85Å; Q297-G301 VanDerWaalsContact O-N 3.11Å
302	L	70.5	Confident	73.5	Confident	178 Å²	178	81.1 Å²	81.1	93%	0.932	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	3.2	179.3	-64.3	171.3	0	0	0	113.7	Q300 S304	Q300-L302 PolarHBondContact O-N 3.28Å; L302-S304 PolarHBondContact O-N 3.46Å
303	L	70	Confident	74.4	Confident	127 Å²	127	78.8 Å²	78.8	67%	0.665	43%	0.429	S	S	*	.			trans	-70.7	105.9	179.4	-153.5	89.1	0	0	0	109.3	Q300	Q300-L303 HydrophobicContact CB-CB 4.44Å; Q300-L303 VanDerWaalsContact O-CB 3.29Å; Q300-L303 WeakPolarHBondContact O-CB 3.46Å; Q300-L303 PolarHBondContact O-N 3.05Å
304	S	69.7	Low	75.3	Confident	63 Å²	63	77.5 Å²	77.5	44%	0.441	41%	0.412	S	S	.	.			trans	-94.2	128	177.2	40.6	0	0	0	0	110	L302	L302-S304 PolarHBondContact O-N 3.46Å
305	D	79.8	Confident	75.8	Confident	65 Å²	65	75.7 Å²	75.7	35%	0.348	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	141.9	164	-72.1	-13.3	0	0	0	107.9	P289 R290 K292	P289-D305 CarbonylContact C-O 3.56Å; R290-D305 HydrophobicContact CB-CB 4.39Å; R290-D305 WeakPolarHBondContact CB-O 3.29Å; R290-D305 PolarHBondContact N-O 2.82Å; K292-D305 WeakPolarHBondContact CE-OD2 3.31Å; K292-D305 IonicContact NZ-OD1 3.63Å; K292-D305 IonicContact NZ-OD2 3.99Å; K292-D305 PolarHBondContact NZ-OD2 3.16Å
306	T	87.9	Confident	76.3	Confident	58 Å²	58	69.3 Å²	69.3	36%	0.356	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	148.3	-179.7	53.5	0	0	0	0	110.6	F287 L288	F287-T306 HydrophobicContact CE1-CG2 3.86Å; F287-T306 HydrophobicContact CE2-CG2 4.24Å; F287-T306 HydrophobicContact CZ-CG2 3.49Å; F287-T306 VanDerWaalsContact CZ-CG2 3.49Å; F287-T306 WeakPolarHBondContact CZ-OG1 3.43Å; L288-T306 WeakPolarHBondContact O-CA 3.48Å
307	F	91.8	Very high	76.3	Confident	28 Å²	28	62.6 Å²	62.6	12%	0.123	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	157.2	173.8	70.7	-78.8	0	0	0	109.8	T264 Q266 L288 R290 E309	T264-F307 CarbonylContact O-C 3.33Å; T264-F307 VanDerWaalsContact O-CA 3.29Å; T264-F307 WeakPolarHBondContact O-CA 3.39Å; Q266-F307 HydrophobicContact CB-CD2 4.11Å; Q266-F307 HydrophobicContact CG-CD2 3.87Å; Q266-F307 HydrophobicContact CG-CG 4.48Å; Q266-F307 VanDerWaalsContact OE1-CD2 3.29Å; L288-F307 HydrophobicContact CB-CD1 4.46Å; L288-F307 HydrophobicContact CB-CE1 3.88Å; L288-F307 HydrophobicContact CB-CE2 4.35Å; L288-F307 HydrophobicContact CB-CZ 3.83Å; L288-F307 HydrophobicContact CD1-CZ 4.23Å; L288-F307 PolarHBondContact N-O 2.82Å; L288-F307 VanDerWaalsContact O-CD1 3.31Å; L288-F307 WeakPolarHBondContact O-CD1 3.49Å; L288-F307 PolarHBondContact O-N 3.35Å; L288-F307 VanDerWaalsContact O-O 3.1Å; R290-F307 HydrophobicContact CB-CD1 3.75Å; R290-F307 HydrophobicContact CB-CE1 3.97Å; R290-F307 HydrophobicContact CG-CD1 4.48Å; F307-E309 HydrophobicContact CE2-CB 4.27Å
308	L	92.2	Very high	76.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	119	174.5	-170.5	76.1	0	0	0	108.8	V173 L263 T264 V265 Q266 M283 V286 F287 L310	V173-L308 HydrophobicContact CG2-CD2 4.49Å; L263-L308 HydrophobicContact CD2-CB 4.07Å; L263-L308 HydrophobicContact CD2-CD2 4.27Å; T264-L308 PolarHBondContact O-N 3.35Å; V265-L308 CarbonylContact C-O 3.58Å; V265-L308 WeakPolarHBondContact CA-O 3.37Å; V265-L308 HydrophobicContact CG1-CB 4.45Å; V265-L308 HydrophobicContact CG1-CD2 4.41Å; V265-L308 HydrophobicContact CG2-CB 4.16Å; V265-L308 HydrophobicContact CG2-CD2 4.17Å; Q266-L308 PolarHBondContact N-O 2.83Å; M283-L308 HydrophobicContact CB-CD2 4.28Å; V286-L308 WeakPolarHBondContact O-CA 3.48Å; F287-L308 HydrophobicContact CB-CD1 4.22Å; L308-L310 PolarHBondContact O-N 2.92Å
309	E	92.4	Very high	75.4	Confident	46 Å²	46	54.3 Å²	54.3	22%	0.215	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	111.3	171	-175.7	172.9	-171.6	0	0	108.7	R78 G285 V286 L288 F307	R78-E309 IonicContact NH1-OE2 3.25Å; R78-E309 PolarHBondContact NH1-OE2 2.86Å; G285-E309 CarbonylContact C-O 3.57Å; G285-E309 WeakPolarHBondContact CA-O 3.46Å; V286-E309 HydrophobicContact CB-CB 4.48Å; V286-E309 PolarHBondContact N-O 3.46Å; V286-E309 PolarHBondContact O-N 2.77Å; L288-E309 HydrophobicContact CD1-CB 4.39Å; L288-E309 WeakPolarHBondContact CD1-OE2 3.41Å; F307-E309 HydrophobicContact CE2-CB 4.27Å
310	L	92.3	Very high	74.7	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127.3	-172.9	-173	80.1	0	0	0	111.5	V265 Q266 I267 M283 L308 H312 C313	V265-L310 HydrophobicContact CG1-CB 3.85Å; V265-L310 HydrophobicContact CG1-CD1 4.14Å; V265-L310 HydrophobicContact CG1-CG 4.49Å; Q266-L310 WeakPolarHBondContact O-CB 3.43Å; Q266-L310 PolarHBondContact O-N 3.26Å; I267-L310 HydrophobicContact CB-CD2 4.33Å; I267-L310 HydrophobicContact CD1-CD2 3.52Å; I267-L310 HydrophobicContact CG1-CB 4.01Å; I267-L310 HydrophobicContact CG1-CD2 3.54Å; I267-L310 HydrophobicContact CG1-CG 4.4Å; I267-L310 HydrophobicContact CG2-CD2 4.08Å; M283-L310 HydrophobicContact CB-CD1 3.52Å; M283-L310 HydrophobicContact CG-CD1 3.75Å; M283-L310 HydrophobicContact SD-CD1 4.33Å; L308-L310 PolarHBondContact O-N 2.92Å; L310-H312 WeakPolarHBondContact CD1-O 3.23Å; L310-C313 HydrophobicContact CD1-CB 4.18Å; L310-C313 HydrophobicContact CD2-CB 3.82Å; L310-C313 HydrophobicContact CG-CB 4.47Å
311	H	88.1	Confident	73.8	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.037	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-42.1	169.2	-72.8	-164.3	0	0	0	111.9	Y147 F148 N271 T284	Y147-H311 WeakPolarHBondContact CB-O 3.13Å; Y147-H311 HydrophobicContact CD1-CB 4.24Å; Y147-H311 WeakPolarHBondContact CD1-O 3.29Å; F148-H311 AromaticContact CD2-ND1 3.94Å; N271-H311 PolarHBondContact ND2-O 3.03Å; T284-H311 PolarHBondContact O-N 3.32Å
312	H	87	Confident	72.3	Confident	39 Å²	39	59.7 Å²	59.7	18%	0.181	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	136.2	-176.4	-170.6	64.5	0	0	0	110.9	T284 L310 I314	T284-H312 PolarHBondContact N-O 3.05Å; T284-H312 PolarHBondContact O-N 3.06Å; T284-H312 VanDerWaalsContact O-N 3.1Å; L310-H312 WeakPolarHBondContact CD1-O 3.23Å; H312-I314 WeakPolarHBondContact NE2-CG1 3.28Å
313	C	86.4	Confident	70.9	Confident	15 Å²	15	55.2 Å²	55.2	10%	0.101	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135.6	177.3	-177.7	0	0	0	0	111.2	V275 Q282 L310	V275-C313 WeakPolarHBondContact CG2-SG 3.38Å; Q282-C313 WeakPolarHBondContact O-CA 3.48Å; L310-C313 HydrophobicContact CD1-CB 4.18Å; L310-C313 HydrophobicContact CD2-CB 3.82Å; L310-C313 HydrophobicContact CG-CB 4.47Å
314	I	84.3	Confident	69.3	Low	46 Å²	46	49.7 Å²	49.7	24%	0.236	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	113.9	174.6	-56.3	173.8	0	0	0	107.7	A281 Q282 H312 L316 T319	A281-I314 WeakPolarHBondContact CA-O 3.34Å; Q282-I314 HydrophobicContact CB-CB 4.47Å; Q282-I314 PolarHBondContact N-O 3.33Å; Q282-I314 PolarHBondContact O-N 3.44Å; H312-I314 WeakPolarHBondContact NE2-CG1 3.28Å; I314-L316 PolarHBondContact O-N 2.79Å; I314-T319 HydrophobicContact CG2-CG2 4.27Å; I314-T319 WeakPolarHBondContact CG2-OG1 3.26Å
315	C	75.7	Confident	67.6	Low	11 Å²	11	54.3 Å²	54.3	7%	0.074	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	88.4	177.8	-67.5	0	0	0	0	111.1	L274 H280 S317 K318 T319	L274-C315 PolarHBondContact O-SG 2.82Å; H280-C315 CarbonylContact O-C 3.59Å; C315-S317 PolarHBondContact O-N 2.84Å; C315-K318 HydrophobicContact CB-CB 4.24Å; C315-K318 PolarHBondContact O-N 2.89Å; C315-T319 PolarHBondContact N-OG1 3.35Å; C315-T319 PolarHBondContact O-N 2.87Å; C315-T319 PolarHBondContact O-OG1 3.37Å
316	L	70.6	Confident	65.6	Low	56 Å²	56	54.8 Å²	54.8	29%	0.293	29%	0.287	S	S	.	.	H	α-helix	trans	-49.3	-30.9	-177.4	-63.2	170.3	0	0	0	114.3	R174 H280 I314	R174-L316 HydrophobicContact CG-CD1 4.32Å; H280-L316 HydrophobicContact CB-CB 4.4Å; H280-L316 PolarHBondContact O-N 3.3Å; I314-L316 PolarHBondContact O-N 2.79Å
317	S	59.2	Low	63.5	Low	36 Å²	36	57.7 Å²	57.7	25%	0.252	30%	0.3	S	S	.	.	H	α-helix	trans	-65.6	-38.1	175.5	54.5	0	0	0	0	113.7	D279 C315	D279-S317 VanDerWaalsContact CG-OG 3.23Å; D279-S317 PolarHBondContact OD1-OG 2.69Å; C315-S317 PolarHBondContact O-N 2.84Å
318	K	55.2	Low	61.3	Low	89 Å²	89	59.6 Å²	59.6	39%	0.387	31%	0.307	S	S	.	.	H	α-helix	trans	-100.3	-30.1	-176.9	-65.8	175.4	-178.5	152.7	0	112.4	D279 C315 N320 E321	D279-K318 VanDerWaalsContact OD2-CE 3.23Å; D279-K318 WeakPolarHBondContact OD2-CE 3.48Å; D279-K318 IonicContact OD2-NZ 3.36Å; D279-K318 PolarHBondContact OD2-NZ 2.76Å; C315-K318 HydrophobicContact CB-CB 4.24Å; C315-K318 PolarHBondContact O-N 2.89Å; K318-N320 PolarHBondContact O-N 3.22Å; K318-E321 VanDerWaalsContact O-CB 3.22Å; K318-E321 WeakPolarHBondContact O-CB 3.38Å; K318-E321 VanDerWaalsContact O-CG 3.3Å; K318-E321 WeakPolarHBondContact O-CG 3.49Å; K318-E321 PolarHBondContact O-N 3.48Å
319	T	43.4	Very low	59.1	Low	24 Å²	24	66.8 Å²	66.8	15%	0.147	34%	0.34	C	S	.	.	H	α-helix	trans	-76.4	-5.2	-174.8	-18.4	0	0	0	0	113.9	I314 C315 E321 Q322 V323	I314-T319 HydrophobicContact CG2-CG2 4.27Å; I314-T319 WeakPolarHBondContact CG2-OG1 3.26Å; C315-T319 PolarHBondContact N-OG1 3.35Å; C315-T319 PolarHBondContact O-N 2.87Å; C315-T319 PolarHBondContact O-OG1 3.37Å; T319-E321 PolarHBondContact O-N 3Å; T319-Q322 HydrophobicContact CG2-CB 4.12Å; T319-Q322 PolarHBondContact O-N 3.44Å; T319-V323 HydrophobicContact CG2-CG2 3.76Å; T319-V323 PolarHBondContact O-N 2.83Å
320	N	44.4	Very low	57.3	Low	78 Å²	78	66.4 Å²	66.4	42%	0.417	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-10.1	156.7	-82.6	-0.4	0	0	0	111.9	K318 S324 R328	K318-N320 PolarHBondContact O-N 3.22Å; N320-S324 VanDerWaalsContact C-OG 3.3Å; N320-S324 WeakPolarHBondContact CA-OG 3.16Å; N320-S324 WeakPolarHBondContact O-CB 3.35Å; N320-S324 PolarHBondContact O-OG 3Å; N320-R328 PolarHBondContact O-NE 3.11Å; N320-R328 PolarHBondContact O-NH1 3.15Å; N320-R328 PolarHBondContact O-NH2 3.06Å
321	E	40.1	Very low	55.4	Low	124 Å²	124	70.2 Å²	70.2	58%	0.579	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-29.4	171.1	-56.7	-148.9	124.5	0	0	115.2	K318 T319 R328	K318-E321 VanDerWaalsContact O-CB 3.22Å; K318-E321 WeakPolarHBondContact O-CB 3.38Å; K318-E321 VanDerWaalsContact O-CG 3.3Å; K318-E321 WeakPolarHBondContact O-CG 3.49Å; K318-E321 PolarHBondContact O-N 3.48Å; T319-E321 PolarHBondContact O-N 3Å; E321-R328 PolarHBondContact O-NH1 2.92Å; E321-R328 VanDerWaalsContact O-NH1 3.15Å; E321-R328 IonicContact OE1-NH2 2.68Å
322	Q	36.5	Very low	54	Low	161 Å²	161	76.9 Å²	76.9	75%	0.752	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	-35	-174.3	-69.6	-178.7	-12.4	0	0	114.1	T319	T319-Q322 HydrophobicContact CG2-CB 4.12Å; T319-Q322 PolarHBondContact O-N 3.44Å
323	V	40.9	Very low	52.7	Low	85 Å²	85	81.9 Å²	81.9	52%	0.515	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-27.6	173.9	173.8	0	0	0	0	110.6	T319 Q325 S326	T319-V323 HydrophobicContact CG2-CG2 3.76Å; T319-V323 PolarHBondContact O-N 2.83Å; V323-Q325 PolarHBondContact O-N 2.71Å; V323-S326 PolarHBondContact O-OG 3.34Å
324	S	37	Very low	51.6	Low	11 Å²	11	82.4 Å²	82.4	8%	0.077	42%	0.419	C	S	.	.	H	α-helix	trans	-84.7	22.4	-179.6	-35.5	0	0	0	0	114.1	N320 R328	N320-S324 VanDerWaalsContact C-OG 3.3Å; N320-S324 WeakPolarHBondContact CA-OG 3.16Å; N320-S324 WeakPolarHBondContact O-CB 3.35Å; N320-S324 PolarHBondContact O-OG 3Å; S324-R328 WeakPolarHBondContact O-CA 3.26Å; S324-R328 WeakPolarHBondContact O-CB 3.47Å; S324-R328 VanDerWaalsContact O-CD 3.25Å; S324-R328 WeakPolarHBondContact O-CD 3.41Å; S324-R328 WeakPolarHBondContact O-CG 3.45Å; S324-R328 PolarHBondContact O-N 2.78Å
325	Q	35	Very low	50.6	Low	159 Å²	159	84.9 Å²	84.9	74%	0.743	43%	0.432	S	S	*	.	H	α-helix	trans	-68.9	-29.9	163.1	-85.1	-171	-12.8	0	0	111.3	V323	V323-Q325 PolarHBondContact O-N 2.71Å
326	S	37.1	Very low	50	Low	76 Å²	76	91.1 Å²	91.1	53%	0.531	46%	0.458	S	S	.	.	H	α-helix	trans	-81.2	-45	169	53.6	0	0	0	0	111.6	V323 R328 Q329	V323-S326 PolarHBondContact O-OG 3.34Å; S326-R328 PolarHBondContact O-N 3.11Å; S326-Q329 PolarHBondContact O-N 2.86Å
327	D	43.9	Very low	49.7	Very low	119 Å²	119	90.1 Å²	90.1	64%	0.636	45%	0.454	S	S	*	.	H	α-helix	trans	-85	-6.8	-173.7	-62.2	0.8	0	0	0	114.3
328	R	46.1	Very low	49.8	Very low	68 Å²	68	90.3 Å²	90.3	26%	0.257	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-5	167.3	-71.7	164.3	173.8	163	-7.2	113.2	N320 E321 S324 S326 L330	N320-R328 PolarHBondContact O-NE 3.11Å; N320-R328 PolarHBondContact O-NH1 3.15Å; N320-R328 PolarHBondContact O-NH2 3.06Å; E321-R328 PolarHBondContact O-NH1 2.92Å; E321-R328 VanDerWaalsContact O-NH1 3.15Å; E321-R328 IonicContact OE1-NH2 2.68Å; S324-R328 WeakPolarHBondContact O-CA 3.26Å; S324-R328 WeakPolarHBondContact O-CB 3.47Å; S324-R328 VanDerWaalsContact O-CD 3.25Å; S324-R328 WeakPolarHBondContact O-CD 3.41Å; S324-R328 WeakPolarHBondContact O-CG 3.45Å; S324-R328 PolarHBondContact O-N 2.78Å; S326-R328 PolarHBondContact O-N 3.11Å; R328-L330 PolarHBondContact O-N 2.6Å
329	Q	45.5	Very low	50.1	Low	151 Å²	151	89.9 Å²	89.9	71%	0.706	46%	0.464	S	S	*	.	S	Bend	trans	-69.1	87.7	157.5	-66.5	-178.6	15.4	0	0	103.9	S326 T331	S326-Q329 PolarHBondContact O-N 2.86Å; Q329-T331 PolarHBondContact O-N 3.07Å
330	L	54.1	Low	51.3	Low	38 Å²	38	93 Å²	93	20%	0.199	48%	0.477	C	S	.	.			trans	-41.9	121.5	158.4	-100.9	82.2	0	0	0	104.4	R328 D334 I335 M338 L576	R328-L330 PolarHBondContact O-N 2.6Å; L330-D334 HydrophobicContact CB-CB 3.83Å; L330-D334 HydrophobicContact CD2-CB 3.74Å; L330-D334 HydrophobicContact CG-CB 3.7Å; L330-I335 HydrophobicContact CB-CD1 4.43Å; L330-I335 HydrophobicContact CB-CG1 3.8Å; L330-I335 HydrophobicContact CD2-CG1 4.25Å; L330-M338 HydrophobicContact CD2-CG 3.69Å; L330-M338 HydrophobicContact CD2-SD 4.33Å; L330-L576 HydrophobicContact CD1-CD1 4.06Å
331	T	53.8	Low	52.2	Low	80 Å²	80	98.6 Å²	98.6	49%	0.491	50%	0.501	S	S	.	.			trans	-52.8	149.1	175.7	-25.8	0	0	0	0	106.7	Q329 E333 D334 I335	Q329-T331 PolarHBondContact O-N 3.07Å; T331-E333 CarbonylContact O-C 3.47Å; T331-E333 PolarHBondContact O-N 2.78Å; T331-D334 WeakPolarHBondContact CB-OD2 3.29Å; T331-D334 PolarHBondContact N-OD2 3.37Å; T331-D334 WeakPolarHBondContact O-CA 3.04Å; T331-D334 WeakPolarHBondContact O-CB 3.03Å; T331-D334 PolarHBondContact O-N 3.44Å; T331-D334 PolarHBondContact OG1-OD2 3.36Å; T331-I335 PolarHBondContact O-N 2.91Å; T331-I335 VanDerWaalsContact O-N 3.1Å
332	E	57.2	Low	53.7	Low	149 Å²	149	96.9 Å²	96.9	70%	0.696	50%	0.496	S	S	*	.	H	α-helix	trans	-52.4	-27.7	174.7	-70.5	-175.5	170.6	0	0	111.6	K336	E332-K336 VanDerWaalsContact O-CG 3.26Å; E332-K336 WeakPolarHBondContact O-CG 3.31Å; E332-K336 PolarHBondContact O-N 3Å
333	E	59.4	Low	55.6	Low	144 Å²	144	90.1 Å²	90.1	67%	0.673	46%	0.464	S	S	*	.	H	α-helix	trans	-62.9	-46.5	170.7	-57	-172.3	170.2	0	0	113	T331 I335 K336 T337	T331-E333 CarbonylContact O-C 3.47Å; T331-E333 PolarHBondContact O-N 2.78Å; E333-I335 VanDerWaalsContact C-N 3.31Å; E333-I335 PolarHBondContact O-N 3.44Å; E333-K336 WeakPolarHBondContact O-CB 3.24Å; E333-K336 PolarHBondContact O-N 3.24Å; E333-K336 VanDerWaalsContact O-N 3.14Å; E333-T337 PolarHBondContact O-N 3.09Å; E333-T337 PolarHBondContact O-OG1 3.06Å
334	D	64.3	Low	57.7	Low	25 Å²	25	88.3 Å²	88.3	13%	0.134	45%	0.448	C	S	.	.	H	α-helix	trans	-62.1	-42.2	177.5	-62.7	-49.4	0	0	0	110.6	L330 T331 K336 T337 M338	L330-D334 HydrophobicContact CB-CB 3.83Å; L330-D334 HydrophobicContact CD2-CB 3.74Å; L330-D334 HydrophobicContact CG-CB 3.7Å; T331-D334 WeakPolarHBondContact CB-OD2 3.29Å; T331-D334 PolarHBondContact N-OD2 3.37Å; T331-D334 WeakPolarHBondContact O-CA 3.04Å; T331-D334 WeakPolarHBondContact O-CB 3.03Å; T331-D334 PolarHBondContact O-N 3.44Å; T331-D334 PolarHBondContact OG1-OD2 3.36Å; D334-K336 VanDerWaalsContact C-N 3.3Å; D334-K336 PolarHBondContact O-N 3.14Å; D334-T337 WeakPolarHBondContact CA-OG1 3.49Å; D334-T337 PolarHBondContact O-N 3.1Å; D334-T337 PolarHBondContact O-OG1 3.27Å; D334-M338 VanDerWaalsContact O-CE 3.28Å; D334-M338 WeakPolarHBondContact O-CE 3.28Å; D334-M338 WeakPolarHBondContact O-CG 3.34Å; D334-M338 PolarHBondContact O-N 3.11Å
335	I	63.6	Low	60	Low	98 Å²	98	92.4 Å²	92.4	50%	0.503	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-39.6	176.1	-57.6	178.1	0	0	0	110.6	L330 T331 E333 M338 A339	L330-I335 HydrophobicContact CB-CD1 4.43Å; L330-I335 HydrophobicContact CB-CG1 3.8Å; L330-I335 HydrophobicContact CD2-CG1 4.25Å; T331-I335 PolarHBondContact O-N 2.91Å; T331-I335 VanDerWaalsContact O-N 3.1Å; E333-I335 VanDerWaalsContact C-N 3.31Å; E333-I335 PolarHBondContact O-N 3.44Å; I335-M338 WeakPolarHBondContact O-CB 3.28Å; I335-M338 PolarHBondContact O-N 2.82Å; I335-A339 PolarHBondContact O-N 3.02Å
336	K	63.5	Low	62.4	Low	143 Å²	143	86.2 Å²	86.2	62%	0.622	44%	0.436	S	S	*	.	H	α-helix	trans	-63.5	-42.6	175.2	-74.1	167.8	-173.8	173	0	111.7	E332 E333 D334 M338 A339	E332-K336 VanDerWaalsContact O-CG 3.26Å; E332-K336 WeakPolarHBondContact O-CG 3.31Å; E332-K336 PolarHBondContact O-N 3Å; E333-K336 WeakPolarHBondContact O-CB 3.24Å; E333-K336 PolarHBondContact O-N 3.24Å; E333-K336 VanDerWaalsContact O-N 3.14Å; D334-K336 VanDerWaalsContact C-N 3.3Å; D334-K336 PolarHBondContact O-N 3.14Å; K336-M338 VanDerWaalsContact C-N 3.27Å; K336-M338 PolarHBondContact O-N 3.49Å; K336-A339 PolarHBondContact O-N 2.82Å
337	T	64.7	Low	64.7	Low	35 Å²	35	82.7 Å²	82.7	22%	0.215	41%	0.411	C	S	.	.	H	α-helix	trans	-67.3	-28.1	173.5	6.9	0	0	0	0	112.7	E333 D334 A339	E333-T337 PolarHBondContact O-N 3.09Å; E333-T337 PolarHBondContact O-OG1 3.06Å; D334-T337 WeakPolarHBondContact CA-OG1 3.49Å; D334-T337 PolarHBondContact O-N 3.1Å; D334-T337 PolarHBondContact O-OG1 3.27Å; T337-A339 VanDerWaalsContact C-N 3.33Å
338	M	60	Low	66.8	Low	39 Å²	39	77.3 Å²	77.3	19%	0.192	38%	0.382	C	S	.	.	H	α-helix	trans	-73.7	-24.4	174.2	-61.3	-46.3	96	0	0	112.6	L330 D334 I335 K336 E340 F343 Y573	L330-M338 HydrophobicContact CD2-CG 3.69Å; L330-M338 HydrophobicContact CD2-SD 4.33Å; D334-M338 VanDerWaalsContact O-CE 3.28Å; D334-M338 WeakPolarHBondContact O-CE 3.28Å; D334-M338 WeakPolarHBondContact O-CG 3.34Å; D334-M338 PolarHBondContact O-N 3.11Å; I335-M338 WeakPolarHBondContact O-CB 3.28Å; I335-M338 PolarHBondContact O-N 2.82Å; K336-M338 VanDerWaalsContact C-N 3.27Å; K336-M338 PolarHBondContact O-N 3.49Å; M338-E340 VanDerWaalsContact C-N 3.29Å; M338-E340 PolarHBondContact O-N 3.03Å; M338-F343 HydrophobicContact CE-CD2 4.4Å; M338-F343 HydrophobicContact CE-CE2 3.47Å; M338-F343 VanDerWaalsContact CE-CE2 3.47Å; M338-F343 HydrophobicContact CE-CZ 3.93Å; M338-F343 HydrophobicContact SD-CD2 4.18Å; M338-F343 HydrophobicContact SD-CE1 4.03Å; M338-F343 HydrophobicContact SD-CE2 3.26Å; M338-F343 WeakPolarHBondContact SD-CE2 3.34Å; M338-F343 HydrophobicContact SD-CZ 3.16Å; M338-F343 WeakPolarHBondContact SD-CZ 3.48Å; M338-Y573 HydrophobicContact CG-CD2 4.29Å; M338-Y573 HydrophobicContact CG-CE2 4.07Å; M338-Y573 HydrophobicContact SD-CD2 3.37Å; M338-Y573 WeakPolarHBondContact SD-CD2 3.33Å; M338-Y573 HydrophobicContact SD-CE2 3.49Å; M338-Y573 WeakPolarHBondContact SD-CE2 3.25Å; M338-Y573 HydrophobicContact SD-CG 4.25Å
339	A	62.1	Low	68.7	Low	80 Å²	80	76.7 Å²	76.7	66%	0.661	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-4.7	-174.8	0	0	0	0	0	113.9	I335 K336 T337	I335-A339 PolarHBondContact O-N 3.02Å; K336-A339 PolarHBondContact O-N 2.82Å; T337-A339 VanDerWaalsContact C-N 3.33Å
340	E	68.5	Low	70.6	Confident	90 Å²	90	69.5 Å²	69.5	42%	0.421	35%	0.347	S	S	.	.	S	Bend	trans	-70.2	132.2	173.7	-66.6	174	-177.3	0	0	110.2	M338 D342 F343 R346	M338-E340 VanDerWaalsContact C-N 3.29Å; M338-E340 PolarHBondContact O-N 3.03Å; E340-D342 PolarHBondContact O-N 3.43Å; E340-D342 VanDerWaalsContact O-N 3.14Å; E340-F343 VanDerWaalsContact O-CB 3.28Å; E340-F343 WeakPolarHBondContact O-CB 3.29Å; E340-F343 PolarHBondContact O-N 3.36Å; E340-F343 VanDerWaalsContact O-N 3.14Å; E340-R346 IonicContact OE1-NH1 2.85Å; E340-R346 IonicContact OE2-CZ 3.54Å; E340-R346 IonicContact OE2-NH1 3.43Å; E340-R346 PolarHBondContact OE2-NH1 3.39Å
341	E	62.8	Low	72.2	Confident	195 Å²	195	67.8 Å²	67.8	91%	0.911	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-25	-175.6	-65.2	-178.6	167.8	0	0	113	F343	E341-F343 VanDerWaalsContact C-N 3.28Å; E341-F343 PolarHBondContact O-N 3.44Å
342	D	71.7	Confident	73.7	Confident	89 Å²	89	64 Å²	64	48%	0.476	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	16	-179.7	-61.8	-26.8	0	0	0	113.9	E340 Y344 E345 R346 F562	E340-D342 PolarHBondContact O-N 3.43Å; E340-D342 VanDerWaalsContact O-N 3.14Å; D342-Y344 PolarHBondContact O-N 2.7Å; D342-E345 PolarHBondContact O-N 3.15Å; D342-E345 VanDerWaalsContact O-N 3.12Å; D342-R346 WeakPolarHBondContact O-CB 3.25Å; D342-R346 PolarHBondContact O-N 3.17Å; D342-F562 HydrophobicContact CB-CE1 4.21Å; D342-F562 HydrophobicContact CB-CZ 4.31Å
343	F	77.1	Confident	75	Confident	18 Å²	18	57.7 Å²	57.7	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-33.3	-173.1	-177.1	-102.3	0	0	0	113.5	M338 E340 E341 R346 L347 L565 Y573	M338-F343 HydrophobicContact CE-CD2 4.4Å; M338-F343 HydrophobicContact CE-CE2 3.47Å; M338-F343 VanDerWaalsContact CE-CE2 3.47Å; M338-F343 HydrophobicContact CE-CZ 3.93Å; M338-F343 HydrophobicContact SD-CD2 4.18Å; M338-F343 HydrophobicContact SD-CE1 4.03Å; M338-F343 HydrophobicContact SD-CE2 3.26Å; M338-F343 WeakPolarHBondContact SD-CE2 3.34Å; M338-F343 HydrophobicContact SD-CZ 3.16Å; M338-F343 WeakPolarHBondContact SD-CZ 3.48Å; E340-F343 VanDerWaalsContact O-CB 3.28Å; E340-F343 WeakPolarHBondContact O-CB 3.29Å; E340-F343 PolarHBondContact O-N 3.36Å; E340-F343 VanDerWaalsContact O-N 3.14Å; E341-F343 VanDerWaalsContact C-N 3.28Å; E341-F343 PolarHBondContact O-N 3.44Å; F343-R346 PolarHBondContact O-N 3.13Å; F343-L347 HydrophobicContact CD1-CD1 3.81Å; F343-L347 HydrophobicContact CD1-CG 4.12Å; F343-L347 HydrophobicContact CE1-CD1 3.11Å; F343-L347 HydrophobicContact CE1-CD2 4.21Å; F343-L347 HydrophobicContact CE1-CG 3.56Å; F343-L347 HydrophobicContact CE2-CD1 4.48Å; F343-L347 HydrophobicContact CE2-CD2 4.25Å; F343-L347 HydrophobicContact CE2-CG 4.04Å; F343-L347 HydrophobicContact CZ-CD1 3.52Å; F343-L347 HydrophobicContact CZ-CD2 3.7Å; F343-L347 HydrophobicContact CZ-CG 3.5Å; F343-L347 VanDerWaalsContact CZ-CG 3.5Å; F343-L347 WeakPolarHBondContact O-CB 3.16Å; F343-L347 WeakPolarHBondContact O-CG 3.42Å; F343-L347 PolarHBondContact O-N 3.04Å; F343-L565 HydrophobicContact CE2-CD1 4.12Å; F343-Y573 HydrophobicContact CD1-CE1 4.46Å; F343-Y573 AromaticContact CE1-CD1 3.95Å; F343-Y573 HydrophobicContact CE1-CD1 3.95Å; F343-Y573 HydrophobicContact CE1-CD2 4.32Å; F343-Y573 AromaticContact CE1-CE1 3.39Å; F343-Y573 HydrophobicContact CE1-CE1 3.39Å; F343-Y573 AromaticContact CE1-CE2 3.79Å; F343-Y573 HydrophobicContact CE1-CE2 3.79Å; F343-Y573 HydrophobicContact CE1-CG 4.39Å; F343-Y573 AromaticContact CE1-CZ 3.29Å; F343-Y573 HydrophobicContact CZ-CD1 4.08Å; F343-Y573 HydrophobicContact CZ-CD2 4.08Å; F343-Y573 AromaticContact CZ-CE1 3.97Å; F343-Y573 HydrophobicContact CZ-CE1 3.97Å; F343-Y573 AromaticContact CZ-CE2 3.95Å; F343-Y573 HydrophobicContact CZ-CE2 3.95Å; F343-Y573 HydrophobicContact CZ-CG 4.15Å; F343-Y573 AromaticContact CZ-CZ 3.9Å
344	Y	85.1	Confident	76.2	Confident	48 Å²	48	54.7 Å²	54.7	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-43.6	176	178.6	-117.9	0	0	0	112.8	D342 T348 K363 L366 L627 L630	D342-Y344 PolarHBondContact O-N 2.7Å; Y344-T348 WeakPolarHBondContact O-CB 3.44Å; Y344-T348 PolarHBondContact O-N 3.33Å; Y344-T348 PolarHBondContact O-OG1 3.02Å; Y344-K363 HydrophobicContact CE1-CD 3.68Å; Y344-K363 HydrophobicContact CE1-CG 3.95Å; Y344-K363 VanDerWaalsContact OH-CB 3.32Å; Y344-K363 WeakPolarHBondContact OH-CB 3.22Å; Y344-K363 WeakPolarHBondContact OH-CG 3.48Å; Y344-L366 HydrophobicContact CD2-CD2 4.02Å; Y344-L366 HydrophobicContact CE2-CD2 3.92Å; Y344-L627 HydrophobicContact CE2-CD2 4.15Å; Y344-L630 HydrophobicContact CD2-CD1 3.93Å; Y344-L630 HydrophobicContact CE2-CD1 3.74Å
345	E	85.4	Confident	77.3	Confident	96 Å²	96	54.3 Å²	54.3	45%	0.449	27%	0.271	S	S	.	.	H	α-helix	trans	-70.5	-39.6	177.8	-61.9	-159	153.4	0	0	111.2	D342 L347 T348 Y349	D342-E345 PolarHBondContact O-N 3.15Å; D342-E345 VanDerWaalsContact O-N 3.12Å; E345-L347 PolarHBondContact O-N 2.78Å; E345-T348 WeakPolarHBondContact O-CB 3.49Å; E345-T348 PolarHBondContact O-N 3.44Å; E345-Y349 WeakPolarHBondContact O-CB 3.39Å; E345-Y349 PolarHBondContact O-N 2.7Å
346	R	84.4	Confident	78.3	Confident	29 Å²	29	53.5 Å²	53.5	11%	0.109	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-43	176.2	-174.3	168.8	-176.5	179.2	-3.3	112.6	E340 D342 F343 Y349 S350 F562 K563 L565	E340-R346 IonicContact OE1-NH1 2.85Å; E340-R346 IonicContact OE2-CZ 3.54Å; E340-R346 IonicContact OE2-NH1 3.43Å; E340-R346 PolarHBondContact OE2-NH1 3.39Å; D342-R346 WeakPolarHBondContact O-CB 3.25Å; D342-R346 PolarHBondContact O-N 3.17Å; F343-R346 PolarHBondContact O-N 3.13Å; R346-Y349 PolarHBondContact O-N 2.71Å; R346-S350 WeakPolarHBondContact O-CB 3.41Å; R346-S350 PolarHBondContact O-N 3.21Å; R346-S350 PolarHBondContact O-OG 3.48Å; R346-F562 HydrophobicContact CB-CD1 4.4Å; R346-F562 HydrophobicContact CG-CB 4.21Å; R346-F562 HydrophobicContact CG-CD1 4.45Å; R346-F562 HydrophobicContact CG-CG 4.5Å; R346-K563 PolarHBondContact NE-O 2.93Å; R346-L565 HydrophobicContact CG-CD1 4.38Å
347	L	85.9	Confident	79.2	Confident	3 Å²	3	48 Å²	48	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-44.1	172.4	-81.8	-177.7	0	0	0	111.6	F343 E345 Y349 S350 I351 L366 L565 I570 Y573 L630	F343-L347 HydrophobicContact CD1-CD1 3.81Å; F343-L347 HydrophobicContact CD1-CG 4.12Å; F343-L347 HydrophobicContact CE1-CD1 3.11Å; F343-L347 HydrophobicContact CE1-CD2 4.21Å; F343-L347 HydrophobicContact CE1-CG 3.56Å; F343-L347 HydrophobicContact CE2-CD1 4.48Å; F343-L347 HydrophobicContact CE2-CD2 4.25Å; F343-L347 HydrophobicContact CE2-CG 4.04Å; F343-L347 HydrophobicContact CZ-CD1 3.52Å; F343-L347 HydrophobicContact CZ-CD2 3.7Å; F343-L347 HydrophobicContact CZ-CG 3.5Å; F343-L347 VanDerWaalsContact CZ-CG 3.5Å; F343-L347 WeakPolarHBondContact O-CB 3.16Å; F343-L347 WeakPolarHBondContact O-CG 3.42Å; F343-L347 PolarHBondContact O-N 3.04Å; E345-L347 PolarHBondContact O-N 2.78Å; L347-Y349 VanDerWaalsContact C-N 3.34Å; L347-Y349 PolarHBondContact O-N 3.33Å; L347-S350 WeakPolarHBondContact O-CB 3.5Å; L347-S350 PolarHBondContact O-N 3.14Å; L347-I351 PolarHBondContact O-N 3.49Å; L347-L366 HydrophobicContact CB-CD2 3.89Å; L347-L366 HydrophobicContact CD1-CD1 4.49Å; L347-L366 HydrophobicContact CD1-CD2 4.23Å; L347-L565 HydrophobicContact CD2-CD1 3.72Å; L347-L565 HydrophobicContact CG-CD1 4.47Å; L347-I570 HydrophobicContact CD2-CG1 4.26Å; L347-Y573 HydrophobicContact CD1-CD1 4.03Å; L347-Y573 HydrophobicContact CD1-CE1 3.95Å; L347-L630 HydrophobicContact CD1-CD2 4.35Å
348	T	88.7	Confident	80.1	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-45.7	178.4	-63	0	0	0	0	111.2	Y344 E345 S350 I351 K362 K363	Y344-T348 WeakPolarHBondContact O-CB 3.44Å; Y344-T348 PolarHBondContact O-N 3.33Å; Y344-T348 PolarHBondContact O-OG1 3.02Å; E345-T348 WeakPolarHBondContact O-CB 3.49Å; E345-T348 PolarHBondContact O-N 3.44Å; T348-S350 VanDerWaalsContact C-N 3.28Å; T348-S350 PolarHBondContact O-N 3.18Å; T348-I351 PolarHBondContact O-N 3.14Å; T348-K362 HydrophobicContact CG2-CB 3.74Å; T348-K363 HydrophobicContact CG2-CB 4.41Å; T348-K363 HydrophobicContact CG2-CG 3.51Å; T348-K363 WeakPolarHBondContact OG1-CG 3.28Å
349	Y	85.6	Confident	81.4	Confident	55 Å²	55	53.8 Å²	53.8	22%	0.216	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-35.2	178.1	-169	-91.9	0	0	0	112	E345 R346 L347 I351 S560	E345-Y349 WeakPolarHBondContact O-CB 3.39Å; E345-Y349 PolarHBondContact O-N 2.7Å; R346-Y349 PolarHBondContact O-N 2.71Å; L347-Y349 VanDerWaalsContact C-N 3.34Å; L347-Y349 PolarHBondContact O-N 3.33Å; Y349-I351 PolarHBondContact O-N 3.12Å; Y349-S560 WeakPolarHBondContact CE1-OG 3.41Å; Y349-S560 WeakPolarHBondContact OH-CB 3.49Å; Y349-S560 PolarHBondContact OH-OG 3.35Å
350	S	85.8	Confident	82.7	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-69.5	-16.2	177.8	-56.8	0	0	0	0	113.4	R346 L347 T348 A352 Y404 L565	R346-S350 WeakPolarHBondContact O-CB 3.41Å; R346-S350 PolarHBondContact O-N 3.21Å; R346-S350 PolarHBondContact O-OG 3.48Å; L347-S350 WeakPolarHBondContact O-CB 3.5Å; L347-S350 PolarHBondContact O-N 3.14Å; T348-S350 VanDerWaalsContact C-N 3.28Å; T348-S350 PolarHBondContact O-N 3.18Å; S350-A352 PolarHBondContact O-N 2.91Å; S350-Y404 PolarHBondContact O-OH 3.29Å; S350-Y404 VanDerWaalsContact O-OH 3.1Å; S350-L565 PolarHBondContact OG-N 2.91Å
351	I	87.4	Confident	83.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.235	C	C	.	.	S	Bend	trans	-80.1	116.8	173	-65.4	174.3	0	0	0	109.3	L347 T348 Y349 K362 L366 Y404 L408	L347-I351 PolarHBondContact O-N 3.49Å; T348-I351 PolarHBondContact O-N 3.14Å; Y349-I351 PolarHBondContact O-N 3.12Å; I351-K362 VanDerWaalsContact O-CD 3.28Å; I351-K362 WeakPolarHBondContact O-CD 3.26Å; I351-K362 VanDerWaalsContact O-CE 3.27Å; I351-K362 WeakPolarHBondContact O-CE 3.43Å; I351-K362 PolarHBondContact O-NZ 2.97Å; I351-K362 VanDerWaalsContact O-NZ 3.13Å; I351-L366 HydrophobicContact CD1-CB 3.59Å; I351-L366 HydrophobicContact CD1-CD1 3.9Å; I351-L366 HydrophobicContact CD1-CG 4.24Å; I351-Y404 HydrophobicContact CB-CE1 4.44Å; I351-Y404 HydrophobicContact CG2-CD1 4.11Å; I351-Y404 HydrophobicContact CG2-CE1 4.01Å; I351-L408 HydrophobicContact CG1-CD2 4.28Å
352	A	85.3	Confident	85.3	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	19%	0.193	C	C	.	.	S	Bend	trans	49.6	64.9	-179.2	0	0	0	0	0	112.6	S350 E354 I355 K362 L401 Y404	S350-A352 PolarHBondContact O-N 2.91Å; A352-E354 PolarHBondContact O-N 3.35Å; A352-I355 HydrophobicContact CB-CD1 4.26Å; A352-I355 PolarHBondContact O-N 3.04Å; A352-K362 PolarHBondContact O-NZ 3.43Å; A352-L401 HydrophobicContact CB-CD2 4.03Å; A352-Y404 HydrophobicContact CB-CD1 3.98Å; A352-Y404 HydrophobicContact CB-CD2 4.17Å; A352-Y404 HydrophobicContact CB-CE1 4.39Å; A352-Y404 HydrophobicContact CB-CG 3.87Å; A352-Y404 VanDerWaalsContact N-CZ 3.27Å
353	P	84.9	Confident	86.2	Confident	16 Å²	16	36.4 Å²	36.4	10%	0.104	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.4	180	28.1	-35.2	0	0	0	112.4	I355 H547 E557	P353-I355 PolarHBondContact O-N 2.76Å; P353-H547 PolarHBondContact O-CE1 2.82Å; P353-H547 VanDerWaalsContact O-CE1 3.31Å; P353-H547 PolarHBondContact O-NE2 2.93Å; P353-E557 HydrophobicContact CB-CB 4.13Å; P353-E557 HydrophobicContact CB-CG 3.92Å
354	E	84.4	Confident	87	Confident	81 Å²	81	35.6 Å²	35.6	38%	0.379	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.1	172.5	-63.6	170.8	-167.9	0	0	112.9	A352 Q400 H547	A352-E354 PolarHBondContact O-N 3.35Å; E354-Q400 PolarHBondContact OE2-NE2 2.74Å; E354-H547 PolarHBondContact O-CD2 3.35Å; E354-H547 VanDerWaalsContact O-CD2 3.24Å; E354-H547 PolarHBondContact O-NE2 2.64Å; E354-H547 VanDerWaalsContact O-NE2 3.08Å
355	I	86.1	Confident	87.4	Confident	18 Å²	18	33.4 Å²	33.4	9%	0.092	16%	0.163	C	C	.	.	S	Bend	trans	-101.1	120.1	-177.8	-59.2	172.7	0	0	0	109.2	A352 P353 K362 A397 Q400 L401	A352-I355 HydrophobicContact CB-CD1 4.26Å; A352-I355 PolarHBondContact O-N 3.04Å; P353-I355 PolarHBondContact O-N 2.76Å; I355-K362 PolarHBondContact O-NZ 2.8Å; I355-A397 HydrophobicContact CD1-CB 3.9Å; I355-A397 HydrophobicContact CG1-CB 4.3Å; I355-Q400 HydrophobicContact CD1-CB 4.04Å; I355-Q400 HydrophobicContact CD1-CG 3.91Å; I355-Q400 HydrophobicContact CG1-CG 4.42Å; I355-L401 HydrophobicContact CD1-CD2 3.66Å; I355-L401 HydrophobicContact CD1-CG 3.77Å
356	F	84.1	Confident	87.7	Confident	81 Å²	81	28.8 Å²	28.8	36%	0.355	14%	0.142	S	C	.	.			trans	-77	138.9	173.5	-177.4	-104.4	0	0	0	111.4	K543 L544 H547	F356-K543 HydrophobicContact CD1-CB 4.44Å; F356-K543 HydrophobicContact CE1-CB 3.73Å; F356-K543 HydrophobicContact CE1-CD 4.36Å; F356-K543 HydrophobicContact CZ-CB 3.94Å; F356-K543 HydrophobicContact CZ-CD 4.14Å; F356-L544 HydrophobicContact CB-CD1 4.06Å; F356-H547 HydrophobicContact CB-CB 3.91Å; F356-H547 HydrophobicContact CD2-CB 4.5Å; F356-H547 HydrophobicContact CG-CB 4.32Å
357	G	83	Confident	88.2	Confident	27 Å²	27	27.4 Å²	27.4	28%	0.278	14%	0.137	S	C	.	.	S	Bend	trans	82	-158.8	176.9	0	0	0	0	0	114.8	E359 K362	G357-E359 VanDerWaalsContact C-N 3.32Å; G357-E359 PolarHBondContact O-N 3.06Å; G357-K362 WeakPolarHBondContact O-CE 3.43Å
358	H	83.6	Confident	88.5	Confident	70 Å²	70	27.4 Å²	27.4	32%	0.324	14%	0.136	S	C	.	.			trans	51.7	42.9	-179.1	-55.5	-51	0	0	0	114.6	D360 V361 K362 I532	H358-D360 VanDerWaalsContact C-N 3.32Å; H358-D360 PolarHBondContact O-N 3.03Å; H358-V361 HydrophobicContact CB-CB 4.08Å; H358-V361 HydrophobicContact CB-CG2 4.14Å; H358-V361 PolarHBondContact O-N 3.47Å; H358-V361 VanDerWaalsContact O-N 3.13Å; H358-K362 WeakPolarHBondContact O-CG 3.21Å; H358-K362 PolarHBondContact O-N 3.06Å; H358-I532 WeakPolarHBondContact CE1-CG2 3.48Å
359	E	87.2	Confident	88.6	Confident	125 Å²	125	27.4 Å²	27.4	58%	0.584	14%	0.136	S	C	*	.	H	α-helix	trans	-57.6	-43.6	-177.6	-62.8	-178.8	177.9	0	0	112	G357 V361 K362 K363	G357-E359 VanDerWaalsContact C-N 3.32Å; G357-E359 PolarHBondContact O-N 3.06Å; E359-V361 VanDerWaalsContact C-N 3.34Å; E359-V361 PolarHBondContact O-N 3.49Å; E359-K362 PolarHBondContact O-N 2.63Å; E359-K363 WeakPolarHBondContact O-CG 3.43Å; E359-K363 PolarHBondContact O-N 2.86Å
360	D	90.8	Very high	88.8	Confident	53 Å²	53	24.9 Å²	24.9	28%	0.283	13%	0.127	S	C	.	.	H	α-helix	trans	-65	-35.5	178	-64.6	-48.8	0	0	0	113.1	H358 K363 A364 W530 R646 L647	H358-D360 VanDerWaalsContact C-N 3.32Å; H358-D360 PolarHBondContact O-N 3.03Å; D360-K363 WeakPolarHBondContact O-CB 3.28Å; D360-K363 PolarHBondContact O-N 2.82Å; D360-A364 PolarHBondContact O-N 3.02Å; D360-W530 HydrophobicContact CB-CH2 3.87Å; D360-W530 HydrophobicContact CB-CZ2 4.42Å; D360-W530 HydrophobicContact CB-CZ3 4.33Å; D360-R646 IonicContact OD1-CZ 3.64Å; D360-R646 IonicContact OD1-NH1 3.81Å; D360-R646 PolarHBondContact OD1-NH1 2.99Å; D360-R646 IonicContact OD1-NH2 2.76Å; D360-R646 PolarHBondContact OD1-NH2 2.95Å; D360-R646 IonicContact OD2-NH1 3.05Å; D360-L647 HydrophobicContact CB-CD2 4.41Å
361	V	91.8	Very high	88.9	Confident	8 Å²	8	25.2 Å²	25.2	5%	0.048	13%	0.13	C	C	.	.	H	α-helix	trans	-68.4	-42.6	175.7	-177.3	0	0	0	0	109.8	H358 E359 K363 A364 L365 L390 L401 W530 I532	H358-V361 HydrophobicContact CB-CB 4.08Å; H358-V361 HydrophobicContact CB-CG2 4.14Å; H358-V361 PolarHBondContact O-N 3.47Å; H358-V361 VanDerWaalsContact O-N 3.13Å; E359-V361 VanDerWaalsContact C-N 3.34Å; E359-V361 PolarHBondContact O-N 3.49Å; V361-K363 VanDerWaalsContact C-N 3.34Å; V361-K363 PolarHBondContact O-N 3.02Å; V361-A364 WeakPolarHBondContact O-CB 3.43Å; V361-A364 PolarHBondContact O-N 3.24Å; V361-L365 HydrophobicContact CG1-CD1 4.41Å; V361-L365 WeakPolarHBondContact O-CG 3.47Å; V361-L365 PolarHBondContact O-N 3Å; V361-L390 HydrophobicContact CG1-CD2 3.7Å; V361-L401 HydrophobicContact CG1-CD1 4.4Å; V361-W530 HydrophobicContact CG2-CB 4.48Å; V361-W530 HydrophobicContact CG2-CD2 4.15Å; V361-W530 HydrophobicContact CG2-CE3 4.39Å; V361-W530 HydrophobicContact CG2-CG 4.17Å; V361-I532 HydrophobicContact CG2-CD1 4.39Å
362	K	92.5	Very high	88.8	Confident	7 Å²	7	25.4 Å²	25.4	3%	0.03	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-40.5	176.1	-68.8	178.3	-179.8	-163.4	0	111.6	T348 I351 A352 I355 G357 H358 E359 A364 L365 L366	T348-K362 HydrophobicContact CG2-CB 3.74Å; I351-K362 VanDerWaalsContact O-CD 3.28Å; I351-K362 WeakPolarHBondContact O-CD 3.26Å; I351-K362 VanDerWaalsContact O-CE 3.27Å; I351-K362 WeakPolarHBondContact O-CE 3.43Å; I351-K362 PolarHBondContact O-NZ 2.97Å; I351-K362 VanDerWaalsContact O-NZ 3.13Å; A352-K362 PolarHBondContact O-NZ 3.43Å; I355-K362 PolarHBondContact O-NZ 2.8Å; G357-K362 WeakPolarHBondContact O-CE 3.43Å; H358-K362 WeakPolarHBondContact O-CG 3.21Å; H358-K362 PolarHBondContact O-N 3.06Å; E359-K362 PolarHBondContact O-N 2.63Å; K362-A364 VanDerWaalsContact C-N 3.35Å; K362-A364 PolarHBondContact O-N 3.41Å; K362-L365 PolarHBondContact O-N 3.19Å; K362-L366 PolarHBondContact O-N 3.21Å
363	K	92.1	Very high	88.9	Confident	22 Å²	22	26 Å²	26	10%	0.096	14%	0.136	C	C	.	.	H	α-helix	trans	-57.1	-47.3	172.2	-77.8	-177.5	177.4	-176.5	0	111.1	Y344 T348 E359 D360 V361 L365 L366 L367 E643 L647	Y344-K363 HydrophobicContact CE1-CD 3.68Å; Y344-K363 HydrophobicContact CE1-CG 3.95Å; Y344-K363 VanDerWaalsContact OH-CB 3.32Å; Y344-K363 WeakPolarHBondContact OH-CB 3.22Å; Y344-K363 WeakPolarHBondContact OH-CG 3.48Å; T348-K363 HydrophobicContact CG2-CB 4.41Å; T348-K363 HydrophobicContact CG2-CG 3.51Å; T348-K363 WeakPolarHBondContact OG1-CG 3.28Å; E359-K363 WeakPolarHBondContact O-CG 3.43Å; E359-K363 PolarHBondContact O-N 2.86Å; D360-K363 WeakPolarHBondContact O-CB 3.28Å; D360-K363 PolarHBondContact O-N 2.82Å; V361-K363 VanDerWaalsContact C-N 3.34Å; V361-K363 PolarHBondContact O-N 3.02Å; K363-L365 PolarHBondContact O-N 3.37Å; K363-L366 WeakPolarHBondContact O-CB 3.39Å; K363-L366 PolarHBondContact O-N 3.41Å; K363-L367 WeakPolarHBondContact O-CG 3.36Å; K363-L367 PolarHBondContact O-N 3.18Å; K363-L367 VanDerWaalsContact O-N 3.1Å; K363-E643 IonicContact NZ-OE1 3.37Å; K363-L647 HydrophobicContact CB-CD2 4.26Å
364	A	93	Very high	88.9	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-63.6	-40.9	177.4	0	0	0	0	0	112.6	D360 V361 K362 L366 L367 M368 I388 L528 W530	D360-A364 PolarHBondContact O-N 3.02Å; V361-A364 WeakPolarHBondContact O-CB 3.43Å; V361-A364 PolarHBondContact O-N 3.24Å; K362-A364 VanDerWaalsContact C-N 3.35Å; K362-A364 PolarHBondContact O-N 3.41Å; A364-L366 VanDerWaalsContact C-N 3.34Å; A364-L366 PolarHBondContact O-N 2.94Å; A364-L367 PolarHBondContact O-N 3.14Å; A364-M368 PolarHBondContact O-N 3.25Å; A364-I388 HydrophobicContact CB-CD1 3.93Å; A364-I388 VanDerWaalsContact O-CD1 3.26Å; A364-I388 WeakPolarHBondContact O-CD1 3.37Å; A364-L528 HydrophobicContact CB-CD1 3.76Å; A364-W530 HydrophobicContact CB-CZ2 4.17Å
365	L	93.7	Very high	88.7	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-64	-37.7	176.1	-68.6	176.9	0	0	0	112.3	V361 K362 K363 M368 L369 L401 V405 L496	V361-L365 HydrophobicContact CG1-CD1 4.41Å; V361-L365 WeakPolarHBondContact O-CG 3.47Å; V361-L365 PolarHBondContact O-N 3Å; K362-L365 PolarHBondContact O-N 3.19Å; K363-L365 PolarHBondContact O-N 3.37Å; L365-M368 HydrophobicContact CD2-CE 4.14Å; L365-M368 WeakPolarHBondContact O-CB 3.27Å; L365-M368 PolarHBondContact O-N 3.5Å; L365-L369 WeakPolarHBondContact O-CG 3.41Å; L365-L369 PolarHBondContact O-N 3.19Å; L365-L401 HydrophobicContact CD1-CB 4.39Å; L365-L401 HydrophobicContact CD1-CD2 4.19Å; L365-V405 HydrophobicContact CB-CG2 4.49Å; L365-V405 HydrophobicContact CD1-CG2 4.03Å; L365-V405 HydrophobicContact CD2-CG2 4.24Å; L365-V405 HydrophobicContact CG-CG2 4.49Å; L365-L496 HydrophobicContact CD2-CD1 3.6Å; L365-L496 HydrophobicContact CD2-CD2 3.73Å; L365-L496 HydrophobicContact CD2-CG 4.35Å
366	L	92.5	Very high	88.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.7	-47.3	173.1	-179.2	60.7	0	0	0	111.1	Y344 L347 I351 K362 K363 A364 M368 L369 V370 L630	Y344-L366 HydrophobicContact CD2-CD2 4.02Å; Y344-L366 HydrophobicContact CE2-CD2 3.92Å; L347-L366 HydrophobicContact CB-CD2 3.89Å; L347-L366 HydrophobicContact CD1-CD1 4.49Å; L347-L366 HydrophobicContact CD1-CD2 4.23Å; I351-L366 HydrophobicContact CD1-CB 3.59Å; I351-L366 HydrophobicContact CD1-CD1 3.9Å; I351-L366 HydrophobicContact CD1-CG 4.24Å; K362-L366 PolarHBondContact O-N 3.21Å; K363-L366 WeakPolarHBondContact O-CB 3.39Å; K363-L366 PolarHBondContact O-N 3.41Å; A364-L366 VanDerWaalsContact C-N 3.34Å; A364-L366 PolarHBondContact O-N 2.94Å; L366-M368 VanDerWaalsContact C-N 3.28Å; L366-M368 PolarHBondContact O-N 3.26Å; L366-L369 PolarHBondContact O-N 3.05Å; L366-L369 VanDerWaalsContact O-N 3.12Å; L366-V370 PolarHBondContact O-N 3.36Å; L366-V370 VanDerWaalsContact O-N 3.14Å; L366-L630 HydrophobicContact CD1-CD2 4.34Å; L366-L630 HydrophobicContact CD2-CD1 4.08Å; L366-L630 HydrophobicContact CD2-CD2 4.22Å; L366-L630 HydrophobicContact CG-CD1 4.2Å; L366-L630 HydrophobicContact CG-CD2 4.19Å
367	L	93.2	Very high	88.1	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-38.7	177.6	-66.6	174.3	0	0	0	111.9	K363 A364 L369 V370 G371 I386 L623 A626 L627 L630 L647	K363-L367 WeakPolarHBondContact O-CG 3.36Å; K363-L367 PolarHBondContact O-N 3.18Å; K363-L367 VanDerWaalsContact O-N 3.1Å; A364-L367 PolarHBondContact O-N 3.14Å; L367-L369 VanDerWaalsContact C-N 3.35Å; L367-L369 PolarHBondContact O-N 3.45Å; L367-V370 PolarHBondContact O-N 2.98Å; L367-G371 PolarHBondContact O-N 3.05Å; L367-I386 HydrophobicContact CB-CD1 4.37Å; L367-L623 HydrophobicContact CB-CD2 4.3Å; L367-L623 HydrophobicContact CD1-CD2 3.85Å; L367-A626 HydrophobicContact CB-CB 4.47Å; L367-A626 HydrophobicContact CD2-CB 3.98Å; L367-L627 HydrophobicContact CD1-CD2 4.34Å; L367-L627 HydrophobicContact CD1-CG 4.34Å; L367-L627 HydrophobicContact CD2-CD2 3.66Å; L367-L627 HydrophobicContact CD2-CG 3.7Å; L367-L630 HydrophobicContact CD2-CD1 3.56Å; L367-L647 HydrophobicContact CD1-CD1 3.53Å
368	M	93.4	Very high	87.8	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-41.1	174.4	-172.3	-170.6	68	0	0	112.5	A364 L365 L366 V370 G371 I386 I388 V405 V452 L496	A364-M368 PolarHBondContact O-N 3.25Å; L365-M368 HydrophobicContact CD2-CE 4.14Å; L365-M368 WeakPolarHBondContact O-CB 3.27Å; L365-M368 PolarHBondContact O-N 3.5Å; L366-M368 VanDerWaalsContact C-N 3.28Å; L366-M368 PolarHBondContact O-N 3.26Å; M368-V370 VanDerWaalsContact C-N 3.35Å; M368-V370 PolarHBondContact O-N 2.88Å; M368-G371 PolarHBondContact O-N 3.36Å; M368-I386 WeakPolarHBondContact CG-O 3.09Å; M368-I388 HydrophobicContact CB-CD1 3.73Å; M368-I388 HydrophobicContact CB-CG1 4.41Å; M368-I388 HydrophobicContact CG-CD1 4.29Å; M368-I388 HydrophobicContact CG-CG1 4.48Å; M368-I388 HydrophobicContact SD-CB 4.34Å; M368-I388 HydrophobicContact SD-CD1 4.19Å; M368-I388 HydrophobicContact SD-CG1 4.21Å; M368-V405 HydrophobicContact CE-CG1 3.78Å; M368-V452 HydrophobicContact CE-CG1 3.67Å; M368-V452 HydrophobicContact CE-CG2 4.25Å; M368-V452 HydrophobicContact SD-CG1 4.31Å; M368-L496 HydrophobicContact CE-CB 3.97Å; M368-L496 HydrophobicContact CE-CD1 4.31Å; M368-L496 HydrophobicContact CE-CD2 3.82Å; M368-L496 HydrophobicContact CE-CG 4.24Å; M368-L496 HydrophobicContact SD-CB 3.79Å; M368-L496 HydrophobicContact SD-CD1 4.01Å; M368-L496 HydrophobicContact SD-CG 4.29Å
369	L	91	Very high	87.5	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-66.5	-36.3	179.7	-76	168.1	0	0	0	112.8	L365 L366 L367 V405 L408 A409 V452 I574 K578	L365-L369 WeakPolarHBondContact O-CG 3.41Å; L365-L369 PolarHBondContact O-N 3.19Å; L366-L369 PolarHBondContact O-N 3.05Å; L366-L369 VanDerWaalsContact O-N 3.12Å; L367-L369 VanDerWaalsContact C-N 3.35Å; L367-L369 PolarHBondContact O-N 3.45Å; L369-V405 HydrophobicContact CD2-CG1 4.14Å; L369-L408 HydrophobicContact CD1-CD2 3.5Å; L369-L408 VanDerWaalsContact CD1-CD2 3.5Å; L369-L408 HydrophobicContact CD1-CG 4.12Å; L369-A409 HydrophobicContact CD2-CB 3.93Å; L369-V452 HydrophobicContact CD2-CG2 4.15Å; L369-I574 HydrophobicContact CB-CD1 4.12Å; L369-I574 HydrophobicContact CD1-CD1 4.26Å; L369-K578 WeakPolarHBondContact O-CE 3.41Å; L369-K578 PolarHBondContact O-NZ 3.5Å
370	V	89.7	Confident	87.2	Confident	2 Å²	2	45 Å²	45	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-74.3	-45.5	175.4	177.7	0	0	0	0	110.9	L366 L367 M368 I574 C577 K578 R629 L630	L366-V370 PolarHBondContact O-N 3.36Å; L366-V370 VanDerWaalsContact O-N 3.14Å; L367-V370 PolarHBondContact O-N 2.98Å; M368-V370 VanDerWaalsContact C-N 3.35Å; M368-V370 PolarHBondContact O-N 2.88Å; V370-I574 HydrophobicContact CG2-CG1 4.45Å; V370-I574 HydrophobicContact CG2-CG2 4.46Å; V370-C577 HydrophobicContact CG1-CB 4.01Å; V370-K578 VanDerWaalsContact O-CE 3.28Å; V370-K578 WeakPolarHBondContact O-CE 3.4Å; V370-K578 WeakPolarHBondContact O-CG 3.37Å; V370-R629 HydrophobicContact CG1-CB 3.74Å; V370-L630 HydrophobicContact CG2-CD2 3.6Å; V370-L630 HydrophobicContact CG2-CG 4.01Å
371	G	87.8	Confident	86.8	Confident	8 Å²	8	50.1 Å²	50.1	8%	0.082	26%	0.255	C	S	.	.			trans	72.5	160.6	-176.4	0	0	0	0	0	113.4	L367 M368 R629	L367-G371 PolarHBondContact O-N 3.05Å; M368-G371 PolarHBondContact O-N 3.36Å; G371-R629 WeakPolarHBondContact O-CD 3.5Å; G371-R629 PolarHBondContact O-NH1 2.9Å
372	G	84.7	Confident	86.5	Confident	5 Å²	5	52.3 Å²	52.3	5%	0.052	27%	0.266	C	S	.	.			trans	-88.7	179.4	174.5	0	0	0	0	0	113.4	G384 T625 R629	G372-G384 CarbonylContact C-O 3.55Å; G372-G384 VanDerWaalsContact CA-O 3.25Å; G372-G384 WeakPolarHBondContact CA-O 2.84Å; G372-G384 PolarHBondContact N-O 2.95Å; G372-T625 WeakPolarHBondContact CA-OG1 3.45Å; G372-R629 PolarHBondContact O-NH1 3.24Å
373	V	87	Confident	86.3	Confident	15 Å²	15	52.7 Å²	52.7	9%	0.091	27%	0.267	C	S	.	.			trans	-82.1	125.2	-177.6	-176	0	0	0	0	111.1	R375 Q581 P582 T625	V373-R375 HydrophobicContact CG1-CG 4.1Å; V373-R375 PolarHBondContact O-N 3.45Å; V373-Q581 HydrophobicContact CG1-CB 4.39Å; V373-Q581 HydrophobicContact CG1-CG 4.46Å; V373-P582 HydrophobicContact CG2-CG 4.01Å; V373-T625 HydrophobicContact CG2-CG2 4.45Å; V373-T625 PolarHBondContact N-OG1 2.94Å
374	D	85.3	Confident	86	Confident	86 Å²	86	51.7 Å²	51.7	46%	0.46	26%	0.263	S	S	.	.			trans	-72.6	122.6	167.6	-63.3	-31.2	0	0	0	109	G384	D374-G384 VanDerWaalsContact OD1-CA 3.22Å; D374-G384 WeakPolarHBondContact OD1-CA 3.36Å; D374-G384 PolarHBondContact OD1-N 3.1Å
375	R	80	Confident	86	Confident	90 Å²	90	52.1 Å²	52.1	34%	0.34	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-119.6	139.3	179.1	-66.5	-170.8	176.7	-177	2.1	110.5	V373 P377 I382 P582	V373-R375 HydrophobicContact CG1-CG 4.1Å; V373-R375 PolarHBondContact O-N 3.45Å; R375-P377 WeakPolarHBondContact O-CD 3.42Å; R375-I382 PolarHBondContact N-O 3.45Å; R375-I382 PolarHBondContact O-N 3.05Å; R375-P582 PolarHBondContact NH2-O 2.99Å
376	N	82.8	Confident	85.9	Confident	102 Å²	102	52.1 Å²	52.1	55%	0.545	27%	0.266	S	S	.	.			trans	-119.3	60.8	177.2	-64.3	-11.8	0	0	0	112.3	R378 M380 K381	N376-R378 PolarHBondContact O-N 3.43Å; N376-M380 WeakPolarHBondContact CA-O 3.33Å; N376-K381 WeakPolarHBondContact OD1-CA 3.28Å; N376-K381 WeakPolarHBondContact OD1-CB 3.41Å; N376-K381 WeakPolarHBondContact OD1-CG 3.27Å
377	P	74.8	Confident	86	Confident	66 Å²	66	52.1 Å²	52.1	43%	0.429	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-67.6	124.8	175.7	29.3	-34.1	0	0	0	110.5	R375 G379 M380 I382	R375-P377 WeakPolarHBondContact O-CD 3.42Å; P377-G379 PolarHBondContact O-N 2.85Å; P377-G379 VanDerWaalsContact O-N 3.12Å; P377-M380 VanDerWaalsContact CD-O 3.31Å; P377-M380 WeakPolarHBondContact CD-O 3.39Å; P377-M380 PolarHBondContact O-N 2.68Å; P377-M380 VanDerWaalsContact O-N 3.08Å; P377-I382 HydrophobicContact CG-CD1 3.89Å
378	R	76.3	Confident	86	Confident	261 Å²	261	52.1 Å²	52.1	99%	0.985	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	53.4	33.4	172.9	-58.5	-176.9	175.7	179.1	-0.8	115.1	N376 M380	N376-R378 PolarHBondContact O-N 3.43Å; R378-M380 VanDerWaalsContact C-N 3.29Å; R378-M380 PolarHBondContact O-N 3Å
379	G	77.5	Confident	85.9	Confident	73 Å²	73	52 Å²	52	75%	0.753	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	84.2	-6.6	178.4	0	0	0	0	0	115.1	P377	P377-G379 PolarHBondContact O-N 2.85Å; P377-G379 VanDerWaalsContact O-N 3.12Å
380	M	82.1	Confident	86	Confident	137 Å²	137	51.8 Å²	51.8	68%	0.675	26%	0.264	S	S	*	.			trans	-84.8	114.9	170.2	-174.1	174.9	177.9	0	0	109.1	N376 P377 R378	N376-M380 WeakPolarHBondContact CA-O 3.33Å; P377-M380 VanDerWaalsContact CD-O 3.31Å; P377-M380 WeakPolarHBondContact CD-O 3.39Å; P377-M380 PolarHBondContact O-N 2.68Å; P377-M380 VanDerWaalsContact O-N 3.08Å; R378-M380 VanDerWaalsContact C-N 3.29Å; R378-M380 PolarHBondContact O-N 3Å
381	K	82.4	Confident	85.9	Confident	161 Å²	161	52 Å²	52	70%	0.7	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-80.6	120	175.2	-58.4	-170.4	177.6	172.7	0	109.6	N376	N376-K381 WeakPolarHBondContact OD1-CA 3.28Å; N376-K381 WeakPolarHBondContact OD1-CB 3.41Å; N376-K381 WeakPolarHBondContact OD1-CG 3.27Å
382	I	84.9	Confident	85.8	Confident	54 Å²	54	51.6 Å²	51.6	28%	0.277	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	-99.7	118.6	173.2	-58.6	175.7	0	0	0	107.2	R375 P377	R375-I382 PolarHBondContact N-O 3.45Å; R375-I382 PolarHBondContact O-N 3.05Å; P377-I382 HydrophobicContact CG-CD1 3.89Å
383	R	88.8	Confident	85.8	Confident	16 Å²	16	52 Å²	52	6%	0.06	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-58.7	137.5	174.9	72.3	175	-157.8	-170	1.1	110.7	N387 M473 Q476 R525 D527 R622	R383-N387 PolarHBondContact NH1-ND2 3.25Å; R383-M473 VanDerWaalsContact CD-O 3.29Å; R383-M473 WeakPolarHBondContact CD-O 3.43Å; R383-M473 PolarHBondContact NH1-O 3.49Å; R383-Q476 HydrophobicContact CB-CG 4.11Å; R383-R525 PolarHBondContact NH1-O 2.91Å; R383-R525 PolarHBondContact NH2-O 3.35Å; R383-D527 IonicContact CZ-OD1 2.88Å; R383-D527 IonicContact NH2-OD1 3.16Å; R383-D527 PolarHBondContact NH2-OD1 3.25Å; R383-D527 IonicContact NH2-OD2 2.96Å; R383-D527 PolarHBondContact NH2-OD2 2.87Å; R383-R622 VanDerWaalsContact CG-CZ 3.47Å; R383-R622 VanDerWaalsContact NE-CZ 3.26Å; R383-R622 PolarHBondContact O-NE 3.1Å
384	G	86	Confident	85.7	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.01	29%	0.285	C	S	.	.			trans	-102.7	-6.7	168.3	0	0	0	0	0	113.3	G372 D374	G372-G384 CarbonylContact C-O 3.55Å; G372-G384 VanDerWaalsContact CA-O 3.25Å; G372-G384 WeakPolarHBondContact CA-O 2.84Å; G372-G384 PolarHBondContact N-O 2.95Å; D374-G384 VanDerWaalsContact OD1-CA 3.22Å; D374-G384 WeakPolarHBondContact OD1-CA 3.36Å; D374-G384 PolarHBondContact OD1-N 3.1Å
385	S	91.4	Very high	85.5	Confident	10 Å²	10	55 Å²	55	7%	0.07	30%	0.3	C	S	.	.			trans	-68.6	138.8	174.7	62.9	0	0	0	0	111.4	Q476 T493 S494	S385-Q476 PolarHBondContact OG-NE2 2.95Å; S385-T493 PolarHBondContact OG-O 3.38Å; S385-S494 WeakPolarHBondContact CB-OG 3.27Å
386	I	92.8	Very high	85.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.288	C	S	.	.			trans	-101	127.9	178.1	-62	163.3	0	0	0	107.2	L367 M368 I388 S494 D527 R622 L623 A626	L367-I386 HydrophobicContact CB-CD1 4.37Å; M368-I386 WeakPolarHBondContact CG-O 3.09Å; I386-I388 HydrophobicContact CG2-CD1 4.44Å; I386-I388 HydrophobicContact CG2-CG1 4.06Å; I386-S494 WeakPolarHBondContact O-CB 3.31Å; I386-D527 HydrophobicContact CG2-CB 4.23Å; I386-R622 HydrophobicContact CG1-CB 4.27Å; I386-L623 HydrophobicContact CD1-CD2 4Å; I386-L623 HydrophobicContact CG2-CD2 4.37Å; I386-A626 HydrophobicContact CD1-CB 3.96Å
387	N	93.9	Very high	85.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.278	C	S	.	.			trans	-108.2	128	177.7	-62.9	-35.7	0	0	0	109.7	R383 M473 I495 F526 D527 L528	R383-N387 PolarHBondContact NH1-ND2 3.25Å; N387-M473 HydrophobicContact CB-CE 3.67Å; N387-M473 WeakPolarHBondContact ND2-CE 3.42Å; N387-I495 WeakPolarHBondContact CA-O 3.12Å; N387-I495 PolarHBondContact OD1-N 3.41Å; N387-F526 HydrophobicContact CB-CD1 3.8Å; N387-F526 HydrophobicContact CB-CE1 4.31Å; N387-D527 PolarHBondContact O-N 2.88Å; N387-L528 PolarHBondContact O-N 2.68Å
388	I	93.4	Very high	86.5	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136	-176.5	-58.4	-175	0	0	0	109.7	A364 M368 I386 L390 I495 L496 A497 L528	A364-I388 HydrophobicContact CB-CD1 3.93Å; A364-I388 VanDerWaalsContact O-CD1 3.26Å; A364-I388 WeakPolarHBondContact O-CD1 3.37Å; M368-I388 HydrophobicContact CB-CD1 3.73Å; M368-I388 HydrophobicContact CB-CG1 4.41Å; M368-I388 HydrophobicContact CG-CD1 4.29Å; M368-I388 HydrophobicContact CG-CG1 4.48Å; M368-I388 HydrophobicContact SD-CB 4.34Å; M368-I388 HydrophobicContact SD-CD1 4.19Å; M368-I388 HydrophobicContact SD-CG1 4.21Å; I386-I388 HydrophobicContact CG2-CD1 4.44Å; I386-I388 HydrophobicContact CG2-CG1 4.06Å; I388-L390 HydrophobicContact CG2-CD2 4.05Å; I388-I495 PolarHBondContact N-O 2.79Å; I388-L496 HydrophobicContact CB-CD1 3.8Å; I388-L496 HydrophobicContact CG2-CD1 3.95Å; I388-L496 WeakPolarHBondContact O-CA 3.38Å; I388-A497 PolarHBondContact O-N 2.81Å; I388-L528 WeakPolarHBondContact CA-O 3.19Å; I388-L528 HydrophobicContact CD1-CD1 4.45Å; I388-L528 HydrophobicContact CG1-CB 4.34Å
389	C	91.8	Very high	87.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.2	170.4	-170	0	0	0	0	110.9	M391 A497 F526 L528 W530	C389-M391 HydrophobicContact CB-CE 4.39Å; C389-M391 VanDerWaalsContact SG-CE 3.58Å; C389-A497 CarbonylContact C-O 3.54Å; C389-A497 VanDerWaalsContact CA-O 3.32Å; C389-A497 WeakPolarHBondContact CA-O 3.49Å; C389-F526 HydrophobicContact CB-CD1 3.96Å; C389-F526 HydrophobicContact CB-CD2 3.87Å; C389-F526 HydrophobicContact CB-CE1 4.07Å; C389-F526 HydrophobicContact CB-CE2 3.91Å; C389-F526 HydrophobicContact CB-CG 3.89Å; C389-F526 HydrophobicContact CB-CZ 4.05Å; C389-L528 PolarHBondContact N-O 3.43Å; C389-W530 PolarHBondContact O-N 3.5Å
390	L	91.9	Very high	87.7	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	108.8	174.8	-56.6	-178.6	0	0	0	109.6	V361 I388 K398 L401 L496 A497 A498 A499 W530	V361-L390 HydrophobicContact CG1-CD2 3.7Å; I388-L390 HydrophobicContact CG2-CD2 4.05Å; L390-K398 HydrophobicContact CB-CD 4.36Å; L390-L401 HydrophobicContact CD1-CD1 4.34Å; L390-L496 HydrophobicContact CD1-CD1 4.37Å; L390-L496 HydrophobicContact CG-CD1 4.29Å; L390-A497 PolarHBondContact N-O 3.23Å; L390-A498 CarbonylContact O-C 3.57Å; L390-A498 VanDerWaalsContact O-CA 3.32Å; L390-A498 WeakPolarHBondContact O-CA 3.45Å; L390-A499 PolarHBondContact O-N 2.78Å; L390-W530 HydrophobicContact CD2-CB 3.95Å; L390-W530 HydrophobicContact CD2-CG 4.31Å
391	M	88.3	Confident	88.2	Confident	5 Å²	5	29.5 Å²	29.5	3%	0.025	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	155.8	175.8	-60.6	176.8	-178.6	0	0	109.8	C389 K398 A499 I516 L518 L523 I529 W530 L531 I532	C389-M391 HydrophobicContact CB-CE 4.39Å; C389-M391 VanDerWaalsContact SG-CE 3.58Å; M391-K398 VanDerWaalsContact C-CE 3.47Å; M391-A499 WeakPolarHBondContact CA-O 3.43Å; M391-A499 HydrophobicContact CG-CB 4.35Å; M391-I516 HydrophobicContact CE-CD1 4.18Å; M391-I516 HydrophobicContact CE-CG2 4.05Å; M391-I516 HydrophobicContact SD-CD1 3.31Å; M391-I516 WeakPolarHBondContact SD-CD1 3.45Å; M391-I516 HydrophobicContact SD-CG1 3.98Å; M391-I516 HydrophobicContact SD-CG2 4.29Å; M391-L518 HydrophobicContact CE-CD1 4.06Å; M391-L523 HydrophobicContact CE-CD2 3.56Å; M391-I529 HydrophobicContact CE-CG2 3.67Å; M391-I529 HydrophobicContact CG-CG2 4.39Å; M391-I529 HydrophobicContact SD-CG2 3.58Å; M391-I529 VanDerWaalsContact SD-CG2 3.58Å; M391-W530 WeakPolarHBondContact CA-O 3.44Å; M391-W530 WeakPolarHBondContact CB-O 3.38Å; M391-W530 PolarHBondContact N-O 3.26Å; M391-L531 HydrophobicContact CB-CD1 3.8Å; M391-I532 PolarHBondContact O-N 3.47Å
392	G	85.9	Confident	88.7	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.5	178.9	-179.1	0	0	0	0	0	115.4	K398 P501 I532	G392-K398 VanDerWaalsContact CA-CE 3.46Å; G392-K398 PolarHBondContact O-NZ 3.14Å; G392-P501 WeakPolarHBondContact O-CD 3.48Å; G392-I532 WeakPolarHBondContact CA-O 3.32Å
393	D	85.3	Confident	89	Confident	15 Å²	15	21.6 Å²	21.6	8%	0.08	15%	0.147	C	C	.	.			trans	-75.6	156.6	-176.2	-57.9	-30.7	0	0	0	111.7	G395 V396 K505 Y506 I532 D534	D393-G395 PolarHBondContact O-N 3.08Å; D393-V396 VanDerWaalsContact O-CG2 3.26Å; D393-V396 WeakPolarHBondContact O-CG2 3.48Å; D393-K505 VanDerWaalsContact OD1-CA 3.3Å; D393-K505 WeakPolarHBondContact OD1-CA 3.04Å; D393-Y506 PolarHBondContact OD1-N 2.89Å; D393-I532 PolarHBondContact N-O 2.84Å; D393-D534 HydrophobicContact CB-CB 4.28Å; D393-D534 PolarHBondContact OD2-N 3.02Å
394	P	83.5	Confident	89.1	Confident	87 Å²	87	21.5 Å²	21.5	57%	0.565	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	131.4	171.1	28.7	-33.3	0	0	0	109.2	G504	P394-G504 WeakPolarHBondContact CD-O 3.34Å
395	G	81.4	Confident	89.4	Confident	76 Å²	76	21.5 Å²	21.5	78%	0.784	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	118.5	-19.5	-178.9	0	0	0	0	0	114.5	D393 A397	D393-G395 PolarHBondContact O-N 3.08Å; G395-A397 PolarHBondContact O-N 3.49Å
396	V	85	Confident	89.4	Confident	15 Å²	15	23.1 Å²	23.1	9%	0.091	15%	0.154	C	C	.	.	S	Bend	trans	-79.7	28.8	-177.7	-55.6	0	0	0	0	114.5	D393 K398 I532 D534	D393-V396 VanDerWaalsContact O-CG2 3.26Å; D393-V396 WeakPolarHBondContact O-CG2 3.48Å; V396-K398 HydrophobicContact CG2-CD 4.07Å; V396-K398 VanDerWaalsContact CG2-CE 3.45Å; V396-K398 HydrophobicContact CG2-CG 3.57Å; V396-K398 PolarHBondContact O-N 3.5Å; V396-I532 HydrophobicContact CB-CB 4.49Å; V396-I532 HydrophobicContact CB-CG2 3.79Å; V396-I532 HydrophobicContact CG1-CG2 3.93Å; V396-I532 HydrophobicContact CG2-CB 4.08Å; V396-I532 HydrophobicContact CG2-CG2 3.94Å; V396-D534 HydrophobicContact CG1-CB 4.04Å
397	A	85.8	Confident	89.1	Confident	41 Å²	41	28.1 Å²	28.1	34%	0.339	17%	0.173	S	C	.	.			trans	52.5	21.6	175.4	0	0	0	0	0	117.4	I355 G395 S399 Q400 L401	I355-A397 HydrophobicContact CD1-CB 3.9Å; I355-A397 HydrophobicContact CG1-CB 4.3Å; G395-A397 PolarHBondContact O-N 3.49Å; A397-S399 PolarHBondContact O-N 3.21Å; A397-Q400 HydrophobicContact CB-CB 4.37Å; A397-Q400 WeakPolarHBondContact O-CB 3.46Å; A397-Q400 PolarHBondContact O-N 2.85Å; A397-L401 PolarHBondContact O-N 3.41Å; A397-L401 VanDerWaalsContact O-N 3.09Å
398	K	88.5	Confident	88.8	Confident	10 Å²	10	28.2 Å²	28.2	4%	0.043	17%	0.174	C	C	.	.	H	α-helix	trans	-56.8	-45.4	-178.5	-57.9	179.4	-164.5	157.7	0	113.8	L390 M391 G392 V396 Q400 L401 L402 A498 A499 N500	L390-K398 HydrophobicContact CB-CD 4.36Å; M391-K398 VanDerWaalsContact C-CE 3.47Å; G392-K398 VanDerWaalsContact CA-CE 3.46Å; G392-K398 PolarHBondContact O-NZ 3.14Å; V396-K398 HydrophobicContact CG2-CD 4.07Å; V396-K398 VanDerWaalsContact CG2-CE 3.45Å; V396-K398 HydrophobicContact CG2-CG 3.57Å; V396-K398 PolarHBondContact O-N 3.5Å; K398-Q400 PolarHBondContact O-N 3.4Å; K398-L401 WeakPolarHBondContact O-CB 3.39Å; K398-L401 PolarHBondContact O-N 3.32Å; K398-L401 VanDerWaalsContact O-N 3.12Å; K398-L402 PolarHBondContact O-N 2.88Å; K398-A498 HydrophobicContact CB-CB 4.33Å; K398-A498 HydrophobicContact CD-CB 4.39Å; K398-A499 PolarHBondContact NZ-O 3.08Å; K398-N500 PolarHBondContact NZ-OD1 2.98Å; K398-N500 VanDerWaalsContact NZ-OD1 3.07Å
399	S	88.5	Confident	88.4	Confident	51 Å²	51	28.9 Å²	28.9	36%	0.357	18%	0.179	S	C	.	.	H	α-helix	trans	-65.1	-28.9	179.8	-49.4	0	0	0	0	111.6	A397 T403 D456	A397-S399 PolarHBondContact O-N 3.21Å; S399-T403 WeakPolarHBondContact O-CB 3.48Å; S399-T403 PolarHBondContact O-N 3.18Å; S399-T403 PolarHBondContact O-OG1 3.49Å; S399-D456 WeakPolarHBondContact CB-OD2 3.48Å; S399-D456 PolarHBondContact OG-OD2 3.5Å
400	Q	90	Very high	87.5	Confident	75 Å²	75	33.3 Å²	33.3	35%	0.35	20%	0.202	S	C	.	.	H	α-helix	trans	-70.6	-39.6	173.3	-172.2	66.2	4.3	0	0	111.2	E354 I355 A397 K398 T403 Y404	E354-Q400 PolarHBondContact OE2-NE2 2.74Å; I355-Q400 HydrophobicContact CD1-CB 4.04Å; I355-Q400 HydrophobicContact CD1-CG 3.91Å; I355-Q400 HydrophobicContact CG1-CG 4.42Å; A397-Q400 HydrophobicContact CB-CB 4.37Å; A397-Q400 WeakPolarHBondContact O-CB 3.46Å; A397-Q400 PolarHBondContact O-N 2.85Å; K398-Q400 PolarHBondContact O-N 3.4Å; Q400-T403 PolarHBondContact O-N 2.86Å; Q400-Y404 WeakPolarHBondContact O-CB 3.11Å; Q400-Y404 PolarHBondContact O-N 2.85Å
401	L	92.3	Very high	87	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-46.9	171.9	-69.9	171.4	0	0	0	111.5	A352 I355 V361 L365 L390 A397 K398 T403 Y404 V405	A352-L401 HydrophobicContact CB-CD2 4.03Å; I355-L401 HydrophobicContact CD1-CD2 3.66Å; I355-L401 HydrophobicContact CD1-CG 3.77Å; V361-L401 HydrophobicContact CG1-CD1 4.4Å; L365-L401 HydrophobicContact CD1-CB 4.39Å; L365-L401 HydrophobicContact CD1-CD2 4.19Å; L390-L401 HydrophobicContact CD1-CD1 4.34Å; A397-L401 PolarHBondContact O-N 3.41Å; A397-L401 VanDerWaalsContact O-N 3.09Å; K398-L401 WeakPolarHBondContact O-CB 3.39Å; K398-L401 PolarHBondContact O-N 3.32Å; K398-L401 VanDerWaalsContact O-N 3.12Å; L401-T403 VanDerWaalsContact C-N 3.32Å; L401-T403 PolarHBondContact O-N 3.34Å; L401-Y404 PolarHBondContact O-N 3.18Å; L401-V405 VanDerWaalsContact O-CG2 3.31Å; L401-V405 WeakPolarHBondContact O-CG2 3.27Å; L401-V405 PolarHBondContact O-N 2.89Å
402	L	92.8	Very high	86.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-47.5	175.4	-69.5	179.2	0	0	0	111.5	K398 Y404 V405 N406 Y414 C454 D456 L496 A498	K398-L402 PolarHBondContact O-N 2.88Å; L402-Y404 VanDerWaalsContact C-N 3.34Å; L402-Y404 PolarHBondContact O-N 3.16Å; L402-V405 PolarHBondContact O-N 3.02Å; L402-N406 WeakPolarHBondContact O-CB 3.5Å; L402-N406 PolarHBondContact O-N 2.76Å; L402-Y414 HydrophobicContact CB-CD2 4.44Å; L402-Y414 HydrophobicContact CB-CE2 4.02Å; L402-Y414 HydrophobicContact CD1-CE2 4.23Å; L402-C454 HydrophobicContact CB-CB 4.42Å; L402-C454 HydrophobicContact CD2-CB 4.11Å; L402-D456 HydrophobicContact CD1-CB 3.74Å; L402-L496 HydrophobicContact CD2-CB 4.23Å; L402-L496 HydrophobicContact CD2-CD2 3.46Å; L402-L496 VanDerWaalsContact CD2-CD2 3.46Å; L402-L496 HydrophobicContact CD2-CG 3.43Å; L402-L496 VanDerWaalsContact CD2-CG 3.43Å; L402-A498 HydrophobicContact CD1-CB 3.67Å; L402-A498 HydrophobicContact CG-CB 4.35Å
403	T	91.4	Very high	87	Confident	48 Å²	48	39.8 Å²	39.8	29%	0.294	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-39.9	-179.6	-57.7	0	0	0	0	111.4	S399 Q400 L401 N406 R407	S399-T403 WeakPolarHBondContact O-CB 3.48Å; S399-T403 PolarHBondContact O-N 3.18Å; S399-T403 PolarHBondContact O-OG1 3.49Å; Q400-T403 PolarHBondContact O-N 2.86Å; L401-T403 VanDerWaalsContact C-N 3.32Å; L401-T403 PolarHBondContact O-N 3.34Å; T403-N406 PolarHBondContact O-N 3.12Å; T403-R407 WeakPolarHBondContact O-CG 3.43Å; T403-R407 PolarHBondContact O-N 2.77Å
404	Y	91.5	Very high	87.3	Confident	14 Å²	14	43.2 Å²	43.2	6%	0.055	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-45.7	176.2	-171.1	-87.8	0	0	0	111.8	S350 I351 A352 Q400 L401 L402 N406 R407 L408	S350-Y404 PolarHBondContact O-OH 3.29Å; S350-Y404 VanDerWaalsContact O-OH 3.1Å; I351-Y404 HydrophobicContact CB-CE1 4.44Å; I351-Y404 HydrophobicContact CG2-CD1 4.11Å; I351-Y404 HydrophobicContact CG2-CE1 4.01Å; A352-Y404 HydrophobicContact CB-CD1 3.98Å; A352-Y404 HydrophobicContact CB-CD2 4.17Å; A352-Y404 HydrophobicContact CB-CE1 4.39Å; A352-Y404 HydrophobicContact CB-CG 3.87Å; A352-Y404 VanDerWaalsContact N-CZ 3.27Å; Q400-Y404 WeakPolarHBondContact O-CB 3.11Å; Q400-Y404 PolarHBondContact O-N 2.85Å; L401-Y404 PolarHBondContact O-N 3.18Å; L402-Y404 VanDerWaalsContact C-N 3.34Å; L402-Y404 PolarHBondContact O-N 3.16Å; Y404-N406 VanDerWaalsContact C-N 3.34Å; Y404-N406 PolarHBondContact O-N 3.03Å; Y404-R407 CarbonylContact O-C 3.58Å; Y404-R407 WeakPolarHBondContact O-CB 2.95Å; Y404-R407 PolarHBondContact O-N 2.84Å; Y404-R407 VanDerWaalsContact O-N 3.1Å; Y404-L408 HydrophobicContact CE1-CB 4.49Å; Y404-L408 HydrophobicContact CE1-CD2 4.16Å; Y404-L408 PolarHBondContact O-N 2.82Å
405	V	92.1	Very high	87.6	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-40.8	176.9	172.6	0	0	0	0	111.3	L365 M368 L369 L401 L402 R407 L408 A409 V452 L496	L365-V405 HydrophobicContact CB-CG2 4.49Å; L365-V405 HydrophobicContact CD1-CG2 4.03Å; L365-V405 HydrophobicContact CD2-CG2 4.24Å; L365-V405 HydrophobicContact CG-CG2 4.49Å; M368-V405 HydrophobicContact CE-CG1 3.78Å; L369-V405 HydrophobicContact CD2-CG1 4.14Å; L401-V405 VanDerWaalsContact O-CG2 3.31Å; L401-V405 WeakPolarHBondContact O-CG2 3.27Å; L401-V405 PolarHBondContact O-N 2.89Å; L402-V405 PolarHBondContact O-N 3.02Å; V405-R407 VanDerWaalsContact C-N 3.27Å; V405-R407 PolarHBondContact O-N 3.26Å; V405-L408 PolarHBondContact O-N 3.19Å; V405-L408 VanDerWaalsContact O-N 3.09Å; V405-A409 WeakPolarHBondContact O-CB 3.06Å; V405-A409 PolarHBondContact O-N 3.2Å; V405-V452 HydrophobicContact CG1-CG1 4.23Å; V405-L496 HydrophobicContact CB-CD2 4.14Å; V405-L496 HydrophobicContact CG1-CD2 4.03Å; V405-L496 HydrophobicContact CG2-CD2 4.15Å
406	N	90.7	Very high	88.1	Confident	44 Å²	44	38.3 Å²	38.3	24%	0.235	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-34.2	174.2	-176.1	39.9	0	0	0	112.1	L402 T403 Y404 S412	L402-N406 WeakPolarHBondContact O-CB 3.5Å; L402-N406 PolarHBondContact O-N 2.76Å; T403-N406 PolarHBondContact O-N 3.12Å; Y404-N406 VanDerWaalsContact C-N 3.34Å; Y404-N406 PolarHBondContact O-N 3.03Å; N406-S412 WeakPolarHBondContact CA-OG 3.28Å; N406-S412 PolarHBondContact O-OG 3.17Å; N406-S412 WeakPolarHBondContact OD1-CB 3.4Å; N406-S412 PolarHBondContact OD1-OG 3.25Å
407	R	87.1	Confident	87.9	Confident	106 Å²	106	37.8 Å²	37.8	40%	0.4	20%	0.196	S	C	.	.	H	α-helix	trans	-73.1	-37.7	171.5	-70.4	-175.3	-67.3	171.3	-0.9	111.3	T403 Y404 V405 M567 R571	T403-R407 WeakPolarHBondContact O-CG 3.43Å; T403-R407 PolarHBondContact O-N 2.77Å; Y404-R407 CarbonylContact O-C 3.58Å; Y404-R407 WeakPolarHBondContact O-CB 2.95Å; Y404-R407 PolarHBondContact O-N 2.84Å; Y404-R407 VanDerWaalsContact O-N 3.1Å; V405-R407 VanDerWaalsContact C-N 3.27Å; V405-R407 PolarHBondContact O-N 3.26Å; R407-M567 HydrophobicContact CB-CE 3.97Å; R407-R571 PolarHBondContact O-NH2 3.46Å
408	L	87.5	Confident	87.8	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-73.6	-39.4	-174.5	-172.1	58.8	0	0	0	112.6	I351 L369 Y404 V405 M567 I570 R571	I351-L408 HydrophobicContact CG1-CD2 4.28Å; L369-L408 HydrophobicContact CD1-CD2 3.5Å; L369-L408 VanDerWaalsContact CD1-CD2 3.5Å; L369-L408 HydrophobicContact CD1-CG 4.12Å; Y404-L408 HydrophobicContact CE1-CB 4.49Å; Y404-L408 HydrophobicContact CE1-CD2 4.16Å; Y404-L408 PolarHBondContact O-N 2.82Å; V405-L408 PolarHBondContact O-N 3.19Å; V405-L408 VanDerWaalsContact O-N 3.09Å; L408-M567 HydrophobicContact CD1-CB 4.42Å; L408-M567 HydrophobicContact CD1-CE 4.33Å; L408-I570 HydrophobicContact CD1-CB 4.18Å; L408-I570 HydrophobicContact CD1-CG2 3.86Å; L408-I570 HydrophobicContact CD2-CG2 4.09Å; L408-I570 HydrophobicContact CG-CG2 4.4Å; L408-R571 HydrophobicContact CD1-CG 4.22Å; L408-R571 WeakPolarHBondContact O-CG 3.35Å; L408-R571 PolarHBondContact O-NE 3.43Å
409	A	84.4	Confident	87.4	Confident	15 Å²	15	47.1 Å²	47.1	12%	0.124	24%	0.241	C	C	.	.	S	Bend	trans	-66.6	143.9	-180	0	0	0	0	0	112.7	L369 V405 R411 V452	L369-A409 HydrophobicContact CD2-CB 3.93Å; V405-A409 WeakPolarHBondContact O-CB 3.06Å; V405-A409 PolarHBondContact O-N 3.2Å; A409-R411 VanDerWaalsContact C-N 3.34Å; A409-V452 HydrophobicContact CB-CG2 4.36Å
410	L	73.4	Confident	86.8	Confident	92 Å²	92	45.8 Å²	45.8	48%	0.482	23%	0.232	S	C	.	.	S	Bend	trans	-72.1	-29.8	178.4	-70.2	169.7	0	0	0	113.1
411	R	80.8	Confident	86.4	Confident	60 Å²	60	45.5 Å²	45.5	23%	0.226	24%	0.238	C	C	.	.	S	Bend	trans	-135.3	115.6	174.8	-76.8	-176.7	171.1	172	-1.9	107.1	D279 A409 D449 G451 V452	D279-R411 IonicContact OD1-CZ 3.77Å; D279-R411 IonicContact OD1-NH2 2.89Å; D279-R411 PolarHBondContact OD1-NH2 3.2Å; A409-R411 VanDerWaalsContact C-N 3.34Å; R411-D449 PolarHBondContact NH1-O 3.47Å; R411-G451 CarbonylContact O-C 3.47Å; R411-G451 WeakPolarHBondContact O-CA 3.25Å; R411-V452 PolarHBondContact O-N 3.01Å
412	S	87.3	Confident	85.8	Confident	21 Å²	21	45.9 Å²	45.9	15%	0.147	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	155.5	175.5	46.4	0	0	0	0	111.1	N406 V452	N406-S412 WeakPolarHBondContact CA-OG 3.28Å; N406-S412 PolarHBondContact O-OG 3.17Å; N406-S412 WeakPolarHBondContact OD1-CB 3.4Å; N406-S412 PolarHBondContact OD1-OG 3.25Å; S412-V452 WeakPolarHBondContact CA-O 3.15Å; S412-V452 WeakPolarHBondContact CB-O 3.27Å
413	Q	88.3	Confident	85.3	Confident	61 Å²	61	48.7 Å²	48.7	29%	0.285	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.8	176.5	-68	-64.1	-15.8	0	0	108.1	A444 L447 A448 V452 C454	Q413-A444 HydrophobicContact CB-CB 4.39Å; Q413-L447 HydrophobicContact CG-CB 4.23Å; Q413-A448 HydrophobicContact CB-CB 4.22Å; Q413-A448 HydrophobicContact CG-CB 3.95Å; Q413-V452 PolarHBondContact N-O 3.34Å; Q413-C454 PolarHBondContact O-N 2.81Å
414	Y	91.2	Very high	84.9	Confident	87 Å²	87	48 Å²	48	34%	0.341	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.5	174.4	-179.5	-92.8	0	0	0	109.3	L402 T416 C454 D456	L402-Y414 HydrophobicContact CB-CD2 4.44Å; L402-Y414 HydrophobicContact CB-CE2 4.02Å; L402-Y414 HydrophobicContact CD1-CE2 4.23Å; Y414-T416 HydrophobicContact CE1-CG2 4.12Å; Y414-C454 HydrophobicContact CD2-CB 3.98Å; Y414-D456 HydrophobicContact CE2-CB 4.4Å; Y414-D456 PolarHBondContact OH-OD2 2.94Å
415	T	90.2	Very high	84.5	Confident	11 Å²	11	47.4 Å²	47.4	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.6	178.7	-174.4	0	0	0	0	111.2	S420 L425 C454 I455 D456	T415-S420 WeakPolarHBondContact OG1-CB 3.45Å; T415-S420 PolarHBondContact OG1-OG 3.39Å; T415-L425 HydrophobicContact CG2-CD2 4.01Å; T415-C454 WeakPolarHBondContact CG2-O 3.3Å; T415-C454 PolarHBondContact N-O 2.7Å; T415-I455 HydrophobicContact CG2-CB 4.21Å; T415-I455 HydrophobicContact CG2-CG1 3.72Å; T415-I455 HydrophobicContact CG2-CG2 4.23Å; T415-I455 CarbonylContact O-C 3.56Å; T415-I455 WeakPolarHBondContact O-CA 3.49Å; T415-D456 PolarHBondContact O-N 3.42Å
416	T	90.7	Very high	84.1	Confident	49 Å²	49	48.2 Å²	48.2	30%	0.301	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.3	173.5	68.4	0	0	0	0	109.5	Y414 R418 G419 S420 D456	Y414-T416 HydrophobicContact CE1-CG2 4.12Å; T416-R418 PolarHBondContact O-N 3.31Å; T416-G419 PolarHBondContact O-N 2.92Å; T416-G419 WeakPolarHBondContact OG1-CA 3.32Å; T416-G419 PolarHBondContact OG1-N 3.09Å; T416-G419 VanDerWaalsContact OG1-N 3.08Å; T416-S420 PolarHBondContact O-N 2.85Å; T416-S420 VanDerWaalsContact O-N 3.15Å; T416-D456 CarbonylContact C-O 3.39Å; T416-D456 WeakPolarHBondContact CA-O 3.42Å
417	G	81.8	Confident	83.8	Confident	4 Å²	4	46.2 Å²	46.2	4%	0.041	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.6	-175.3	0	0	0	0	0	114.2	D456 M461	G417-D456 PolarHBondContact N-O 3.1Å; G417-M461 WeakPolarHBondContact O-CG 3.35Å
418	R	83.5	Confident	83.7	Confident	185 Å²	185	42.4 Å²	42.4	70%	0.698	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-26.1	172.5	-71.8	-172.2	171.5	-177.6	3.2	113.9	T416 K460	T416-R418 PolarHBondContact O-N 3.31Å; R418-K460 HydrophobicContact CG-CB 3.77Å; R418-K460 HydrophobicContact CG-CD 4.44Å
419	G	80	Confident	83.6	Confident	62 Å²	62	44.1 Å²	44.1	64%	0.639	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-17.3	-175.5	0	0	0	0	0	113.8	T416	T416-G419 PolarHBondContact O-N 2.92Å; T416-G419 WeakPolarHBondContact OG1-CA 3.32Å; T416-G419 PolarHBondContact OG1-N 3.09Å; T416-G419 VanDerWaalsContact OG1-N 3.08Å
420	S	75.7	Confident	83.7	Confident	22 Å²	22	45.8 Å²	45.8	15%	0.154	27%	0.265	C	S	.	.			trans	-114.8	123.7	176.1	-74.8	0	0	0	0	112	T415 T416	T415-S420 WeakPolarHBondContact OG1-CB 3.45Å; T415-S420 PolarHBondContact OG1-OG 3.39Å; T416-S420 PolarHBondContact O-N 2.85Å; T416-S420 VanDerWaalsContact O-N 3.15Å
421	S	81	Confident	84.2	Confident	69 Å²	69	49.2 Å²	49.2	48%	0.483	27%	0.271	S	S	.	.			trans	-76.8	160.8	164.4	62.9	0	0	0	0	110.4	V423 G424 L425	S421-V423 PolarHBondContact O-N 2.79Å; S421-G424 CarbonylContact O-C 3.51Å; S421-G424 WeakPolarHBondContact O-CA 3.47Å; S421-G424 PolarHBondContact O-N 2.88Å; S421-G424 PolarHBondContact OG-N 3.48Å; S421-L425 PolarHBondContact O-N 3.45Å
422	G	80.4	Confident	83.9	Confident	11 Å²	11	46.8 Å²	46.8	11%	0.113	26%	0.262	C	S	.	.	H	α-helix	trans	-54.9	-30	177	0	0	0	0	0	113.5	L425 T426 D465	G422-L425 PolarHBondContact O-N 2.65Å; G422-T426 WeakPolarHBondContact O-CB 3.24Å; G422-T426 WeakPolarHBondContact O-CG2 3.33Å; G422-T426 PolarHBondContact O-N 3.1Å; G422-T426 PolarHBondContact O-OG1 3.13Å; G422-D465 WeakPolarHBondContact CA-OD1 3.41Å; G422-D465 PolarHBondContact N-OD1 3.02Å; G422-D465 PolarHBondContact N-OD2 3.1Å
423	V	82.3	Confident	83.2	Confident	59 Å²	59	51.2 Å²	51.2	36%	0.358	29%	0.291	S	S	.	.	H	α-helix	trans	-70	-38.8	173.7	-177.1	0	0	0	0	111.7	S421 L425 A427 A428	S421-V423 PolarHBondContact O-N 2.79Å; V423-L425 VanDerWaalsContact C-N 3.33Å; V423-A427 CarbonylContact O-C 3.55Å; V423-A427 PolarHBondContact O-N 3.29Å; V423-A428 HydrophobicContact CG1-CB 3.61Å
424	G	82.6	Confident	82.2	Confident	33 Å²	33	53.3 Å²	53.3	34%	0.34	30%	0.303	S	S	.	.	H	α-helix	trans	-70.9	-25.6	175.2	0	0	0	0	0	113.6	S421 G443 A444	S421-G424 CarbonylContact O-C 3.51Å; S421-G424 WeakPolarHBondContact O-CA 3.47Å; S421-G424 PolarHBondContact O-N 2.88Å; S421-G424 PolarHBondContact OG-N 3.48Å; G424-G443 CarbonylContact O-C 3.6Å; G424-G443 WeakPolarHBondContact O-CA 3.43Å; G424-A444 PolarHBondContact O-N 3.12Å
425	L	84.3	Confident	81.3	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-80.1	-41.7	173.3	-67.3	175.2	0	0	0	112.6	T415 S421 G422 V423 G443 A444 L445 M461 I469	T415-L425 HydrophobicContact CG2-CD2 4.01Å; S421-L425 PolarHBondContact O-N 3.45Å; G422-L425 PolarHBondContact O-N 2.65Å; V423-L425 VanDerWaalsContact C-N 3.33Å; L425-G443 CarbonylContact O-C 3.6Å; L425-A444 HydrophobicContact CD2-CB 4.34Å; L425-A444 PolarHBondContact O-N 3.33Å; L425-L445 HydrophobicContact CB-CD1 4.11Å; L425-L445 VanDerWaalsContact O-CB 3.28Å; L425-L445 WeakPolarHBondContact O-CB 3.34Å; L425-L445 PolarHBondContact O-N 3.08Å; L425-M461 HydrophobicContact CD1-CE 3.52Å; L425-I469 HydrophobicContact CD1-CD1 4.29Å
426	T	83.7	Confident	80.8	Confident	18 Å²	18	52.2 Å²	52.2	11%	0.11	31%	0.311	C	S	.	.	S	Bend	trans	-88	-95	-173.5	53.2	0	0	0	0	112.6	G422 G443 V446 A468 V478	G422-T426 WeakPolarHBondContact O-CB 3.24Å; G422-T426 WeakPolarHBondContact O-CG2 3.33Å; G422-T426 PolarHBondContact O-N 3.1Å; G422-T426 PolarHBondContact O-OG1 3.13Å; T426-G443 VanDerWaalsContact O-CA 3.22Å; T426-G443 WeakPolarHBondContact O-CA 3.31Å; T426-G443 PolarHBondContact O-N 3.44Å; T426-V446 WeakPolarHBondContact O-CG2 3.22Å; T426-A468 HydrophobicContact CG2-CB 3.42Å; T426-A468 VanDerWaalsContact CG2-CB 3.42Å; T426-V478 HydrophobicContact CG2-CG1 3.85Å
427	A	83.8	Confident	80.3	Confident	2 Å²	2	55.4 Å²	55.4	2%	0.017	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	151.8	167.8	0	0	0	0	0	109.5	V423 E441 I480 L489	V423-A427 CarbonylContact O-C 3.55Å; V423-A427 PolarHBondContact O-N 3.29Å; A427-E441 CarbonylContact C-O 3.5Å; A427-E441 WeakPolarHBondContact CA-O 3.43Å; A427-E441 WeakPolarHBondContact CB-O 3.36Å; A427-I480 HydrophobicContact CB-CD1 3.14Å; A427-L489 HydrophobicContact CB-CD1 3.61Å
428	A	84.7	Confident	80.4	Confident	26 Å²	26	60.4 Å²	60.4	22%	0.215	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	146.9	174.6	0	0	0	0	0	110.3	V423 V430 L440 E441	V423-A428 HydrophobicContact CG1-CB 3.61Å; A428-V430 HydrophobicContact CB-CG2 4.22Å; A428-L440 WeakPolarHBondContact O-CA 3.46Å; A428-E441 PolarHBondContact N-O 3.01Å; A428-E441 PolarHBondContact O-N 3Å
429	V	86.1	Confident	80.2	Confident	38 Å²	38	53.1 Å²	53.1	23%	0.23	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117	165.8	-177.8	0	0	0	0	107.6	F438 T439 L440 I480 K482 A483 I485	V429-F438 HydrophobicContact CG1-CB 3.73Å; V429-F438 HydrophobicContact CG1-CD1 3.93Å; V429-F438 HydrophobicContact CG1-CG 4.19Å; V429-T439 WeakPolarHBondContact CA-O 3.42Å; V429-L440 HydrophobicContact CG2-CD2 3.73Å; V429-I480 HydrophobicContact CG2-CG2 4.39Å; V429-K482 HydrophobicContact CG2-CB 3.92Å; V429-A483 HydrophobicContact CG1-CB 4.01Å; V429-I485 HydrophobicContact CG1-CD1 3.87Å; V429-I485 HydrophobicContact CG2-CD1 4.41Å
430	V	85.2	Confident	80.3	Confident	49 Å²	49	52.7 Å²	52.7	30%	0.297	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.5	-179.8	-178.5	0	0	0	0	109.2	A428 T439 E441	A428-V430 HydrophobicContact CB-CG2 4.22Å; V430-T439 PolarHBondContact N-O 2.95Å; V430-T439 PolarHBondContact O-N 3.11Å; V430-T439 VanDerWaalsContact O-O 3.12Å; V430-T439 PolarHBondContact O-OG1 3.01Å; V430-E441 HydrophobicContact CB-CG 4.23Å; V430-E441 HydrophobicContact CG2-CB 4.42Å; V430-E441 HydrophobicContact CG2-CG 4.01Å; V430-E441 WeakPolarHBondContact CG2-OE2 3.41Å
431	R	83.6	Confident	80.4	Confident	165 Å²	165	54 Å²	54	62%	0.623	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.3	174.8	-168.7	178	-175.3	-168.1	-2.1	109.8	P433 G436 F438	R431-P433 WeakPolarHBondContact O-CD 3.42Å; R431-G436 WeakPolarHBondContact CG-O 3.36Å; R431-G436 PolarHBondContact NE-O 3.29Å; R431-G436 VanDerWaalsContact NE-O 3.1Å; R431-F438 HydrophobicContact CB-CD1 4.16Å; R431-F438 HydrophobicContact CB-CE1 4.16Å; R431-F438 HydrophobicContact CG-CD1 4.49Å; R431-F438 HydrophobicContact CG-CE1 4.39Å
432	D	74.3	Confident	80.3	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.043	30%	0.299	C	S	.	.			trans	-68	125.7	176.3	-161.3	-2.8	0	0	0	110.3	R179 L434 T435 G436 E437	R179-D432 IonicContact CZ-OD1 2.96Å; R179-D432 IonicContact CZ-OD2 2.81Å; R179-D432 IonicContact NH1-OD1 3.37Å; R179-D432 PolarHBondContact NH1-OD1 3.41Å; R179-D432 IonicContact NH1-OD2 3.23Å; R179-D432 PolarHBondContact NH1-OD2 3.31Å; R179-D432 IonicContact NH2-OD1 3.69Å; R179-D432 PolarHBondContact NH2-OD1 2.93Å; R179-D432 IonicContact NH2-OD2 3.84Å; R179-D432 PolarHBondContact NH2-OD2 3.23Å; D432-L434 PolarHBondContact O-N 3Å; D432-T435 WeakPolarHBondContact CB-OG1 3.41Å; D432-G436 WeakPolarHBondContact O-CA 3.35Å; D432-G436 PolarHBondContact O-N 2.94Å; D432-E437 PolarHBondContact N-O 3.5Å
433	P	74.1	Confident	80.6	Confident	114 Å²	114	52 Å²	52	74%	0.74	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-21.6	176.5	23.9	-36	0	0	0	114.1	R431	R431-P433 WeakPolarHBondContact O-CD 3.42Å
434	L	67.6	Low	80.8	Confident	105 Å²	105	49.9 Å²	49.9	55%	0.55	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-48.2	-176.9	-71.2	170.7	0	0	0	113.2	E244 D432	E244-L434 VanDerWaalsContact OE2-CD1 3.26Å; E244-L434 WeakPolarHBondContact OE2-CD1 3.43Å; D432-L434 PolarHBondContact O-N 3Å
435	T	72.5	Confident	81.1	Confident	50 Å²	50	48.3 Å²	48.3	31%	0.307	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-21	179.8	60	0	0	0	0	113.2	D432 E437	D432-T435 WeakPolarHBondContact CB-OG1 3.41Å; T435-E437 WeakPolarHBondContact CB-OE2 3.34Å; T435-E437 PolarHBondContact O-N 2.99Å; T435-E437 WeakPolarHBondContact OG1-CB 3.49Å; T435-E437 PolarHBondContact OG1-N 3.23Å; T435-E437 PolarHBondContact OG1-OE2 3.28Å; T435-E437 VanDerWaalsContact OG1-OE2 3.08Å
436	G	78	Confident	81.3	Confident	26 Å²	26	49.6 Å²	49.6	27%	0.268	28%	0.277	S	S	.	.			trans	72.1	1.4	-168.9	0	0	0	0	0	113.8	R431 D432	R431-G436 WeakPolarHBondContact CG-O 3.36Å; R431-G436 PolarHBondContact NE-O 3.29Å; R431-G436 VanDerWaalsContact NE-O 3.1Å; D432-G436 WeakPolarHBondContact O-CA 3.35Å; D432-G436 PolarHBondContact O-N 2.94Å
437	E	81.7	Confident	81.3	Confident	115 Å²	115	51.4 Å²	51.4	54%	0.537	29%	0.286	S	S	.	.			trans	-76.5	147.1	178.4	-64.2	163.8	160.2	0	0	110.6	D432 T435	D432-E437 PolarHBondContact N-O 3.5Å; T435-E437 WeakPolarHBondContact CB-OE2 3.34Å; T435-E437 PolarHBondContact O-N 2.99Å; T435-E437 WeakPolarHBondContact OG1-CB 3.49Å; T435-E437 PolarHBondContact OG1-N 3.23Å; T435-E437 PolarHBondContact OG1-OE2 3.28Å; T435-E437 VanDerWaalsContact OG1-OE2 3.08Å
438	F	83.3	Confident	81.4	Confident	109 Å²	109	51.3 Å²	51.3	48%	0.478	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.2	171.4	-66.6	-72.5	0	0	0	109.1	V429 R431 A483 I485	V429-F438 HydrophobicContact CG1-CB 3.73Å; V429-F438 HydrophobicContact CG1-CD1 3.93Å; V429-F438 HydrophobicContact CG1-CG 4.19Å; R431-F438 HydrophobicContact CB-CD1 4.16Å; R431-F438 HydrophobicContact CB-CE1 4.16Å; R431-F438 HydrophobicContact CG-CD1 4.49Å; R431-F438 HydrophobicContact CG-CE1 4.39Å; F438-A483 HydrophobicContact CD1-CB 4.23Å; F438-A483 HydrophobicContact CE1-CB 4.41Å; F438-A483 HydrophobicContact CG-CB 4.29Å; F438-I485 HydrophobicContact CB-CD1 3.77Å; F438-I485 HydrophobicContact CB-CG1 4.45Å
439	T	79.8	Confident	81.4	Confident	33 Å²	33	51.4 Å²	51.4	20%	0.202	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	150.1	176.2	60.1	0	0	0	0	110.7	R179 V429 V430	R179-T439 VanDerWaalsContact CZ-OG1 3.24Å; R179-T439 PolarHBondContact NE-OG1 3.14Å; R179-T439 PolarHBondContact NH2-OG1 3.43Å; V429-T439 WeakPolarHBondContact CA-O 3.42Å; V430-T439 PolarHBondContact N-O 2.95Å; V430-T439 PolarHBondContact O-N 3.11Å; V430-T439 VanDerWaalsContact O-O 3.12Å; V430-T439 PolarHBondContact O-OG1 3.01Å
440	L	80.5	Confident	81.3	Confident	53 Å²	53	54.9 Å²	54.9	28%	0.277	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.7	177.4	-69.5	164.6	0	0	0	109.8	A428 V429 I480 I485 A487	A428-L440 WeakPolarHBondContact O-CA 3.46Å; V429-L440 HydrophobicContact CG2-CD2 3.73Å; L440-I480 HydrophobicContact CD2-CD1 4.29Å; L440-I480 HydrophobicContact CD2-CG2 4.2Å; L440-I485 HydrophobicContact CD1-CG2 3.79Å; L440-I485 HydrophobicContact CD2-CD1 4.5Å; L440-I485 HydrophobicContact CD2-CG2 4.31Å; L440-I485 HydrophobicContact CG-CD1 4.24Å; L440-I485 HydrophobicContact CG-CG2 4.14Å; L440-A487 HydrophobicContact CD1-CB 3.8Å
441	E	79.7	Confident	81.4	Confident	48 Å²	48	52.9 Å²	52.9	22%	0.224	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.9	168.2	-68.4	-166.6	159.3	0	0	108.9	R246 A427 A428 V430	R246-E441 IonicContact NH2-OE1 3.95Å; R246-E441 PolarHBondContact NH2-OE1 3.31Å; A427-E441 CarbonylContact C-O 3.5Å; A427-E441 WeakPolarHBondContact CA-O 3.43Å; A427-E441 WeakPolarHBondContact CB-O 3.36Å; A428-E441 PolarHBondContact N-O 3.01Å; A428-E441 PolarHBondContact O-N 3Å; V430-E441 HydrophobicContact CB-CG 4.23Å; V430-E441 HydrophobicContact CG2-CB 4.42Å; V430-E441 HydrophobicContact CG2-CG 4.01Å; V430-E441 WeakPolarHBondContact CG2-OE2 3.41Å
442	G	78.6	Confident	81.8	Confident	32 Å²	32	45.2 Å²	45.2	33%	0.33	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	135.1	-179.9	0	0	0	0	0	112.3
443	G	85.9	Confident	82.7	Confident	7 Å²	7	44.8 Å²	44.8	7%	0.072	25%	0.254	C	S	.	.			trans	-80.9	-176.7	170.3	0	0	0	0	0	112.6	G424 L425 T426 L445 V446 L447	G424-G443 CarbonylContact O-C 3.6Å; G424-G443 WeakPolarHBondContact O-CA 3.43Å; L425-G443 CarbonylContact O-C 3.6Å; T426-G443 VanDerWaalsContact O-CA 3.22Å; T426-G443 WeakPolarHBondContact O-CA 3.31Å; T426-G443 PolarHBondContact O-N 3.44Å; G443-L445 VanDerWaalsContact C-N 3.27Å; G443-L445 PolarHBondContact O-N 3.28Å; G443-V446 PolarHBondContact O-N 3.25Å; G443-V446 VanDerWaalsContact O-N 3.08Å; G443-L447 WeakPolarHBondContact O-CG 3.5Å; G443-L447 PolarHBondContact O-N 3.34Å
444	A	87.1	Confident	83.7	Confident	15 Å²	15	39.4 Å²	39.4	12%	0.124	22%	0.219	C	C	.	.	H	α-helix	trans	-55.9	-37.4	-175.6	0	0	0	0	0	113.5	Q413 G424 L425 A448	Q413-A444 HydrophobicContact CB-CB 4.39Å; G424-A444 PolarHBondContact O-N 3.12Å; L425-A444 HydrophobicContact CD2-CB 4.34Å; L425-A444 PolarHBondContact O-N 3.33Å; A444-A448 VanDerWaalsContact O-CB 3.31Å; A444-A448 WeakPolarHBondContact O-CB 3.28Å; A444-A448 PolarHBondContact O-N 2.94Å; A444-A448 VanDerWaalsContact O-N 3.17Å
445	L	88.7	Confident	84.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-72.3	-37.1	178.8	-65.6	167.8	0	0	0	111.9	L425 G443 A448 C453 I469 V472 T493 I495	L425-L445 HydrophobicContact CB-CD1 4.11Å; L425-L445 VanDerWaalsContact O-CB 3.28Å; L425-L445 WeakPolarHBondContact O-CB 3.34Å; L425-L445 PolarHBondContact O-N 3.08Å; G443-L445 VanDerWaalsContact C-N 3.27Å; G443-L445 PolarHBondContact O-N 3.28Å; L445-A448 PolarHBondContact O-N 3.49Å; L445-C453 HydrophobicContact CD2-CB 3.81Å; L445-I469 HydrophobicContact CD1-CG1 4.41Å; L445-V472 HydrophobicContact CD1-CB 4.5Å; L445-V472 HydrophobicContact CD1-CG2 4.01Å; L445-T493 WeakPolarHBondContact O-CG2 3.32Å; L445-I495 HydrophobicContact CD2-CD1 4.48Å
446	V	87.5	Confident	85.8	Confident	29 Å²	29	32.8 Å²	32.8	18%	0.176	18%	0.183	C	C	.	.	H	α-helix	trans	-72	-38.9	178.6	177.2	0	0	0	0	110.7	T426 G443 A448 D449 V478 L489	T426-V446 WeakPolarHBondContact O-CG2 3.22Å; G443-V446 PolarHBondContact O-N 3.25Å; G443-V446 VanDerWaalsContact O-N 3.08Å; V446-A448 PolarHBondContact O-N 2.79Å; V446-D449 PolarHBondContact O-N 2.92Å; V446-V478 HydrophobicContact CG2-CG2 4.38Å; V446-L489 HydrophobicContact CG1-CD1 4.4Å; V446-L489 HydrophobicContact CG2-CB 4.2Å; V446-L489 HydrophobicContact CG2-CD1 4.06Å
447	L	83.8	Confident	86.4	Confident	55 Å²	55	34.1 Å²	34.1	29%	0.288	18%	0.182	S	C	.	.	H	α-helix	trans	-67	-24.1	175.6	-66	173.7	0	0	0	112.8	Q413 G443	Q413-L447 HydrophobicContact CG-CB 4.23Å; G443-L447 WeakPolarHBondContact O-CG 3.5Å; G443-L447 PolarHBondContact O-N 3.34Å
448	A	86.1	Confident	86.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	13.6	178.2	0	0	0	0	0	114.1	Q413 A444 L445 V446 Q450 G451 C453 T493	Q413-A448 HydrophobicContact CB-CB 4.22Å; Q413-A448 HydrophobicContact CG-CB 3.95Å; A444-A448 VanDerWaalsContact O-CB 3.31Å; A444-A448 WeakPolarHBondContact O-CB 3.28Å; A444-A448 PolarHBondContact O-N 2.94Å; A444-A448 VanDerWaalsContact O-N 3.17Å; L445-A448 PolarHBondContact O-N 3.49Å; V446-A448 PolarHBondContact O-N 2.79Å; A448-Q450 PolarHBondContact O-N 3.12Å; A448-G451 CarbonylContact O-C 3.55Å; A448-G451 VanDerWaalsContact O-CA 3.27Å; A448-G451 WeakPolarHBondContact O-CA 3.38Å; A448-G451 PolarHBondContact O-N 3.43Å; A448-C453 HydrophobicContact CB-CB 4.26Å; A448-T493 HydrophobicContact CB-CG2 3.94Å; A448-T493 WeakPolarHBondContact O-CG2 3.19Å
449	D	86	Confident	86.8	Confident	28 Å²	28	25.2 Å²	25.2	15%	0.15	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	133.4	-179.8	-172.2	41.3	0	0	0	112.5	R411 V446 G451 R492	R411-D449 PolarHBondContact NH1-O 3.47Å; V446-D449 PolarHBondContact O-N 2.92Å; D449-G451 PolarHBondContact O-N 3.31Å; D449-R492 WeakPolarHBondContact OD1-CA 3.45Å; D449-R492 VanDerWaalsContact OD1-CB 3.27Å; D449-R492 WeakPolarHBondContact OD1-CB 3.47Å; D449-R492 IonicContact OD1-CZ 2.86Å; D449-R492 PolarHBondContact OD1-N 3.24Å; D449-R492 IonicContact OD1-NE 2.96Å; D449-R492 PolarHBondContact OD1-NE 3.22Å; D449-R492 IonicContact OD1-NH2 3.44Å; D449-R492 IonicContact OD2-CZ 3.14Å; D449-R492 IonicContact OD2-NE 2.66Å; D449-R492 IonicContact OD2-NH2 2.9Å; D449-R492 PolarHBondContact OD2-NH2 3.26Å
450	Q	83.6	Confident	87	Confident	111 Å²	111	27.2 Å²	27.2	52%	0.519	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	11.6	-172.1	-55.2	-179	-42.1	0	0	115.4	A448 R492	A448-Q450 PolarHBondContact O-N 3.12Å; Q450-R492 VanDerWaalsContact CA-O 3.27Å; Q450-R492 WeakPolarHBondContact CA-O 3.46Å; Q450-R492 PolarHBondContact N-O 3.07Å; Q450-R492 VanDerWaalsContact NE2-NH2 3.16Å
451	G	87.5	Confident	87.3	Confident	7 Å²	7	25 Å²	25	7%	0.072	14%	0.137	C	C	.	.	S	Bend	trans	-117.7	-156.5	-178.5	0	0	0	0	0	113.4	R411 A448 D449 S494	R411-G451 CarbonylContact O-C 3.47Å; R411-G451 WeakPolarHBondContact O-CA 3.25Å; A448-G451 CarbonylContact O-C 3.55Å; A448-G451 VanDerWaalsContact O-CA 3.27Å; A448-G451 WeakPolarHBondContact O-CA 3.38Å; A448-G451 PolarHBondContact O-N 3.43Å; D449-G451 PolarHBondContact O-N 3.31Å; G451-S494 PolarHBondContact O-N 2.86Å
452	V	92	Very high	87.6	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.024	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.9	178.3	-177.1	0	0	0	0	110.2	M368 L369 V405 A409 R411 S412 Q413 S494 L496	M368-V452 HydrophobicContact CE-CG1 3.67Å; M368-V452 HydrophobicContact CE-CG2 4.25Å; M368-V452 HydrophobicContact SD-CG1 4.31Å; L369-V452 HydrophobicContact CD2-CG2 4.15Å; V405-V452 HydrophobicContact CG1-CG1 4.23Å; A409-V452 HydrophobicContact CB-CG2 4.36Å; R411-V452 PolarHBondContact O-N 3.01Å; S412-V452 WeakPolarHBondContact CA-O 3.15Å; S412-V452 WeakPolarHBondContact CB-O 3.27Å; Q413-V452 PolarHBondContact N-O 3.34Å; V452-S494 CarbonylContact C-O 3.55Å; V452-S494 WeakPolarHBondContact CA-O 3.33Å; V452-L496 HydrophobicContact CG1-CB 4.13Å
453	C	93	Very high	87.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117.6	169.3	-174.5	0	0	0	0	109.3	L445 A448 S494 L496	L445-C453 HydrophobicContact CD2-CB 3.81Å; A448-C453 HydrophobicContact CB-CB 4.26Å; C453-S494 PolarHBondContact N-O 2.98Å; C453-L496 PolarHBondContact O-N 3.12Å
454	C	94.2	Very high	87.7	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.8	177.5	-62.2	0	0	0	0	109	L402 Q413 Y414 T415 L496	L402-C454 HydrophobicContact CB-CB 4.42Å; L402-C454 HydrophobicContact CD2-CB 4.11Å; Q413-C454 PolarHBondContact O-N 2.81Å; Y414-C454 HydrophobicContact CD2-CB 3.98Å; T415-C454 WeakPolarHBondContact CG2-O 3.3Å; T415-C454 PolarHBondContact N-O 2.7Å; C454-L496 CarbonylContact C-O 3.56Å; C454-L496 WeakPolarHBondContact CA-O 3.46Å
455	I	92.6	Very high	87.5	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	113.6	179.3	-50.3	177.6	0	0	0	108.8	T415 F458 M461 I469 I495 L496 A497 A498	T415-I455 HydrophobicContact CG2-CB 4.21Å; T415-I455 HydrophobicContact CG2-CG1 3.72Å; T415-I455 HydrophobicContact CG2-CG2 4.23Å; T415-I455 CarbonylContact O-C 3.56Å; T415-I455 WeakPolarHBondContact O-CA 3.49Å; I455-F458 HydrophobicContact CB-CD2 4.45Å; I455-F458 HydrophobicContact CD1-CE2 4.48Å; I455-F458 HydrophobicContact CG2-CD2 3.94Å; I455-M461 HydrophobicContact CG2-SD 4.04Å; I455-I469 HydrophobicContact CD1-CD1 3.87Å; I455-I495 HydrophobicContact CD1-CG2 3.99Å; I455-L496 PolarHBondContact N-O 3.09Å; I455-A497 CarbonylContact O-C 3.56Å; I455-A497 WeakPolarHBondContact O-CA 3.38Å; I455-A498 PolarHBondContact O-N 3.35Å
456	D	92.2	Very high	87.2	Confident	16 Å²	16	38.9 Å²	38.9	9%	0.086	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	157.5	171.6	-157	-0.9	0	0	0	111.3	S399 L402 Y414 T415 T416 G417 F458	S399-D456 WeakPolarHBondContact CB-OD2 3.48Å; S399-D456 PolarHBondContact OG-OD2 3.5Å; L402-D456 HydrophobicContact CD1-CB 3.74Å; Y414-D456 HydrophobicContact CE2-CB 4.4Å; Y414-D456 PolarHBondContact OH-OD2 2.94Å; T415-D456 PolarHBondContact O-N 3.42Å; T416-D456 CarbonylContact C-O 3.39Å; T416-D456 WeakPolarHBondContact CA-O 3.42Å; G417-D456 PolarHBondContact N-O 3.1Å; D456-F458 VanDerWaalsContact C-N 3.31Å; D456-F458 PolarHBondContact O-N 2.87Å
457	E	89.7	Confident	86.9	Confident	53 Å²	53	41.8 Å²	41.8	25%	0.248	22%	0.217	C	C	.	.			trans	50.8	46.1	-179.1	-52.2	-163.7	139.5	0	0	113.8	D459 K460 A498	E457-D459 PolarHBondContact O-N 2.93Å; E457-K460 HydrophobicContact CB-CB 4.45Å; E457-K460 HydrophobicContact CB-CD 4.2Å; E457-K460 HydrophobicContact CB-CG 4.36Å; E457-K460 PolarHBondContact O-N 2.8Å; E457-K460 IonicContact OE1-NZ 3.71Å; E457-K460 PolarHBondContact OE1-NZ 3.37Å; E457-K460 WeakPolarHBondContact OE2-CD 3.06Å; E457-K460 IonicContact OE2-NZ 2.68Å; E457-K460 PolarHBondContact OE2-NZ 3.44Å; E457-K460 VanDerWaalsContact OE2-NZ 3.16Å; E457-A498 PolarHBondContact N-O 2.79Å
458	F	88	Confident	86.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-59.7	-28.9	-176.5	-171.3	-102.8	0	0	0	113.4	I455 D456 K460 M461 I469 A497 A498 A499 L518 L522 F526	I455-F458 HydrophobicContact CB-CD2 4.45Å; I455-F458 HydrophobicContact CD1-CE2 4.48Å; I455-F458 HydrophobicContact CG2-CD2 3.94Å; D456-F458 VanDerWaalsContact C-N 3.31Å; D456-F458 PolarHBondContact O-N 2.87Å; F458-K460 VanDerWaalsContact C-N 3.26Å; F458-K460 PolarHBondContact O-N 2.85Å; F458-M461 HydrophobicContact CD2-SD 3.6Å; F458-M461 VanDerWaalsContact CD2-SD 3.6Å; F458-M461 HydrophobicContact CE2-SD 3.72Å; F458-M461 WeakPolarHBondContact O-CB 3.16Å; F458-M461 PolarHBondContact O-N 3.08Å; F458-I469 HydrophobicContact CE2-CD1 3.73Å; F458-I469 HydrophobicContact CZ-CD1 4.45Å; F458-A497 HydrophobicContact CB-CB 4.24Å; F458-A497 HydrophobicContact CD2-CB 4.09Å; F458-A497 HydrophobicContact CG-CB 4.06Å; F458-A498 VanDerWaalsContact CB-O 3.31Å; F458-A498 WeakPolarHBondContact CB-O 3.4Å; F458-A498 PolarHBondContact N-O 2.98Å; F458-A499 HydrophobicContact CB-CB 4.28Å; F458-L518 HydrophobicContact CD1-CD1 3.96Å; F458-L518 HydrophobicContact CD1-CD2 3.85Å; F458-L518 HydrophobicContact CE1-CD1 4.14Å; F458-L518 HydrophobicContact CE1-CD2 3.8Å; F458-L522 HydrophobicContact CE1-CD1 3.9Å; F458-L522 HydrophobicContact CE1-CD2 3.56Å; F458-L522 HydrophobicContact CE1-CG 4.42Å; F458-L522 HydrophobicContact CZ-CD1 3.74Å; F458-L522 HydrophobicContact CZ-CD2 3.79Å; F458-L522 HydrophobicContact CZ-CG 4.38Å; F458-F526 HydrophobicContact CE1-CE2 4.42Å; F458-F526 HydrophobicContact CE1-CZ 4.48Å; F458-F526 HydrophobicContact CZ-CZ 4.46Å
459	D	86.7	Confident	87	Confident	38 Å²	38	39.9 Å²	39.9	20%	0.203	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-63.6	-30.6	175.7	60.7	-61.9	0	0	0	112.7	E457 M461 R466 N500	E457-D459 PolarHBondContact O-N 2.93Å; D459-M461 VanDerWaalsContact C-N 3.32Å; D459-M461 PolarHBondContact O-N 3.28Å; D459-R466 PolarHBondContact O-NH2 3.34Å; D459-N500 PolarHBondContact OD1-N 3.24Å
460	K	84.7	Confident	87	Confident	74 Å²	74	40.5 Å²	40.5	32%	0.322	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-86.5	0.9	-177.6	-57.2	-174.3	-165.9	165.7	0	114	R418 E457 F458	R418-K460 HydrophobicContact CG-CB 3.77Å; R418-K460 HydrophobicContact CG-CD 4.44Å; E457-K460 HydrophobicContact CB-CB 4.45Å; E457-K460 HydrophobicContact CB-CD 4.2Å; E457-K460 HydrophobicContact CB-CG 4.36Å; E457-K460 PolarHBondContact O-N 2.8Å; E457-K460 IonicContact OE1-NZ 3.71Å; E457-K460 PolarHBondContact OE1-NZ 3.37Å; E457-K460 WeakPolarHBondContact OE2-CD 3.06Å; E457-K460 IonicContact OE2-NZ 2.68Å; E457-K460 PolarHBondContact OE2-NZ 3.44Å; E457-K460 VanDerWaalsContact OE2-NZ 3.16Å; F458-K460 VanDerWaalsContact C-N 3.26Å; F458-K460 PolarHBondContact O-N 2.85Å
461	M	85.3	Confident	87.2	Confident	7 Å²	7	37.3 Å²	37.3	3%	0.034	20%	0.196	C	C	.	.	S	Bend	trans	-68.1	139.3	174.9	-74.4	-167.9	59.6	0	0	112.2	G417 L425 I455 F458 D459 D465 R466 I469	G417-M461 WeakPolarHBondContact O-CG 3.35Å; L425-M461 HydrophobicContact CD1-CE 3.52Å; I455-M461 HydrophobicContact CG2-SD 4.04Å; F458-M461 HydrophobicContact CD2-SD 3.6Å; F458-M461 VanDerWaalsContact CD2-SD 3.6Å; F458-M461 HydrophobicContact CE2-SD 3.72Å; F458-M461 WeakPolarHBondContact O-CB 3.16Å; F458-M461 PolarHBondContact O-N 3.08Å; D459-M461 VanDerWaalsContact C-N 3.32Å; D459-M461 PolarHBondContact O-N 3.28Å; M461-D465 HydrophobicContact CE-CB 3.72Å; M461-R466 PolarHBondContact O-NE 3.27Å; M461-R466 PolarHBondContact O-NH2 2.95Å; M461-I469 HydrophobicContact CE-CD1 3.6Å; M461-I469 HydrophobicContact SD-CD1 3.9Å
462	L	85.8	Confident	87.3	Confident	114 Å²	114	37.1 Å²	37.1	60%	0.597	19%	0.194	S	C	*	.			trans	-62.2	146.3	173.1	-64.9	174.7	0	0	0	111.2	S464 D465 R466	L462-S464 VanDerWaalsContact C-N 3.27Å; L462-S464 PolarHBondContact O-N 2.9Å; L462-D465 PolarHBondContact O-N 2.85Å; L462-D465 VanDerWaalsContact O-N 3.08Å; L462-R466 WeakPolarHBondContact O-CG 3.17Å; L462-R466 PolarHBondContact O-N 2.81Å
463	E	84.6	Confident	87.1	Confident	163 Å²	163	37.1 Å²	37.1	76%	0.762	19%	0.193	S	C	*	.	H	α-helix	trans	-62.4	-33.5	-179.5	-171.3	170.3	-169.2	0	0	112.9	D465 R466	E463-D465 VanDerWaalsContact C-N 3.26Å; E463-D465 PolarHBondContact O-N 2.78Å; E463-R466 WeakPolarHBondContact O-CB 3.48Å; E463-R466 PolarHBondContact O-N 2.75Å
464	S	81.9	Confident	86.6	Confident	73 Å²	73	41.1 Å²	41.1	51%	0.51	21%	0.212	S	C	.	.	H	α-helix	trans	-56.8	-41.6	173.1	55.8	0	0	0	0	112.1	L462 R466 T467	L462-S464 VanDerWaalsContact C-N 3.27Å; L462-S464 PolarHBondContact O-N 2.9Å; S464-R466 VanDerWaalsContact C-N 3.34Å; S464-T467 PolarHBondContact O-N 2.96Å; S464-T467 PolarHBondContact O-OG1 3.48Å
465	D	84.3	Confident	86.1	Confident	14 Å²	14	47.2 Å²	47.2	8%	0.075	24%	0.241	C	C	.	.	H	α-helix	trans	-78.6	-24.8	-173.7	-57.9	-16.3	0	0	0	111.1	G422 M461 L462 E463 T467 A468	G422-D465 WeakPolarHBondContact CA-OD1 3.41Å; G422-D465 PolarHBondContact N-OD1 3.02Å; G422-D465 PolarHBondContact N-OD2 3.1Å; M461-D465 HydrophobicContact CE-CB 3.72Å; L462-D465 PolarHBondContact O-N 2.85Å; L462-D465 VanDerWaalsContact O-N 3.08Å; E463-D465 VanDerWaalsContact C-N 3.26Å; E463-D465 PolarHBondContact O-N 2.78Å; D465-T467 VanDerWaalsContact C-N 3.28Å; D465-T467 PolarHBondContact O-N 3.38Å; D465-A468 PolarHBondContact O-N 2.98Å
466	R	81.6	Confident	85.9	Confident	29 Å²	29	48.1 Å²	48.1	11%	0.109	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-33.2	172.7	-63.3	176.8	-170.4	-160.8	-5.6	112	D459 M461 L462 E463 S464 A468 I469 H470 Q517 L522	D459-R466 PolarHBondContact O-NH2 3.34Å; M461-R466 PolarHBondContact O-NE 3.27Å; M461-R466 PolarHBondContact O-NH2 2.95Å; L462-R466 WeakPolarHBondContact O-CG 3.17Å; L462-R466 PolarHBondContact O-N 2.81Å; E463-R466 WeakPolarHBondContact O-CB 3.48Å; E463-R466 PolarHBondContact O-N 2.75Å; S464-R466 VanDerWaalsContact C-N 3.34Å; R466-A468 VanDerWaalsContact C-N 3.32Å; R466-A468 PolarHBondContact O-N 3.08Å; R466-I469 PolarHBondContact O-N 3.39Å; R466-H470 PolarHBondContact O-CD2 3Å; R466-H470 VanDerWaalsContact O-CD2 3.24Å; R466-H470 PolarHBondContact O-N 2.82Å; R466-H470 VanDerWaalsContact O-N 3.13Å; R466-Q517 PolarHBondContact NH1-O 3.41Å; R466-L522 HydrophobicContact CB-CD1 4.41Å
467	T	82.4	Confident	85.8	Confident	90 Å²	90	48.8 Å²	48.8	55%	0.552	25%	0.25	S	C	*	.	H	α-helix	trans	-62.8	-38.2	178.5	67.9	0	0	0	0	112.4	S464 D465 I469 H470	S464-T467 PolarHBondContact O-N 2.96Å; S464-T467 PolarHBondContact O-OG1 3.48Å; D465-T467 VanDerWaalsContact C-N 3.28Å; D465-T467 PolarHBondContact O-N 3.38Å; T467-I469 VanDerWaalsContact C-N 3.33Å; T467-I469 PolarHBondContact O-N 2.8Å; T467-H470 WeakPolarHBondContact O-CB 3.49Å; T467-H470 PolarHBondContact O-N 2.82Å
468	A	83.5	Confident	85.8	Confident	15 Å²	15	46.3 Å²	46.3	12%	0.124	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-38.5	176.4	0	0	0	0	0	112.3	T426 D465 R466 H470 E471 V472	T426-A468 HydrophobicContact CG2-CB 3.42Å; T426-A468 VanDerWaalsContact CG2-CB 3.42Å; D465-A468 PolarHBondContact O-N 2.98Å; R466-A468 VanDerWaalsContact C-N 3.32Å; R466-A468 PolarHBondContact O-N 3.08Å; A468-H470 VanDerWaalsContact C-N 3.32Å; A468-H470 PolarHBondContact O-N 3.1Å; A468-E471 PolarHBondContact O-N 3.22Å; A468-V472 PolarHBondContact O-N 3.1Å
469	I	87.1	Confident	85.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69	-33.6	178.1	-65.6	-178.1	0	0	0	111.2	L425 L445 I455 F458 M461 R466 T467 E471 V472 M473 I495	L425-I469 HydrophobicContact CD1-CD1 4.29Å; L445-I469 HydrophobicContact CD1-CG1 4.41Å; I455-I469 HydrophobicContact CD1-CD1 3.87Å; F458-I469 HydrophobicContact CE2-CD1 3.73Å; F458-I469 HydrophobicContact CZ-CD1 4.45Å; M461-I469 HydrophobicContact CE-CD1 3.6Å; M461-I469 HydrophobicContact SD-CD1 3.9Å; R466-I469 PolarHBondContact O-N 3.39Å; T467-I469 VanDerWaalsContact C-N 3.33Å; T467-I469 PolarHBondContact O-N 2.8Å; I469-E471 VanDerWaalsContact C-N 3.26Å; I469-E471 PolarHBondContact O-N 3.48Å; I469-V472 PolarHBondContact O-N 3.3Å; I469-M473 HydrophobicContact CG2-CG 3.94Å; I469-M473 HydrophobicContact CG2-SD 3.79Å; I469-M473 WeakPolarHBondContact O-CB 3.43Å; I469-M473 WeakPolarHBondContact O-CG 3.39Å; I469-M473 PolarHBondContact O-N 3.45Å; I469-I495 HydrophobicContact CG2-CD1 3.87Å
470	H	86.6	Confident	85.7	Confident	42 Å²	42	48.3 Å²	48.3	19%	0.194	25%	0.254	C	S	.	.	H	α-helix	trans	-58.4	-39.8	177.4	-67.7	175.5	0	0	0	112.6	R466 T467 A468 E474 L522 R525	R466-H470 PolarHBondContact O-CD2 3Å; R466-H470 VanDerWaalsContact O-CD2 3.24Å; R466-H470 PolarHBondContact O-N 2.82Å; R466-H470 VanDerWaalsContact O-N 3.13Å; T467-H470 WeakPolarHBondContact O-CB 3.49Å; T467-H470 PolarHBondContact O-N 2.82Å; A468-H470 VanDerWaalsContact C-N 3.32Å; A468-H470 PolarHBondContact O-N 3.1Å; H470-E474 PolarHBondContact O-N 3.27Å; H470-L522 WeakPolarHBondContact NE2-CD1 3.45Å; H470-R525 PolarHBondContact CD2-NH1 2.89Å
471	E	87.8	Confident	85.7	Confident	44 Å²	44	48.8 Å²	48.8	21%	0.206	27%	0.271	C	S	.	.	H	α-helix	trans	-66.5	-49.2	177.9	-165.6	-173.2	167.4	0	0	111	A468 I469 M473 E474 Q475 T477 S479	A468-E471 PolarHBondContact O-N 3.22Å; I469-E471 VanDerWaalsContact C-N 3.26Å; I469-E471 PolarHBondContact O-N 3.48Å; E471-M473 VanDerWaalsContact C-N 3.34Å; E471-M473 PolarHBondContact O-N 2.88Å; E471-E474 PolarHBondContact O-N 3.48Å; E471-Q475 PolarHBondContact O-N 2.92Å; E471-T477 WeakPolarHBondContact CG-O 3.46Å; E471-S479 VanDerWaalsContact CD-OG 3.31Å; E471-S479 WeakPolarHBondContact OE1-CB 3.26Å; E471-S479 PolarHBondContact OE1-N 3Å; E471-S479 PolarHBondContact OE1-OG 3.2Å; E471-S479 PolarHBondContact OE2-OG 2.84Å
472	V	89	Confident	85.7	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-41.2	-179.5	177.4	0	0	0	0	111.7	L445 A468 I469 E474 Q476 V478 A491	L445-V472 HydrophobicContact CD1-CB 4.5Å; L445-V472 HydrophobicContact CD1-CG2 4.01Å; A468-V472 PolarHBondContact O-N 3.1Å; I469-V472 PolarHBondContact O-N 3.3Å; V472-E474 PolarHBondContact O-N 3.48Å; V472-Q476 WeakPolarHBondContact O-CA 3.48Å; V472-Q476 PolarHBondContact O-N 3.21Å; V472-V478 HydrophobicContact CG2-CG2 3.37Å; V472-A491 HydrophobicContact CG1-CB 4.11Å; V472-A491 HydrophobicContact CG2-CB 4.36Å
473	M	88.6	Confident	85.5	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-68.2	-35.4	179.8	-71.4	-176.1	97.4	0	0	112.9	R383 N387 I469 E471 I495 R525 F526	R383-M473 VanDerWaalsContact CD-O 3.29Å; R383-M473 WeakPolarHBondContact CD-O 3.43Å; R383-M473 PolarHBondContact NH1-O 3.49Å; N387-M473 HydrophobicContact CB-CE 3.67Å; N387-M473 WeakPolarHBondContact ND2-CE 3.42Å; I469-M473 HydrophobicContact CG2-CG 3.94Å; I469-M473 HydrophobicContact CG2-SD 3.79Å; I469-M473 WeakPolarHBondContact O-CB 3.43Å; I469-M473 WeakPolarHBondContact O-CG 3.39Å; I469-M473 PolarHBondContact O-N 3.45Å; E471-M473 VanDerWaalsContact C-N 3.34Å; E471-M473 PolarHBondContact O-N 2.88Å; M473-I495 HydrophobicContact CG-CD1 3.6Å; M473-I495 HydrophobicContact SD-CD1 4.37Å; M473-R525 HydrophobicContact CB-CB 4.24Å; M473-R525 HydrophobicContact CE-CB 3.91Å; M473-R525 WeakPolarHBondContact CE-O 3.39Å; M473-R525 HydrophobicContact SD-CB 3.93Å; M473-F526 HydrophobicContact CE-CD1 3.48Å; M473-F526 VanDerWaalsContact CE-CD1 3.48Å; M473-F526 HydrophobicContact CE-CD2 4.37Å; M473-F526 HydrophobicContact CE-CE1 3.43Å; M473-F526 VanDerWaalsContact CE-CE1 3.43Å; M473-F526 HydrophobicContact CE-CE2 4.39Å; M473-F526 HydrophobicContact CE-CG 3.95Å; M473-F526 HydrophobicContact CE-CZ 3.91Å
474	E	81.9	Confident	85.3	Confident	84 Å²	84	47.3 Å²	47.3	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-86.4	-50.5	-176	-162.1	76.4	-163.7	0	0	112	H470 E471 V472 R525 R615	H470-E474 PolarHBondContact O-N 3.27Å; E471-E474 PolarHBondContact O-N 3.48Å; V472-E474 PolarHBondContact O-N 3.48Å; E474-R525 IonicContact OE2-NE 3.79Å; E474-R525 PolarHBondContact OE2-NE 3.05Å; E474-R615 IonicContact OE1-CZ 2.99Å; E474-R615 IonicContact OE1-NE 2.76Å; E474-R615 IonicContact OE1-NH2 3.71Å; E474-R615 PolarHBondContact OE1-NH2 2.95Å; E474-R615 IonicContact OE2-CZ 3.11Å; E474-R615 IonicContact OE2-NE 3.17Å; E474-R615 IonicContact OE2-NH2 3.77Å; E474-R615 PolarHBondContact OE2-NH2 3.26Å; E474-R615 VanDerWaalsContact OE2-NH2 3.11Å
475	Q	84.8	Confident	85.4	Confident	128 Å²	128	45.6 Å²	45.6	60%	0.598	28%	0.277	S	S	*	.	H	α-helix	trans	-102.5	-13.4	-170.4	-64.9	178.9	-9.6	0	0	113.2	E471 T477	E471-Q475 PolarHBondContact O-N 2.92Å; Q475-T477 WeakPolarHBondContact CB-OG1 3.32Å; Q475-T477 PolarHBondContact O-N 2.83Å
476	Q	88.1	Confident	85.6	Confident	21 Å²	21	52.3 Å²	52.3	10%	0.098	31%	0.312	C	S	.	.	S	Bend	trans	55.7	31.4	-171	-64.3	-179.5	-35.1	0	0	113	R383 S385 V472 A491 R492	R383-Q476 HydrophobicContact CB-CG 4.11Å; S385-Q476 PolarHBondContact OG-NE2 2.95Å; V472-Q476 WeakPolarHBondContact O-CA 3.48Å; V472-Q476 PolarHBondContact O-N 3.21Å; Q476-A491 CarbonylContact O-C 3.56Å; Q476-A491 PolarHBondContact O-N 2.82Å; Q476-R492 HydrophobicContact CB-CG 4.14Å
477	T	89.8	Confident	85.8	Confident	30 Å²	30	52.3 Å²	52.3	18%	0.184	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	155.8	177.2	54.9	0	0	0	0	110.4	E471 Q475 L489	E471-T477 WeakPolarHBondContact CG-O 3.46Å; Q475-T477 WeakPolarHBondContact CB-OG1 3.32Å; Q475-T477 PolarHBondContact O-N 2.83Å; T477-L489 CarbonylContact C-O 3.54Å; T477-L489 VanDerWaalsContact CA-O 3.3Å; T477-L489 WeakPolarHBondContact CA-O 3.45Å
478	V	88.5	Confident	86	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.3	172.7	177.2	0	0	0	0	107.5	T426 V446 V472 I480 T488 L489 A491	T426-V478 HydrophobicContact CG2-CG1 3.85Å; V446-V478 HydrophobicContact CG2-CG2 4.38Å; V472-V478 HydrophobicContact CG2-CG2 3.37Å; V478-I480 HydrophobicContact CG1-CD1 4.23Å; V478-I480 HydrophobicContact CG1-CG1 4.04Å; V478-T488 WeakPolarHBondContact O-CA 3.08Å; V478-L489 HydrophobicContact CB-CB 4.41Å; V478-L489 PolarHBondContact N-O 2.83Å; V478-L489 PolarHBondContact O-N 3.47Å; V478-A491 HydrophobicContact CG2-CB 3.92Å
479	S	86.8	Confident	86.1	Confident	68 Å²	68	54 Å²	54	48%	0.476	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.6	175.3	58.6	0	0	0	0	110.7	E471	E471-S479 VanDerWaalsContact CD-OG 3.31Å; E471-S479 WeakPolarHBondContact OE1-CB 3.26Å; E471-S479 PolarHBondContact OE1-N 3Å; E471-S479 PolarHBondContact OE1-OG 3.2Å; E471-S479 PolarHBondContact OE2-OG 2.84Å
480	I	86	Confident	86.1	Confident	12 Å²	12	58.3 Å²	58.3	6%	0.062	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120.1	178.6	-58.7	179.6	0	0	0	108.2	A427 V429 L440 V478 K482 I486 A487 L489	A427-I480 HydrophobicContact CB-CD1 3.14Å; V429-I480 HydrophobicContact CG2-CG2 4.39Å; L440-I480 HydrophobicContact CD2-CD1 4.29Å; L440-I480 HydrophobicContact CD2-CG2 4.2Å; V478-I480 HydrophobicContact CG1-CD1 4.23Å; V478-I480 HydrophobicContact CG1-CG1 4.04Å; I480-K482 HydrophobicContact CG2-CB 4.11Å; I480-K482 HydrophobicContact CG2-CG 4.26Å; I480-I486 WeakPolarHBondContact O-CA 3.31Å; I480-A487 PolarHBondContact N-O 3.36Å; I480-A487 PolarHBondContact O-N 2.91Å; I480-L489 HydrophobicContact CD1-CD1 3.92Å
481	A	85.5	Confident	86.1	Confident	83 Å²	83	56.3 Å²	56.3	69%	0.686	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	78.3	172.2	0	0	0	0	0	108.7	I485	A481-I485 WeakPolarHBondContact CA-O 3.07Å
482	K	84.4	Confident	86.1	Confident	110 Å²	110	58.5 Å²	58.5	48%	0.478	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	142.8	-178.1	-70.9	-175.7	-179	175	0	110.9	V429 I480 G484 I485	V429-K482 HydrophobicContact CG2-CB 3.92Å; I480-K482 HydrophobicContact CG2-CB 4.11Å; I480-K482 HydrophobicContact CG2-CG 4.26Å; K482-G484 PolarHBondContact O-N 3.43Å; K482-G484 VanDerWaalsContact O-N 3.17Å; K482-I485 PolarHBondContact N-O 3.4Å; K482-I485 VanDerWaalsContact N-O 3.09Å; K482-I485 WeakPolarHBondContact O-CB 3.32Å; K482-I485 PolarHBondContact O-N 3.22Å
483	A	83	Confident	86.2	Confident	61 Å²	61	58.4 Å²	58.4	50%	0.504	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	36.7	176.5	0	0	0	0	0	114.6	V429 F438 I485	V429-A483 HydrophobicContact CG1-CB 4.01Å; F438-A483 HydrophobicContact CD1-CB 4.23Å; F438-A483 HydrophobicContact CE1-CB 4.41Å; F438-A483 HydrophobicContact CG-CB 4.29Å; A483-I485 PolarHBondContact O-N 2.98Å
484	G	80.1	Confident	86.4	Confident	83 Å²	83	59 Å²	59	86%	0.856	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	-2.2	-178.6	0	0	0	0	0	114.9	K482	K482-G484 PolarHBondContact O-N 3.43Å; K482-G484 VanDerWaalsContact O-N 3.17Å
485	I	82.9	Confident	86.9	Confident	36 Å²	36	55 Å²	55	19%	0.185	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	114.7	173.3	-52.7	177.4	0	0	0	108	V429 F438 L440 A481 K482 A483 A487	V429-I485 HydrophobicContact CG1-CD1 3.87Å; V429-I485 HydrophobicContact CG2-CD1 4.41Å; F438-I485 HydrophobicContact CB-CD1 3.77Å; F438-I485 HydrophobicContact CB-CG1 4.45Å; L440-I485 HydrophobicContact CD1-CG2 3.79Å; L440-I485 HydrophobicContact CD2-CD1 4.5Å; L440-I485 HydrophobicContact CD2-CG2 4.31Å; L440-I485 HydrophobicContact CG-CD1 4.24Å; L440-I485 HydrophobicContact CG-CG2 4.14Å; A481-I485 WeakPolarHBondContact CA-O 3.07Å; K482-I485 PolarHBondContact N-O 3.4Å; K482-I485 VanDerWaalsContact N-O 3.09Å; K482-I485 WeakPolarHBondContact O-CB 3.32Å; K482-I485 PolarHBondContact O-N 3.22Å; A483-I485 PolarHBondContact O-N 2.98Å; I485-A487 HydrophobicContact CG2-CB 3.98Å
486	I	89.5	Confident	87.4	Confident	156 Å²	156	48.9 Å²	48.9	80%	0.8	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	99.8	168.7	-57.2	172.9	0	0	0	106.2	I480	I480-I486 WeakPolarHBondContact O-CA 3.31Å
487	A	85.6	Confident	87.6	Confident	28 Å²	28	47.9 Å²	47.9	23%	0.231	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	148.3	-178.6	0	0	0	0	0	110.7	L440 I480 I485	L440-A487 HydrophobicContact CD1-CB 3.8Å; I480-A487 PolarHBondContact N-O 3.36Å; I480-A487 PolarHBondContact O-N 2.91Å; I485-A487 HydrophobicContact CG2-CB 3.98Å
488	T	86.6	Confident	87.8	Confident	102 Å²	102	46.5 Å²	46.5	63%	0.626	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.6	169.6	51.2	0	0	0	0	108.1	V478	V478-T488 WeakPolarHBondContact O-CA 3.08Å
489	L	86	Confident	87.9	Confident	38 Å²	38	46.6 Å²	46.6	20%	0.199	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	134	176.7	-62.6	173.5	0	0	0	108.5	A427 V446 T477 V478 I480	A427-L489 HydrophobicContact CB-CD1 3.61Å; V446-L489 HydrophobicContact CG1-CD1 4.4Å; V446-L489 HydrophobicContact CG2-CB 4.2Å; V446-L489 HydrophobicContact CG2-CD1 4.06Å; T477-L489 CarbonylContact C-O 3.54Å; T477-L489 VanDerWaalsContact CA-O 3.3Å; T477-L489 WeakPolarHBondContact CA-O 3.45Å; V478-L489 HydrophobicContact CB-CB 4.41Å; V478-L489 PolarHBondContact N-O 2.83Å; V478-L489 PolarHBondContact O-N 3.47Å; I480-L489 HydrophobicContact CD1-CD1 3.92Å
490	N	86.7	Confident	88	Confident	92 Å²	92	45.4 Å²	45.4	49%	0.492	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131	174.8	-64.1	-34.1	0	0	0	109.3
491	A	86.7	Confident	88	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	28%	0.278	C	S	.	.			trans	-135.3	69.1	178.3	0	0	0	0	0	109	V472 Q476 V478 T493	V472-A491 HydrophobicContact CG1-CB 4.11Å; V472-A491 HydrophobicContact CG2-CB 4.36Å; Q476-A491 CarbonylContact O-C 3.56Å; Q476-A491 PolarHBondContact O-N 2.82Å; V478-A491 HydrophobicContact CG2-CB 3.92Å; A491-T493 PolarHBondContact O-N 2.84Å
492	R	88	Confident	87.9	Confident	89 Å²	89	44.5 Å²	44.5	34%	0.336	26%	0.264	S	S	.	.			trans	-80.1	64.2	178.6	-57.5	165.1	-67.7	177.1	-1.7	109.7	D449 Q450 Q476	D449-R492 WeakPolarHBondContact OD1-CA 3.45Å; D449-R492 VanDerWaalsContact OD1-CB 3.27Å; D449-R492 WeakPolarHBondContact OD1-CB 3.47Å; D449-R492 IonicContact OD1-CZ 2.86Å; D449-R492 PolarHBondContact OD1-N 3.24Å; D449-R492 IonicContact OD1-NE 2.96Å; D449-R492 PolarHBondContact OD1-NE 3.22Å; D449-R492 IonicContact OD1-NH2 3.44Å; D449-R492 IonicContact OD2-CZ 3.14Å; D449-R492 IonicContact OD2-NE 2.66Å; D449-R492 IonicContact OD2-NH2 2.9Å; D449-R492 PolarHBondContact OD2-NH2 3.26Å; Q450-R492 VanDerWaalsContact CA-O 3.27Å; Q450-R492 WeakPolarHBondContact CA-O 3.46Å; Q450-R492 PolarHBondContact N-O 3.07Å; Q450-R492 VanDerWaalsContact NE2-NH2 3.16Å; Q476-R492 HydrophobicContact CB-CG 4.14Å
493	T	90.6	Very high	87.8	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.012	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-102.6	149.8	-176.2	64.1	0	0	0	0	110.7	S385 L445 A448 A491	S385-T493 PolarHBondContact OG-O 3.38Å; L445-T493 WeakPolarHBondContact O-CG2 3.32Å; A448-T493 HydrophobicContact CB-CG2 3.94Å; A448-T493 WeakPolarHBondContact O-CG2 3.19Å; A491-T493 PolarHBondContact O-N 2.84Å
494	S	92.2	Very high	87.6	Confident	14 Å²	14	44.3 Å²	44.3	10%	0.098	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.8	165.2	-53.2	0	0	0	0	107.8	S385 I386 G451 V452 C453	S385-S494 WeakPolarHBondContact CB-OG 3.27Å; I386-S494 WeakPolarHBondContact O-CB 3.31Å; G451-S494 PolarHBondContact O-N 2.86Å; V452-S494 CarbonylContact C-O 3.55Å; V452-S494 WeakPolarHBondContact CA-O 3.33Å; C453-S494 PolarHBondContact N-O 2.98Å
495	I	93.7	Very high	87.5	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.3	-178.6	-57.6	-176.4	0	0	0	109	N387 I388 L445 I455 I469 M473 A497 F526	N387-I495 WeakPolarHBondContact CA-O 3.12Å; N387-I495 PolarHBondContact OD1-N 3.41Å; I388-I495 PolarHBondContact N-O 2.79Å; L445-I495 HydrophobicContact CD2-CD1 4.48Å; I455-I495 HydrophobicContact CD1-CG2 3.99Å; I469-I495 HydrophobicContact CG2-CD1 3.87Å; M473-I495 HydrophobicContact CG-CD1 3.6Å; M473-I495 HydrophobicContact SD-CD1 4.37Å; I495-A497 HydrophobicContact CG2-CB 4.47Å; I495-F526 HydrophobicContact CG2-CE1 4.42Å
496	L	94.8	Very high	87.3	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	107.8	167.7	-176.5	60.6	0	0	0	108.4	L365 M368 I388 L390 L402 V405 V452 C453 C454 I455	L365-L496 HydrophobicContact CD2-CD1 3.6Å; L365-L496 HydrophobicContact CD2-CD2 3.73Å; L365-L496 HydrophobicContact CD2-CG 4.35Å; M368-L496 HydrophobicContact CE-CB 3.97Å; M368-L496 HydrophobicContact CE-CD1 4.31Å; M368-L496 HydrophobicContact CE-CD2 3.82Å; M368-L496 HydrophobicContact CE-CG 4.24Å; M368-L496 HydrophobicContact SD-CB 3.79Å; M368-L496 HydrophobicContact SD-CD1 4.01Å; M368-L496 HydrophobicContact SD-CG 4.29Å; I388-L496 HydrophobicContact CB-CD1 3.8Å; I388-L496 HydrophobicContact CG2-CD1 3.95Å; I388-L496 WeakPolarHBondContact O-CA 3.38Å; L390-L496 HydrophobicContact CD1-CD1 4.37Å; L390-L496 HydrophobicContact CG-CD1 4.29Å; L402-L496 HydrophobicContact CD2-CB 4.23Å; L402-L496 HydrophobicContact CD2-CD2 3.46Å; L402-L496 VanDerWaalsContact CD2-CD2 3.46Å; L402-L496 HydrophobicContact CD2-CG 3.43Å; L402-L496 VanDerWaalsContact CD2-CG 3.43Å; V405-L496 HydrophobicContact CB-CD2 4.14Å; V405-L496 HydrophobicContact CG1-CD2 4.03Å; V405-L496 HydrophobicContact CG2-CD2 4.15Å; V452-L496 HydrophobicContact CG1-CB 4.13Å; C453-L496 PolarHBondContact O-N 3.12Å; C454-L496 CarbonylContact C-O 3.56Å; C454-L496 WeakPolarHBondContact CA-O 3.46Å; I455-L496 PolarHBondContact N-O 3.09Å
497	A	93	Very high	86.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.5	-178.3	0	0	0	0	0	110.8	I388 C389 L390 I455 F458 I495 F526	I388-A497 PolarHBondContact O-N 2.81Å; C389-A497 CarbonylContact C-O 3.54Å; C389-A497 VanDerWaalsContact CA-O 3.32Å; C389-A497 WeakPolarHBondContact CA-O 3.49Å; L390-A497 PolarHBondContact N-O 3.23Å; I455-A497 CarbonylContact O-C 3.56Å; I455-A497 WeakPolarHBondContact O-CA 3.38Å; F458-A497 HydrophobicContact CB-CB 4.24Å; F458-A497 HydrophobicContact CD2-CB 4.09Å; F458-A497 HydrophobicContact CG-CB 4.06Å; I495-A497 HydrophobicContact CG2-CB 4.47Å; A497-F526 HydrophobicContact CB-CE1 4.13Å; A497-F526 HydrophobicContact CB-CZ 3.86Å
498	A	93.1	Very high	86.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.2	165.6	0	0	0	0	0	110.1	L390 K398 L402 I455 E457 F458	L390-A498 CarbonylContact O-C 3.57Å; L390-A498 VanDerWaalsContact O-CA 3.32Å; L390-A498 WeakPolarHBondContact O-CA 3.45Å; K398-A498 HydrophobicContact CB-CB 4.33Å; K398-A498 HydrophobicContact CD-CB 4.39Å; L402-A498 HydrophobicContact CD1-CB 3.67Å; L402-A498 HydrophobicContact CG-CB 4.35Å; I455-A498 PolarHBondContact O-N 3.35Å; E457-A498 PolarHBondContact N-O 2.79Å; F458-A498 VanDerWaalsContact CB-O 3.31Å; F458-A498 WeakPolarHBondContact CB-O 3.4Å; F458-A498 PolarHBondContact N-O 2.98Å
499	A	90.4	Very high	86	Confident	3 Å²	3	50.5 Å²	50.5	3%	0.025	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.9	179.5	0	0	0	0	0	110.7	L390 M391 K398 F458	L390-A499 PolarHBondContact O-N 2.78Å; M391-A499 WeakPolarHBondContact CA-O 3.43Å; M391-A499 HydrophobicContact CG-CB 4.35Å; K398-A499 PolarHBondContact NZ-O 3.08Å; F458-A499 HydrophobicContact CB-CB 4.28Å
500	N	88.8	Confident	85.5	Confident	43 Å²	43	52.1 Å²	52.1	23%	0.23	26%	0.256	C	S	.	.			trans	-108.4	149.2	175.2	-62.9	-34.8	0	0	0	110.5	K398 D459	K398-N500 PolarHBondContact NZ-OD1 2.98Å; K398-N500 VanDerWaalsContact NZ-OD1 3.07Å; D459-N500 PolarHBondContact OD1-N 3.24Å
501	P	86.6	Confident	84.9	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.065	25%	0.247	C	C	.	.			trans	-66.4	150.3	173.2	29.1	-35	0	0	0	110.2	G392 Y503 G504	G392-P501 WeakPolarHBondContact O-CD 3.48Å; P501-Y503 PolarHBondContact O-N 2.94Å; P501-Y503 VanDerWaalsContact O-N 3.13Å; P501-G504 PolarHBondContact O-N 3.16Å
502	V	83.3	Confident	84.2	Confident	66 Å²	66	50.5 Å²	50.5	40%	0.4	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-36.6	-171.8	175.8	0	0	0	0	113.2	N515 Q517	V502-N515 WeakPolarHBondContact CG2-O 3.25Å; V502-N515 PolarHBondContact N-O 2.64Å; V502-Q517 HydrophobicContact CG2-CB 3.79Å
503	Y	81.9	Confident	83.5	Confident	140 Å²	140	52 Å²	52	55%	0.549	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	13.9	-177.6	-58.4	-71.9	0	0	0	113.5	P501 K505 K510	P501-Y503 PolarHBondContact O-N 2.94Å; P501-Y503 VanDerWaalsContact O-N 3.13Å; Y503-K505 PolarHBondContact O-N 3.47Å; Y503-K510 HydrophobicContact CE2-CD 4.34Å; Y503-K510 PolarHBondContact OH-NZ 3.01Å
504	G	78.6	Confident	82.9	Confident	27 Å²	27	58 Å²	58	28%	0.278	29%	0.29	S	S	.	.	S	Bend	trans	74.7	-30	-174.6	0	0	0	0	0	114	P394 P501	P394-G504 WeakPolarHBondContact CD-O 3.34Å; P501-G504 PolarHBondContact O-N 3.16Å
505	K	79.4	Confident	82.3	Confident	149 Å²	149	57.4 Å²	57.4	65%	0.648	29%	0.285	S	S	*	.	S	Bend	trans	-119.7	145.2	171.2	-66.4	-167.8	177.6	-165.5	0	112.4	D393 Y503 N507	D393-K505 VanDerWaalsContact OD1-CA 3.3Å; D393-K505 WeakPolarHBondContact OD1-CA 3.04Å; Y503-K505 PolarHBondContact O-N 3.47Å; K505-N507 PolarHBondContact O-N 3.5Å
506	Y	78.6	Confident	81.3	Confident	27 Å²	27	57.8 Å²	57.8	11%	0.106	29%	0.288	C	S	.	.			trans	-68.6	119.7	173.5	-169.2	-97.4	0	0	0	111.4	D393 P508 V512 N515 L531	D393-Y506 PolarHBondContact OD1-N 2.89Å; Y506-P508 WeakPolarHBondContact O-CD 3.23Å; Y506-V512 WeakPolarHBondContact OH-CG2 3.5Å; Y506-N515 HydrophobicContact CD2-CB 4.2Å; Y506-N515 HydrophobicContact CE2-CB 3.9Å; Y506-N515 VanDerWaalsContact CE2-ND2 3.33Å; Y506-N515 WeakPolarHBondContact CE2-ND2 3.4Å; Y506-L531 HydrophobicContact CD1-CD2 4.24Å; Y506-L531 HydrophobicContact CD2-CD1 3.91Å; Y506-L531 HydrophobicContact CD2-CD2 3.78Å; Y506-L531 HydrophobicContact CD2-CG 4.48Å; Y506-L531 HydrophobicContact CE1-CD2 4.03Å; Y506-L531 HydrophobicContact CE2-CD1 4.21Å; Y506-L531 HydrophobicContact CE2-CD2 3.55Å; Y506-L531 HydrophobicContact CG-CD2 4.12Å
507	N	80.2	Confident	80.5	Confident	66 Å²	66	64.3 Å²	64.3	35%	0.353	32%	0.318	S	S	.	.			trans	-93.1	111.8	176.8	-81.3	-37.7	0	0	0	110.2	K505 K509 K510 N515	K505-N507 PolarHBondContact O-N 3.5Å; N507-K509 PolarHBondContact O-N 3.24Å; N507-K509 VanDerWaalsContact O-N 3.08Å; N507-K510 PolarHBondContact O-N 3.48Å; N507-N515 PolarHBondContact O-ND2 2.98Å
508	P	76	Confident	79.8	Confident	87 Å²	87	64.8 Å²	64.8	57%	0.565	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.4	-175.3	28.2	-36	0	0	0	113.9	Y506 P657	Y506-P508 WeakPolarHBondContact O-CD 3.23Å; P508-P657 HydrophobicContact CB-CB 4.31Å
509	K	76.8	Confident	79.1	Confident	207 Å²	207	67.6 Å²	67.6	90%	0.9	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-18.4	178.4	-63.8	-175.5	179.4	-179.4	0	113.7	N507	N507-K509 PolarHBondContact O-N 3.24Å; N507-K509 VanDerWaalsContact O-N 3.08Å
510	K	76.1	Confident	78.6	Confident	72 Å²	72	69.6 Å²	69.6	31%	0.313	36%	0.355	S	S	.	.	S	Bend	trans	-101.1	150.2	-179	-72.1	-174.9	178.1	-174.7	0	109.5	Y503 N507 Q514 N515	Y503-K510 HydrophobicContact CE2-CD 4.34Å; Y503-K510 PolarHBondContact OH-NZ 3.01Å; N507-K510 PolarHBondContact O-N 3.48Å; K510-Q514 HydrophobicContact CB-CB 4.36Å; K510-N515 VanDerWaalsContact CB-OD1 3.3Å; K510-N515 WeakPolarHBondContact CB-OD1 3.26Å; K510-N515 PolarHBondContact O-ND2 3.16Å
511	S	73.7	Confident	78.3	Confident	42 Å²	42	70.2 Å²	70.2	29%	0.294	37%	0.366	S	S	.	.			trans	-65.9	155.5	174.4	63.2	0	0	0	0	111	E513 Q514 N515	S511-E513 PolarHBondContact O-N 2.92Å; S511-Q514 PolarHBondContact O-N 3.23Å; S511-Q514 WeakPolarHBondContact OG-CG 3.38Å; S511-N515 PolarHBondContact O-N 3.01Å
512	V	72.4	Confident	78.2	Confident	16 Å²	16	69.7 Å²	69.7	10%	0.097	36%	0.363	C	S	.	.	H	α-helix	trans	-52.1	-42.5	179	176.5	0	0	0	0	111.1	Y506 Q514 N515 I516 T610 L655	Y506-V512 WeakPolarHBondContact OH-CG2 3.5Å; V512-Q514 PolarHBondContact O-N 3.49Å; V512-N515 PolarHBondContact O-N 3.38Å; V512-I516 HydrophobicContact CG1-CD1 3.48Å; V512-I516 VanDerWaalsContact CG1-CD1 3.48Å; V512-I516 WeakPolarHBondContact O-CB 3.49Å; V512-I516 WeakPolarHBondContact O-CD1 3.35Å; V512-I516 WeakPolarHBondContact O-CG1 3.48Å; V512-I516 PolarHBondContact O-N 2.73Å; V512-T610 HydrophobicContact CG1-CG2 4.08Å; V512-L655 HydrophobicContact CG1-CD2 4.45Å; V512-L655 HydrophobicContact CG2-CD2 4.33Å
513	E	73.9	Confident	78.1	Confident	120 Å²	120	67.7 Å²	67.7	56%	0.561	35%	0.35	S	S	*	.	H	α-helix	trans	-67	-31.3	178.8	-60.4	-178.2	165.6	0	0	113.8	S511	S511-E513 PolarHBondContact O-N 2.92Å
514	Q	77.7	Confident	78.2	Confident	127 Å²	127	62 Å²	62	59%	0.593	33%	0.33	S	S	*	.	H	α-helix	trans	-81.7	-29.7	176.5	-70.1	176.8	1.9	0	0	111.9	K510 S511 V512	K510-Q514 HydrophobicContact CB-CB 4.36Å; S511-Q514 PolarHBondContact O-N 3.23Å; S511-Q514 WeakPolarHBondContact OG-CG 3.38Å; V512-Q514 PolarHBondContact O-N 3.49Å
515	N	78.6	Confident	78.7	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.011	32%	0.324	C	S	.	.	H	α-helix	trans	-74.5	-29.7	176	-80.6	-25.7	0	0	0	112.5	V502 Y506 N507 K510 S511 V512	V502-N515 WeakPolarHBondContact CG2-O 3.25Å; V502-N515 PolarHBondContact N-O 2.64Å; Y506-N515 HydrophobicContact CD2-CB 4.2Å; Y506-N515 HydrophobicContact CE2-CB 3.9Å; Y506-N515 VanDerWaalsContact CE2-ND2 3.33Å; Y506-N515 WeakPolarHBondContact CE2-ND2 3.4Å; N507-N515 PolarHBondContact O-ND2 2.98Å; K510-N515 VanDerWaalsContact CB-OD1 3.3Å; K510-N515 WeakPolarHBondContact CB-OD1 3.26Å; K510-N515 PolarHBondContact O-ND2 3.16Å; S511-N515 PolarHBondContact O-N 3.01Å; V512-N515 PolarHBondContact O-N 3.38Å
516	I	74.4	Confident	79.2	Confident	10 Å²	10	56 Å²	56	5%	0.051	30%	0.296	C	S	.	.	S	Bend	trans	-117	108.1	-176.4	-57.9	154.5	0	0	0	107.6	M391 V512 L518	M391-I516 HydrophobicContact CE-CD1 4.18Å; M391-I516 HydrophobicContact CE-CG2 4.05Å; M391-I516 HydrophobicContact SD-CD1 3.31Å; M391-I516 WeakPolarHBondContact SD-CD1 3.45Å; M391-I516 HydrophobicContact SD-CG1 3.98Å; M391-I516 HydrophobicContact SD-CG2 4.29Å; V512-I516 HydrophobicContact CG1-CD1 3.48Å; V512-I516 VanDerWaalsContact CG1-CD1 3.48Å; V512-I516 WeakPolarHBondContact O-CB 3.49Å; V512-I516 WeakPolarHBondContact O-CD1 3.35Å; V512-I516 WeakPolarHBondContact O-CG1 3.48Å; V512-I516 PolarHBondContact O-N 2.73Å; I516-L518 HydrophobicContact CG2-CB 3.81Å; I516-L518 HydrophobicContact CG2-CD1 3.63Å; I516-L518 HydrophobicContact CG2-CG 3.62Å; I516-L518 PolarHBondContact O-N 2.9Å
517	Q	78.1	Confident	79.7	Confident	136 Å²	136	55.1 Å²	55.1	64%	0.636	29%	0.293	S	S	*	.			trans	-72.7	49.7	177.8	-164.7	-177.7	-15.2	0	0	112.5	R466 V502	R466-Q517 PolarHBondContact NH1-O 3.41Å; V502-Q517 HydrophobicContact CG2-CB 3.79Å
518	L	76.8	Confident	80.2	Confident	10 Å²	10	52 Å²	52	5%	0.052	28%	0.276	C	S	.	.	S	Bend	trans	-119.5	134	176.2	-63.4	177.4	0	0	0	109.5	M391 F458 I516 L523	M391-L518 HydrophobicContact CE-CD1 4.06Å; F458-L518 HydrophobicContact CD1-CD1 3.96Å; F458-L518 HydrophobicContact CD1-CD2 3.85Å; F458-L518 HydrophobicContact CE1-CD1 4.14Å; F458-L518 HydrophobicContact CE1-CD2 3.8Å; I516-L518 HydrophobicContact CG2-CB 3.81Å; I516-L518 HydrophobicContact CG2-CD1 3.63Å; I516-L518 HydrophobicContact CG2-CG 3.62Å; I516-L518 PolarHBondContact O-N 2.9Å; L518-L523 HydrophobicContact CB-CD2 4.25Å; L518-L523 HydrophobicContact CB-CG 4.44Å; L518-L523 HydrophobicContact CD1-CD2 4.15Å
519	P	79.9	Confident	80.8	Confident	59 Å²	59	49.4 Å²	49.4	38%	0.383	26%	0.257	S	S	.	.			trans	-65.3	140.2	177.3	26.7	-33	0	0	0	110.6	A521 L522 L523	P519-A521 PolarHBondContact O-N 3.49Å; P519-A521 VanDerWaalsContact O-N 3.08Å; P519-L522 HydrophobicContact CG-CB 4.05Å; P519-L522 WeakPolarHBondContact O-CB 3.24Å; P519-L522 PolarHBondContact O-N 3.34Å; P519-L523 PolarHBondContact O-N 3.21Å
520	A	78.3	Confident	81.4	Confident	45 Å²	45	40 Å²	40	37%	0.372	22%	0.216	S	C	.	.	H	α-helix	trans	-55.6	-29.1	178.5	0	0	0	0	0	113.2	L522 L523 S524	A520-L522 VanDerWaalsContact C-N 3.26Å; A520-L522 PolarHBondContact O-N 3Å; A520-L523 PolarHBondContact O-N 3.33Å; A520-S524 PolarHBondContact O-N 3.49Å
521	A	82.3	Confident	82	Confident	56 Å²	56	36.9 Å²	36.9	46%	0.463	20%	0.203	S	C	.	.	H	α-helix	trans	-57.6	-38.2	174	0	0	0	0	0	112.7	P519 S524	P519-A521 PolarHBondContact O-N 3.49Å; P519-A521 VanDerWaalsContact O-N 3.08Å; A521-S524 PolarHBondContact O-OG 3.44Å
522	L	85	Confident	82.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-77.5	-43	179	-163.3	157.2	0	0	0	110.6	F458 R466 H470 P519 A520 S524 R525 F526	F458-L522 HydrophobicContact CE1-CD1 3.9Å; F458-L522 HydrophobicContact CE1-CD2 3.56Å; F458-L522 HydrophobicContact CE1-CG 4.42Å; F458-L522 HydrophobicContact CZ-CD1 3.74Å; F458-L522 HydrophobicContact CZ-CD2 3.79Å; F458-L522 HydrophobicContact CZ-CG 4.38Å; R466-L522 HydrophobicContact CB-CD1 4.41Å; H470-L522 WeakPolarHBondContact NE2-CD1 3.45Å; P519-L522 HydrophobicContact CG-CB 4.05Å; P519-L522 WeakPolarHBondContact O-CB 3.24Å; P519-L522 PolarHBondContact O-N 3.34Å; A520-L522 VanDerWaalsContact C-N 3.26Å; A520-L522 PolarHBondContact O-N 3Å; L522-S524 PolarHBondContact O-N 3.02Å; L522-R525 WeakPolarHBondContact O-CB 3.25Å; L522-R525 PolarHBondContact O-N 2.74Å; L522-F526 HydrophobicContact CD2-CD2 3.9Å; L522-F526 HydrophobicContact CD2-CE2 3.2Å; L522-F526 HydrophobicContact CD2-CZ 4Å
523	L	82.5	Confident	83.1	Confident	23 Å²	23	36.9 Å²	36.9	12%	0.12	20%	0.197	C	C	.	.	H	α-helix	trans	-56.4	-38.7	175	-63.1	179.1	0	0	0	111.9	M391 L518 P519 A520 R525 F526 I529	M391-L523 HydrophobicContact CE-CD2 3.56Å; L518-L523 HydrophobicContact CB-CD2 4.25Å; L518-L523 HydrophobicContact CB-CG 4.44Å; L518-L523 HydrophobicContact CD1-CD2 4.15Å; P519-L523 PolarHBondContact O-N 3.21Å; A520-L523 PolarHBondContact O-N 3.33Å; L523-R525 PolarHBondContact O-N 3.3Å; L523-R525 VanDerWaalsContact O-N 3.13Å; L523-F526 PolarHBondContact O-N 2.98Å; L523-I529 HydrophobicContact CB-CD1 4.12Å; L523-I529 HydrophobicContact CD2-CD1 4.1Å
524	S	83.6	Confident	83.6	Confident	20 Å²	20	35.7 Å²	35.7	14%	0.14	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-16.6	177.7	81	0	0	0	0	114.8	A520 A521 L522 R615	A520-S524 PolarHBondContact O-N 3.49Å; A521-S524 PolarHBondContact O-OG 3.44Å; L522-S524 PolarHBondContact O-N 3.02Å; S524-R615 WeakPolarHBondContact O-CD 3.5Å; S524-R615 PolarHBondContact OG-NH1 3.03Å
525	R	88.4	Confident	83.8	Confident	40 Å²	40	34.9 Å²	34.9	15%	0.151	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-14.9	179.8	-66	-167.4	-179.8	105.3	-9.9	113.5	R383 H470 M473 E474 L522 L523	R383-R525 PolarHBondContact NH1-O 2.91Å; R383-R525 PolarHBondContact NH2-O 3.35Å; H470-R525 PolarHBondContact CD2-NH1 2.89Å; M473-R525 HydrophobicContact CB-CB 4.24Å; M473-R525 HydrophobicContact CE-CB 3.91Å; M473-R525 WeakPolarHBondContact CE-O 3.39Å; M473-R525 HydrophobicContact SD-CB 3.93Å; E474-R525 IonicContact OE2-NE 3.79Å; E474-R525 PolarHBondContact OE2-NE 3.05Å; L522-R525 WeakPolarHBondContact O-CB 3.25Å; L522-R525 PolarHBondContact O-N 2.74Å; L523-R525 PolarHBondContact O-N 3.3Å; L523-R525 VanDerWaalsContact O-N 3.13Å
526	F	89.2	Confident	84	Confident	11 Å²	11	40.7 Å²	40.7	5%	0.048	22%	0.224	C	C	.	.			trans	-78.8	135.5	168.7	-71.8	-66.2	0	0	0	109.2	N387 C389 F458 M473 I495 A497 L522 L523 I529	N387-F526 HydrophobicContact CB-CD1 3.8Å; N387-F526 HydrophobicContact CB-CE1 4.31Å; C389-F526 HydrophobicContact CB-CD1 3.96Å; C389-F526 HydrophobicContact CB-CD2 3.87Å; C389-F526 HydrophobicContact CB-CE1 4.07Å; C389-F526 HydrophobicContact CB-CE2 3.91Å; C389-F526 HydrophobicContact CB-CG 3.89Å; C389-F526 HydrophobicContact CB-CZ 4.05Å; F458-F526 HydrophobicContact CE1-CE2 4.42Å; F458-F526 HydrophobicContact CE1-CZ 4.48Å; F458-F526 HydrophobicContact CZ-CZ 4.46Å; M473-F526 HydrophobicContact CE-CD1 3.48Å; M473-F526 VanDerWaalsContact CE-CD1 3.48Å; M473-F526 HydrophobicContact CE-CD2 4.37Å; M473-F526 HydrophobicContact CE-CE1 3.43Å; M473-F526 VanDerWaalsContact CE-CE1 3.43Å; M473-F526 HydrophobicContact CE-CE2 4.39Å; M473-F526 HydrophobicContact CE-CG 3.95Å; M473-F526 HydrophobicContact CE-CZ 3.91Å; I495-F526 HydrophobicContact CG2-CE1 4.42Å; A497-F526 HydrophobicContact CB-CE1 4.13Å; A497-F526 HydrophobicContact CB-CZ 3.86Å; L522-F526 HydrophobicContact CD2-CD2 3.9Å; L522-F526 HydrophobicContact CD2-CE2 3.2Å; L522-F526 HydrophobicContact CD2-CZ 4Å; L523-F526 PolarHBondContact O-N 2.98Å; F526-I529 HydrophobicContact CB-CD1 4.44Å; F526-I529 HydrophobicContact CB-CG1 3.93Å
527	D	90.2	Very high	84.6	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.043	24%	0.238	C	C	.	.	S	Bend	trans	-82.5	-36.3	-179.9	-69.1	-22.3	0	0	0	110.1	R383 I386 N387 A619 R622 M648	R383-D527 IonicContact CZ-OD1 2.88Å; R383-D527 IonicContact NH2-OD1 3.16Å; R383-D527 PolarHBondContact NH2-OD1 3.25Å; R383-D527 IonicContact NH2-OD2 2.96Å; R383-D527 PolarHBondContact NH2-OD2 2.87Å; I386-D527 HydrophobicContact CG2-CB 4.23Å; N387-D527 PolarHBondContact O-N 2.88Å; D527-A619 HydrophobicContact CB-CB 3.75Å; D527-R622 IonicContact OD1-NH1 3.15Å; D527-R622 PolarHBondContact OD1-NH1 3.33Å; D527-R622 IonicContact OD2-NH1 2.94Å; D527-R622 PolarHBondContact OD2-NH1 3.04Å; D527-M648 WeakPolarHBondContact O-CE 3.33Å
528	L	89.8	Confident	85.1	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.2	173.5	-65.6	173.8	0	0	0	110.9	A364 N387 I388 C389 L623 M648	A364-L528 HydrophobicContact CB-CD1 3.76Å; N387-L528 PolarHBondContact O-N 2.68Å; I388-L528 WeakPolarHBondContact CA-O 3.19Å; I388-L528 HydrophobicContact CD1-CD1 4.45Å; I388-L528 HydrophobicContact CG1-CB 4.34Å; C389-L528 PolarHBondContact N-O 3.43Å; L528-L623 HydrophobicContact CD1-CD1 4.2Å; L528-L623 HydrophobicContact CD1-CD2 3.96Å; L528-L623 HydrophobicContact CD2-CD1 3.99Å; L528-L623 HydrophobicContact CG-CD1 4.2Å; L528-M648 HydrophobicContact CD2-CE 3.92Å; L528-M648 HydrophobicContact CD2-SD 4.34Å
529	I	89.5	Confident	85.8	Confident	33 Å²	33	52.1 Å²	52.1	17%	0.169	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	112.3	175.1	-59.8	167.7	0	0	0	107.4	M391 L523 F526 S651	M391-I529 HydrophobicContact CE-CG2 3.67Å; M391-I529 HydrophobicContact CG-CG2 4.39Å; M391-I529 HydrophobicContact SD-CG2 3.58Å; M391-I529 VanDerWaalsContact SD-CG2 3.58Å; L523-I529 HydrophobicContact CB-CD1 4.12Å; L523-I529 HydrophobicContact CD2-CD1 4.1Å; F526-I529 HydrophobicContact CB-CD1 4.44Å; F526-I529 HydrophobicContact CB-CG1 3.93Å; I529-S651 WeakPolarHBondContact O-CB 3.38Å
530	W	90.1	Very high	86.1	Confident	8 Å²	8	53.1 Å²	53.1	3%	0.03	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.8	178.3	-70.6	109.7	0	0	0	109.9	D360 V361 A364 C389 L390 M391 L647 A650 S651	D360-W530 HydrophobicContact CB-CH2 3.87Å; D360-W530 HydrophobicContact CB-CZ2 4.42Å; D360-W530 HydrophobicContact CB-CZ3 4.33Å; V361-W530 HydrophobicContact CG2-CB 4.48Å; V361-W530 HydrophobicContact CG2-CD2 4.15Å; V361-W530 HydrophobicContact CG2-CE3 4.39Å; V361-W530 HydrophobicContact CG2-CG 4.17Å; A364-W530 HydrophobicContact CB-CZ2 4.17Å; C389-W530 PolarHBondContact O-N 3.5Å; L390-W530 HydrophobicContact CD2-CB 3.95Å; L390-W530 HydrophobicContact CD2-CG 4.31Å; M391-W530 WeakPolarHBondContact CA-O 3.44Å; M391-W530 WeakPolarHBondContact CB-O 3.38Å; M391-W530 PolarHBondContact N-O 3.26Å; W530-L647 WeakPolarHBondContact CH2-O 3.48Å; W530-A650 HydrophobicContact CH2-CB 3.89Å; W530-A650 HydrophobicContact CZ3-CB 4.05Å; W530-S651 VanDerWaalsContact CZ3-CA 3.49Å
531	L	87	Confident	86.6	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	109.8	169.5	-177.6	70.1	0	0	0	109.4	M391 Y506 Q533 L655	M391-L531 HydrophobicContact CB-CD1 3.8Å; Y506-L531 HydrophobicContact CD1-CD2 4.24Å; Y506-L531 HydrophobicContact CD2-CD1 3.91Å; Y506-L531 HydrophobicContact CD2-CD2 3.78Å; Y506-L531 HydrophobicContact CD2-CG 4.48Å; Y506-L531 HydrophobicContact CE1-CD2 4.03Å; Y506-L531 HydrophobicContact CE2-CD1 4.21Å; Y506-L531 HydrophobicContact CE2-CD2 3.55Å; Y506-L531 HydrophobicContact CG-CD2 4.12Å; L531-Q533 HydrophobicContact CD2-CG 4.15Å; L531-Q533 VanDerWaalsContact CD2-NE2 3.29Å; L531-Q533 HydrophobicContact CG-CG 4.15Å; L531-L655 HydrophobicContact CB-CD2 3.65Å; L531-L655 HydrophobicContact CD2-CD2 3.72Å; L531-L655 HydrophobicContact CG-CD2 4.26Å
532	I	86.9	Confident	87.1	Confident	11 Å²	11	55.8 Å²	55.8	6%	0.056	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	105.2	178.3	-50.3	174.3	0	0	0	108.2	H358 V361 M391 G392 D393 V396	H358-I532 WeakPolarHBondContact CE1-CG2 3.48Å; V361-I532 HydrophobicContact CG2-CD1 4.39Å; M391-I532 PolarHBondContact O-N 3.47Å; G392-I532 WeakPolarHBondContact CA-O 3.32Å; D393-I532 PolarHBondContact N-O 2.84Å; V396-I532 HydrophobicContact CB-CB 4.49Å; V396-I532 HydrophobicContact CB-CG2 3.79Å; V396-I532 HydrophobicContact CG1-CG2 3.93Å; V396-I532 HydrophobicContact CG2-CB 4.08Å; V396-I532 HydrophobicContact CG2-CG2 3.94Å
533	Q	83.6	Confident	87.3	Confident	47 Å²	47	61 Å²	61	22%	0.22	30%	0.298	C	S	.	.			trans	-93.7	134.2	175.6	-64.8	174.6	9.8	0	0	109.5	L531 R535 S654	L531-Q533 HydrophobicContact CD2-CG 4.15Å; L531-Q533 VanDerWaalsContact CD2-NE2 3.29Å; L531-Q533 HydrophobicContact CG-CG 4.15Å; Q533-R535 HydrophobicContact CB-CG 4.33Å; Q533-R535 PolarHBondContact O-N 3.4Å; Q533-S654 PolarHBondContact NE2-O 3.44Å
534	D	83.6	Confident	87.6	Confident	95 Å²	95	63.1 Å²	63.1	51%	0.508	31%	0.309	S	S	.	.			trans	-85.5	92.1	171.6	-175.2	26.2	0	0	0	109	D393 V396	D393-D534 HydrophobicContact CB-CB 4.28Å; D393-D534 PolarHBondContact OD2-N 3.02Å; V396-D534 HydrophobicContact CG1-CB 4.04Å
535	R	82.8	Confident	87.9	Confident	109 Å²	109	64.6 Å²	64.6	41%	0.411	32%	0.323	S	S	.	.			trans	-92.1	123.4	177.1	-66.7	-172.9	-175	161.7	4.1	108.9	Q533 D537 I658	Q533-R535 HydrophobicContact CB-CG 4.33Å; Q533-R535 PolarHBondContact O-N 3.4Å; R535-D537 PolarHBondContact O-N 3.19Å; R535-I658 VanDerWaalsContact NH1-CG1 3.31Å
536	P	82.7	Confident	88	Confident	124 Å²	124	69.2 Å²	69.2	81%	0.805	34%	0.344	S	S	*	.			trans	-68.1	106.6	-179.9	28.3	-33.7	0	0	0	109.3
537	D	86.7	Confident	87.9	Confident	66 Å²	66	69.1 Å²	69.1	35%	0.353	34%	0.343	S	S	.	.			trans	-131.7	120.7	178.5	176.7	29	0	0	0	109.8	R535 D539 N540 D541	R535-D537 PolarHBondContact O-N 3.19Å; D537-D539 VanDerWaalsContact C-N 3.29Å; D537-D539 PolarHBondContact O-N 2.93Å; D537-N540 HydrophobicContact CB-CB 4.24Å; D537-N540 PolarHBondContact O-N 3.01Å; D537-N540 VanDerWaalsContact OD2-CG 3.31Å; D537-N540 PolarHBondContact OD2-ND2 2.92Å; D537-D541 VanDerWaalsContact O-CB 3.3Å; D537-D541 WeakPolarHBondContact O-CB 3.39Å; D537-D541 PolarHBondContact O-N 3.39Å
538	R	89.1	Confident	87.9	Confident	221 Å²	221	72.3 Å²	72.3	83%	0.834	36%	0.36	S	S	*	.	H	α-helix	trans	-59.8	-38.6	-169.5	-71.9	-176	171.5	-177.1	-1.9	112.8	L542	R538-L542 VanDerWaalsContact O-CB 3.3Å; R538-L542 WeakPolarHBondContact O-CB 3.4Å; R538-L542 PolarHBondContact O-N 2.71Å
539	D	91.3	Very high	88	Confident	109 Å²	109	76.7 Å²	76.7	58%	0.583	39%	0.386	S	S	*	.	H	α-helix	trans	-76.4	-40.5	-175.6	-70.5	-21.6	0	0	0	111.7	D537 L542 K543	D537-D539 VanDerWaalsContact C-N 3.29Å; D537-D539 PolarHBondContact O-N 2.93Å; D539-L542 PolarHBondContact O-N 2.97Å; D539-K543 WeakPolarHBondContact O-CG 3.29Å; D539-K543 PolarHBondContact O-N 2.76Å; D539-K543 VanDerWaalsContact O-N 3.1Å
540	N	86	Confident	88	Confident	81 Å²	81	78 Å²	78	43%	0.433	39%	0.39	S	S	.	.	H	α-helix	trans	-67.9	-41.7	175.2	-76.9	-34.3	0	0	0	111.5	D537 L542 K543 L544	D537-N540 HydrophobicContact CB-CB 4.24Å; D537-N540 PolarHBondContact O-N 3.01Å; D537-N540 VanDerWaalsContact OD2-CG 3.31Å; D537-N540 PolarHBondContact OD2-ND2 2.92Å; N540-L542 VanDerWaalsContact C-N 3.33Å; N540-L542 PolarHBondContact O-N 3.01Å; N540-K543 PolarHBondContact O-N 3.09Å; N540-L544 VanDerWaalsContact O-CB 3.27Å; N540-L544 WeakPolarHBondContact O-CB 3.17Å; N540-L544 PolarHBondContact O-N 3.34Å
541	D	89	Confident	88	Confident	69 Å²	69	78.9 Å²	78.9	37%	0.369	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-41.5	175.6	-67.9	-20.9	0	0	0	111.3	D537 L544 A545	D537-D541 VanDerWaalsContact O-CB 3.3Å; D537-D541 WeakPolarHBondContact O-CB 3.39Å; D537-D541 PolarHBondContact O-N 3.39Å; D541-L544 PolarHBondContact O-N 3.17Å; D541-A545 WeakPolarHBondContact O-CB 3.15Å; D541-A545 PolarHBondContact O-N 3.36Å
542	L	92.2	Very high	88.1	Confident	88 Å²	88	86.2 Å²	86.2	46%	0.461	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-44.9	176.7	-177	158.7	0	0	0	111.5	R538 D539 N540 K546	R538-L542 VanDerWaalsContact O-CB 3.3Å; R538-L542 WeakPolarHBondContact O-CB 3.4Å; R538-L542 PolarHBondContact O-N 2.71Å; D539-L542 PolarHBondContact O-N 2.97Å; N540-L542 VanDerWaalsContact C-N 3.33Å; N540-L542 PolarHBondContact O-N 3.01Å; L542-K546 HydrophobicContact CD2-CD 3.73Å; L542-K546 HydrophobicContact CD2-CG 4.33Å; L542-K546 WeakPolarHBondContact O-CB 3.42Å; L542-K546 WeakPolarHBondContact O-CG 3.32Å; L542-K546 PolarHBondContact O-N 3.5Å
543	K	89.3	Confident	88.3	Confident	109 Å²	109	89.4 Å²	89.4	47%	0.474	46%	0.458	S	S	.	.	H	α-helix	trans	-64.3	-44.9	176.9	-71.3	171	-173.3	168.6	0	111.4	F356 D539 N540 K546 H547	F356-K543 HydrophobicContact CD1-CB 4.44Å; F356-K543 HydrophobicContact CE1-CB 3.73Å; F356-K543 HydrophobicContact CE1-CD 4.36Å; F356-K543 HydrophobicContact CZ-CB 3.94Å; F356-K543 HydrophobicContact CZ-CD 4.14Å; D539-K543 WeakPolarHBondContact O-CG 3.29Å; D539-K543 PolarHBondContact O-N 2.76Å; D539-K543 VanDerWaalsContact O-N 3.1Å; N540-K543 PolarHBondContact O-N 3.09Å; K543-K546 PolarHBondContact O-N 2.93Å; K543-H547 WeakPolarHBondContact O-CB 3.36Å; K543-H547 PolarHBondContact O-N 3.1Å
544	L	88	Confident	88.6	Confident	67 Å²	67	92.1 Å²	92.1	35%	0.351	47%	0.47	S	S	.	.	H	α-helix	trans	-60.6	-47.3	177	-178.6	65.6	0	0	0	111.1	F356 N540 D541 K546 H547 I548	F356-L544 HydrophobicContact CB-CD1 4.06Å; N540-L544 VanDerWaalsContact O-CB 3.27Å; N540-L544 WeakPolarHBondContact O-CB 3.17Å; N540-L544 PolarHBondContact O-N 3.34Å; D541-L544 PolarHBondContact O-N 3.17Å; L544-K546 PolarHBondContact O-N 2.98Å; L544-H547 WeakPolarHBondContact O-CB 3.47Å; L544-H547 PolarHBondContact O-N 2.92Å; L544-H547 VanDerWaalsContact O-N 3.16Å; L544-I548 HydrophobicContact CD1-CD1 3.94Å; L544-I548 HydrophobicContact CD1-CG1 4.32Å; L544-I548 HydrophobicContact CD2-CD1 4.47Å; L544-I548 HydrophobicContact CG-CD1 3.81Å; L544-I548 WeakPolarHBondContact O-CG1 3.46Å; L544-I548 PolarHBondContact O-N 2.77Å
545	A	89.9	Confident	88.5	Confident	52 Å²	52	90.9 Å²	90.9	43%	0.43	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-42.2	178	0	0	0	0	0	111.9	D541 H547 I548 T549	D541-A545 WeakPolarHBondContact O-CB 3.15Å; D541-A545 PolarHBondContact O-N 3.36Å; A545-H547 VanDerWaalsContact C-N 3.33Å; A545-H547 PolarHBondContact O-N 3.37Å; A545-I548 PolarHBondContact O-N 2.82Å; A545-T549 WeakPolarHBondContact O-CB 3.28Å; A545-T549 VanDerWaalsContact O-CG2 3.25Å; A545-T549 WeakPolarHBondContact O-CG2 3.22Å; A545-T549 PolarHBondContact O-N 2.82Å; A545-T549 PolarHBondContact O-OG1 2.94Å
546	K	91	Very high	88.5	Confident	137 Å²	137	90.1 Å²	90.1	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-61.5	-41	173.8	-77.7	-177.1	-179.2	178	0	111.9	L542 K543 L544 T549 Y550	L542-K546 HydrophobicContact CD2-CD 3.73Å; L542-K546 HydrophobicContact CD2-CG 4.33Å; L542-K546 WeakPolarHBondContact O-CB 3.42Å; L542-K546 WeakPolarHBondContact O-CG 3.32Å; L542-K546 PolarHBondContact O-N 3.5Å; K543-K546 PolarHBondContact O-N 2.93Å; L544-K546 PolarHBondContact O-N 2.98Å; K546-T549 WeakPolarHBondContact CA-OG1 3.4Å; K546-T549 PolarHBondContact O-OG1 2.77Å; K546-Y550 VanDerWaalsContact O-CB 3.24Å; K546-Y550 WeakPolarHBondContact O-CB 3.4Å; K546-Y550 PolarHBondContact O-N 3.3Å
547	H	87.4	Confident	88.4	Confident	8 Å²	8	86.5 Å²	86.5	4%	0.037	45%	0.453	C	S	.	.	H	α-helix	trans	-65.5	-50	178.4	-170.7	88.4	0	0	0	111.5	P353 E354 F356 K543 L544 A545 T549 Y550 V551 P558	P353-H547 PolarHBondContact O-CE1 2.82Å; P353-H547 VanDerWaalsContact O-CE1 3.31Å; P353-H547 PolarHBondContact O-NE2 2.93Å; E354-H547 PolarHBondContact O-CD2 3.35Å; E354-H547 VanDerWaalsContact O-CD2 3.24Å; E354-H547 PolarHBondContact O-NE2 2.64Å; E354-H547 VanDerWaalsContact O-NE2 3.08Å; F356-H547 HydrophobicContact CB-CB 3.91Å; F356-H547 HydrophobicContact CD2-CB 4.5Å; F356-H547 HydrophobicContact CG-CB 4.32Å; K543-H547 WeakPolarHBondContact O-CB 3.36Å; K543-H547 PolarHBondContact O-N 3.1Å; L544-H547 WeakPolarHBondContact O-CB 3.47Å; L544-H547 PolarHBondContact O-N 2.92Å; L544-H547 VanDerWaalsContact O-N 3.16Å; A545-H547 VanDerWaalsContact C-N 3.33Å; A545-H547 PolarHBondContact O-N 3.37Å; H547-T549 PolarHBondContact O-N 2.9Å; H547-Y550 WeakPolarHBondContact O-CB 3.47Å; H547-Y550 PolarHBondContact O-N 3.46Å; H547-V551 VanDerWaalsContact O-CG2 3.32Å; H547-V551 WeakPolarHBondContact O-CG2 3.46Å; H547-V551 PolarHBondContact O-N 2.99Å; H547-P558 VanDerWaalsContact CE1-CD 3.43Å; H547-P558 WeakPolarHBondContact CE1-CD 3.47Å; H547-P558 WeakPolarHBondContact ND1-CD 3.38Å; H547-P558 WeakPolarHBondContact ND1-CG 3.42Å
548	I	89.3	Confident	88.1	Confident	76 Å²	76	84.9 Å²	84.9	39%	0.39	45%	0.446	S	S	.	.	H	α-helix	trans	-61.6	-47.1	179.8	-67.3	170.5	0	0	0	110.7	L544 A545 Y550 V551 H552	L544-I548 HydrophobicContact CD1-CD1 3.94Å; L544-I548 HydrophobicContact CD1-CG1 4.32Å; L544-I548 HydrophobicContact CD2-CD1 4.47Å; L544-I548 HydrophobicContact CG-CD1 3.81Å; L544-I548 WeakPolarHBondContact O-CG1 3.46Å; L544-I548 PolarHBondContact O-N 2.77Å; A545-I548 PolarHBondContact O-N 2.82Å; I548-Y550 VanDerWaalsContact C-N 3.29Å; I548-Y550 PolarHBondContact O-N 3Å; I548-V551 PolarHBondContact O-N 2.85Å; I548-H552 PolarHBondContact O-CD2 2.96Å; I548-H552 VanDerWaalsContact O-CD2 3.23Å; I548-H552 PolarHBondContact O-N 3.44Å
549	T	91.6	Very high	87.5	Confident	92 Å²	92	79.9 Å²	79.9	56%	0.564	44%	0.442	S	S	*	.	H	α-helix	trans	-62	-38.4	178.4	50.3	0	0	0	0	111.7	A545 K546 H547 A553	A545-T549 WeakPolarHBondContact O-CB 3.28Å; A545-T549 VanDerWaalsContact O-CG2 3.25Å; A545-T549 WeakPolarHBondContact O-CG2 3.22Å; A545-T549 PolarHBondContact O-N 2.82Å; A545-T549 PolarHBondContact O-OG1 2.94Å; K546-T549 WeakPolarHBondContact CA-OG1 3.4Å; K546-T549 PolarHBondContact O-OG1 2.77Å; H547-T549 PolarHBondContact O-N 2.9Å; T549-A553 VanDerWaalsContact O-CB 3.26Å; T549-A553 WeakPolarHBondContact O-CB 3.44Å; T549-A553 PolarHBondContact O-N 3.13Å
550	Y	91.1	Very high	86.6	Confident	62 Å²	62	76.8 Å²	76.8	24%	0.243	43%	0.429	C	S	.	.	H	α-helix	trans	-64	-48.2	175.4	-171.3	-81.3	0	0	0	112.4	K546 H547 I548 H552 A553 H554 H556 E557 P558	K546-Y550 VanDerWaalsContact O-CB 3.24Å; K546-Y550 WeakPolarHBondContact O-CB 3.4Å; K546-Y550 PolarHBondContact O-N 3.3Å; H547-Y550 WeakPolarHBondContact O-CB 3.47Å; H547-Y550 PolarHBondContact O-N 3.46Å; I548-Y550 VanDerWaalsContact C-N 3.29Å; I548-Y550 PolarHBondContact O-N 3Å; Y550-H552 VanDerWaalsContact C-N 3.32Å; Y550-H552 PolarHBondContact O-N 2.88Å; Y550-A553 PolarHBondContact O-N 3.01Å; Y550-A553 VanDerWaalsContact O-N 3.14Å; Y550-H554 HydrophobicContact CD1-CB 4.48Å; Y550-H554 AromaticContact CD1-ND1 3.82Å; Y550-H554 AromaticContact CD2-CE1 3.63Å; Y550-H554 AromaticContact CD2-ND1 3.56Å; Y550-H554 HydrophobicContact CE1-CB 4.02Å; Y550-H554 AromaticContact CE1-CG 3.92Å; Y550-H554 AromaticContact CE1-ND1 3.71Å; Y550-H554 AromaticContact CE2-CE1 3.41Å; Y550-H554 VanDerWaalsContact CE2-CE1 3.41Å; Y550-H554 WeakPolarHBondContact CE2-CE1 3.5Å; Y550-H554 AromaticContact CE2-ND1 3.47Å; Y550-H554 WeakPolarHBondContact CE2-ND1 3.16Å; Y550-H554 AromaticContact CG-ND1 3.74Å; Y550-H554 AromaticContact CZ-CE1 3.87Å; Y550-H554 AromaticContact CZ-CG 3.82Å; Y550-H554 AromaticContact CZ-ND1 3.56Å; Y550-H554 PolarHBondContact O-N 3.34Å; Y550-H554 PolarHBondContact O-ND1 3.32Å; Y550-H554 VanDerWaalsContact O-ND1 3.11Å; Y550-H556 WeakPolarHBondContact CD1-O 3.39Å; Y550-H556 AromaticContact CE1-CE1 3.75Å; Y550-H556 AromaticContact CE1-ND1 3.78Å; Y550-H556 WeakPolarHBondContact CE1-O 3.37Å; Y550-H556 AromaticContact CZ-CE1 3.94Å; Y550-H556 PolarHBondContact OH-CE1 3.47Å; Y550-H556 VanDerWaalsContact OH-CE1 3.26Å; Y550-E557 VanDerWaalsContact CE1-C 3.47Å; Y550-E557 WeakPolarHBondContact CE1-O 3.38Å; Y550-P558 HydrophobicContact CD1-CB 3.82Å; Y550-P558 HydrophobicContact CD1-CG 4.28Å; Y550-P558 VanDerWaalsContact CD1-N 3.27Å; Y550-P558 HydrophobicContact CD2-CB 4.32Å; Y550-P558 HydrophobicContact CE1-CB 4.05Å; Y550-P558 HydrophobicContact CG-CB 3.96Å; Y550-P558 HydrophobicContact CG-CG 4.5Å
551	V	89.3	Confident	85.9	Confident	26 Å²	26	82.4 Å²	82.4	16%	0.158	45%	0.45	C	S	.	.	H	α-helix	trans	-59.6	-43.4	179.1	170.8	0	0	0	0	110.9	H547 I548 G555	H547-V551 VanDerWaalsContact O-CG2 3.32Å; H547-V551 WeakPolarHBondContact O-CG2 3.46Å; H547-V551 PolarHBondContact O-N 2.99Å; I548-V551 PolarHBondContact O-N 2.85Å; V551-G555 VanDerWaalsContact O-CA 3.27Å; V551-G555 WeakPolarHBondContact O-CA 3.44Å; V551-G555 PolarHBondContact O-N 2.84Å
552	H	88.7	Confident	85.1	Confident	162 Å²	162	81.6 Å²	81.6	75%	0.75	44%	0.443	S	S	*	.	H	α-helix	trans	-69.6	-30.1	176.8	-80.7	-75	0	0	0	113.7	I548 Y550	I548-H552 PolarHBondContact O-CD2 2.96Å; I548-H552 VanDerWaalsContact O-CD2 3.23Å; I548-H552 PolarHBondContact O-N 3.44Å; Y550-H552 VanDerWaalsContact C-N 3.32Å; Y550-H552 PolarHBondContact O-N 2.88Å
553	A	91.8	Very high	84.4	Confident	78 Å²	78	85.5 Å²	85.5	65%	0.645	46%	0.456	S	S	*	.	H	α-helix	trans	-78.2	-39.2	179.7	0	0	0	0	0	113.2	T549 Y550	T549-A553 VanDerWaalsContact O-CB 3.26Å; T549-A553 WeakPolarHBondContact O-CB 3.44Å; T549-A553 PolarHBondContact O-N 3.13Å; Y550-A553 PolarHBondContact O-N 3.01Å; Y550-A553 VanDerWaalsContact O-N 3.14Å
554	H	89.3	Confident	83.8	Confident	104 Å²	104	81.6 Å²	81.6	48%	0.481	45%	0.445	S	S	.	.	H	α-helix	trans	-108.4	-16.6	-172.1	-58.3	85.8	0	0	0	113.8	Y550 H556	Y550-H554 HydrophobicContact CD1-CB 4.48Å; Y550-H554 AromaticContact CD1-ND1 3.82Å; Y550-H554 AromaticContact CD2-CE1 3.63Å; Y550-H554 AromaticContact CD2-ND1 3.56Å; Y550-H554 HydrophobicContact CE1-CB 4.02Å; Y550-H554 AromaticContact CE1-CG 3.92Å; Y550-H554 AromaticContact CE1-ND1 3.71Å; Y550-H554 AromaticContact CE2-CE1 3.41Å; Y550-H554 VanDerWaalsContact CE2-CE1 3.41Å; Y550-H554 WeakPolarHBondContact CE2-CE1 3.5Å; Y550-H554 AromaticContact CE2-ND1 3.47Å; Y550-H554 WeakPolarHBondContact CE2-ND1 3.16Å; Y550-H554 AromaticContact CG-ND1 3.74Å; Y550-H554 AromaticContact CZ-CE1 3.87Å; Y550-H554 AromaticContact CZ-CG 3.82Å; Y550-H554 AromaticContact CZ-ND1 3.56Å; Y550-H554 PolarHBondContact O-N 3.34Å; Y550-H554 PolarHBondContact O-ND1 3.32Å; Y550-H554 VanDerWaalsContact O-ND1 3.11Å; H554-H556 PolarHBondContact O-CD2 2.86Å; H554-H556 PolarHBondContact O-N 2.88Å
555	G	82.8	Confident	83.4	Confident	69 Å²	69	79.6 Å²	79.6	71%	0.711	43%	0.434	S	S	*	.	S	Bend	trans	73.8	6.7	-174.6	0	0	0	0	0	114.4	V551	V551-G555 VanDerWaalsContact O-CA 3.27Å; V551-G555 WeakPolarHBondContact O-CA 3.44Å; V551-G555 PolarHBondContact O-N 2.84Å
556	H	83	Confident	83.1	Confident	93 Å²	93	81.2 Å²	81.2	43%	0.431	44%	0.436	S	S	.	.	S	Bend	trans	-140.2	162.7	174	65.5	79	0	0	0	110.5	Y550 H554	Y550-H556 WeakPolarHBondContact CD1-O 3.39Å; Y550-H556 AromaticContact CE1-CE1 3.75Å; Y550-H556 AromaticContact CE1-ND1 3.78Å; Y550-H556 WeakPolarHBondContact CE1-O 3.37Å; Y550-H556 AromaticContact CZ-CE1 3.94Å; Y550-H556 PolarHBondContact OH-CE1 3.47Å; Y550-H556 VanDerWaalsContact OH-CE1 3.26Å; H554-H556 PolarHBondContact O-CD2 2.86Å; H554-H556 PolarHBondContact O-N 2.88Å
557	E	80.6	Confident	82.8	Confident	48 Å²	48	77.1 Å²	77.1	22%	0.224	42%	0.419	C	S	.	.			trans	-64.4	152.7	177.2	67.5	-82	-171.5	0	0	112.6	P353 Y550 A564	P353-E557 HydrophobicContact CB-CB 4.13Å; P353-E557 HydrophobicContact CB-CG 3.92Å; Y550-E557 VanDerWaalsContact CE1-C 3.47Å; Y550-E557 WeakPolarHBondContact CE1-O 3.38Å; E557-A564 VanDerWaalsContact OE1-CB 3.28Å; E557-A564 WeakPolarHBondContact OE1-CB 3.33Å
558	P	78.8	Confident	82.4	Confident	31 Å²	31	86 Å²	86	20%	0.201	45%	0.452	C	S	.	.			trans	-58.4	144.9	171.1	23.7	-33.1	0	0	0	111	H547 Y550 S560	H547-P558 VanDerWaalsContact CE1-CD 3.43Å; H547-P558 WeakPolarHBondContact CE1-CD 3.47Å; H547-P558 WeakPolarHBondContact ND1-CD 3.38Å; H547-P558 WeakPolarHBondContact ND1-CG 3.42Å; Y550-P558 HydrophobicContact CD1-CB 3.82Å; Y550-P558 HydrophobicContact CD1-CG 4.28Å; Y550-P558 VanDerWaalsContact CD1-N 3.27Å; Y550-P558 HydrophobicContact CD2-CB 4.32Å; Y550-P558 HydrophobicContact CE1-CB 4.05Å; Y550-P558 HydrophobicContact CG-CB 3.96Å; Y550-P558 HydrophobicContact CG-CG 4.5Å; P558-S560 PolarHBondContact O-N 2.61Å
559	P	77.5	Confident	82.1	Confident	116 Å²	116	85.4 Å²	85.4	75%	0.753	45%	0.45	S	S	*	.			trans	-60.3	109.7	177.6	25.5	-33.5	0	0	0	109
560	S	72	Confident	81.8	Confident	45 Å²	45	81.1 Å²	81.1	32%	0.315	42%	0.423	S	S	.	.			trans	-99.3	-176.7	178.3	75.8	0	0	0	0	110.4	Y349 P558 F562	Y349-S560 WeakPolarHBondContact CE1-OG 3.41Å; Y349-S560 WeakPolarHBondContact OH-CB 3.49Å; Y349-S560 PolarHBondContact OH-OG 3.35Å; P558-S560 PolarHBondContact O-N 2.61Å; S560-F562 PolarHBondContact O-N 3.32Å; S560-F562 PolarHBondContact OG-N 2.96Å; S560-F562 PolarHBondContact OG-O 3.06Å
561	K	70.4	Confident	81.5	Confident	199 Å²	199	82.3 Å²	82.3	87%	0.865	43%	0.427	S	S	*	.	S	Bend	trans	-57.9	-28.8	177.6	-65.6	-176.8	-179.5	179.8	0	112.7
562	F	72.5	Confident	81.1	Confident	51 Å²	51	83 Å²	83	22%	0.224	44%	0.436	C	S	.	.	S	Bend	trans	-123	134.9	-173.8	-59.3	-71.7	0	0	0	111.1	D342 R346 S560 A564	D342-F562 HydrophobicContact CB-CE1 4.21Å; D342-F562 HydrophobicContact CB-CZ 4.31Å; R346-F562 HydrophobicContact CB-CD1 4.4Å; R346-F562 HydrophobicContact CG-CB 4.21Å; R346-F562 HydrophobicContact CG-CD1 4.45Å; R346-F562 HydrophobicContact CG-CG 4.5Å; S560-F562 PolarHBondContact O-N 3.32Å; S560-F562 PolarHBondContact OG-N 2.96Å; S560-F562 PolarHBondContact OG-O 3.06Å; F562-A564 PolarHBondContact O-N 2.68Å
563	K	77.4	Confident	80.8	Confident	171 Å²	171	76 Å²	76	74%	0.743	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-71.7	121.3	169.7	-174.5	178.4	179.7	-177.7	0	109.3	R346	R346-K563 PolarHBondContact NE-O 2.93Å
564	A	77.2	Confident	80.5	Confident	27 Å²	27	73 Å²	73	22%	0.223	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-58	138.6	175.5	0	0	0	0	0	111.1	E557 F562	E557-A564 VanDerWaalsContact OE1-CB 3.28Å; E557-A564 WeakPolarHBondContact OE1-CB 3.33Å; F562-A564 PolarHBondContact O-N 2.68Å
565	L	80.2	Confident	80.2	Confident	24 Å²	24	69.4 Å²	69.4	13%	0.126	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-83.6	147.9	177.9	-68.2	163.2	0	0	0	110.7	F343 R346 L347 S350 I570	F343-L565 HydrophobicContact CE2-CD1 4.12Å; R346-L565 HydrophobicContact CG-CD1 4.38Å; L347-L565 HydrophobicContact CD2-CD1 3.72Å; L347-L565 HydrophobicContact CG-CD1 4.47Å; S350-L565 PolarHBondContact OG-N 2.91Å; L565-I570 HydrophobicContact CB-CD1 4.14Å; L565-I570 HydrophobicContact CB-CG1 3.95Å
566	D	83.5	Confident	80.3	Confident	87 Å²	87	69 Å²	69	47%	0.465	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-66.5	144.1	175.2	-176.1	30.1	0	0	0	111.1	R568 L569 I570	D566-R568 PolarHBondContact O-N 3.27Å; D566-R568 VanDerWaalsContact O-N 3.15Å; D566-R568 WeakPolarHBondContact OD2-CB 3.39Å; D566-R568 WeakPolarHBondContact OD2-CG 3.36Å; D566-L569 HydrophobicContact CB-CD1 4.45Å; D566-L569 HydrophobicContact CB-CG 4.49Å; D566-L569 PolarHBondContact O-N 3.45Å; D566-L569 VanDerWaalsContact O-N 3.11Å; D566-I570 WeakPolarHBondContact O-CG1 3.4Å; D566-I570 PolarHBondContact O-N 3.27Å; D566-I570 VanDerWaalsContact O-N 3.11Å
567	M	83.6	Confident	80.4	Confident	50 Å²	50	64.5 Å²	64.5	25%	0.246	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-31	-178.8	-62.6	-179	75	0	0	112.1	R407 L408 R571	R407-M567 HydrophobicContact CB-CE 3.97Å; L408-M567 HydrophobicContact CD1-CB 4.42Å; L408-M567 HydrophobicContact CD1-CE 4.33Å; M567-R571 VanDerWaalsContact O-CG 3.29Å; M567-R571 WeakPolarHBondContact O-CG 3.37Å; M567-R571 PolarHBondContact O-N 3.1Å
568	R	80.9	Confident	80.6	Confident	194 Å²	194	66.7 Å²	66.7	73%	0.732	33%	0.333	S	S	*	.	H	α-helix	trans	-65.3	-45.8	177.7	-62.7	-179.7	-179.9	-175	2.1	111.6	D566 R571 A572	D566-R568 PolarHBondContact O-N 3.27Å; D566-R568 VanDerWaalsContact O-N 3.15Å; D566-R568 WeakPolarHBondContact OD2-CB 3.39Å; D566-R568 WeakPolarHBondContact OD2-CG 3.36Å; R568-R571 PolarHBondContact O-N 2.98Å; R568-A572 PolarHBondContact O-N 3.1Å
569	L	82.4	Confident	80.8	Confident	65 Å²	65	71.7 Å²	71.7	34%	0.34	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-44.6	177.7	-65.2	176.1	0	0	0	110.8	D566 R571 A572 Y573	D566-L569 HydrophobicContact CB-CD1 4.45Å; D566-L569 HydrophobicContact CB-CG 4.49Å; D566-L569 PolarHBondContact O-N 3.45Å; D566-L569 VanDerWaalsContact O-N 3.11Å; L569-R571 VanDerWaalsContact C-N 3.32Å; L569-R571 PolarHBondContact O-N 2.85Å; L569-A572 PolarHBondContact O-N 3.35Å; L569-Y573 WeakPolarHBondContact O-CB 3.47Å; L569-Y573 PolarHBondContact O-N 3.29Å
570	I	84.7	Confident	81.1	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-58.8	-44.7	177.1	-62.1	170.1	0	0	0	110.7	L347 L408 L565 D566 Y573 I574	L347-I570 HydrophobicContact CD2-CG1 4.26Å; L408-I570 HydrophobicContact CD1-CB 4.18Å; L408-I570 HydrophobicContact CD1-CG2 3.86Å; L408-I570 HydrophobicContact CD2-CG2 4.09Å; L408-I570 HydrophobicContact CG-CG2 4.4Å; L565-I570 HydrophobicContact CB-CD1 4.14Å; L565-I570 HydrophobicContact CB-CG1 3.95Å; D566-I570 WeakPolarHBondContact O-CG1 3.4Å; D566-I570 PolarHBondContact O-N 3.27Å; D566-I570 VanDerWaalsContact O-N 3.11Å; I570-Y573 PolarHBondContact O-N 3.32Å; I570-I574 HydrophobicContact CG2-CD1 3.66Å; I570-I574 HydrophobicContact CG2-CG1 4.35Å; I570-I574 VanDerWaalsContact O-CG1 3.26Å; I570-I574 WeakPolarHBondContact O-CG1 3.32Å; I570-I574 PolarHBondContact O-N 3.41Å
571	R	84.2	Confident	81.9	Confident	86 Å²	86	73.9 Å²	73.9	33%	0.325	34%	0.342	S	S	.	.	H	α-helix	trans	-63	-44.3	177.1	-75.8	175.3	-175.9	163.1	5.6	112.6	R407 L408 M567 R568 L569 Y573 I574 A575	R407-R571 PolarHBondContact O-NH2 3.46Å; L408-R571 HydrophobicContact CD1-CG 4.22Å; L408-R571 WeakPolarHBondContact O-CG 3.35Å; L408-R571 PolarHBondContact O-NE 3.43Å; M567-R571 VanDerWaalsContact O-CG 3.29Å; M567-R571 WeakPolarHBondContact O-CG 3.37Å; M567-R571 PolarHBondContact O-N 3.1Å; R568-R571 PolarHBondContact O-N 2.98Å; L569-R571 VanDerWaalsContact C-N 3.32Å; L569-R571 PolarHBondContact O-N 2.85Å; R571-Y573 VanDerWaalsContact C-N 3.3Å; R571-I574 PolarHBondContact O-N 2.82Å; R571-A575 WeakPolarHBondContact O-CB 3.46Å; R571-A575 PolarHBondContact O-N 2.89Å
572	A	80.7	Confident	82.9	Confident	41 Å²	41	64.4 Å²	64.4	34%	0.339	30%	0.301	S	S	.	.	H	α-helix	trans	-61.3	-42.9	177.3	0	0	0	0	0	110.9	R568 L569 A575 L576	R568-A572 PolarHBondContact O-N 3.1Å; L569-A572 PolarHBondContact O-N 3.35Å; A572-A575 PolarHBondContact O-N 2.89Å; A572-L576 PolarHBondContact O-N 3.2Å
573	Y	83.5	Confident	83.7	Confident	15 Å²	15	66.7 Å²	66.7	6%	0.059	32%	0.316	C	S	.	.	H	α-helix	trans	-63.5	-48.2	177.4	-170.6	-97.8	0	0	0	112.7	M338 F343 L347 L569 I570 R571 A575 L576 C577 L630 L632	M338-Y573 HydrophobicContact CG-CD2 4.29Å; M338-Y573 HydrophobicContact CG-CE2 4.07Å; M338-Y573 HydrophobicContact SD-CD2 3.37Å; M338-Y573 WeakPolarHBondContact SD-CD2 3.33Å; M338-Y573 HydrophobicContact SD-CE2 3.49Å; M338-Y573 WeakPolarHBondContact SD-CE2 3.25Å; M338-Y573 HydrophobicContact SD-CG 4.25Å; F343-Y573 HydrophobicContact CD1-CE1 4.46Å; F343-Y573 AromaticContact CE1-CD1 3.95Å; F343-Y573 HydrophobicContact CE1-CD1 3.95Å; F343-Y573 HydrophobicContact CE1-CD2 4.32Å; F343-Y573 AromaticContact CE1-CE1 3.39Å; F343-Y573 HydrophobicContact CE1-CE1 3.39Å; F343-Y573 AromaticContact CE1-CE2 3.79Å; F343-Y573 HydrophobicContact CE1-CE2 3.79Å; F343-Y573 HydrophobicContact CE1-CG 4.39Å; F343-Y573 AromaticContact CE1-CZ 3.29Å; F343-Y573 HydrophobicContact CZ-CD1 4.08Å; F343-Y573 HydrophobicContact CZ-CD2 4.08Å; F343-Y573 AromaticContact CZ-CE1 3.97Å; F343-Y573 HydrophobicContact CZ-CE1 3.97Å; F343-Y573 AromaticContact CZ-CE2 3.95Å; F343-Y573 HydrophobicContact CZ-CE2 3.95Å; F343-Y573 HydrophobicContact CZ-CG 4.15Å; F343-Y573 AromaticContact CZ-CZ 3.9Å; L347-Y573 HydrophobicContact CD1-CD1 4.03Å; L347-Y573 HydrophobicContact CD1-CE1 3.95Å; L569-Y573 WeakPolarHBondContact O-CB 3.47Å; L569-Y573 PolarHBondContact O-N 3.29Å; I570-Y573 PolarHBondContact O-N 3.32Å; R571-Y573 VanDerWaalsContact C-N 3.3Å; Y573-A575 VanDerWaalsContact C-N 3.26Å; Y573-A575 PolarHBondContact O-N 3.07Å; Y573-L576 WeakPolarHBondContact O-CB 3.43Å; Y573-L576 PolarHBondContact O-N 3.02Å; Y573-C577 WeakPolarHBondContact CE1-SG 3.27Å; Y573-C577 PolarHBondContact O-N 2.91Å; Y573-C577 PolarHBondContact O-SG 3.06Å; Y573-L630 HydrophobicContact CE1-CD2 4.35Å; Y573-L630 PolarHBondContact OH-O 2.66Å; Y573-L632 HydrophobicContact CE2-CD1 4.28Å
574	I	85.8	Confident	84.2	Confident	14 Å²	14	60.9 Å²	60.9	7%	0.072	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-40.1	176.7	-68.6	164.7	0	0	0	110.7	L369 V370 I570 R571 L576 C577 K578	L369-I574 HydrophobicContact CB-CD1 4.12Å; L369-I574 HydrophobicContact CD1-CD1 4.26Å; V370-I574 HydrophobicContact CG2-CG1 4.45Å; V370-I574 HydrophobicContact CG2-CG2 4.46Å; I570-I574 HydrophobicContact CG2-CD1 3.66Å; I570-I574 HydrophobicContact CG2-CG1 4.35Å; I570-I574 VanDerWaalsContact O-CG1 3.26Å; I570-I574 WeakPolarHBondContact O-CG1 3.32Å; I570-I574 PolarHBondContact O-N 3.41Å; R571-I574 PolarHBondContact O-N 2.82Å; I574-L576 VanDerWaalsContact C-N 3.3Å; I574-L576 PolarHBondContact O-N 3.15Å; I574-C577 PolarHBondContact O-N 3.18Å; I574-K578 HydrophobicContact CG2-CD 4.43Å; I574-K578 WeakPolarHBondContact O-CG 3.4Å; I574-K578 PolarHBondContact O-N 3Å
575	A	82.3	Confident	84.8	Confident	30 Å²	30	61.1 Å²	61.1	25%	0.248	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-34.7	176.9	0	0	0	0	0	112.4	R571 A572 Y573	R571-A575 WeakPolarHBondContact O-CB 3.46Å; R571-A575 PolarHBondContact O-N 2.89Å; A572-A575 PolarHBondContact O-N 2.89Å; Y573-A575 VanDerWaalsContact C-N 3.26Å; Y573-A575 PolarHBondContact O-N 3.07Å
576	L	84.2	Confident	85.2	Confident	59 Å²	59	68.1 Å²	68.1	31%	0.309	32%	0.324	S	S	.	.	H	α-helix	trans	-68.5	-46.2	174	-166.1	154.4	0	0	0	110.9	L330 A572 Y573 I574 K578 R579 L632	L330-L576 HydrophobicContact CD1-CD1 4.06Å; A572-L576 PolarHBondContact O-N 3.2Å; Y573-L576 WeakPolarHBondContact O-CB 3.43Å; Y573-L576 PolarHBondContact O-N 3.02Å; I574-L576 VanDerWaalsContact C-N 3.3Å; I574-L576 PolarHBondContact O-N 3.15Å; L576-K578 VanDerWaalsContact C-N 3.32Å; L576-K578 PolarHBondContact O-N 3.34Å; L576-R579 WeakPolarHBondContact O-CB 3.43Å; L576-R579 PolarHBondContact O-N 3.43Å; L576-R579 VanDerWaalsContact O-N 3.16Å; L576-L632 HydrophobicContact CD2-CD1 3.66Å; L576-L632 HydrophobicContact CD2-CD2 3.25Å; L576-L632 HydrophobicContact CD2-CG 4.09Å
577	C	85.4	Confident	85.4	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58	-41.3	177.7	-65.2	0	0	0	0	112.7	V370 Y573 I574 R579 K580 L632	V370-C577 HydrophobicContact CG1-CB 4.01Å; Y573-C577 WeakPolarHBondContact CE1-SG 3.27Å; Y573-C577 PolarHBondContact O-N 2.91Å; Y573-C577 PolarHBondContact O-SG 3.06Å; I574-C577 PolarHBondContact O-N 3.18Å; C577-R579 PolarHBondContact O-N 3.26Å; C577-R579 VanDerWaalsContact O-N 3.13Å; C577-K580 PolarHBondContact O-N 3.11Å; C577-K580 VanDerWaalsContact O-N 3.17Å; C577-L632 HydrophobicContact CB-CD2 4.38Å
578	K	84.4	Confident	85.7	Confident	93 Å²	93	69.2 Å²	69.2	40%	0.404	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.3	179.6	-80.1	-177	177.7	-174.3	0	114.3	L369 V370 I574 L576	L369-K578 WeakPolarHBondContact O-CE 3.41Å; L369-K578 PolarHBondContact O-NZ 3.5Å; V370-K578 VanDerWaalsContact O-CE 3.28Å; V370-K578 WeakPolarHBondContact O-CE 3.4Å; V370-K578 WeakPolarHBondContact O-CG 3.37Å; I574-K578 HydrophobicContact CG2-CD 4.43Å; I574-K578 WeakPolarHBondContact O-CG 3.4Å; I574-K578 PolarHBondContact O-N 3Å; L576-K578 VanDerWaalsContact C-N 3.32Å; L576-K578 PolarHBondContact O-N 3.34Å
579	R	84.2	Confident	85.9	Confident	136 Å²	136	62.9 Å²	62.9	51%	0.513	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-29.2	179.3	-67.5	173.2	164.7	-160.9	-18.7	112.9	L576 C577	L576-R579 WeakPolarHBondContact O-CB 3.43Å; L576-R579 PolarHBondContact O-N 3.43Å; L576-R579 VanDerWaalsContact O-N 3.16Å; C577-R579 PolarHBondContact O-N 3.26Å; C577-R579 VanDerWaalsContact O-N 3.13Å
580	K	84.4	Confident	86.3	Confident	69 Å²	69	67.7 Å²	67.7	30%	0.3	34%	0.337	S	S	.	.			trans	-76.9	139.9	-178.8	-70.7	-63.2	-163	173.2	0	110.6	C577 R629 E634	C577-K580 PolarHBondContact O-N 3.11Å; C577-K580 VanDerWaalsContact O-N 3.17Å; K580-R629 PolarHBondContact O-NE 3.17Å; K580-E634 IonicContact NZ-OE1 3.56Å; K580-E634 PolarHBondContact NZ-OE1 3.48Å
581	Q	88.4	Confident	86.5	Confident	138 Å²	138	71.7 Å²	71.7	65%	0.645	35%	0.352	S	S	*	.			trans	-122.8	86.4	178.7	-66.2	-176.5	1.4	0	0	108.6	V373	V373-Q581 HydrophobicContact CG1-CB 4.39Å; V373-Q581 HydrophobicContact CG1-CG 4.46Å
582	P	90.8	Very high	86.7	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-68.7	143.1	-178.6	25	-34.1	0	0	0	112.6	V373 R375 T625 A628 R629 E634 V636	V373-P582 HydrophobicContact CG2-CG 4.01Å; R375-P582 PolarHBondContact NH2-O 2.99Å; P582-T625 WeakPolarHBondContact CG-O 3.49Å; P582-A628 HydrophobicContact CB-CB 3.79Å; P582-A628 HydrophobicContact CG-CB 3.88Å; P582-R629 HydrophobicContact CG-CG 3.96Å; P582-E634 CarbonylContact C-O 3.47Å; P582-E634 VanDerWaalsContact CA-O 3.25Å; P582-E634 WeakPolarHBondContact CA-O 3.47Å; P582-V636 HydrophobicContact CB-CG2 4.33Å
583	N	88.8	Confident	87.1	Confident	100 Å²	100	70.1 Å²	70.1	54%	0.535	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-94.3	149.9	172.9	-69.5	-26	0	0	0	110.5	E634 M635 V636	N583-E634 PolarHBondContact N-O 3.32Å; N583-M635 HydrophobicContact CB-SD 3.96Å; N583-V636 PolarHBondContact O-N 3.3Å
584	I	87.4	Confident	87.4	Confident	48 Å²	48	71 Å²	71	25%	0.246	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-97.5	119.3	177	-62.9	157.1	0	0	0	106.2	L592 L621 T625 V636	I584-L592 HydrophobicContact CG2-CD1 4.42Å; I584-L621 HydrophobicContact CD1-CD2 3.76Å; I584-T625 HydrophobicContact CD1-CG2 4.28Å; I584-T625 HydrophobicContact CG1-CG2 4.28Å; I584-V636 HydrophobicContact CG1-CG2 4.08Å
585	P	90.3	Very high	87.3	Confident	32 Å²	32	71 Å²	71	21%	0.208	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-68.4	147.4	176.5	28.7	-34.7	0	0	0	111.2	N587 L588 V636	P585-N587 VanDerWaalsContact C-N 3.25Å; P585-N587 PolarHBondContact O-N 2.81Å; P585-L588 HydrophobicContact CG-CB 4.43Å; P585-L588 HydrophobicContact CG-CD1 3.6Å; P585-L588 HydrophobicContact CG-CG 3.83Å; P585-L588 PolarHBondContact O-N 3.22Å; P585-V636 WeakPolarHBondContact CD-O 3.5Å; P585-V636 WeakPolarHBondContact CG-O 3.48Å
586	E	88.1	Confident	87.5	Confident	171 Å²	171	70.8 Å²	70.8	80%	0.799	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-32	-178.1	-65.8	-176.5	171.4	0	0	112.4	L588 S589	E586-L588 PolarHBondContact O-N 2.67Å; E586-L588 VanDerWaalsContact O-N 3.16Å; E586-S589 VanDerWaalsContact O-CB 3.24Å; E586-S589 WeakPolarHBondContact O-CB 3.29Å; E586-S589 PolarHBondContact O-N 2.76Å; E586-S589 PolarHBondContact O-OG 3.03Å
587	N	89.2	Confident	87.7	Confident	146 Å²	146	72 Å²	72	78%	0.781	36%	0.364	S	S	*	.	H	α-helix	trans	-57.7	-30.7	179.1	-59.3	-2	0	0	0	113.2	P585 S589	P585-N587 VanDerWaalsContact C-N 3.25Å; P585-N587 PolarHBondContact O-N 2.81Å; N587-S589 VanDerWaalsContact C-N 3.3Å
588	L	88.4	Confident	87.8	Confident	15 Å²	15	78 Å²	78	8%	0.079	39%	0.392	C	S	.	.	H	α-helix	trans	-81.5	-9.7	179.9	-66	179	0	0	0	113.2	P585 E586 E590 Y591 L592 V636 E638 V641	P585-L588 HydrophobicContact CG-CB 4.43Å; P585-L588 HydrophobicContact CG-CD1 3.6Å; P585-L588 HydrophobicContact CG-CG 3.83Å; P585-L588 PolarHBondContact O-N 3.22Å; E586-L588 PolarHBondContact O-N 2.67Å; E586-L588 VanDerWaalsContact O-N 3.16Å; L588-E590 PolarHBondContact O-N 3.26Å; L588-Y591 PolarHBondContact O-N 3.29Å; L588-L592 HydrophobicContact CB-CD1 4.45Å; L588-L592 WeakPolarHBondContact O-CB 3.46Å; L588-L592 WeakPolarHBondContact O-CD1 3.5Å; L588-L592 VanDerWaalsContact O-CG 3.25Å; L588-L592 WeakPolarHBondContact O-CG 3.41Å; L588-L592 PolarHBondContact O-N 3.43Å; L588-V636 HydrophobicContact CD1-CB 4.48Å; L588-V636 HydrophobicContact CD1-CG1 4.18Å; L588-V636 WeakPolarHBondContact CD1-O 3.47Å; L588-E638 HydrophobicContact CD2-CB 3.75Å; L588-E638 HydrophobicContact CD2-CG 4.08Å; L588-V641 HydrophobicContact CD1-CG2 4.27Å
589	S	87	Confident	87.7	Confident	61 Å²	61	73.9 Å²	73.9	43%	0.427	37%	0.374	S	S	.	.	H	α-helix	trans	-63.7	-42.8	-177	65.2	0	0	0	0	112.2	E586 N587 L592 V593	E586-S589 VanDerWaalsContact O-CB 3.24Å; E586-S589 WeakPolarHBondContact O-CB 3.29Å; E586-S589 PolarHBondContact O-N 2.76Å; E586-S589 PolarHBondContact O-OG 3.03Å; N587-S589 VanDerWaalsContact C-N 3.3Å; S589-L592 PolarHBondContact O-N 3.29Å; S589-V593 VanDerWaalsContact O-CG2 3.25Å; S589-V593 WeakPolarHBondContact O-CG2 3.35Å; S589-V593 PolarHBondContact O-N 3.33Å
590	E	89.1	Confident	87.6	Confident	165 Å²	165	74 Å²	74	77%	0.771	38%	0.375	S	S	*	.	H	α-helix	trans	-64.5	-43.2	176.7	-64.7	-173.4	171.8	0	0	111.2	L588 V593 G594	L588-E590 PolarHBondContact O-N 3.26Å; E590-V593 PolarHBondContact O-N 2.86Å; E590-G594 PolarHBondContact O-N 3.08Å
591	Y	89	Confident	87.7	Confident	87 Å²	87	80.5 Å²	80.5	34%	0.341	40%	0.398	S	S	.	.	H	α-helix	trans	-60.8	-50.2	177.2	-173.4	-102	0	0	0	111.7	L588 V593 G594 T595 E638 V641 V642	L588-Y591 PolarHBondContact O-N 3.29Å; Y591-V593 VanDerWaalsContact C-N 3.28Å; Y591-V593 PolarHBondContact O-N 3.35Å; Y591-G594 PolarHBondContact O-N 2.65Å; Y591-G594 VanDerWaalsContact O-N 3.1Å; Y591-T595 PolarHBondContact O-N 3.39Å; Y591-T595 PolarHBondContact O-OG1 2.92Å; Y591-E638 HydrophobicContact CD1-CG 4.34Å; Y591-E638 HydrophobicContact CE1-CG 4.19Å; Y591-V641 HydrophobicContact CD1-CB 4.44Å; Y591-V641 HydrophobicContact CD1-CG1 3.95Å; Y591-V641 HydrophobicContact CE1-CB 4.3Å; Y591-V641 HydrophobicContact CE1-CG1 3.88Å; Y591-V642 HydrophobicContact CE1-CG2 4.35Å; Y591-V642 WeakPolarHBondContact OH-CG2 3.48Å
592	L	88.8	Confident	87.3	Confident	12 Å²	12	78.4 Å²	78.4	6%	0.063	39%	0.388	C	S	.	.	H	α-helix	trans	-57.6	-39.5	177.2	-75.8	164.1	0	0	0	112.7	I584 L588 S589 Y596 L617 I620 L621 V641	I584-L592 HydrophobicContact CG2-CD1 4.42Å; L588-L592 HydrophobicContact CB-CD1 4.45Å; L588-L592 WeakPolarHBondContact O-CB 3.46Å; L588-L592 WeakPolarHBondContact O-CD1 3.5Å; L588-L592 VanDerWaalsContact O-CG 3.25Å; L588-L592 WeakPolarHBondContact O-CG 3.41Å; L588-L592 PolarHBondContact O-N 3.43Å; S589-L592 PolarHBondContact O-N 3.29Å; L592-Y596 VanDerWaalsContact O-CB 3.32Å; L592-Y596 WeakPolarHBondContact O-CB 3.32Å; L592-Y596 PolarHBondContact O-N 3.43Å; L592-L617 HydrophobicContact CB-CD1 4.49Å; L592-I620 HydrophobicContact CD2-CG2 3.82Å; L592-L621 HydrophobicContact CD1-CD2 3.54Å; L592-L621 HydrophobicContact CD2-CD2 4.22Å; L592-V641 HydrophobicContact CD2-CB 4.43Å; L592-V641 HydrophobicContact CD2-CG1 3.43Å; L592-V641 VanDerWaalsContact CD2-CG1 3.43Å; L592-V641 HydrophobicContact CD2-CG2 4.08Å; L592-V641 HydrophobicContact CG-CG1 4.23Å
593	V	89.5	Confident	86.6	Confident	82 Å²	82	79.3 Å²	79.3	50%	0.497	40%	0.395	S	S	.	.	H	α-helix	trans	-68.5	-44.6	176.4	172.3	0	0	0	0	110.5	S589 E590 Y591 Y596 V597	S589-V593 VanDerWaalsContact O-CG2 3.25Å; S589-V593 WeakPolarHBondContact O-CG2 3.35Å; S589-V593 PolarHBondContact O-N 3.33Å; E590-V593 PolarHBondContact O-N 2.86Å; Y591-V593 VanDerWaalsContact C-N 3.28Å; Y591-V593 PolarHBondContact O-N 3.35Å; V593-Y596 PolarHBondContact O-N 3.48Å; V593-V597 HydrophobicContact CG1-CG2 4.42Å; V593-V597 VanDerWaalsContact O-CG2 3.29Å; V593-V597 WeakPolarHBondContact O-CG2 3.31Å; V593-V597 PolarHBondContact O-N 2.82Å
594	G	89.7	Confident	86.1	Confident	33 Å²	33	83.8 Å²	83.8	34%	0.34	41%	0.41	S	S	.	.	H	α-helix	trans	-54.7	-54.4	175.2	0	0	0	0	0	111.9	E590 Y591 Y596 V597 E598	E590-G594 PolarHBondContact O-N 3.08Å; Y591-G594 PolarHBondContact O-N 2.65Å; Y591-G594 VanDerWaalsContact O-N 3.1Å; G594-Y596 VanDerWaalsContact C-N 3.31Å; G594-Y596 PolarHBondContact O-N 3.28Å; G594-V597 PolarHBondContact O-N 3.11Å; G594-V597 VanDerWaalsContact O-N 3.1Å; G594-E598 WeakPolarHBondContact O-CG 3.35Å; G594-E598 PolarHBondContact O-N 3.25Å
595	T	84.5	Confident	85.4	Confident	15 Å²	15	84.4 Å²	84.4	9%	0.092	43%	0.428	C	S	.	.	H	α-helix	trans	-61.8	-38.1	179.5	-43.6	0	0	0	0	112.2	Y591 E598 L599 C645	Y591-T595 PolarHBondContact O-N 3.39Å; Y591-T595 PolarHBondContact O-OG1 2.92Å; T595-E598 PolarHBondContact O-N 3.13Å; T595-L599 HydrophobicContact CG2-CD1 4.33Å; T595-L599 WeakPolarHBondContact O-CB 3.19Å; T595-L599 VanDerWaalsContact O-CG 3.3Å; T595-L599 WeakPolarHBondContact O-CG 3.5Å; T595-L599 PolarHBondContact O-N 3.22Å; T595-C645 HydrophobicContact CG2-CB 4.26Å; T595-C645 WeakPolarHBondContact CG2-SG 3.46Å
596	Y	86.8	Confident	84.5	Confident	25 Å²	25	86.4 Å²	86.4	10%	0.098	44%	0.437	C	S	.	.	H	α-helix	trans	-64.4	-40	175.4	173.2	-104.8	0	0	0	112.7	L592 V593 G594 R600 P614 T616 L617	L592-Y596 VanDerWaalsContact O-CB 3.32Å; L592-Y596 WeakPolarHBondContact O-CB 3.32Å; L592-Y596 PolarHBondContact O-N 3.43Å; V593-Y596 PolarHBondContact O-N 3.48Å; G594-Y596 VanDerWaalsContact C-N 3.31Å; G594-Y596 PolarHBondContact O-N 3.28Å; Y596-R600 WeakPolarHBondContact O-CB 3.32Å; Y596-R600 PolarHBondContact O-N 3.41Å; Y596-P614 WeakPolarHBondContact OH-CA 3.2Å; Y596-T616 WeakPolarHBondContact CE2-OG1 3.3Å; Y596-L617 HydrophobicContact CD2-CB 3.9Å; Y596-L617 HydrophobicContact CE2-CB 4.22Å; Y596-L617 HydrophobicContact CG-CB 4.31Å; Y596-L617 HydrophobicContact CG-CD1 4.39Å
597	V	88.5	Confident	83.3	Confident	84 Å²	84	88.2 Å²	88.2	51%	0.509	44%	0.442	S	S	.	.	H	α-helix	trans	-65.1	-42	177.3	170.7	0	0	0	0	110.6	V593 G594 R600 R601	V593-V597 HydrophobicContact CG1-CG2 4.42Å; V593-V597 VanDerWaalsContact O-CG2 3.29Å; V593-V597 WeakPolarHBondContact O-CG2 3.31Å; V593-V597 PolarHBondContact O-N 2.82Å; G594-V597 PolarHBondContact O-N 3.11Å; G594-V597 VanDerWaalsContact O-N 3.1Å; V597-R600 PolarHBondContact O-N 3.22Å; V597-R601 WeakPolarHBondContact O-CB 3.45Å; V597-R601 PolarHBondContact O-N 2.88Å
598	E	86	Confident	82	Confident	127 Å²	127	86.9 Å²	86.9	59%	0.593	44%	0.435	S	S	*	.	H	α-helix	trans	-61.2	-51.3	175.3	-70.7	176.8	167.9	0	0	111.5	G594 T595 R600 R601 E602	G594-E598 WeakPolarHBondContact O-CG 3.35Å; G594-E598 PolarHBondContact O-N 3.25Å; T595-E598 PolarHBondContact O-N 3.13Å; E598-R600 PolarHBondContact O-N 3.5Å; E598-R600 VanDerWaalsContact O-N 3.15Å; E598-R601 WeakPolarHBondContact O-CA 3.5Å; E598-R601 WeakPolarHBondContact O-CB 3.38Å; E598-R601 PolarHBondContact O-N 3.01Å; E598-E602 PolarHBondContact O-N 3.45Å
599	L	82.7	Confident	80.7	Confident	5 Å²	5	88.3 Å²	88.3	3%	0.026	45%	0.449	C	S	.	.	H	α-helix	trans	-56.5	-34.5	176.6	-74.5	169.8	0	0	0	112.8	T595 A603 I620 E649	T595-L599 HydrophobicContact CG2-CD1 4.33Å; T595-L599 WeakPolarHBondContact O-CB 3.19Å; T595-L599 VanDerWaalsContact O-CG 3.3Å; T595-L599 WeakPolarHBondContact O-CG 3.5Å; T595-L599 PolarHBondContact O-N 3.22Å; L599-A603 WeakPolarHBondContact O-CB 3.26Å; L599-A603 PolarHBondContact O-N 2.86Å; L599-I620 HydrophobicContact CD1-CD1 3.84Å; L599-E649 HydrophobicContact CD2-CG 4.02Å
600	R	83.1	Confident	79.7	Confident	139 Å²	139	87.5 Å²	87.5	53%	0.525	44%	0.442	S	S	.	.	H	α-helix	trans	-77.2	-34.7	177.1	-168	172.5	-175.5	179.8	-0.8	112.2	Y596 V597 E598 A603 K604	Y596-R600 WeakPolarHBondContact O-CB 3.32Å; Y596-R600 PolarHBondContact O-N 3.41Å; V597-R600 PolarHBondContact O-N 3.22Å; E598-R600 PolarHBondContact O-N 3.5Å; E598-R600 VanDerWaalsContact O-N 3.15Å; R600-A603 PolarHBondContact O-N 3.42Å; R600-K604 PolarHBondContact O-N 3.36Å; R600-K604 VanDerWaalsContact O-N 3.13Å
601	R	85.6	Confident	78.7	Confident	206 Å²	206	87.9 Å²	87.9	78%	0.777	44%	0.437	S	S	*	.	H	α-helix	trans	-64.4	-44.4	174.8	-173.1	179.2	-178.4	176.2	-0	110.6	V597 E598 K604 G605	V597-R601 WeakPolarHBondContact O-CB 3.45Å; V597-R601 PolarHBondContact O-N 2.88Å; E598-R601 WeakPolarHBondContact O-CA 3.5Å; E598-R601 WeakPolarHBondContact O-CB 3.38Å; E598-R601 PolarHBondContact O-N 3.01Å; R601-K604 PolarHBondContact O-N 3.07Å; R601-G605 PolarHBondContact O-N 2.73Å
602	E	79.9	Confident	78.1	Confident	94 Å²	94	84.8 Å²	84.8	44%	0.439	43%	0.427	S	S	.	.	H	α-helix	trans	-62.2	-43	175.9	-68.2	-166.1	164.8	0	0	112.7	E598 K604 G605 N606 R656	E598-E602 PolarHBondContact O-N 3.45Å; E602-K604 PolarHBondContact O-N 3.22Å; E602-G605 PolarHBondContact O-N 2.85Å; E602-G605 VanDerWaalsContact O-N 3.12Å; E602-N606 PolarHBondContact O-N 2.76Å; E602-R656 IonicContact OE2-NH2 2.7Å
603	A	76.4	Confident	77.6	Confident	19 Å²	19	84.6 Å²	84.6	16%	0.157	43%	0.427	C	S	.	.	H	α-helix	trans	-63.4	-31.5	177.5	0	0	0	0	0	112.4	L599 R600 A609 T612	L599-A603 WeakPolarHBondContact O-CB 3.26Å; L599-A603 PolarHBondContact O-N 2.86Å; R600-A603 PolarHBondContact O-N 3.42Å; A603-A609 HydrophobicContact CB-CB 4.35Å; A603-T612 HydrophobicContact CB-CG2 3.51Å; A603-T612 WeakPolarHBondContact CB-OG1 3.41Å
604	K	78.1	Confident	77.3	Confident	193 Å²	193	84.8 Å²	84.8	84%	0.839	43%	0.43	S	S	*	.	H	α-helix	trans	-72.6	-30.8	175.1	-166.7	179.1	179.5	-175.3	0	112.5	R600 R601 E602	R600-K604 PolarHBondContact O-N 3.36Å; R600-K604 VanDerWaalsContact O-N 3.13Å; R601-K604 PolarHBondContact O-N 3.07Å; E602-K604 PolarHBondContact O-N 3.22Å
605	G	73.3	Confident	77.1	Confident	61 Å²	61	87 Å²	87	63%	0.629	43%	0.428	S	S	*	.	H	α-helix	trans	-71.5	-32.2	179	0	0	0	0	0	113.5	R601 E602	R601-G605 PolarHBondContact O-N 2.73Å; E602-G605 PolarHBondContact O-N 2.85Å; E602-G605 VanDerWaalsContact O-N 3.12Å
606	N	70.5	Confident	77.2	Confident	74 Å²	74	87.4 Å²	87.4	40%	0.396	43%	0.431	S	S	.	.			trans	-104.1	113.4	-176.5	-76.4	-26.3	0	0	0	111.6	E602 D608 A609	E602-N606 PolarHBondContact O-N 2.76Å; N606-D608 PolarHBondContact O-N 3.24Å; N606-A609 HydrophobicContact CB-CB 3.84Å; N606-A609 WeakPolarHBondContact O-CB 3.34Å; N606-A609 PolarHBondContact O-N 2.88Å; N606-A609 VanDerWaalsContact O-N 3.09Å
607	K	62.9	Low	77.3	Confident	210 Å²	210	88.5 Å²	88.5	91%	0.913	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.8	175.7	-68	-175.7	179.7	179.8	0	113.5
608	D	61.5	Low	77.4	Confident	117 Å²	117	87.8 Å²	87.8	63%	0.626	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-1.9	179.9	-57.9	-33.1	0	0	0	113	N606	N606-D608 PolarHBondContact O-N 3.24Å
609	A	62.9	Low	77.5	Confident	45 Å²	45	81.8 Å²	81.8	37%	0.372	40%	0.403	S	S	.	.	S	Bend	trans	-73.7	141.3	178.9	0	0	0	0	0	111.1	A603 N606	A603-A609 HydrophobicContact CB-CB 4.35Å; N606-A609 HydrophobicContact CB-CB 3.84Å; N606-A609 WeakPolarHBondContact O-CB 3.34Å; N606-A609 PolarHBondContact O-N 2.88Å; N606-A609 VanDerWaalsContact O-N 3.09Å
610	T	65.6	Low	78	Confident	44 Å²	44	81.6 Å²	81.6	27%	0.27	40%	0.402	S	S	.	.			trans	-60.7	149.8	174.9	45.4	0	0	0	0	111.5	V512 T612 L655	V512-T610 HydrophobicContact CG1-CG2 4.08Å; T610-T612 PolarHBondContact O-N 2.82Å; T610-L655 HydrophobicContact CG2-CD1 3.54Å
611	Y	68.2	Low	78.3	Confident	174 Å²	174	77.1 Å²	77.1	68%	0.682	39%	0.388	S	S	*	.			trans	-59.6	103.8	178.3	-176.5	-96.9	0	0	0	111.4	S613	Y611-S613 PolarHBondContact O-N 3.33Å
612	T	75.4	Confident	78.6	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.129	36%	0.355	C	S	.	.			trans	-80.2	105.9	174.8	55	0	0	0	0	110.3	A603 T610	A603-T612 HydrophobicContact CB-CG2 3.51Å; A603-T612 WeakPolarHBondContact CB-OG1 3.41Å; T610-T612 PolarHBondContact O-N 2.82Å
613	S	78.6	Confident	79.3	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.063	33%	0.334	C	S	.	.			trans	-93.4	163.5	176.9	74.2	0	0	0	0	111.8	Y611 R615 T616	Y611-S613 PolarHBondContact O-N 3.33Å; S613-R615 PolarHBondContact O-N 2.77Å; S613-R615 WeakPolarHBondContact OG-CB 3.3Å; S613-R615 PolarHBondContact OG-N 3.15Å; S613-T616 WeakPolarHBondContact O-CG2 3.3Å; S613-T616 PolarHBondContact O-N 3.2Å; S613-T616 PolarHBondContact O-OG1 3.08Å
614	P	83.8	Confident	80	Confident	85 Å²	85	63.1 Å²	63.1	55%	0.552	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.3	170.3	-25.1	35.1	0	0	0	114.1	Y596 T616 L617	Y596-P614 WeakPolarHBondContact OH-CA 3.2Å; P614-T616 PolarHBondContact O-N 3.16Å; P614-L617 WeakPolarHBondContact O-CB 3.46Å; P614-L617 PolarHBondContact O-N 2.74Å
615	R	85.9	Confident	80.7	Confident	80 Å²	80	54.3 Å²	54.3	30%	0.302	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-22.6	174	-62.8	-177.7	170.2	116.5	1.9	112.6	E474 S524 S613 L617 L618 A619	E474-R615 IonicContact OE1-CZ 2.99Å; E474-R615 IonicContact OE1-NE 2.76Å; E474-R615 IonicContact OE1-NH2 3.71Å; E474-R615 PolarHBondContact OE1-NH2 2.95Å; E474-R615 IonicContact OE2-CZ 3.11Å; E474-R615 IonicContact OE2-NE 3.17Å; E474-R615 IonicContact OE2-NH2 3.77Å; E474-R615 PolarHBondContact OE2-NH2 3.26Å; E474-R615 VanDerWaalsContact OE2-NH2 3.11Å; S524-R615 WeakPolarHBondContact O-CD 3.5Å; S524-R615 PolarHBondContact OG-NH1 3.03Å; S613-R615 PolarHBondContact O-N 2.77Å; S613-R615 WeakPolarHBondContact OG-CB 3.3Å; S613-R615 PolarHBondContact OG-N 3.15Å; R615-L617 VanDerWaalsContact C-N 3.28Å; R615-L617 PolarHBondContact O-N 2.95Å; R615-L618 WeakPolarHBondContact O-CB 3.29Å; R615-L618 PolarHBondContact O-N 2.68Å; R615-L618 VanDerWaalsContact O-N 3.15Å; R615-A619 PolarHBondContact O-N 3.49Å
616	T	86.2	Confident	81.6	Confident	24 Å²	24	51.4 Å²	51.4	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-65.7	-33.6	175.8	64.4	0	0	0	0	111.7	Y596 S613 P614 L618 A619 I620	Y596-T616 WeakPolarHBondContact CE2-OG1 3.3Å; S613-T616 WeakPolarHBondContact O-CG2 3.3Å; S613-T616 PolarHBondContact O-N 3.2Å; S613-T616 PolarHBondContact O-OG1 3.08Å; P614-T616 PolarHBondContact O-N 3.16Å; T616-L618 VanDerWaalsContact C-N 3.33Å; T616-A619 WeakPolarHBondContact O-CB 3.42Å; T616-A619 PolarHBondContact O-N 3.23Å; T616-I620 WeakPolarHBondContact O-CG1 3.49Å; T616-I620 PolarHBondContact O-N 3.06Å
617	L	89.3	Confident	82.7	Confident	47 Å²	47	48.4 Å²	48.4	25%	0.246	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-43.4	172.5	179.2	65	0	0	0	110.6	L592 Y596 P614 R615 A619 I620 L621	L592-L617 HydrophobicContact CB-CD1 4.49Å; Y596-L617 HydrophobicContact CD2-CB 3.9Å; Y596-L617 HydrophobicContact CE2-CB 4.22Å; Y596-L617 HydrophobicContact CG-CB 4.31Å; Y596-L617 HydrophobicContact CG-CD1 4.39Å; P614-L617 WeakPolarHBondContact O-CB 3.46Å; P614-L617 PolarHBondContact O-N 2.74Å; R615-L617 VanDerWaalsContact C-N 3.28Å; R615-L617 PolarHBondContact O-N 2.95Å; L617-A619 VanDerWaalsContact C-N 3.28Å; L617-A619 PolarHBondContact O-N 3.43Å; L617-I620 PolarHBondContact O-N 3.45Å; L617-L621 WeakPolarHBondContact O-CG 3.44Å; L617-L621 PolarHBondContact O-N 3.31Å
618	L	89.1	Confident	84	Confident	69 Å²	69	38.4 Å²	38.4	36%	0.361	20%	0.2	S	C	.	.	H	α-helix	trans	-63.7	-34.6	174.7	-61.6	176.7	0	0	0	112	R615 T616 L621 R622	R615-L618 WeakPolarHBondContact O-CB 3.29Å; R615-L618 PolarHBondContact O-N 2.68Å; R615-L618 VanDerWaalsContact O-N 3.15Å; T616-L618 VanDerWaalsContact C-N 3.33Å; L618-L621 HydrophobicContact CD2-CD1 4.44Å; L618-L621 PolarHBondContact O-N 2.95Å; L618-R622 WeakPolarHBondContact O-CG 3.39Å; L618-R622 PolarHBondContact O-N 2.97Å
619	A	89.4	Confident	85.4	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-46.8	175.3	0	0	0	0	0	111.6	D527 R615 T616 L617 L621 R622 L623 M648	D527-A619 HydrophobicContact CB-CB 3.75Å; R615-A619 PolarHBondContact O-N 3.49Å; T616-A619 WeakPolarHBondContact O-CB 3.42Å; T616-A619 PolarHBondContact O-N 3.23Å; L617-A619 VanDerWaalsContact C-N 3.28Å; L617-A619 PolarHBondContact O-N 3.43Å; A619-L621 VanDerWaalsContact C-N 3.33Å; A619-L621 PolarHBondContact O-N 3.3Å; A619-R622 PolarHBondContact O-N 3.41Å; A619-L623 WeakPolarHBondContact O-CG 3.36Å; A619-L623 PolarHBondContact O-N 2.91Å; A619-M648 HydrophobicContact CB-CE 4Å
620	I	91.6	Very high	86.6	Confident	1 Å²	1	32 Å²	32	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-57.5	-48.6	175.1	-65.7	165.3	0	0	0	109.7	L592 L599 T616 L617 R622 L623 S624 V641 A644	L592-I620 HydrophobicContact CD2-CG2 3.82Å; L599-I620 HydrophobicContact CD1-CD1 3.84Å; T616-I620 WeakPolarHBondContact O-CG1 3.49Å; T616-I620 PolarHBondContact O-N 3.06Å; L617-I620 PolarHBondContact O-N 3.45Å; I620-R622 VanDerWaalsContact C-N 3.34Å; I620-R622 PolarHBondContact O-N 3.02Å; I620-L623 PolarHBondContact O-N 2.87Å; I620-S624 PolarHBondContact O-N 3.31Å; I620-S624 PolarHBondContact O-OG 3.31Å; I620-V641 HydrophobicContact CG2-CG1 4.33Å; I620-A644 HydrophobicContact CG2-CB 4.4Å
621	L	91.1	Very high	87.6	Confident	46 Å²	46	34.8 Å²	34.8	24%	0.241	16%	0.164	C	C	.	.	H	α-helix	trans	-56.5	-44.9	177	-72.6	178.8	0	0	0	112.9	I584 L592 L617 L618 A619 T625	I584-L621 HydrophobicContact CD1-CD2 3.76Å; L592-L621 HydrophobicContact CD1-CD2 3.54Å; L592-L621 HydrophobicContact CD2-CD2 4.22Å; L617-L621 WeakPolarHBondContact O-CG 3.44Å; L617-L621 PolarHBondContact O-N 3.31Å; L618-L621 HydrophobicContact CD2-CD1 4.44Å; L618-L621 PolarHBondContact O-N 2.95Å; A619-L621 VanDerWaalsContact C-N 3.33Å; A619-L621 PolarHBondContact O-N 3.3Å; L621-T625 WeakPolarHBondContact O-CG2 3.49Å; L621-T625 PolarHBondContact O-N 2.98Å; L621-T625 PolarHBondContact O-OG1 3.11Å
622	R	91.8	Very high	88.5	Confident	22 Å²	22	29.2 Å²	29.2	8%	0.083	15%	0.146	C	C	.	.	H	α-helix	trans	-63.8	-45.4	177.5	-72.9	175.8	-164.6	133.1	11	111.8	R383 I386 D527 L618 A619 I620 T625 A626	R383-R622 VanDerWaalsContact CG-CZ 3.47Å; R383-R622 VanDerWaalsContact NE-CZ 3.26Å; R383-R622 PolarHBondContact O-NE 3.1Å; I386-R622 HydrophobicContact CG1-CB 4.27Å; D527-R622 IonicContact OD1-NH1 3.15Å; D527-R622 PolarHBondContact OD1-NH1 3.33Å; D527-R622 IonicContact OD2-NH1 2.94Å; D527-R622 PolarHBondContact OD2-NH1 3.04Å; L618-R622 WeakPolarHBondContact O-CG 3.39Å; L618-R622 PolarHBondContact O-N 2.97Å; A619-R622 PolarHBondContact O-N 3.41Å; I620-R622 VanDerWaalsContact C-N 3.34Å; I620-R622 PolarHBondContact O-N 3.02Å; R622-T625 PolarHBondContact O-N 3.13Å; R622-T625 PolarHBondContact O-OG1 2.77Å; R622-A626 WeakPolarHBondContact O-CB 3.47Å; R622-A626 PolarHBondContact O-N 2.93Å
623	L	92.9	Very high	89	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.9	-45.7	178.7	-69.8	168.8	0	0	0	111.3	L367 I386 L528 A619 I620 T625 A626 L627 A644 M648	L367-L623 HydrophobicContact CB-CD2 4.3Å; L367-L623 HydrophobicContact CD1-CD2 3.85Å; I386-L623 HydrophobicContact CD1-CD2 4Å; I386-L623 HydrophobicContact CG2-CD2 4.37Å; L528-L623 HydrophobicContact CD1-CD1 4.2Å; L528-L623 HydrophobicContact CD1-CD2 3.96Å; L528-L623 HydrophobicContact CD2-CD1 3.99Å; L528-L623 HydrophobicContact CG-CD1 4.2Å; A619-L623 WeakPolarHBondContact O-CG 3.36Å; A619-L623 PolarHBondContact O-N 2.91Å; I620-L623 PolarHBondContact O-N 2.87Å; L623-T625 VanDerWaalsContact C-N 3.35Å; L623-T625 PolarHBondContact O-N 2.8Å; L623-A626 WeakPolarHBondContact O-CB 3.19Å; L623-A626 PolarHBondContact O-N 3.04Å; L623-A626 VanDerWaalsContact O-N 3.08Å; L623-L627 PolarHBondContact O-N 3.22Å; L623-A644 HydrophobicContact CB-CB 3.79Å; L623-M648 HydrophobicContact CD1-CE 4.47Å
624	S	92.7	Very high	89.5	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-62.6	-40.2	176.4	-53.9	0	0	0	0	112	I620 A626 L627 A628 D640	I620-S624 PolarHBondContact O-N 3.31Å; I620-S624 PolarHBondContact O-OG 3.31Å; S624-A626 VanDerWaalsContact C-N 3.31Å; S624-A626 PolarHBondContact O-N 2.98Å; S624-L627 PolarHBondContact O-N 2.95Å; S624-A628 WeakPolarHBondContact O-CB 3.43Å; S624-A628 PolarHBondContact O-N 3.26Å; S624-D640 PolarHBondContact OG-O 3.33Å
625	T	93	Very high	89.9	Confident	7 Å²	7	35.8 Å²	35.8	4%	0.043	17%	0.171	C	C	.	.	H	α-helix	trans	-67.3	-31	173.6	62.5	0	0	0	0	113.2	G372 V373 P582 I584 L621 R622 L623 R629 V636	G372-T625 WeakPolarHBondContact CA-OG1 3.45Å; V373-T625 HydrophobicContact CG2-CG2 4.45Å; V373-T625 PolarHBondContact N-OG1 2.94Å; P582-T625 WeakPolarHBondContact CG-O 3.49Å; I584-T625 HydrophobicContact CD1-CG2 4.28Å; I584-T625 HydrophobicContact CG1-CG2 4.28Å; L621-T625 WeakPolarHBondContact O-CG2 3.49Å; L621-T625 PolarHBondContact O-N 2.98Å; L621-T625 PolarHBondContact O-OG1 3.11Å; R622-T625 PolarHBondContact O-N 3.13Å; R622-T625 PolarHBondContact O-OG1 2.77Å; L623-T625 VanDerWaalsContact C-N 3.35Å; L623-T625 PolarHBondContact O-N 2.8Å; T625-R629 WeakPolarHBondContact O-CG 3.31Å; T625-R629 PolarHBondContact O-N 3.32Å; T625-R629 VanDerWaalsContact O-N 3.1Å; T625-V636 HydrophobicContact CG2-CG2 4.28Å
626	A	92.1	Very high	90.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-72.1	-37.9	175.5	0	0	0	0	0	111.7	L367 I386 R622 L623 S624 R629 L630	L367-A626 HydrophobicContact CB-CB 4.47Å; L367-A626 HydrophobicContact CD2-CB 3.98Å; I386-A626 HydrophobicContact CD1-CB 3.96Å; R622-A626 WeakPolarHBondContact O-CB 3.47Å; R622-A626 PolarHBondContact O-N 2.93Å; L623-A626 WeakPolarHBondContact O-CB 3.19Å; L623-A626 PolarHBondContact O-N 3.04Å; L623-A626 VanDerWaalsContact O-N 3.08Å; S624-A626 VanDerWaalsContact C-N 3.31Å; S624-A626 PolarHBondContact O-N 2.98Å; A626-R629 WeakPolarHBondContact O-CB 3.47Å; A626-R629 PolarHBondContact O-N 3.31Å; A626-L630 PolarHBondContact O-N 3.42Å
627	L	92.6	Very high	90.4	Very high	11 Å²	11	34.6 Å²	34.6	6%	0.058	17%	0.169	C	C	.	.	H	α-helix	trans	-63.7	-46.6	172.2	-75	165	0	0	0	111.4	Y344 L367 L623 S624 R629 L630 R631 D640 E643 A644	Y344-L627 HydrophobicContact CE2-CD2 4.15Å; L367-L627 HydrophobicContact CD1-CD2 4.34Å; L367-L627 HydrophobicContact CD1-CG 4.34Å; L367-L627 HydrophobicContact CD2-CD2 3.66Å; L367-L627 HydrophobicContact CD2-CG 3.7Å; L623-L627 PolarHBondContact O-N 3.22Å; S624-L627 PolarHBondContact O-N 2.95Å; L627-R629 PolarHBondContact O-N 3.33Å; L627-L630 WeakPolarHBondContact O-CB 3.45Å; L627-L630 PolarHBondContact O-N 3.35Å; L627-R631 PolarHBondContact O-N 2.91Å; L627-R631 VanDerWaalsContact O-N 3.15Å; L627-D640 HydrophobicContact CB-CB 4.04Å; L627-D640 HydrophobicContact CD1-CB 4.38Å; L627-D640 WeakPolarHBondContact CD1-O 2.89Å; L627-E643 HydrophobicContact CD1-CB 4.09Å; L627-E643 HydrophobicContact CD1-CG 4.13Å; L627-E643 HydrophobicContact CD2-CG 4.4Å; L627-A644 HydrophobicContact CD1-CB 4.2Å
628	A	91	Very high	90.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-34.5	176	0	0	0	0	0	112.7	P582 S624 R631 L632 S633 V636	P582-A628 HydrophobicContact CB-CB 3.79Å; P582-A628 HydrophobicContact CG-CB 3.88Å; S624-A628 WeakPolarHBondContact O-CB 3.43Å; S624-A628 PolarHBondContact O-N 3.26Å; A628-R631 PolarHBondContact O-N 3.06Å; A628-L632 PolarHBondContact O-N 3.13Å; A628-S633 PolarHBondContact O-N 2.78Å; A628-S633 VanDerWaalsContact O-N 3.1Å; A628-S633 PolarHBondContact O-OG 3.27Å; A628-V636 HydrophobicContact CB-CB 4.49Å; A628-V636 HydrophobicContact CB-CG2 3.87Å
629	R	90.2	Very high	90.6	Very high	18 Å²	18	40.8 Å²	40.8	7%	0.068	20%	0.195	C	C	.	.	H	α-helix	trans	-66.1	-39	171.7	-81	176.5	167.8	175.8	0.3	113.1	V370 G371 G372 K580 P582 T625 A626 L627 R631 L632	V370-R629 HydrophobicContact CG1-CB 3.74Å; G371-R629 WeakPolarHBondContact O-CD 3.5Å; G371-R629 PolarHBondContact O-NH1 2.9Å; G372-R629 PolarHBondContact O-NH1 3.24Å; K580-R629 PolarHBondContact O-NE 3.17Å; P582-R629 HydrophobicContact CG-CG 3.96Å; T625-R629 WeakPolarHBondContact O-CG 3.31Å; T625-R629 PolarHBondContact O-N 3.32Å; T625-R629 VanDerWaalsContact O-N 3.1Å; A626-R629 WeakPolarHBondContact O-CB 3.47Å; A626-R629 PolarHBondContact O-N 3.31Å; L627-R629 PolarHBondContact O-N 3.33Å; R629-R631 VanDerWaalsContact C-N 3.27Å; R629-R631 PolarHBondContact O-N 2.99Å; R629-L632 PolarHBondContact O-N 3.43Å
630	L	88.8	Confident	90.7	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.058	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-35.9	175.8	-80.6	170.1	0	0	0	111.9	Y344 L347 L366 L367 V370 Y573 A626 L627 L632	Y344-L630 HydrophobicContact CD2-CD1 3.93Å; Y344-L630 HydrophobicContact CE2-CD1 3.74Å; L347-L630 HydrophobicContact CD1-CD2 4.35Å; L366-L630 HydrophobicContact CD1-CD2 4.34Å; L366-L630 HydrophobicContact CD2-CD1 4.08Å; L366-L630 HydrophobicContact CD2-CD2 4.22Å; L366-L630 HydrophobicContact CG-CD1 4.2Å; L366-L630 HydrophobicContact CG-CD2 4.19Å; L367-L630 HydrophobicContact CD2-CD1 3.56Å; V370-L630 HydrophobicContact CG2-CD2 3.6Å; V370-L630 HydrophobicContact CG2-CG 4.01Å; Y573-L630 HydrophobicContact CE1-CD2 4.35Å; Y573-L630 PolarHBondContact OH-O 2.66Å; A626-L630 PolarHBondContact O-N 3.42Å; L627-L630 WeakPolarHBondContact O-CB 3.45Å; L627-L630 PolarHBondContact O-N 3.35Å; L630-L632 PolarHBondContact O-N 3.46Å
631	R	86.3	Confident	90.7	Very high	101 Å²	101	41.2 Å²	41.2	38%	0.381	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.1	173.5	-61.1	-170.7	-61.7	98.6	6.6	114	L627 A628 R629 S633 M635 I637 D640	L627-R631 PolarHBondContact O-N 2.91Å; L627-R631 VanDerWaalsContact O-N 3.15Å; A628-R631 PolarHBondContact O-N 3.06Å; R629-R631 VanDerWaalsContact C-N 3.27Å; R629-R631 PolarHBondContact O-N 2.99Å; R631-S633 PolarHBondContact NH1-OG 3.25Å; R631-S633 PolarHBondContact NH2-OG 3.34Å; R631-S633 VanDerWaalsContact NH2-OG 3.14Å; R631-S633 PolarHBondContact O-N 3.24Å; R631-S633 VanDerWaalsContact O-N 3.09Å; R631-M635 PolarHBondContact NH2-O 2.79Å; R631-I637 VanDerWaalsContact NH1-CD1 3.31Å; R631-D640 IonicContact CZ-OD1 3.01Å; R631-D640 IonicContact CZ-OD2 2.75Å; R631-D640 IonicContact NE-OD1 3.39Å; R631-D640 PolarHBondContact NE-OD1 3.07Å; R631-D640 IonicContact NE-OD2 3.91Å; R631-D640 IonicContact NH2-OD1 2.92Å; R631-D640 PolarHBondContact NH2-OD1 3.41Å; R631-D640 IonicContact NH2-OD2 3.27Å; R631-D640 PolarHBondContact NH2-OD2 3.01Å
632	L	86	Confident	90.8	Very high	58 Å²	58	42.3 Å²	42.3	30%	0.304	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	19.4	-174.1	-56.6	177.2	0	0	0	114.7	Y573 L576 C577 A628 R629 L630	Y573-L632 HydrophobicContact CE2-CD1 4.28Å; L576-L632 HydrophobicContact CD2-CD1 3.66Å; L576-L632 HydrophobicContact CD2-CD2 3.25Å; L576-L632 HydrophobicContact CD2-CG 4.09Å; C577-L632 HydrophobicContact CB-CD2 4.38Å; A628-L632 PolarHBondContact O-N 3.13Å; R629-L632 PolarHBondContact O-N 3.43Å; L630-L632 PolarHBondContact O-N 3.46Å
633	S	86.7	Confident	90.7	Very high	25 Å²	25	43.2 Å²	43.2	18%	0.175	21%	0.211	C	C	.	.			trans	-87.5	153.1	-177.3	69.7	0	0	0	0	112.1	A628 R631 M635	A628-S633 PolarHBondContact O-N 2.78Å; A628-S633 VanDerWaalsContact O-N 3.1Å; A628-S633 PolarHBondContact O-OG 3.27Å; R631-S633 PolarHBondContact NH1-OG 3.25Å; R631-S633 PolarHBondContact NH2-OG 3.34Å; R631-S633 VanDerWaalsContact NH2-OG 3.14Å; R631-S633 PolarHBondContact O-N 3.24Å; R631-S633 VanDerWaalsContact O-N 3.09Å; S633-M635 PolarHBondContact OG-O 3.08Å
634	E	88.7	Confident	90.6	Very high	121 Å²	121	43.2 Å²	43.2	57%	0.565	21%	0.211	S	C	*	.	S	Bend	trans	-93.1	-7.4	179.3	-63.2	-175.7	176.2	0	0	113	K580 P582 N583	K580-E634 IonicContact NZ-OE1 3.56Å; K580-E634 PolarHBondContact NZ-OE1 3.48Å; P582-E634 CarbonylContact C-O 3.47Å; P582-E634 VanDerWaalsContact CA-O 3.25Å; P582-E634 WeakPolarHBondContact CA-O 3.47Å; N583-E634 PolarHBondContact N-O 3.32Å
635	M	91.5	Very high	90.5	Very high	106 Å²	106	43.4 Å²	43.4	52%	0.522	21%	0.212	S	C	.	.	B	Isolated β-bridge	trans	-130.5	136.1	-178.3	-62	-68.6	-109.6	0	0	110	N583 R631 S633	N583-M635 HydrophobicContact CB-SD 3.96Å; R631-M635 PolarHBondContact NH2-O 2.79Å; S633-M635 PolarHBondContact OG-O 3.08Å
636	V	91.9	Very high	90.4	Very high	5 Å²	5	47 Å²	47	3%	0.03	23%	0.225	C	C	.	.			trans	-74.5	134.2	172.4	-178.9	0	0	0	0	109.5	P582 N583 I584 P585 L588 T625 A628 D640 V641	P582-V636 HydrophobicContact CB-CG2 4.33Å; N583-V636 PolarHBondContact O-N 3.3Å; I584-V636 HydrophobicContact CG1-CG2 4.08Å; P585-V636 WeakPolarHBondContact CD-O 3.5Å; P585-V636 WeakPolarHBondContact CG-O 3.48Å; L588-V636 HydrophobicContact CD1-CB 4.48Å; L588-V636 HydrophobicContact CD1-CG1 4.18Å; L588-V636 WeakPolarHBondContact CD1-O 3.47Å; T625-V636 HydrophobicContact CG2-CG2 4.28Å; A628-V636 HydrophobicContact CB-CB 4.49Å; A628-V636 HydrophobicContact CB-CG2 3.87Å; V636-D640 HydrophobicContact CG1-CB 4.05Å; V636-V641 HydrophobicContact CG1-CG2 4.25Å
637	I	92.1	Very high	90.4	Very high	74 Å²	74	47 Å²	47	38%	0.379	23%	0.225	S	C	.	.			trans	-102.7	158.3	177.4	-58.7	176.2	0	0	0	109.1	R631 E639 D640	R631-I637 VanDerWaalsContact NH1-CD1 3.31Å; I637-E639 VanDerWaalsContact C-N 3.26Å; I637-E639 HydrophobicContact CG2-CB 4.34Å; I637-E639 HydrophobicContact CG2-CG 4.34Å; I637-E639 PolarHBondContact O-N 3.3Å; I637-D640 PolarHBondContact N-OD2 2.76Å; I637-D640 WeakPolarHBondContact O-CB 3.39Å; I637-D640 PolarHBondContact O-N 3.38Å; I637-D640 VanDerWaalsContact O-N 3.12Å
638	E	91.9	Very high	90.1	Very high	101 Å²	101	47 Å²	47	47%	0.472	22%	0.224	S	C	.	.	H	α-helix	trans	-54.5	-40.6	175.7	-167.3	175.9	164.9	0	0	112.5	L588 Y591 D640 V641 V642	L588-E638 HydrophobicContact CD2-CB 3.75Å; L588-E638 HydrophobicContact CD2-CG 4.08Å; Y591-E638 HydrophobicContact CD1-CG 4.34Å; Y591-E638 HydrophobicContact CE1-CG 4.19Å; E638-D640 VanDerWaalsContact C-N 3.25Å; E638-D640 PolarHBondContact O-N 3.02Å; E638-V641 WeakPolarHBondContact O-CA 3.45Å; E638-V641 WeakPolarHBondContact O-CB 2.92Å; E638-V641 PolarHBondContact O-N 3.2Å; E638-V642 WeakPolarHBondContact O-CG2 2.91Å; E638-V642 PolarHBondContact O-N 3.36Å
639	E	91	Very high	89.8	Confident	146 Å²	146	51.1 Å²	51.1	68%	0.682	24%	0.244	S	C	*	.	H	α-helix	trans	-56.3	-36.3	176.5	-63.8	176.1	-179.7	0	0	112.9	I637 V641 V642 E643	I637-E639 VanDerWaalsContact C-N 3.26Å; I637-E639 HydrophobicContact CG2-CB 4.34Å; I637-E639 HydrophobicContact CG2-CG 4.34Å; I637-E639 PolarHBondContact O-N 3.3Å; E639-V641 VanDerWaalsContact C-N 3.27Å; E639-V641 PolarHBondContact O-N 3.24Å; E639-V642 PolarHBondContact O-N 3.47Å; E639-E643 PolarHBondContact O-N 3.26Å
640	D	91.4	Very high	89.6	Confident	9 Å²	9	51 Å²	51	5%	0.048	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-32	176.3	-57.7	-46	0	0	0	111.4	S624 L627 R631 V636 I637 E638 A644	S624-D640 PolarHBondContact OG-O 3.33Å; L627-D640 HydrophobicContact CB-CB 4.04Å; L627-D640 HydrophobicContact CD1-CB 4.38Å; L627-D640 WeakPolarHBondContact CD1-O 2.89Å; R631-D640 IonicContact CZ-OD1 3.01Å; R631-D640 IonicContact CZ-OD2 2.75Å; R631-D640 IonicContact NE-OD1 3.39Å; R631-D640 PolarHBondContact NE-OD1 3.07Å; R631-D640 IonicContact NE-OD2 3.91Å; R631-D640 IonicContact NH2-OD1 2.92Å; R631-D640 PolarHBondContact NH2-OD1 3.41Å; R631-D640 IonicContact NH2-OD2 3.27Å; R631-D640 PolarHBondContact NH2-OD2 3.01Å; V636-D640 HydrophobicContact CG1-CB 4.05Å; I637-D640 PolarHBondContact N-OD2 2.76Å; I637-D640 WeakPolarHBondContact O-CB 3.39Å; I637-D640 PolarHBondContact O-N 3.38Å; I637-D640 VanDerWaalsContact O-N 3.12Å; E638-D640 VanDerWaalsContact C-N 3.25Å; E638-D640 PolarHBondContact O-N 3.02Å; D640-A644 VanDerWaalsContact O-CB 3.28Å; D640-A644 WeakPolarHBondContact O-CB 3.4Å; D640-A644 PolarHBondContact O-N 2.66Å; D640-A644 VanDerWaalsContact O-N 3.1Å
641	V	91	Very high	89.3	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-73.9	-43.8	176.8	-177.9	0	0	0	0	109.8	L588 Y591 L592 I620 V636 E638 E639 E643 A644 C645	L588-V641 HydrophobicContact CD1-CG2 4.27Å; Y591-V641 HydrophobicContact CD1-CB 4.44Å; Y591-V641 HydrophobicContact CD1-CG1 3.95Å; Y591-V641 HydrophobicContact CE1-CB 4.3Å; Y591-V641 HydrophobicContact CE1-CG1 3.88Å; L592-V641 HydrophobicContact CD2-CB 4.43Å; L592-V641 HydrophobicContact CD2-CG1 3.43Å; L592-V641 VanDerWaalsContact CD2-CG1 3.43Å; L592-V641 HydrophobicContact CD2-CG2 4.08Å; L592-V641 HydrophobicContact CG-CG1 4.23Å; I620-V641 HydrophobicContact CG2-CG1 4.33Å; V636-V641 HydrophobicContact CG1-CG2 4.25Å; E638-V641 WeakPolarHBondContact O-CA 3.45Å; E638-V641 WeakPolarHBondContact O-CB 2.92Å; E638-V641 PolarHBondContact O-N 3.2Å; E639-V641 VanDerWaalsContact C-N 3.27Å; E639-V641 PolarHBondContact O-N 3.24Å; V641-E643 PolarHBondContact O-N 2.95Å; V641-A644 PolarHBondContact O-N 3.25Å; V641-C645 WeakPolarHBondContact O-CB 3.44Å; V641-C645 PolarHBondContact O-N 3.42Å; V641-C645 PolarHBondContact O-SG 2.99Å; V641-C645 VanDerWaalsContact O-SG 3.4Å
642	V	92.7	Very high	88.9	Confident	69 Å²	69	47.5 Å²	47.5	42%	0.418	24%	0.235	S	C	.	.	H	α-helix	trans	-58.3	-47.6	176	176.2	0	0	0	0	110.7	Y591 E638 E639 A644 C645 R646	Y591-V642 HydrophobicContact CE1-CG2 4.35Å; Y591-V642 WeakPolarHBondContact OH-CG2 3.48Å; E638-V642 WeakPolarHBondContact O-CG2 2.91Å; E638-V642 PolarHBondContact O-N 3.36Å; E639-V642 PolarHBondContact O-N 3.47Å; V642-A644 PolarHBondContact O-N 2.96Å; V642-C645 PolarHBondContact O-N 2.73Å; V642-R646 PolarHBondContact O-N 2.88Å
643	E	90.6	Very high	88.3	Confident	41 Å²	41	51.1 Å²	51.1	19%	0.192	25%	0.25	C	S	.	.	H	α-helix	trans	-66.4	-39	178.2	-178.9	63	-174	0	0	112.1	K363 L627 E639 V641 C645 R646 L647	K363-E643 IonicContact NZ-OE1 3.37Å; L627-E643 HydrophobicContact CD1-CB 4.09Å; L627-E643 HydrophobicContact CD1-CG 4.13Å; L627-E643 HydrophobicContact CD2-CG 4.4Å; E639-E643 PolarHBondContact O-N 3.26Å; V641-E643 PolarHBondContact O-N 2.95Å; E643-C645 VanDerWaalsContact C-N 3.3Å; E643-C645 PolarHBondContact O-N 3.06Å; E643-R646 WeakPolarHBondContact O-CB 3.5Å; E643-R646 PolarHBondContact O-N 3.15Å; E643-R646 IonicContact OE1-CZ 3.7Å; E643-R646 IonicContact OE1-NE 2.77Å; E643-R646 PolarHBondContact OE1-NE 3.3Å; E643-R646 IonicContact OE1-NH2 3.79Å; E643-R646 PolarHBondContact OE1-NH2 3.13Å; E643-R646 WeakPolarHBondContact OE2-CD 3.49Å; E643-R646 IonicContact OE2-CZ 2.82Å; E643-R646 IonicContact OE2-NE 3.65Å; E643-R646 PolarHBondContact OE2-NE 3.48Å; E643-R646 IonicContact OE2-NH2 4Å; E643-L647 WeakPolarHBondContact O-CG 3.5Å; E643-L647 PolarHBondContact O-N 3.48Å
644	A	91.3	Very high	87.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-39.4	174.3	0	0	0	0	0	112.1	I620 L623 L627 D640 V641 V642 M648	I620-A644 HydrophobicContact CG2-CB 4.4Å; L623-A644 HydrophobicContact CB-CB 3.79Å; L627-A644 HydrophobicContact CD1-CB 4.2Å; D640-A644 VanDerWaalsContact O-CB 3.28Å; D640-A644 WeakPolarHBondContact O-CB 3.4Å; D640-A644 PolarHBondContact O-N 2.66Å; D640-A644 VanDerWaalsContact O-N 3.1Å; V641-A644 PolarHBondContact O-N 3.25Å; V642-A644 PolarHBondContact O-N 2.96Å; A644-M648 PolarHBondContact O-N 3.08Å; A644-M648 VanDerWaalsContact O-N 3.1Å
645	C	89.9	Confident	86.3	Confident	8 Å²	8	46.9 Å²	46.9	5%	0.054	23%	0.233	C	C	.	.	H	α-helix	trans	-68	-42.4	174.8	-75	0	0	0	0	111.8	T595 V641 V642 E643 L647 M648 E649	T595-C645 HydrophobicContact CG2-CB 4.26Å; T595-C645 WeakPolarHBondContact CG2-SG 3.46Å; V641-C645 WeakPolarHBondContact O-CB 3.44Å; V641-C645 PolarHBondContact O-N 3.42Å; V641-C645 PolarHBondContact O-SG 2.99Å; V641-C645 VanDerWaalsContact O-SG 3.4Å; V642-C645 PolarHBondContact O-N 2.73Å; E643-C645 VanDerWaalsContact C-N 3.3Å; E643-C645 PolarHBondContact O-N 3.06Å; C645-L647 VanDerWaalsContact C-N 3.31Å; C645-L647 PolarHBondContact O-N 3.26Å; C645-M648 CarbonylContact O-C 3.53Å; C645-M648 WeakPolarHBondContact O-CB 3.49Å; C645-M648 PolarHBondContact O-N 3.06Å; C645-M648 VanDerWaalsContact O-N 3.08Å; C645-E649 WeakPolarHBondContact O-CG 3.44Å; C645-E649 PolarHBondContact O-N 3.26Å
646	R	91.6	Very high	85.2	Confident	83 Å²	83	47.3 Å²	47.3	31%	0.313	23%	0.228	S	C	.	.	H	α-helix	trans	-55.2	-46	173.4	-169.6	-167.8	72.1	79.3	2.4	111.5	D360 V642 E643 M648 E649 A650	D360-R646 IonicContact OD1-CZ 3.64Å; D360-R646 IonicContact OD1-NH1 3.81Å; D360-R646 PolarHBondContact OD1-NH1 2.99Å; D360-R646 IonicContact OD1-NH2 2.76Å; D360-R646 PolarHBondContact OD1-NH2 2.95Å; D360-R646 IonicContact OD2-NH1 3.05Å; V642-R646 PolarHBondContact O-N 2.88Å; E643-R646 WeakPolarHBondContact O-CB 3.5Å; E643-R646 PolarHBondContact O-N 3.15Å; E643-R646 IonicContact OE1-CZ 3.7Å; E643-R646 IonicContact OE1-NE 2.77Å; E643-R646 PolarHBondContact OE1-NE 3.3Å; E643-R646 IonicContact OE1-NH2 3.79Å; E643-R646 PolarHBondContact OE1-NH2 3.13Å; E643-R646 WeakPolarHBondContact OE2-CD 3.49Å; E643-R646 IonicContact OE2-CZ 2.82Å; E643-R646 IonicContact OE2-NE 3.65Å; E643-R646 PolarHBondContact OE2-NE 3.48Å; E643-R646 IonicContact OE2-NH2 4Å; R646-M648 VanDerWaalsContact C-N 3.35Å; R646-M648 PolarHBondContact O-N 2.97Å; R646-E649 PolarHBondContact O-N 2.98Å; R646-A650 VanDerWaalsContact O-CB 3.29Å; R646-A650 WeakPolarHBondContact O-CB 3.25Å; R646-A650 PolarHBondContact O-N 3.13Å
647	L	90.6	Very high	83.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-38.9	176.9	-70.3	175.1	0	0	0	112.3	D360 K363 L367 W530 E643 C645 S651	D360-L647 HydrophobicContact CB-CD2 4.41Å; K363-L647 HydrophobicContact CB-CD2 4.26Å; L367-L647 HydrophobicContact CD1-CD1 3.53Å; W530-L647 WeakPolarHBondContact CH2-O 3.48Å; E643-L647 WeakPolarHBondContact O-CG 3.5Å; E643-L647 PolarHBondContact O-N 3.48Å; C645-L647 VanDerWaalsContact C-N 3.31Å; C645-L647 PolarHBondContact O-N 3.26Å; L647-S651 WeakPolarHBondContact O-CB 3.44Å; L647-S651 PolarHBondContact O-N 3.4Å; L647-S651 VanDerWaalsContact O-N 3.11Å
648	M	86.6	Confident	81.7	Confident	9 Å²	9	51.6 Å²	51.6	4%	0.044	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-42.4	176	-175.5	64.8	62.7	0	0	111.6	D527 L528 A619 L623 A644 C645 R646 S651 K652	D527-M648 WeakPolarHBondContact O-CE 3.33Å; L528-M648 HydrophobicContact CD2-CE 3.92Å; L528-M648 HydrophobicContact CD2-SD 4.34Å; A619-M648 HydrophobicContact CB-CE 4Å; L623-M648 HydrophobicContact CD1-CE 4.47Å; A644-M648 PolarHBondContact O-N 3.08Å; A644-M648 VanDerWaalsContact O-N 3.1Å; C645-M648 CarbonylContact O-C 3.53Å; C645-M648 WeakPolarHBondContact O-CB 3.49Å; C645-M648 PolarHBondContact O-N 3.06Å; C645-M648 VanDerWaalsContact O-N 3.08Å; R646-M648 VanDerWaalsContact C-N 3.35Å; R646-M648 PolarHBondContact O-N 2.97Å; M648-S651 PolarHBondContact O-N 3.49Å; M648-S651 PolarHBondContact O-OG 3.2Å; M648-K652 PolarHBondContact O-N 3.13Å
649	E	85.2	Confident	79.7	Confident	87 Å²	87	57.3 Å²	57.3	41%	0.407	27%	0.271	S	S	.	.	H	α-helix	trans	-66.8	-46.8	177.2	-74.9	174.9	-172.5	0	0	111.7	L599 C645 R646 S651 K652 E653	L599-E649 HydrophobicContact CD2-CG 4.02Å; C645-E649 WeakPolarHBondContact O-CG 3.44Å; C645-E649 PolarHBondContact O-N 3.26Å; R646-E649 PolarHBondContact O-N 2.98Å; E649-S651 PolarHBondContact O-N 3.37Å; E649-K652 CarbonylContact O-C 3.56Å; E649-K652 WeakPolarHBondContact O-CA 3.44Å; E649-K652 WeakPolarHBondContact O-CB 3.3Å; E649-K652 PolarHBondContact O-N 3.41Å; E649-E653 WeakPolarHBondContact O-CB 3.48Å; E649-E653 PolarHBondContact O-N 3.29Å
650	A	85.6	Confident	77.5	Confident	17 Å²	17	57.2 Å²	57.2	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-56.2	-37.1	175.2	0	0	0	0	0	111.9	W530 R646 K652 S654	W530-A650 HydrophobicContact CH2-CB 3.89Å; W530-A650 HydrophobicContact CZ3-CB 4.05Å; R646-A650 VanDerWaalsContact O-CB 3.29Å; R646-A650 WeakPolarHBondContact O-CB 3.25Å; R646-A650 PolarHBondContact O-N 3.13Å; A650-K652 VanDerWaalsContact C-N 3.33Å; A650-K652 PolarHBondContact O-N 3.33Å; A650-S654 PolarHBondContact O-N 3.09Å; A650-S654 VanDerWaalsContact O-N 3.13Å; A650-S654 PolarHBondContact O-OG 3.12Å
651	S	82.3	Confident	75.1	Confident	6 Å²	6	60 Å²	60	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-36.4	175.3	83.9	0	0	0	0	112.7	I529 W530 L647 M648 E649	I529-S651 WeakPolarHBondContact O-CB 3.38Å; W530-S651 VanDerWaalsContact CZ3-CA 3.49Å; L647-S651 WeakPolarHBondContact O-CB 3.44Å; L647-S651 PolarHBondContact O-N 3.4Å; L647-S651 VanDerWaalsContact O-N 3.11Å; M648-S651 PolarHBondContact O-N 3.49Å; M648-S651 PolarHBondContact O-OG 3.2Å; E649-S651 PolarHBondContact O-N 3.37Å
652	K	78.2	Confident	72.5	Confident	32 Å²	32	70.8 Å²	70.8	14%	0.139	35%	0.347	C	S	.	.	H	α-helix	trans	-80.3	-36.9	177.9	-68.8	179.2	-178.3	178.4	0	112.7	M648 E649 A650 S654 L655 R656	M648-K652 PolarHBondContact O-N 3.13Å; E649-K652 CarbonylContact O-C 3.56Å; E649-K652 WeakPolarHBondContact O-CA 3.44Å; E649-K652 WeakPolarHBondContact O-CB 3.3Å; E649-K652 PolarHBondContact O-N 3.41Å; A650-K652 VanDerWaalsContact C-N 3.33Å; A650-K652 PolarHBondContact O-N 3.33Å; K652-S654 PolarHBondContact O-N 3.19Å; K652-L655 WeakPolarHBondContact O-CA 3.37Å; K652-L655 VanDerWaalsContact O-CB 3.25Å; K652-L655 WeakPolarHBondContact O-CB 3.5Å; K652-L655 PolarHBondContact O-N 3.02Å; K652-R656 PolarHBondContact O-N 3.24Å
653	E	74.3	Confident	70.2	Confident	133 Å²	133	75.6 Å²	75.6	62%	0.621	37%	0.365	S	S	*	.	H	α-helix	trans	-63.7	-36.4	177.8	-174.3	168.6	-161	0	0	110.8	E649 L655 R656	E649-E653 WeakPolarHBondContact O-CB 3.48Å; E649-E653 PolarHBondContact O-N 3.29Å; E653-L655 PolarHBondContact O-N 3.24Å; E653-R656 WeakPolarHBondContact O-CB 3.36Å; E653-R656 PolarHBondContact O-N 3.13Å
654	S	69.2	Low	67.9	Low	40 Å²	40	83.6 Å²	83.6	28%	0.28	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.2	171.1	-58.8	0	0	0	0	113.4	Q533 A650 K652	Q533-S654 PolarHBondContact NE2-O 3.44Å; A650-S654 PolarHBondContact O-N 3.09Å; A650-S654 VanDerWaalsContact O-N 3.13Å; A650-S654 PolarHBondContact O-OG 3.12Å; K652-S654 PolarHBondContact O-N 3.19Å
655	L	64.4	Low	65.9	Low	18 Å²	18	89.7 Å²	89.7	9%	0.094	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-23.3	175.7	-57.6	171	0	0	0	113.1	V512 L531 T610 K652 E653 P657	V512-L655 HydrophobicContact CG1-CD2 4.45Å; V512-L655 HydrophobicContact CG2-CD2 4.33Å; L531-L655 HydrophobicContact CB-CD2 3.65Å; L531-L655 HydrophobicContact CD2-CD2 3.72Å; L531-L655 HydrophobicContact CG-CD2 4.26Å; T610-L655 HydrophobicContact CG2-CD1 3.54Å; K652-L655 WeakPolarHBondContact O-CA 3.37Å; K652-L655 VanDerWaalsContact O-CB 3.25Å; K652-L655 WeakPolarHBondContact O-CB 3.5Å; K652-L655 PolarHBondContact O-N 3.02Å; E653-L655 PolarHBondContact O-N 3.24Å; L655-P657 WeakPolarHBondContact O-CD 3.32Å
656	R	67.1	Low	64.4	Low	115 Å²	115	93.7 Å²	93.7	43%	0.434	45%	0.45	S	S	.	.	S	Bend	trans	-70.1	125.1	179.9	-66.2	-176.3	-178.2	177.6	3.8	107.7	E602 K652 E653 I658	E602-R656 IonicContact OE2-NH2 2.7Å; K652-R656 PolarHBondContact O-N 3.24Å; E653-R656 WeakPolarHBondContact O-CB 3.36Å; E653-R656 PolarHBondContact O-N 3.13Å; R656-I658 PolarHBondContact O-N 3.3Å
657	P	57.1	Low	63.2	Low	55 Å²	55	95.7 Å²	95.7	36%	0.357	46%	0.463	S	S	.	.			trans	-59.5	120.9	164.4	25.5	-29.8	0	0	0	105.6	P508 L655 R659	P508-P657 HydrophobicContact CB-CB 4.31Å; L655-P657 WeakPolarHBondContact O-CD 3.32Å; P657-R659 PolarHBondContact O-N 2.97Å
658	I	54.7	Low	62.3	Low	114 Å²	114	99.7 Å²	99.7	59%	0.585	49%	0.489	S	S	*	.			trans	-60.7	97.6	163.3	-62.2	-169.5	0	0	0	103.6	R535 R656 D660	R535-I658 VanDerWaalsContact NH1-CG1 3.31Å; R656-I658 PolarHBondContact O-N 3.3Å; I658-D660 VanDerWaalsContact C-N 3.31Å; I658-D660 PolarHBondContact O-N 2.97Å
659	R	49.1	Very low	61.8	Low	221 Å²	221	100.8 Å²	100.8	83%	0.834	50%	0.496	S	S	*	.			trans	-58.3	113.4	153.8	-73.3	-177.3	175.8	-179.3	0	102	P657 G661	P657-R659 PolarHBondContact O-N 2.97Å; R659-G661 VanDerWaalsContact C-N 3.29Å; R659-G661 PolarHBondContact O-N 2.64Å
660	D	44.6	Very low	61.5	Low	144 Å²	144	99.9 Å²	99.9	77%	0.77	49%	0.494	S	S	*	.			trans	-37.9	107.8	163.3	-73.6	-38.7	0	0	0	105.8	I658 R662	I658-D660 VanDerWaalsContact C-N 3.31Å; I658-D660 PolarHBondContact O-N 2.97Å; D660-R662 PolarHBondContact O-N 2.72Å
661	G	42	Very low	61	Low	68 Å²	68	106.9 Å²	106.9	70%	0.701	52%	0.517	S	S	*	.				51.7	13.5	96.7	0	0	0	0	0	115.1	R659 E663	R659-G661 VanDerWaalsContact C-N 3.29Å; R659-G661 PolarHBondContact O-N 2.64Å; G661-E663 PolarHBondContact O-N 2.88Å
662	R	36.2	Very low	60.9	Low	226 Å²	226	107 Å²	107	85%	0.853	52%	0.517	S	S	*	.				-79.9	70.3	128.7	-63.2	-175	-173.9	177.3	1.5	105.4	D660 R664	D660-R662 PolarHBondContact O-N 2.72Å; R662-R664 PolarHBondContact O-N 3.4Å
663	E	44	Very low	61.1	Low	170 Å²	170	107.7 Å²	107.7	79%	0.794	52%	0.52	S	S	*	.				-48	104.2	120.7	-78.8	-171.6	168.8	0	0	102.2	G661 V665	G661-E663 PolarHBondContact O-N 2.88Å; E663-V665 PolarHBondContact O-N 2.66Å
664	R	41.8	Very low	61.3	Low	210 Å²	210	103.2 Å²	103.2	79%	0.792	51%	0.506	S	S	*	.			trans	-48.7	110.1	165.5	-73.9	179	176.7	-179.4	-2.7	101.2	R662 I666	R662-R664 PolarHBondContact O-N 3.4Å; R664-I666 WeakPolarHBondContact O-CA 3.46Å; R664-I666 WeakPolarHBondContact O-CG1 3.39Å; R664-I666 PolarHBondContact O-N 2.75Å
665	V	48.7	Very low	61.9	Low	128 Å²	128	103.5 Å²	103.5	78%	0.776	50%	0.504	S	S	*	.			trans	-54.5	98.1	167	173.9	0	0	0	0	100.5	E663 Q667	E663-V665 PolarHBondContact O-N 2.66Å; V665-Q667 VanDerWaalsContact C-N 3.27Å; V665-Q667 PolarHBondContact O-N 2.74Å
666	I	58.8	Low	62.6	Low	92 Å²	92	102.7 Å²	102.7	47%	0.472	50%	0.499	S	S	.	.			trans	-61.8	107.9	-171.5	-62.4	177.5	0	0	0	100.6	R664 D670 R671	R664-I666 WeakPolarHBondContact O-CA 3.46Å; R664-I666 WeakPolarHBondContact O-CG1 3.39Å; R664-I666 PolarHBondContact O-N 2.75Å; I666-D670 HydrophobicContact CG2-CB 3.58Å; I666-R671 HydrophobicContact CG2-CB 3.94Å
667	Q	67.5	Low	63.2	Low	124 Å²	124	104.7 Å²	104.7	58%	0.579	51%	0.507	S	S	*	.			trans	-55.9	142.3	-176.8	-71.5	-172.3	-5.3	0	0	105.5	V665 V669 D670 R671	V665-Q667 VanDerWaalsContact C-N 3.27Å; V665-Q667 PolarHBondContact O-N 2.74Å; Q667-V669 CarbonylContact O-C 3.58Å; Q667-V669 PolarHBondContact O-N 2.84Å; Q667-D670 PolarHBondContact O-N 3.08Å; Q667-R671 PolarHBondContact O-N 3.06Å
668	P	71.4	Confident	64.4	Low	85 Å²	85	108.4 Å²	108.4	55%	0.552	52%	0.519	S	S	*	.	H	α-helix	trans	-46.4	-35.6	-179.4	-28.9	34.2	0	0	0	111.9	R671 V672 V700	P668-R671 PolarHBondContact O-N 3.22Å; P668-V672 VanDerWaalsContact O-CG2 3.3Å; P668-V672 WeakPolarHBondContact O-CG2 3.3Å; P668-V672 PolarHBondContact O-N 3.38Å; P668-V700 HydrophobicContact CB-CG1 3.79Å
669	V	76.3	Confident	65.6	Low	32 Å²	32	103.7 Å²	103.7	19%	0.194	50%	0.496	C	S	.	.	H	α-helix	trans	-55.9	-48.1	172.4	-174.5	0	0	0	0	114	Q667 R671 V672 F673 C704 Y708	Q667-V669 CarbonylContact O-C 3.58Å; Q667-V669 PolarHBondContact O-N 2.84Å; V669-R671 VanDerWaalsContact C-N 3.34Å; V669-R671 PolarHBondContact O-N 3.19Å; V669-V672 PolarHBondContact O-N 3.12Å; V669-F673 WeakPolarHBondContact O-CB 3.42Å; V669-F673 PolarHBondContact O-N 2.98Å; V669-C704 HydrophobicContact CG1-CB 4.01Å; V669-Y708 HydrophobicContact CG1-CD2 4.28Å; V669-Y708 HydrophobicContact CG1-CE2 3.55Å
670	D	77.2	Confident	66.9	Low	68 Å²	68	93.6 Å²	93.6	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-67.6	-34.3	178.2	-74.4	-30.7	0	0	0	111.9	I666 Q667 F673 A674 Y708	I666-D670 HydrophobicContact CG2-CB 3.58Å; Q667-D670 PolarHBondContact O-N 3.08Å; D670-F673 PolarHBondContact O-N 3.29Å; D670-A674 PolarHBondContact O-N 2.7Å; D670-Y708 PolarHBondContact OD1-OH 3.09Å
671	R	75.8	Confident	68.2	Low	164 Å²	164	92.2 Å²	92.2	62%	0.619	46%	0.46	S	S	*	.	H	α-helix	trans	-69.5	-41.3	176.6	-165.4	-178.8	-75.6	-176.3	-4.1	110.4	I666 Q667 P668 V669 A674 I675	I666-R671 HydrophobicContact CG2-CB 3.94Å; Q667-R671 PolarHBondContact O-N 3.06Å; P668-R671 PolarHBondContact O-N 3.22Å; V669-R671 VanDerWaalsContact C-N 3.34Å; V669-R671 PolarHBondContact O-N 3.19Å; R671-A674 PolarHBondContact O-N 3.35Å; R671-I675 WeakPolarHBondContact O-CG1 3.29Å; R671-I675 PolarHBondContact O-N 3.4Å; R671-I675 VanDerWaalsContact O-N 3.12Å
672	V	80.7	Confident	69.9	Low	9 Å²	9	93.3 Å²	93.3	6%	0.055	46%	0.462	C	S	.	.	H	α-helix	trans	-62.5	-42.8	172.6	168.2	0	0	0	0	110.9	P668 V669 A674 I675 L676 I696 V700 L701 C704	P668-V672 VanDerWaalsContact O-CG2 3.3Å; P668-V672 WeakPolarHBondContact O-CG2 3.3Å; P668-V672 PolarHBondContact O-N 3.38Å; V669-V672 PolarHBondContact O-N 3.12Å; V672-A674 VanDerWaalsContact C-N 3.34Å; V672-A674 PolarHBondContact O-N 3.47Å; V672-I675 PolarHBondContact O-N 2.63Å; V672-L676 HydrophobicContact CG1-CD1 4.04Å; V672-L676 HydrophobicContact CG1-CG 4.38Å; V672-L676 WeakPolarHBondContact O-CG 3.4Å; V672-L676 PolarHBondContact O-N 3.3Å; V672-I696 HydrophobicContact CB-CD1 4.39Å; V672-I696 HydrophobicContact CB-CG2 4.39Å; V672-I696 HydrophobicContact CG1-CD1 3.8Å; V672-I696 HydrophobicContact CG1-CG2 4.06Å; V672-I696 HydrophobicContact CG2-CD1 4.36Å; V672-I696 HydrophobicContact CG2-CG2 3.46Å; V672-I696 VanDerWaalsContact CG2-CG2 3.46Å; V672-V700 HydrophobicContact CG2-CB 4.49Å; V672-V700 HydrophobicContact CG2-CG1 3.78Å; V672-L701 HydrophobicContact CG1-CD1 4.03Å; V672-C704 HydrophobicContact CB-CB 4.29Å; V672-C704 HydrophobicContact CG1-CB 3.72Å; V672-C704 VanDerWaalsContact CG1-SG 3.53Å
673	F	81.4	Confident	71.5	Confident	46 Å²	46	84.6 Å²	84.6	20%	0.202	44%	0.436	C	S	.	.	H	α-helix	trans	-61	-40.7	175.3	-174.1	-97.9	0	0	0	112.7	V669 D670 I675 L676 R677 Y708 V713 F725	V669-F673 WeakPolarHBondContact O-CB 3.42Å; V669-F673 PolarHBondContact O-N 2.98Å; D670-F673 PolarHBondContact O-N 3.29Å; F673-I675 VanDerWaalsContact C-N 3.35Å; F673-I675 PolarHBondContact O-N 2.95Å; F673-L676 PolarHBondContact O-N 3.4Å; F673-R677 WeakPolarHBondContact O-CB 3.49Å; F673-R677 PolarHBondContact O-N 2.99Å; F673-Y708 HydrophobicContact CB-CE2 3.63Å; F673-Y708 HydrophobicContact CD2-CD1 4.16Å; F673-Y708 AromaticContact CD2-CD2 3.73Å; F673-Y708 HydrophobicContact CD2-CD2 3.73Å; F673-Y708 AromaticContact CD2-CE1 3.97Å; F673-Y708 HydrophobicContact CD2-CE1 3.97Å; F673-Y708 AromaticContact CD2-CE2 3.53Å; F673-Y708 HydrophobicContact CD2-CE2 3.53Å; F673-Y708 HydrophobicContact CD2-CG 4.06Å; F673-Y708 AromaticContact CD2-CZ 3.65Å; F673-Y708 HydrophobicContact CE2-CD1 4.2Å; F673-Y708 HydrophobicContact CE2-CD2 4.44Å; F673-Y708 HydrophobicContact CE2-CE1 4.21Å; F673-Y708 HydrophobicContact CE2-CE2 4.46Å; F673-Y708 HydrophobicContact CE2-CG 4.32Å; F673-Y708 HydrophobicContact CG-CD2 4.47Å; F673-Y708 HydrophobicContact CG-CE1 4.36Å; F673-Y708 AromaticContact CG-CE2 3.83Å; F673-Y708 HydrophobicContact CG-CE2 3.83Å; F673-Y708 AromaticContact CG-CZ 3.76Å; F673-V713 HydrophobicContact CE2-CG1 3.83Å; F673-V713 HydrophobicContact CZ-CG1 3.99Å; F673-F725 HydrophobicContact CD2-CE1 4.33Å; F673-F725 HydrophobicContact CE2-CD1 4.39Å; F673-F725 AromaticContact CE2-CE1 3.59Å; F673-F725 HydrophobicContact CE2-CE1 3.59Å; F673-F725 HydrophobicContact CE2-CZ 4.42Å; F673-F725 HydrophobicContact CZ-CD1 4.45Å; F673-F725 AromaticContact CZ-CE1 3.78Å; F673-F725 HydrophobicContact CZ-CE1 3.78Å
674	A	79.9	Confident	72.7	Confident	38 Å²	38	84.3 Å²	84.3	31%	0.314	44%	0.44	S	S	.	.	H	α-helix	trans	-62.3	-42.1	175.4	0	0	0	0	0	112	D670 R671 V672 R677 E678	D670-A674 PolarHBondContact O-N 2.7Å; R671-A674 PolarHBondContact O-N 3.35Å; V672-A674 VanDerWaalsContact C-N 3.34Å; V672-A674 PolarHBondContact O-N 3.47Å; A674-R677 PolarHBondContact O-N 2.82Å; A674-E678 PolarHBondContact O-N 3.44Å
675	I	80.6	Confident	74	Confident	47 Å²	47	74.8 Å²	74.8	24%	0.241	41%	0.407	C	S	.	.	H	α-helix	trans	-65.9	-43.8	175.5	-62.9	165.6	0	0	0	110.5	R671 V672 F673 R677 E678 L679 I696	R671-I675 WeakPolarHBondContact O-CG1 3.29Å; R671-I675 PolarHBondContact O-N 3.4Å; R671-I675 VanDerWaalsContact O-N 3.12Å; V672-I675 PolarHBondContact O-N 2.63Å; F673-I675 VanDerWaalsContact C-N 3.35Å; F673-I675 PolarHBondContact O-N 2.95Å; I675-R677 VanDerWaalsContact C-N 3.26Å; I675-R677 PolarHBondContact O-N 3.44Å; I675-E678 PolarHBondContact O-N 2.91Å; I675-L679 HydrophobicContact CG2-CD1 4.2Å; I675-L679 HydrophobicContact CG2-CG 4.49Å; I675-L679 WeakPolarHBondContact O-CG 3.17Å; I675-L679 PolarHBondContact O-N 2.95Å; I675-I696 HydrophobicContact CB-CD1 4.05Å; I675-I696 HydrophobicContact CD1-CD1 4.45Å; I675-I696 HydrophobicContact CD1-CG1 4.45Å; I675-I696 HydrophobicContact CG2-CD1 3.8Å; I675-I696 HydrophobicContact CG2-CG1 4.26Å
676	L	80.1	Confident	75.3	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-60.9	-37.2	175.2	-74.2	172.4	0	0	0	111.5	V672 F673 L679 A680 V687 A692 L701 L714 F725	V672-L676 HydrophobicContact CG1-CD1 4.04Å; V672-L676 HydrophobicContact CG1-CG 4.38Å; V672-L676 WeakPolarHBondContact O-CG 3.4Å; V672-L676 PolarHBondContact O-N 3.3Å; F673-L676 PolarHBondContact O-N 3.4Å; L676-L679 PolarHBondContact O-N 3.2Å; L676-A680 VanDerWaalsContact O-CB 3.27Å; L676-A680 WeakPolarHBondContact O-CB 3.4Å; L676-A680 PolarHBondContact O-N 3.19Å; L676-V687 HydrophobicContact CD2-CG1 4.07Å; L676-A692 HydrophobicContact CD2-CB 3.93Å; L676-L701 HydrophobicContact CD1-CD1 4.13Å; L676-L701 HydrophobicContact CD2-CD1 4.17Å; L676-L701 HydrophobicContact CG-CD1 4.47Å; L676-L714 HydrophobicContact CD1-CD1 4.3Å; L676-F725 HydrophobicContact CB-CE2 4.31Å; L676-F725 HydrophobicContact CB-CZ 3.85Å
677	R	80	Confident	76	Confident	158 Å²	158	68 Å²	68	60%	0.596	37%	0.365	S	S	*	.	H	α-helix	trans	-69	-39.3	176.2	-169	-175.8	68.3	166.6	1.7	112.1	F673 A674 I675 A680 C681 F725	F673-R677 WeakPolarHBondContact O-CB 3.49Å; F673-R677 PolarHBondContact O-N 2.99Å; A674-R677 PolarHBondContact O-N 2.82Å; I675-R677 VanDerWaalsContact C-N 3.26Å; I675-R677 PolarHBondContact O-N 3.44Å; R677-A680 PolarHBondContact O-N 3.19Å; R677-C681 WeakPolarHBondContact O-CB 3.4Å; R677-C681 PolarHBondContact O-N 2.61Å; R677-F725 HydrophobicContact CB-CZ 4.47Å
678	E	81.5	Confident	76.5	Confident	132 Å²	132	63.8 Å²	63.8	62%	0.617	35%	0.349	S	S	*	.	H	α-helix	trans	-64.3	-41.7	173.2	-77.1	-178.2	178.9	0	0	111.8	A674 I675 C681 A682	A674-E678 PolarHBondContact O-N 3.44Å; I675-E678 PolarHBondContact O-N 2.91Å; E678-C681 PolarHBondContact O-N 3.24Å; E678-A682 PolarHBondContact O-N 3.38Å
679	L	79	Confident	76.6	Confident	16 Å²	16	61.9 Å²	61.9	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-45.1	174.1	-69.5	173.6	0	0	0	111.1	I675 L676 C681 A682 S683 V687	I675-L679 HydrophobicContact CG2-CD1 4.2Å; I675-L679 HydrophobicContact CG2-CG 4.49Å; I675-L679 WeakPolarHBondContact O-CG 3.17Å; I675-L679 PolarHBondContact O-N 2.95Å; L676-L679 PolarHBondContact O-N 3.2Å; L679-C681 VanDerWaalsContact C-N 3.26Å; L679-C681 PolarHBondContact O-N 2.94Å; L679-A682 WeakPolarHBondContact O-CA 3.42Å; L679-A682 WeakPolarHBondContact O-CB 3.37Å; L679-A682 PolarHBondContact O-N 2.83Å; L679-S683 PolarHBondContact O-N 3.33Å; L679-S683 VanDerWaalsContact O-N 3.12Å; L679-S683 PolarHBondContact O-OG 3.12Å; L679-V687 HydrophobicContact CB-CG1 4Å; L679-V687 HydrophobicContact CB-CG2 3.95Å; L679-V687 HydrophobicContact CD1-CG1 4.11Å
680	A	76.7	Confident	76.6	Confident	9 Å²	9	68 Å²	68	7%	0.074	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-33.2	178.1	0	0	0	0	0	112.9	L676 R677 A682 S683 D684 G685 V687 F725	L676-A680 VanDerWaalsContact O-CB 3.27Å; L676-A680 WeakPolarHBondContact O-CB 3.4Å; L676-A680 PolarHBondContact O-N 3.19Å; R677-A680 PolarHBondContact O-N 3.19Å; A680-A682 VanDerWaalsContact C-N 3.26Å; A680-A682 PolarHBondContact O-N 3.31Å; A680-S683 CarbonylContact O-C 3.6Å; A680-S683 PolarHBondContact O-N 2.84Å; A680-D684 PolarHBondContact O-N 3.44Å; A680-G685 PolarHBondContact O-N 3.34Å; A680-V687 HydrophobicContact CB-CG2 3.7Å; A680-F725 HydrophobicContact CB-CD2 3.57Å; A680-F725 HydrophobicContact CB-CE2 3.44Å; A680-F725 VanDerWaalsContact CB-CE2 3.44Å; A680-F725 HydrophobicContact CB-CZ 4.27Å
681	C	73.4	Confident	76.5	Confident	115 Å²	115	69.2 Å²	69.2	78%	0.777	36%	0.363	S	S	*	.	H	α-helix	trans	-68.6	-27.5	175	-152.4	0	0	0	0	111.9	R677 E678 L679	R677-C681 WeakPolarHBondContact O-CB 3.4Å; R677-C681 PolarHBondContact O-N 2.61Å; E678-C681 PolarHBondContact O-N 3.24Å; L679-C681 VanDerWaalsContact C-N 3.26Å; L679-C681 PolarHBondContact O-N 2.94Å
682	A	76.8	Confident	76.4	Confident	90 Å²	90	61.4 Å²	61.4	74%	0.744	33%	0.334	S	S	*	.	H	α-helix	trans	-81.4	-25.7	175.7	0	0	0	0	0	113.2	E678 L679 A680	E678-A682 PolarHBondContact O-N 3.38Å; L679-A682 WeakPolarHBondContact O-CA 3.42Å; L679-A682 WeakPolarHBondContact O-CB 3.37Å; L679-A682 PolarHBondContact O-N 2.83Å; A680-A682 VanDerWaalsContact C-N 3.26Å; A680-A682 PolarHBondContact O-N 3.31Å
683	S	69.7	Low	76.4	Confident	44 Å²	44	64.1 Å²	64.1	31%	0.308	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	41.7	-172.4	53.3	0	0	0	0	114.1	L679 A680 G685 E686	L679-S683 PolarHBondContact O-N 3.33Å; L679-S683 VanDerWaalsContact O-N 3.12Å; L679-S683 PolarHBondContact O-OG 3.12Å; A680-S683 CarbonylContact O-C 3.6Å; A680-S683 PolarHBondContact O-N 2.84Å; S683-G685 VanDerWaalsContact C-N 3.28Å; S683-G685 PolarHBondContact O-N 3.49Å; S683-G685 VanDerWaalsContact O-N 3.15Å; S683-E686 VanDerWaalsContact CB-O 3.29Å; S683-E686 WeakPolarHBondContact CB-O 3.33Å; S683-E686 PolarHBondContact O-N 3.21Å; S683-E686 VanDerWaalsContact O-N 3.12Å; S683-E686 PolarHBondContact OG-O 2.86Å
684	D	70.2	Confident	76.3	Confident	163 Å²	163	68.7 Å²	68.7	87%	0.872	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	40.1	170.1	-101.7	-1.6	0	0	0	114.5	A680 E686	A680-D684 PolarHBondContact O-N 3.44Å; D684-E686 VanDerWaalsContact C-N 3.33Å; D684-E686 PolarHBondContact O-N 3.43Å
685	G	69	Low	75.9	Confident	10 Å²	10	75.1 Å²	75.1	10%	0.103	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	-1.9	175.2	0	0	0	0	0	115.7	A680 S683 F725	A680-G685 PolarHBondContact O-N 3.34Å; S683-G685 VanDerWaalsContact C-N 3.28Å; S683-G685 PolarHBondContact O-N 3.49Å; S683-G685 VanDerWaalsContact O-N 3.15Å; G685-F725 PolarHBondContact O-N 2.94Å
686	E	74.5	Confident	75.7	Confident	78 Å²	78	73.6 Å²	73.6	36%	0.364	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.9	173.7	-61.1	-171.3	172.3	0	0	110.6	S683 D684 K722	S683-E686 VanDerWaalsContact CB-O 3.29Å; S683-E686 WeakPolarHBondContact CB-O 3.33Å; S683-E686 PolarHBondContact O-N 3.21Å; S683-E686 VanDerWaalsContact O-N 3.12Å; S683-E686 PolarHBondContact OG-O 2.86Å; D684-E686 VanDerWaalsContact C-N 3.33Å; D684-E686 PolarHBondContact O-N 3.43Å; E686-K722 WeakPolarHBondContact OE2-CD 3.41Å; E686-K722 IonicContact OE2-NZ 3.38Å; E686-K722 PolarHBondContact OE2-NZ 3.34Å
687	V	74.9	Confident	75.7	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.8	174.5	-177.3	0	0	0	0	109.4	L676 L679 A680 A692 K722 V723 F725	L676-V687 HydrophobicContact CD2-CG1 4.07Å; L679-V687 HydrophobicContact CB-CG1 4Å; L679-V687 HydrophobicContact CB-CG2 3.95Å; L679-V687 HydrophobicContact CD1-CG1 4.11Å; A680-V687 HydrophobicContact CB-CG2 3.7Å; V687-A692 HydrophobicContact CG1-CB 4.22Å; V687-K722 CarbonylContact O-C 3.5Å; V687-K722 WeakPolarHBondContact O-CA 3.45Å; V687-V723 HydrophobicContact CB-CB 4.46Å; V687-V723 PolarHBondContact N-O 3.34Å; V687-V723 PolarHBondContact O-N 2.98Å; V687-F725 HydrophobicContact CG2-CE2 4.24Å
688	S	78.4	Confident	75.7	Confident	35 Å²	35	75.1 Å²	75.1	25%	0.245	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	136.3	173.5	75.6	0	0	0	0	110.4	Q690 E691 A692	S688-Q690 PolarHBondContact O-N 3.37Å; S688-E691 PolarHBondContact O-N 3.42Å; S688-E691 WeakPolarHBondContact OG-CB 3.3Å; S688-E691 WeakPolarHBondContact OG-CG 3.39Å; S688-E691 PolarHBondContact OG-N 3.18Å; S688-E691 PolarHBondContact OG-OE2 3.03Å; S688-A692 PolarHBondContact O-N 3.15Å
689	M	72.9	Confident	75.6	Confident	46 Å²	46	74.8 Å²	74.8	23%	0.227	41%	0.41	C	S	.	.	H	α-helix	trans	-60.4	-29.2	179.9	-82.7	-68.9	-124.8	0	0	112.3	T693 L701 I705 L716 K720 T721 V723	M689-T693 WeakPolarHBondContact O-CB 3.2Å; M689-T693 PolarHBondContact O-N 3.46Å; M689-T693 PolarHBondContact O-OG1 3.16Å; M689-L701 HydrophobicContact SD-CD2 4.45Å; M689-I705 HydrophobicContact CE-CD1 3.54Å; M689-I705 HydrophobicContact SD-CD1 3.75Å; M689-L716 HydrophobicContact CE-CD2 3.96Å; M689-K720 WeakPolarHBondContact CG-O 3.45Å; M689-T721 WeakPolarHBondContact CB-O 3.36Å; M689-T721 PolarHBondContact N-O 3.4Å; M689-V723 HydrophobicContact CG-CG2 4.39Å; M689-V723 HydrophobicContact SD-CG2 3.79Å
690	Q	75.4	Confident	75.7	Confident	159 Å²	159	75.8 Å²	75.8	74%	0.743	42%	0.417	S	S	*	.	H	α-helix	trans	-67.3	-42.5	177.8	-67.8	-177.4	-9.6	0	0	112.1	S688 T693 N694	S688-Q690 PolarHBondContact O-N 3.37Å; Q690-T693 PolarHBondContact O-N 3.08Å; Q690-N694 VanDerWaalsContact O-CG 3.25Å; Q690-N694 PolarHBondContact O-N 2.91Å; Q690-N694 VanDerWaalsContact O-N 3.13Å; Q690-N694 PolarHBondContact O-ND2 2.79Å
691	E	76.3	Confident	76	Confident	95 Å²	95	75.6 Å²	75.6	44%	0.444	42%	0.415	S	S	.	.	H	α-helix	trans	-67.1	-38.6	177	-72.6	165.3	156.7	0	0	111.9	S688 N694	S688-E691 PolarHBondContact O-N 3.42Å; S688-E691 WeakPolarHBondContact OG-CB 3.3Å; S688-E691 WeakPolarHBondContact OG-CG 3.39Å; S688-E691 PolarHBondContact OG-N 3.18Å; S688-E691 PolarHBondContact OG-OE2 3.03Å; E691-N694 PolarHBondContact O-N 3.29Å
692	A	73.8	Confident	76.3	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-65	-43.8	175.4	0	0	0	0	0	111.9	L676 V687 S688 N694 R695 I696 L701	L676-A692 HydrophobicContact CD2-CB 3.93Å; V687-A692 HydrophobicContact CG1-CB 4.22Å; S688-A692 PolarHBondContact O-N 3.15Å; A692-N694 VanDerWaalsContact C-N 3.28Å; A692-N694 PolarHBondContact O-N 3.22Å; A692-R695 PolarHBondContact O-N 2.77Å; A692-I696 WeakPolarHBondContact O-CB 3.36Å; A692-I696 WeakPolarHBondContact O-CG1 3.27Å; A692-I696 PolarHBondContact O-N 2.96Å; A692-I696 VanDerWaalsContact O-N 3.13Å; A692-L701 HydrophobicContact CB-CD1 4.18Å; A692-L701 HydrophobicContact CB-CD2 3.79Å
693	T	79.5	Confident	76.6	Confident	66 Å²	66	78.2 Å²	78.2	41%	0.405	40%	0.396	S	S	.	.	H	α-helix	trans	-68.9	-26.9	-178.6	-43.8	0	0	0	0	112.4	M689 Q690 R695 P698	M689-T693 WeakPolarHBondContact O-CB 3.2Å; M689-T693 PolarHBondContact O-N 3.46Å; M689-T693 PolarHBondContact O-OG1 3.16Å; Q690-T693 PolarHBondContact O-N 3.08Å; T693-R695 VanDerWaalsContact C-N 3.31Å; T693-R695 PolarHBondContact O-N 3Å; T693-P698 HydrophobicContact CG2-CB 4.19Å
694	N	80	Confident	77.2	Confident	142 Å²	142	76.1 Å²	76.1	76%	0.759	38%	0.381	S	S	*	.	H	α-helix	trans	-72	-23.4	177.1	-75	-15.9	0	0	0	113.5	Q690 E691 A692	Q690-N694 VanDerWaalsContact O-CG 3.25Å; Q690-N694 PolarHBondContact O-N 2.91Å; Q690-N694 VanDerWaalsContact O-N 3.13Å; Q690-N694 PolarHBondContact O-ND2 2.79Å; E691-N694 PolarHBondContact O-N 3.29Å; A692-N694 VanDerWaalsContact C-N 3.28Å; A692-N694 PolarHBondContact O-N 3.22Å
695	R	71.8	Confident	77.7	Confident	173 Å²	173	68.7 Å²	68.7	65%	0.653	34%	0.341	S	S	*	.	H	α-helix	trans	-106.9	-14.3	-177.8	-68.6	-169.5	179.5	-175.8	2.4	114.1	A692 T693	A692-R695 PolarHBondContact O-N 2.77Å; T693-R695 VanDerWaalsContact C-N 3.31Å; T693-R695 PolarHBondContact O-N 3Å
696	I	75.9	Confident	78.4	Confident	15 Å²	15	73.8 Å²	73.8	8%	0.077	36%	0.363	C	S	.	.	S	Bend	trans	-135.4	138.5	-166.8	-51.8	-178.1	0	0	0	109.5	V672 I675 A692 L701	V672-I696 HydrophobicContact CB-CD1 4.39Å; V672-I696 HydrophobicContact CB-CG2 4.39Å; V672-I696 HydrophobicContact CG1-CD1 3.8Å; V672-I696 HydrophobicContact CG1-CG2 4.06Å; V672-I696 HydrophobicContact CG2-CD1 4.36Å; V672-I696 HydrophobicContact CG2-CG2 3.46Å; V672-I696 VanDerWaalsContact CG2-CG2 3.46Å; I675-I696 HydrophobicContact CB-CD1 4.05Å; I675-I696 HydrophobicContact CD1-CD1 4.45Å; I675-I696 HydrophobicContact CD1-CG1 4.45Å; I675-I696 HydrophobicContact CG2-CD1 3.8Å; I675-I696 HydrophobicContact CG2-CG1 4.26Å; A692-I696 WeakPolarHBondContact O-CB 3.36Å; A692-I696 WeakPolarHBondContact O-CG1 3.27Å; A692-I696 PolarHBondContact O-N 2.96Å; A692-I696 VanDerWaalsContact O-N 3.13Å; I696-L701 HydrophobicContact CD1-CD1 4.35Å; I696-L701 HydrophobicContact CG2-CB 4.04Å
697	D	80.3	Confident	78.8	Confident	122 Å²	122	71.8 Å²	71.8	65%	0.652	36%	0.359	S	S	*	.			trans	-57.2	128.2	174.2	-76.7	-36.6	0	0	0	110.7	L699 V700 L701	D697-L699 PolarHBondContact O-N 3.29Å; D697-L699 VanDerWaalsContact O-N 3.08Å; D697-V700 HydrophobicContact CB-CG2 4.18Å; D697-V700 PolarHBondContact O-N 3.12Å; D697-V700 VanDerWaalsContact O-N 3.15Å; D697-L701 PolarHBondContact O-N 3.15Å
698	P	78.9	Confident	79.2	Confident	67 Å²	67	72.9 Å²	72.9	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-64.6	-21.4	-170.1	23.2	-33.6	0	0	0	113.7	T693 R702	T693-P698 HydrophobicContact CG2-CB 4.19Å; P698-R702 WeakPolarHBondContact O-CG 3.5Å; P698-R702 PolarHBondContact O-N 2.9Å
699	L	80.4	Confident	79.4	Confident	125 Å²	125	75.5 Å²	75.5	65%	0.654	37%	0.372	S	S	*	.	H	α-helix	trans	-72.6	-52.1	175.6	-160.3	89.7	0	0	0	110.5	D697 L701 R702 D703	D697-L699 PolarHBondContact O-N 3.29Å; D697-L699 VanDerWaalsContact O-N 3.08Å; L699-L701 VanDerWaalsContact C-N 3.28Å; L699-L701 PolarHBondContact O-N 2.87Å; L699-R702 PolarHBondContact O-N 2.91Å; L699-D703 PolarHBondContact O-N 2.88Å; L699-D703 VanDerWaalsContact O-N 3.16Å
700	V	80.8	Confident	79.8	Confident	37 Å²	37	81 Å²	81	22%	0.224	40%	0.397	C	S	.	.	H	α-helix	trans	-66.2	-33.8	-178.8	-169.7	0	0	0	0	111.1	P668 V672 D697 C704	P668-V700 HydrophobicContact CB-CG1 3.79Å; V672-V700 HydrophobicContact CG2-CB 4.49Å; V672-V700 HydrophobicContact CG2-CG1 3.78Å; D697-V700 HydrophobicContact CB-CG2 4.18Å; D697-V700 PolarHBondContact O-N 3.12Å; D697-V700 VanDerWaalsContact O-N 3.15Å; V700-C704 WeakPolarHBondContact O-CB 3.44Å; V700-C704 PolarHBondContact O-N 3.16Å
701	L	82.1	Confident	79.9	Confident	5 Å²	5	79.8 Å²	79.8	3%	0.026	39%	0.391	C	S	.	.	H	α-helix	trans	-63	-41.9	175.1	-177.7	63.1	0	0	0	112	V672 L676 M689 A692 I696 D697 L699 C704 I705	V672-L701 HydrophobicContact CG1-CD1 4.03Å; L676-L701 HydrophobicContact CD1-CD1 4.13Å; L676-L701 HydrophobicContact CD2-CD1 4.17Å; L676-L701 HydrophobicContact CG-CD1 4.47Å; M689-L701 HydrophobicContact SD-CD2 4.45Å; A692-L701 HydrophobicContact CB-CD1 4.18Å; A692-L701 HydrophobicContact CB-CD2 3.79Å; I696-L701 HydrophobicContact CD1-CD1 4.35Å; I696-L701 HydrophobicContact CG2-CB 4.04Å; D697-L701 PolarHBondContact O-N 3.15Å; L699-L701 VanDerWaalsContact C-N 3.28Å; L699-L701 PolarHBondContact O-N 2.87Å; L701-C704 PolarHBondContact O-N 3.5Å; L701-I705 HydrophobicContact CD1-CD1 3.97Å; L701-I705 HydrophobicContact CD1-CG1 4.34Å; L701-I705 HydrophobicContact CG-CD1 3.89Å; L701-I705 VanDerWaalsContact O-CG1 3.24Å; L701-I705 WeakPolarHBondContact O-CG1 3.3Å; L701-I705 PolarHBondContact O-N 2.88Å
702	R	81.7	Confident	79.9	Confident	173 Å²	173	77.2 Å²	77.2	65%	0.653	39%	0.39	S	S	*	.	H	α-helix	trans	-66.8	-47	177.6	-75.5	-177.2	-147.2	172.5	6.1	111.6	P698 L699 C704 I705 E706	P698-R702 WeakPolarHBondContact O-CG 3.5Å; P698-R702 PolarHBondContact O-N 2.9Å; L699-R702 PolarHBondContact O-N 2.91Å; R702-C704 PolarHBondContact O-N 3.02Å; R702-I705 PolarHBondContact O-N 2.99Å; R702-I705 VanDerWaalsContact O-N 3.16Å; R702-E706 WeakPolarHBondContact O-CB 3.24Å; R702-E706 PolarHBondContact O-N 2.96Å
703	D	82.7	Confident	80.1	Confident	87 Å²	87	78.4 Å²	78.4	47%	0.465	40%	0.397	S	S	.	.	H	α-helix	trans	-59.2	-39.1	178.3	-64.6	-8.2	0	0	0	110.9	L699 A707	L699-D703 PolarHBondContact O-N 2.88Å; L699-D703 VanDerWaalsContact O-N 3.16Å; D703-A707 VanDerWaalsContact O-CB 3.3Å; D703-A707 WeakPolarHBondContact O-CB 3.47Å; D703-A707 PolarHBondContact O-N 3.47Å
704	C	81.3	Confident	80	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-65.6	-47.4	175.4	-178.5	0	0	0	0	112.3	V669 V672 V700 L701 R702 E706 A707 Y708	V669-C704 HydrophobicContact CG1-CB 4.01Å; V672-C704 HydrophobicContact CB-CB 4.29Å; V672-C704 HydrophobicContact CG1-CB 3.72Å; V672-C704 VanDerWaalsContact CG1-SG 3.53Å; V700-C704 WeakPolarHBondContact O-CB 3.44Å; V700-C704 PolarHBondContact O-N 3.16Å; L701-C704 PolarHBondContact O-N 3.5Å; R702-C704 PolarHBondContact O-N 3.02Å; C704-E706 VanDerWaalsContact C-N 3.34Å; C704-E706 PolarHBondContact O-N 3.31Å; C704-A707 PolarHBondContact O-N 3.48Å; C704-Y708 WeakPolarHBondContact O-CD2 3.18Å; C704-Y708 PolarHBondContact O-N 3.03Å; C704-Y708 WeakPolarHBondContact SG-CD2 3.5Å; C704-Y708 WeakPolarHBondContact SG-CE2 3.49Å
705	I	81.8	Confident	79.8	Confident	7 Å²	7	73.6 Å²	73.6	4%	0.036	37%	0.367	C	S	.	.	H	α-helix	trans	-63.6	-42.7	179.7	-69.4	167.3	0	0	0	110.4	M689 L701 R702 Y708 Q709 L716 V723	M689-I705 HydrophobicContact CE-CD1 3.54Å; M689-I705 HydrophobicContact SD-CD1 3.75Å; L701-I705 HydrophobicContact CD1-CD1 3.97Å; L701-I705 HydrophobicContact CD1-CG1 4.34Å; L701-I705 HydrophobicContact CG-CD1 3.89Å; L701-I705 VanDerWaalsContact O-CG1 3.24Å; L701-I705 WeakPolarHBondContact O-CG1 3.3Å; L701-I705 PolarHBondContact O-N 2.88Å; R702-I705 PolarHBondContact O-N 2.99Å; R702-I705 VanDerWaalsContact O-N 3.16Å; I705-Y708 PolarHBondContact O-N 2.7Å; I705-Q709 WeakPolarHBondContact O-CB 3.02Å; I705-Q709 PolarHBondContact O-N 2.84Å; I705-L716 HydrophobicContact CG2-CD1 3.76Å; I705-L716 HydrophobicContact CG2-CD2 4.18Å; I705-L716 HydrophobicContact CG2-CG 3.98Å; I705-V723 HydrophobicContact CD1-CG2 3.91Å; I705-V723 HydrophobicContact CG1-CG2 4.44Å
706	E	83	Confident	80	Confident	118 Å²	118	67.2 Å²	67.2	55%	0.551	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-48.9	178	-169.6	167.7	-166.2	0	0	111.2	R702 C704 Y708 Q709 E710	R702-E706 WeakPolarHBondContact O-CB 3.24Å; R702-E706 PolarHBondContact O-N 2.96Å; C704-E706 VanDerWaalsContact C-N 3.34Å; C704-E706 PolarHBondContact O-N 3.31Å; E706-Y708 PolarHBondContact O-N 3.43Å; E706-Q709 PolarHBondContact O-N 2.8Å; E706-E710 WeakPolarHBondContact O-CG 3.45Å; E706-E710 PolarHBondContact O-N 3.47Å
707	A	82.8	Confident	80	Confident	35 Å²	35	69.6 Å²	69.6	29%	0.289	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-41.9	178.9	0	0	0	0	0	113.5	D703 C704 Q711	D703-A707 VanDerWaalsContact O-CB 3.3Å; D703-A707 WeakPolarHBondContact O-CB 3.47Å; D703-A707 PolarHBondContact O-N 3.47Å; C704-A707 PolarHBondContact O-N 3.48Å; A707-Q711 WeakPolarHBondContact O-CG 3.46Å; A707-Q711 PolarHBondContact O-N 3.43Å
708	Y	82.5	Confident	79.5	Confident	24 Å²	24	72.8 Å²	72.8	9%	0.094	37%	0.37	C	S	.	.	H	α-helix	trans	-83.1	-20.1	178.9	-73.4	-66.4	0	0	0	113.8	V669 D670 F673 C704 I705 E706 Q711 G712 V713 L714	V669-Y708 HydrophobicContact CG1-CD2 4.28Å; V669-Y708 HydrophobicContact CG1-CE2 3.55Å; D670-Y708 PolarHBondContact OD1-OH 3.09Å; F673-Y708 HydrophobicContact CB-CE2 3.63Å; F673-Y708 HydrophobicContact CD2-CD1 4.16Å; F673-Y708 AromaticContact CD2-CD2 3.73Å; F673-Y708 HydrophobicContact CD2-CD2 3.73Å; F673-Y708 AromaticContact CD2-CE1 3.97Å; F673-Y708 HydrophobicContact CD2-CE1 3.97Å; F673-Y708 AromaticContact CD2-CE2 3.53Å; F673-Y708 HydrophobicContact CD2-CE2 3.53Å; F673-Y708 HydrophobicContact CD2-CG 4.06Å; F673-Y708 AromaticContact CD2-CZ 3.65Å; F673-Y708 HydrophobicContact CE2-CD1 4.2Å; F673-Y708 HydrophobicContact CE2-CD2 4.44Å; F673-Y708 HydrophobicContact CE2-CE1 4.21Å; F673-Y708 HydrophobicContact CE2-CE2 4.46Å; F673-Y708 HydrophobicContact CE2-CG 4.32Å; F673-Y708 HydrophobicContact CG-CD2 4.47Å; F673-Y708 HydrophobicContact CG-CE1 4.36Å; F673-Y708 AromaticContact CG-CE2 3.83Å; F673-Y708 HydrophobicContact CG-CE2 3.83Å; F673-Y708 AromaticContact CG-CZ 3.76Å; C704-Y708 WeakPolarHBondContact O-CD2 3.18Å; C704-Y708 PolarHBondContact O-N 3.03Å; C704-Y708 WeakPolarHBondContact SG-CD2 3.5Å; C704-Y708 WeakPolarHBondContact SG-CE2 3.49Å; I705-Y708 PolarHBondContact O-N 2.7Å; E706-Y708 PolarHBondContact O-N 3.43Å; Y708-Q711 PolarHBondContact O-N 3.05Å; Y708-G712 PolarHBondContact O-N 3.5Å; Y708-G712 VanDerWaalsContact O-N 3.16Å; Y708-V713 HydrophobicContact CD1-CB 4.33Å; Y708-V713 HydrophobicContact CD1-CG2 4.46Å; Y708-V713 PolarHBondContact O-N 2.81Å; Y708-L714 HydrophobicContact CD2-CD1 4.36Å; Y708-L714 HydrophobicContact CG-CD1 4.36Å; Y708-L714 PolarHBondContact O-N 3.16Å
709	Q	82.9	Confident	79.1	Confident	90 Å²	90	75.6 Å²	75.6	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-71.6	-40	170.2	-175.3	176.4	-4.2	0	0	110.5	I705 E706 Q711 G712 L714	I705-Q709 WeakPolarHBondContact O-CB 3.02Å; I705-Q709 PolarHBondContact O-N 2.84Å; E706-Q709 PolarHBondContact O-N 2.8Å; Q709-Q711 PolarHBondContact O-N 3.01Å; Q709-G712 PolarHBondContact O-N 2.98Å; Q709-L714 WeakPolarHBondContact CA-O 3.4Å
710	E	81	Confident	78.5	Confident	160 Å²	160	77.1 Å²	77.1	75%	0.748	38%	0.382	S	S	*	.	H	α-helix	trans	-61.7	-33.2	171.5	-73.6	-175.1	167.4	0	0	112.5	E706 G712	E706-E710 WeakPolarHBondContact O-CG 3.45Å; E706-E710 PolarHBondContact O-N 3.47Å; E710-G712 VanDerWaalsContact C-N 3.29Å
711	Q	77.9	Confident	78.2	Confident	135 Å²	135	79 Å²	79	63%	0.631	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.9	175.1	-66.6	176.6	11.1	0	0	113.6	A707 Y708 Q709 V713	A707-Q711 WeakPolarHBondContact O-CG 3.46Å; A707-Q711 PolarHBondContact O-N 3.43Å; Y708-Q711 PolarHBondContact O-N 3.05Å; Q709-Q711 PolarHBondContact O-N 3.01Å; Q711-V713 VanDerWaalsContact C-N 3.29Å; Q711-V713 HydrophobicContact CB-CG2 4.14Å; Q711-V713 PolarHBondContact O-N 3.33Å
712	G	77.4	Confident	77.8	Confident	41 Å²	41	82.6 Å²	82.6	42%	0.423	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	17.1	179.9	0	0	0	0	0	115.1	Y708 Q709 E710 T726	Y708-G712 PolarHBondContact O-N 3.5Å; Y708-G712 VanDerWaalsContact O-N 3.16Å; Q709-G712 PolarHBondContact O-N 2.98Å; E710-G712 VanDerWaalsContact C-N 3.29Å; G712-T726 PolarHBondContact O-OG1 3.03Å
713	V	77.6	Confident	77.6	Confident	24 Å²	24	74.3 Å²	74.3	15%	0.145	38%	0.378	C	S	.	.	S	Bend	trans	-87.7	-31.6	-179.6	-178.5	0	0	0	0	111.8	F673 Y708 Q711 T726	F673-V713 HydrophobicContact CE2-CG1 3.83Å; F673-V713 HydrophobicContact CZ-CG1 3.99Å; Y708-V713 HydrophobicContact CD1-CB 4.33Å; Y708-V713 HydrophobicContact CD1-CG2 4.46Å; Y708-V713 PolarHBondContact O-N 2.81Å; Q711-V713 VanDerWaalsContact C-N 3.29Å; Q711-V713 HydrophobicContact CB-CG2 4.14Å; Q711-V713 PolarHBondContact O-N 3.33Å; V713-T726 VanDerWaalsContact C-OG1 3.24Å; V713-T726 WeakPolarHBondContact CA-OG1 3.33Å; V713-T726 PolarHBondContact O-N 3.4Å; V713-T726 PolarHBondContact O-OG1 2.94Å
714	L	77.8	Confident	77.3	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.5	178.5	-65.9	-179.1	0	0	0	110.1	L676 Y708 Q709 V723 F725	L676-L714 HydrophobicContact CD1-CD1 4.3Å; Y708-L714 HydrophobicContact CD2-CD1 4.36Å; Y708-L714 HydrophobicContact CG-CD1 4.36Å; Y708-L714 PolarHBondContact O-N 3.16Å; Q709-L714 WeakPolarHBondContact CA-O 3.4Å; L714-V723 HydrophobicContact CB-CG1 4.24Å; L714-V723 HydrophobicContact CD1-CG1 4.07Å; L714-V723 HydrophobicContact CD2-CG1 3.73Å; L714-V723 HydrophobicContact CG-CG1 4.24Å; L714-F725 HydrophobicContact CD2-CD1 3.55Å; L714-F725 HydrophobicContact CD2-CD2 3.89Å; L714-F725 HydrophobicContact CD2-CE1 3.55Å; L714-F725 HydrophobicContact CD2-CE2 3.85Å; L714-F725 HydrophobicContact CD2-CG 3.75Å; L714-F725 HydrophobicContact CD2-CZ 3.7Å
715	M	75.5	Confident	76.9	Confident	106 Å²	106	73.9 Å²	73.9	52%	0.522	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.2	171.5	-76.2	-77.9	-78.9	0	0	109.5	I724 T726	M715-I724 PolarHBondContact N-O 2.96Å; M715-I724 PolarHBondContact O-N 3.24Å; M715-T726 HydrophobicContact CB-CG2 3.93Å; M715-T726 HydrophobicContact CG-CG2 3.18Å
716	L	75.1	Confident	76.4	Confident	40 Å²	40	76.7 Å²	76.7	21%	0.209	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.6	169	-73.6	164.9	0	0	0	108.9	M689 I705 V723	M689-L716 HydrophobicContact CE-CD2 3.96Å; I705-L716 HydrophobicContact CG2-CD1 3.76Å; I705-L716 HydrophobicContact CG2-CD2 4.18Å; I705-L716 HydrophobicContact CG2-CG 3.98Å; L716-V723 HydrophobicContact CD2-CG2 3.86Å
717	N	76.7	Confident	75.2	Confident	65 Å²	65	78 Å²	78	35%	0.348	40%	0.4	S	S	.	.			trans	-64.4	158.3	171.6	-155.3	-11.5	0	0	0	110.5	N719 K720 K722 I724	N717-N719 PolarHBondContact O-N 3.48Å; N717-K720 PolarHBondContact O-N 3.28Å; N717-K722 HydrophobicContact CB-CB 4.3Å; N717-K722 PolarHBondContact N-O 3.5Å; N717-K722 VanDerWaalsContact N-O 3.09Å; N717-I724 HydrophobicContact CB-CD1 4.34Å
718	E	69.2	Low	73.7	Confident	189 Å²	189	82.6 Å²	82.6	88%	0.883	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-31.2	-173.1	-67.2	-174.1	159.6	0	0	113.3	K720	E718-K720 PolarHBondContact O-N 2.81Å
719	N	70.9	Confident	71.4	Confident	126 Å²	126	89.8 Å²	89.8	67%	0.674	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	2.4	179.6	-65.1	-21.7	0	0	0	114.6	N717 T721	N717-N719 PolarHBondContact O-N 3.48Å; N719-T721 HydrophobicContact CB-CG2 4.22Å; N719-T721 PolarHBondContact O-N 2.97Å
720	K	68.6	Low	70.9	Confident	156 Å²	156	89.8 Å²	89.8	68%	0.678	49%	0.487	S	S	*	.	S	Bend	trans	52.3	22.9	-173.7	-61.1	-175.6	178.1	-177.2	0	114.8	M689 N717 E718	M689-K720 WeakPolarHBondContact CG-O 3.45Å; N717-K720 PolarHBondContact O-N 3.28Å; E718-K720 PolarHBondContact O-N 2.81Å
721	T	72.7	Confident	70.3	Confident	76 Å²	76	86.1 Å²	86.1	47%	0.466	47%	0.473	S	S	.	.	S	Bend	trans	-96	-21.4	-177.8	49.5	0	0	0	0	113.9	M689 N719	M689-T721 WeakPolarHBondContact CB-O 3.36Å; M689-T721 PolarHBondContact N-O 3.4Å; N719-T721 HydrophobicContact CB-CG2 4.22Å; N719-T721 PolarHBondContact O-N 2.97Å
722	K	75.5	Confident	69.9	Low	81 Å²	81	83.3 Å²	83.3	35%	0.352	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	137.8	-176.2	-65	-176.7	172.1	-169.3	0	110.8	E686 V687 N717	E686-K722 WeakPolarHBondContact OE2-CD 3.41Å; E686-K722 IonicContact OE2-NZ 3.38Å; E686-K722 PolarHBondContact OE2-NZ 3.34Å; V687-K722 CarbonylContact O-C 3.5Å; V687-K722 WeakPolarHBondContact O-CA 3.45Å; N717-K722 HydrophobicContact CB-CB 4.3Å; N717-K722 PolarHBondContact N-O 3.5Å; N717-K722 VanDerWaalsContact N-O 3.09Å
723	V	76	Confident	69.5	Low	0 Å²	0	85.8 Å²	85.8	0%	0	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.4	171.5	179	0	0	0	0	107.5	V687 M689 I705 L714 L716	V687-V723 HydrophobicContact CB-CB 4.46Å; V687-V723 PolarHBondContact N-O 3.34Å; V687-V723 PolarHBondContact O-N 2.98Å; M689-V723 HydrophobicContact CG-CG2 4.39Å; M689-V723 HydrophobicContact SD-CG2 3.79Å; I705-V723 HydrophobicContact CD1-CG2 3.91Å; I705-V723 HydrophobicContact CG1-CG2 4.44Å; L714-V723 HydrophobicContact CB-CG1 4.24Å; L714-V723 HydrophobicContact CD1-CG1 4.07Å; L714-V723 HydrophobicContact CD2-CG1 3.73Å; L714-V723 HydrophobicContact CG-CG1 4.24Å; L716-V723 HydrophobicContact CD2-CG2 3.86Å
724	I	76.3	Confident	69	Low	54 Å²	54	89.7 Å²	89.7	28%	0.277	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.9	-179.5	-55.2	174.2	0	0	0	107.9	M715 N717	M715-I724 PolarHBondContact N-O 2.96Å; M715-I724 PolarHBondContact O-N 3.24Å; N717-I724 HydrophobicContact CB-CD1 4.34Å
725	F	74.1	Confident	68.4	Low	24 Å²	24	95.6 Å²	95.6	11%	0.105	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	121.8	171.9	-77.5	-100.5	0	0	0	109.5	F673 L676 R677 A680 G685 V687 L714 M727	F673-F725 HydrophobicContact CD2-CE1 4.33Å; F673-F725 HydrophobicContact CE2-CD1 4.39Å; F673-F725 AromaticContact CE2-CE1 3.59Å; F673-F725 HydrophobicContact CE2-CE1 3.59Å; F673-F725 HydrophobicContact CE2-CZ 4.42Å; F673-F725 HydrophobicContact CZ-CD1 4.45Å; F673-F725 AromaticContact CZ-CE1 3.78Å; F673-F725 HydrophobicContact CZ-CE1 3.78Å; L676-F725 HydrophobicContact CB-CE2 4.31Å; L676-F725 HydrophobicContact CB-CZ 3.85Å; R677-F725 HydrophobicContact CB-CZ 4.47Å; A680-F725 HydrophobicContact CB-CD2 3.57Å; A680-F725 HydrophobicContact CB-CE2 3.44Å; A680-F725 VanDerWaalsContact CB-CE2 3.44Å; A680-F725 HydrophobicContact CB-CZ 4.27Å; G685-F725 PolarHBondContact O-N 2.94Å; V687-F725 HydrophobicContact CG2-CE2 4.24Å; L714-F725 HydrophobicContact CD2-CD1 3.55Å; L714-F725 HydrophobicContact CD2-CD2 3.89Å; L714-F725 HydrophobicContact CD2-CE1 3.55Å; L714-F725 HydrophobicContact CD2-CE2 3.85Å; L714-F725 HydrophobicContact CD2-CG 3.75Å; L714-F725 HydrophobicContact CD2-CZ 3.7Å; F725-M727 VanDerWaalsContact C-N 3.27Å; F725-M727 PolarHBondContact O-N 2.61Å
726	T	71.4	Confident	67.9	Low	66 Å²	66	94.9 Å²	94.9	41%	0.405	52%	0.518	S	S	.	.	S	Bend	trans	-75.9	-17.6	-179.9	54.1	0	0	0	0	113	G712 V713 M715 N728	G712-T726 PolarHBondContact O-OG1 3.03Å; V713-T726 VanDerWaalsContact C-OG1 3.24Å; V713-T726 WeakPolarHBondContact CA-OG1 3.33Å; V713-T726 PolarHBondContact O-N 3.4Å; V713-T726 PolarHBondContact O-OG1 2.94Å; M715-T726 HydrophobicContact CB-CG2 3.93Å; M715-T726 HydrophobicContact CG-CG2 3.18Å; T726-N728 PolarHBondContact O-N 3.37Å
727	M	58.2	Low	67.3	Low	146 Å²	146	99.1 Å²	99.1	72%	0.719	54%	0.542	S	S	*	.			trans	-92.4	66.9	179.3	-68.3	-112.3	-168.6	0	0	111.1	F725	F725-M727 VanDerWaalsContact C-N 3.27Å; F725-M727 PolarHBondContact O-N 2.61Å
728	N	49.8	Very low	66.5	Low	130 Å²	130	101.9 Å²	101.9	70%	0.695	56%	0.558	S	S	*	*			trans	-112.5	76.5	157.4	-85.6	-11.4	0	0	0	107.8	T726	T726-N728 PolarHBondContact O-N 3.37Å
729	A	35.6	Very low	66.3	Low	175 Å²	175	94 Å²	94	100%	1.446	53%	0.529	S	S	*	.			trans	-143.7	0	164	0	0	0	0	0	109.5

Retrieved 729 of 729 residues in 657.2 ms (Link to these results)

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